USER MOD reduce.3.24.130724 H: found=0, std=0, add=812, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 831 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 43 ASN : amide:sc= -0.483 X(o=-0.55,f=-0.076) USER MOD Set 1.2: A 76 ASN : amide:sc= 1.11 K(o=-0.55,f=-2.1) USER MOD Set 1.3: A 77 ASN : amide:sc= -1.18 K(o=-0.55,f=-3.8!) USER MOD Set 2.1: A 52 THR OG1 : rot -117:sc= 0.217 USER MOD Set 2.2: A 54 MET CE :methyl -124:sc= -0.0925 (180deg=-0.142) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 ASN : amide:sc= 0.516 K(o=0.52,f=0) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 ASN : amide:sc= 0.842 K(o=0.84,f=0) USER MOD Single : A 29 SER OG : rot 84:sc= 1.26 USER MOD Single : A 34 TYR OH : rot -171:sc= 0.247 USER MOD Single : A 37 GLN : amide:sc= -0.0565 K(o=-0.056,f=-0.71) USER MOD Single : A 41 GLN : amide:sc= -0.286 X(o=-0.29,f=-0.24) USER MOD Single : A 42 ASN : amide:sc= -1.09 K(o=-1.1,f=-4.4!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl -175:sc= -0.0705 (180deg=-0.122) USER MOD Single : A 49 THR OG1 : rot 105:sc= 1.22 USER MOD Single : A 50 MET CE :methyl -149:sc= -0.465 (180deg=-2.2) USER MOD Single : A 51 THR OG1 : rot 87:sc= 0.0137 USER MOD Single : A 55 CYS SG : rot 16:sc= 0.033 USER MOD Single : A 60 MET CE :methyl 172:sc= 0 (180deg=-0.0939) USER MOD Single : A 63 SER OG : rot 89:sc= 0.236 USER MOD Single : A 70 LYS NZ :NH3+ 157:sc= 1.1 (180deg=0.703) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 80:sc= 0.822 USER MOD Single : A 89 THR OG1 : rot 78:sc= 1.22 USER MOD Single : A 93 MET CE :methyl -175:sc= 0 (180deg=-0.0742) USER MOD Single : A 94 SER OG : rot 180:sc=0.000955 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 2 13.570 1.054 -15.370 1.00 0.00 N ATOM 2 CA MET A 2 14.400 1.845 -16.302 1.00 0.00 C ATOM 3 C MET A 2 15.798 1.244 -16.410 1.00 0.00 C ATOM 4 O MET A 2 16.137 0.689 -17.454 1.00 0.00 O ATOM 5 CB MET A 2 14.461 3.338 -15.951 1.00 0.00 C ATOM 6 CG MET A 2 13.100 4.023 -15.990 1.00 0.00 C ATOM 7 SD MET A 2 13.152 5.689 -15.293 1.00 0.00 S ATOM 8 CE MET A 2 11.392 6.093 -15.361 1.00 0.00 C ATOM 0 HA MET A 2 13.913 1.791 -17.276 1.00 0.00 H new ATOM 0 HB2 MET A 2 14.889 3.453 -14.955 1.00 0.00 H new ATOM 0 HB3 MET A 2 15.133 3.840 -16.647 1.00 0.00 H new ATOM 0 HG2 MET A 2 12.750 4.074 -17.021 1.00 0.00 H new ATOM 0 HG3 MET A 2 12.377 3.423 -15.437 1.00 0.00 H new ATOM 0 HE1 MET A 2 11.234 7.097 -14.966 1.00 0.00 H new ATOM 0 HE2 MET A 2 11.049 6.051 -16.395 1.00 0.00 H new ATOM 0 HE3 MET A 2 10.831 5.375 -14.763 1.00 0.00 H new ATOM 18 N SER A 3 16.633 1.349 -15.373 1.00 0.00 N ATOM 19 CA SER A 3 17.999 0.834 -15.392 1.00 0.00 C ATOM 20 C SER A 3 18.409 0.499 -13.966 1.00 0.00 C ATOM 21 O SER A 3 19.087 1.287 -13.302 1.00 0.00 O ATOM 22 CB SER A 3 18.959 1.826 -16.068 1.00 0.00 C ATOM 23 OG SER A 3 18.555 3.178 -15.916 1.00 0.00 O ATOM 0 H SER A 3 16.376 1.797 -14.493 1.00 0.00 H new ATOM 0 HA SER A 3 18.048 -0.076 -15.990 1.00 0.00 H new ATOM 0 HB2 SER A 3 19.957 1.701 -15.648 1.00 0.00 H new ATOM 0 HB3 SER A 3 19.028 1.590 -17.130 1.00 0.00 H new ATOM 0 HG SER A 3 19.201 3.765 -16.363 1.00 0.00 H new ATOM 29 N LYS A 4 17.936 -0.662 -13.500 1.00 0.00 N ATOM 30 CA LYS A 4 17.963 -1.116 -12.115 1.00 0.00 C ATOM 31 C LYS A 4 17.380 -0.050 -11.194 1.00 0.00 C ATOM 32 O LYS A 4 16.699 0.865 -11.659 1.00 0.00 O ATOM 33 CB LYS A 4 19.337 -1.697 -11.729 1.00 0.00 C ATOM 34 CG LYS A 4 20.475 -0.678 -11.588 1.00 0.00 C ATOM 35 CD LYS A 4 21.531 -1.112 -10.576 1.00 0.00 C ATOM 36 CE LYS A 4 22.705 -0.134 -10.644 1.00 0.00 C ATOM 37 NZ LYS A 4 23.395 0.013 -9.349 1.00 0.00 N ATOM 0 H LYS A 4 17.500 -1.345 -14.119 1.00 0.00 H new ATOM 0 HA LYS A 4 17.300 -1.972 -11.986 1.00 0.00 H new ATOM 0 HB2 LYS A 4 19.233 -2.230 -10.784 1.00 0.00 H new ATOM 0 HB3 LYS A 4 19.624 -2.433 -12.480 1.00 0.00 H new ATOM 0 HG2 LYS A 4 20.947 -0.530 -12.559 1.00 0.00 H new ATOM 0 HG3 LYS A 4 20.061 0.284 -11.285 1.00 0.00 H new ATOM 0 HD2 LYS A 4 21.109 -1.126 -9.571 1.00 0.00 H new ATOM 0 HD3 LYS A 4 21.870 -2.125 -10.794 1.00 0.00 H new ATOM 0 HE2 LYS A 4 23.417 -0.478 -11.394 1.00 0.00 H new ATOM 0 HE3 LYS A 4 22.343 0.841 -10.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 24.182 0.686 -9.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 22.725 0.367 -8.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 23.766 -0.910 -9.046 1.00 0.00 H new ATOM 51 N LYS A 5 17.600 -0.211 -9.894 1.00 0.00 N ATOM 52 CA LYS A 5 17.054 0.595 -8.817 1.00 0.00 C ATOM 53 C LYS A 5 15.530 0.530 -8.700 1.00 0.00 C ATOM 54 O LYS A 5 14.829 0.210 -9.659 1.00 0.00 O ATOM 55 CB LYS A 5 17.650 2.015 -8.815 1.00 0.00 C ATOM 56 CG LYS A 5 16.701 3.119 -9.311 1.00 0.00 C ATOM 57 CD LYS A 5 17.427 4.465 -9.337 1.00 0.00 C ATOM 58 CE LYS A 5 16.423 5.624 -9.348 1.00 0.00 C ATOM 59 NZ LYS A 5 17.101 6.923 -9.502 1.00 0.00 N ATOM 0 H LYS A 5 18.203 -0.956 -9.546 1.00 0.00 H new ATOM 0 HA LYS A 5 17.382 0.139 -7.883 1.00 0.00 H new ATOM 0 HB2 LYS A 5 17.967 2.258 -7.801 1.00 0.00 H new ATOM 0 HB3 LYS A 5 18.544 2.018 -9.438 1.00 0.00 H new ATOM 0 HG2 LYS A 5 16.336 2.875 -10.309 1.00 0.00 H new ATOM 0 HG3 LYS A 5 15.829 3.180 -8.659 1.00 0.00 H new ATOM 0 HD2 LYS A 5 18.078 4.549 -8.466 1.00 0.00 H new ATOM 0 HD3 LYS A 5 18.065 4.522 -10.219 1.00 0.00 H new ATOM 0 HE2 LYS A 5 15.713 5.484 -10.163 1.00 0.00 H new ATOM 0 HE3 LYS A 5 15.850 5.619 -8.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 16.394 7.685 -9.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 17.761 7.066 -8.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 17.628 6.935 -10.399 1.00 0.00 H new ATOM 73 N VAL A 6 15.033 0.857 -7.506 1.00 0.00 N ATOM 74 CA VAL A 6 13.610 1.061 -7.234 1.00 0.00 C ATOM 75 C VAL A 6 13.396 2.437 -6.601 1.00 0.00 C ATOM 76 O VAL A 6 14.290 2.955 -5.934 1.00 0.00 O ATOM 77 CB VAL A 6 13.076 -0.102 -6.371 1.00 0.00 C ATOM 78 CG1 VAL A 6 11.585 0.024 -6.022 1.00 0.00 C ATOM 79 CG2 VAL A 6 13.284 -1.423 -7.098 1.00 0.00 C ATOM 0 H VAL A 6 15.622 0.990 -6.684 1.00 0.00 H new ATOM 0 HA VAL A 6 13.037 1.053 -8.161 1.00 0.00 H new ATOM 0 HB VAL A 6 13.638 -0.065 -5.438 1.00 0.00 H new ATOM 0 HG11 VAL A 6 11.280 -0.828 -5.414 1.00 0.00 H new ATOM 0 HG12 VAL A 6 11.419 0.945 -5.464 1.00 0.00 H new ATOM 0 HG13 VAL A 6 10.997 0.044 -6.940 1.00 0.00 H new ATOM 0 HG21 VAL A 6 12.905 -2.240 -6.484 1.00 0.00 H new ATOM 0 HG22 VAL A 6 12.749 -1.404 -8.047 1.00 0.00 H new ATOM 0 HG23 VAL A 6 14.348 -1.572 -7.284 1.00 0.00 H new ATOM 89 N THR A 7 12.208 3.023 -6.778 1.00 0.00 N ATOM 90 CA THR A 7 11.827 4.316 -6.219 1.00 0.00 C ATOM 91 C THR A 7 10.393 4.247 -5.714 1.00 0.00 C ATOM 92 O THR A 7 9.637 3.329 -6.036 1.00 0.00 O ATOM 93 CB THR A 7 11.930 5.411 -7.305 1.00 0.00 C ATOM 94 OG1 THR A 7 10.933 5.204 -8.291 1.00 0.00 O ATOM 95 CG2 THR A 7 13.288 5.485 -7.996 1.00 0.00 C ATOM 0 H THR A 7 11.466 2.595 -7.331 1.00 0.00 H new ATOM 0 HA THR A 7 12.498 4.560 -5.396 1.00 0.00 H new ATOM 0 HB THR A 7 11.789 6.357 -6.782 1.00 0.00 H new ATOM 0 HG1 THR A 7 11.001 5.901 -8.976 1.00 0.00 H new ATOM 0 HG21 THR A 7 13.274 6.279 -8.743 1.00 0.00 H new ATOM 0 HG22 THR A 7 14.061 5.696 -7.257 1.00 0.00 H new ATOM 0 HG23 THR A 7 13.501 4.533 -8.483 1.00 0.00 H new ATOM 103 N LYS A 8 9.991 5.254 -4.939 1.00 0.00 N ATOM 104 CA LYS A 8 8.681 5.294 -4.326 1.00 0.00 C ATOM 105 C LYS A 8 7.580 5.369 -5.374 1.00 0.00 C ATOM 106 O LYS A 8 6.478 4.875 -5.159 1.00 0.00 O ATOM 107 CB LYS A 8 8.631 6.483 -3.367 1.00 0.00 C ATOM 108 CG LYS A 8 9.006 7.844 -3.964 1.00 0.00 C ATOM 109 CD LYS A 8 8.901 9.012 -2.966 1.00 0.00 C ATOM 110 CE LYS A 8 7.517 9.199 -2.334 1.00 0.00 C ATOM 111 NZ LYS A 8 6.517 9.768 -3.268 1.00 0.00 N ATOM 0 H LYS A 8 10.573 6.063 -4.723 1.00 0.00 H new ATOM 0 HA LYS A 8 8.509 4.374 -3.768 1.00 0.00 H new ATOM 0 HB2 LYS A 8 7.623 6.553 -2.959 1.00 0.00 H new ATOM 0 HB3 LYS A 8 9.300 6.278 -2.531 1.00 0.00 H new ATOM 0 HG2 LYS A 8 10.026 7.794 -4.345 1.00 0.00 H new ATOM 0 HG3 LYS A 8 8.357 8.047 -4.816 1.00 0.00 H new ATOM 0 HD2 LYS A 8 9.630 8.857 -2.170 1.00 0.00 H new ATOM 0 HD3 LYS A 8 9.178 9.934 -3.477 1.00 0.00 H new ATOM 0 HE2 LYS A 8 7.158 8.236 -1.971 1.00 0.00 H new ATOM 0 HE3 LYS A 8 7.607 9.853 -1.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 5.604 9.869 -2.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 6.840 10.701 -3.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 6.405 9.134 -4.085 1.00 0.00 H new ATOM 125 N GLU A 9 7.890 5.992 -6.499 1.00 0.00 N ATOM 126 CA GLU A 9 6.974 6.194 -7.598 1.00 0.00 C ATOM 127 C GLU A 9 6.711 4.878 -8.328 1.00 0.00 C ATOM 128 O GLU A 9 5.602 4.634 -8.805 1.00 0.00 O ATOM 129 CB GLU A 9 7.617 7.241 -8.507 1.00 0.00 C ATOM 130 CG GLU A 9 6.606 7.849 -9.472 1.00 0.00 C ATOM 131 CD GLU A 9 6.852 9.348 -9.601 1.00 0.00 C ATOM 132 OE1 GLU A 9 7.889 9.760 -10.162 1.00 0.00 O ATOM 133 OE2 GLU A 9 6.075 10.127 -8.994 1.00 0.00 O ATOM 0 H GLU A 9 8.816 6.382 -6.673 1.00 0.00 H new ATOM 0 HA GLU A 9 6.000 6.543 -7.254 1.00 0.00 H new ATOM 0 HB2 GLU A 9 8.058 8.030 -7.898 1.00 0.00 H new ATOM 0 HB3 GLU A 9 8.429 6.783 -9.072 1.00 0.00 H new ATOM 0 HG2 GLU A 9 6.689 7.372 -10.449 1.00 0.00 H new ATOM 0 HG3 GLU A 9 5.593 7.667 -9.114 1.00 0.00 H new ATOM 141 N ASP A 10 7.720 4.007 -8.381 1.00 0.00 N ATOM 142 CA ASP A 10 7.595 2.672 -8.945 1.00 0.00 C ATOM 143 C ASP A 10 6.839 1.789 -7.965 1.00 0.00 C ATOM 144 O ASP A 10 5.942 1.059 -8.363 1.00 0.00 O ATOM 145 CB ASP A 10 8.969 2.086 -9.280 1.00 0.00 C ATOM 146 CG ASP A 10 9.319 2.354 -10.741 1.00 0.00 C ATOM 147 OD1 ASP A 10 8.797 1.616 -11.609 1.00 0.00 O ATOM 148 OD2 ASP A 10 10.030 3.334 -11.060 1.00 0.00 O ATOM 0 H ASP A 10 8.654 4.216 -8.029 1.00 0.00 H new ATOM 0 HA ASP A 10 7.036 2.725 -9.880 1.00 0.00 H new ATOM 0 HB2 ASP A 10 9.727 2.525 -8.631 1.00 0.00 H new ATOM 0 HB3 ASP A 10 8.970 1.013 -9.090 1.00 0.00 H new ATOM 154 N VAL A 11 7.123 1.902 -6.668 1.00 0.00 N ATOM 155 CA VAL A 11 6.399 1.183 -5.618 1.00 0.00 C ATOM 156 C VAL A 11 4.898 1.477 -5.679 1.00 0.00 C ATOM 157 O VAL A 11 4.091 0.564 -5.515 1.00 0.00 O ATOM 158 CB VAL A 11 7.039 1.497 -4.251 1.00 0.00 C ATOM 159 CG1 VAL A 11 6.263 0.942 -3.051 1.00 0.00 C ATOM 160 CG2 VAL A 11 8.462 0.915 -4.203 1.00 0.00 C ATOM 0 H VAL A 11 7.869 2.500 -6.312 1.00 0.00 H new ATOM 0 HA VAL A 11 6.485 0.108 -5.775 1.00 0.00 H new ATOM 0 HB VAL A 11 7.035 2.584 -4.167 1.00 0.00 H new ATOM 0 HG11 VAL A 11 6.780 1.207 -2.129 1.00 0.00 H new ATOM 0 HG12 VAL A 11 5.259 1.367 -3.039 1.00 0.00 H new ATOM 0 HG13 VAL A 11 6.197 -0.143 -3.131 1.00 0.00 H new ATOM 0 HG21 VAL A 11 8.914 1.137 -3.236 1.00 0.00 H new ATOM 0 HG22 VAL A 11 8.418 -0.165 -4.343 1.00 0.00 H new ATOM 0 HG23 VAL A 11 9.064 1.360 -4.996 1.00 0.00 H new ATOM 170 N LEU A 12 4.499 2.715 -5.974 1.00 0.00 N ATOM 171 CA LEU A 12 3.101 3.089 -6.074 1.00 0.00 C ATOM 172 C LEU A 12 2.518 2.451 -7.323 1.00 0.00 C ATOM 173 O LEU A 12 1.487 1.785 -7.249 1.00 0.00 O ATOM 174 CB LEU A 12 2.988 4.615 -6.132 1.00 0.00 C ATOM 175 CG LEU A 12 3.171 5.287 -4.761 1.00 0.00 C ATOM 176 CD1 LEU A 12 3.389 6.784 -4.972 1.00 0.00 C ATOM 177 CD2 LEU A 12 1.965 5.069 -3.836 1.00 0.00 C ATOM 0 H LEU A 12 5.145 3.485 -6.150 1.00 0.00 H new ATOM 0 HA LEU A 12 2.545 2.739 -5.204 1.00 0.00 H new ATOM 0 HB2 LEU A 12 3.737 5.003 -6.823 1.00 0.00 H new ATOM 0 HB3 LEU A 12 2.012 4.886 -6.535 1.00 0.00 H new ATOM 0 HG LEU A 12 4.035 4.832 -4.276 1.00 0.00 H new ATOM 0 HD11 LEU A 12 3.520 7.272 -4.006 1.00 0.00 H new ATOM 0 HD12 LEU A 12 4.279 6.940 -5.581 1.00 0.00 H new ATOM 0 HD13 LEU A 12 2.523 7.210 -5.479 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.145 5.563 -2.881 1.00 0.00 H new ATOM 0 HD22 LEU A 12 1.071 5.487 -4.299 1.00 0.00 H new ATOM 0 HD23 LEU A 12 1.822 4.001 -3.670 1.00 0.00 H new ATOM 189 N ASN A 13 3.194 2.612 -8.459 1.00 0.00 N ATOM 190 CA ASN A 13 2.816 2.043 -9.738 1.00 0.00 C ATOM 191 C ASN A 13 2.702 0.513 -9.683 1.00 0.00 C ATOM 192 O ASN A 13 1.869 -0.068 -10.376 1.00 0.00 O ATOM 193 CB ASN A 13 3.882 2.483 -10.745 1.00 0.00 C ATOM 194 CG ASN A 13 3.491 3.735 -11.518 1.00 0.00 C ATOM 195 OD1 ASN A 13 2.536 3.729 -12.286 1.00 0.00 O ATOM 196 ND2 ASN A 13 4.204 4.834 -11.349 1.00 0.00 N ATOM 0 H ASN A 13 4.051 3.164 -8.509 1.00 0.00 H new ATOM 0 HA ASN A 13 1.827 2.398 -10.029 1.00 0.00 H new ATOM 0 HB2 ASN A 13 4.818 2.666 -10.218 1.00 0.00 H new ATOM 0 HB3 ASN A 13 4.066 1.671 -11.449 1.00 0.00 H new ATOM 0 HD21 ASN A 13 3.961 5.683 -11.859 1.00 0.00 H new ATOM 0 HD22 ASN A 13 4.998 4.833 -10.709 1.00 0.00 H new ATOM 203 N ALA A 14 3.493 -0.156 -8.842 1.00 0.00 N ATOM 204 CA ALA A 14 3.448 -1.591 -8.646 1.00 0.00 C ATOM 205 C ALA A 14 2.251 -1.943 -7.764 1.00 0.00 C ATOM 206 O ALA A 14 1.515 -2.889 -8.058 1.00 0.00 O ATOM 207 CB ALA A 14 4.754 -2.045 -8.000 1.00 0.00 C ATOM 0 H ALA A 14 4.198 0.305 -8.267 1.00 0.00 H new ATOM 0 HA ALA A 14 3.334 -2.102 -9.602 1.00 0.00 H new ATOM 0 HB1 ALA A 14 4.729 -3.124 -7.849 1.00 0.00 H new ATOM 0 HB2 ALA A 14 5.590 -1.789 -8.651 1.00 0.00 H new ATOM 0 HB3 ALA A 14 4.877 -1.546 -7.038 1.00 0.00 H new ATOM 213 N LEU A 15 2.040 -1.179 -6.687 1.00 0.00 N ATOM 214 CA LEU A 15 0.951 -1.395 -5.747 1.00 0.00 C ATOM 215 C LEU A 15 -0.416 -1.157 -6.386 1.00 0.00 C ATOM 216 O LEU A 15 -1.360 -1.871 -6.061 1.00 0.00 O ATOM 217 CB LEU A 15 1.119 -0.509 -4.507 1.00 0.00 C ATOM 218 CG LEU A 15 2.091 -1.075 -3.455 1.00 0.00 C ATOM 219 CD1 LEU A 15 2.445 0.024 -2.445 1.00 0.00 C ATOM 220 CD2 LEU A 15 1.503 -2.282 -2.708 1.00 0.00 C ATOM 0 H LEU A 15 2.632 -0.384 -6.446 1.00 0.00 H new ATOM 0 HA LEU A 15 0.994 -2.441 -5.444 1.00 0.00 H new ATOM 0 HB2 LEU A 15 1.472 0.473 -4.821 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.143 -0.363 -4.043 1.00 0.00 H new ATOM 0 HG LEU A 15 2.983 -1.415 -3.981 1.00 0.00 H new ATOM 0 HD11 LEU A 15 3.133 -0.375 -1.700 1.00 0.00 H new ATOM 0 HD12 LEU A 15 2.917 0.858 -2.965 1.00 0.00 H new ATOM 0 HD13 LEU A 15 1.537 0.371 -1.952 1.00 0.00 H new ATOM 0 HD21 LEU A 15 2.226 -2.645 -1.977 1.00 0.00 H new ATOM 0 HD22 LEU A 15 0.588 -1.983 -2.196 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.277 -3.076 -3.420 1.00 0.00 H new ATOM 232 N LYS A 16 -0.517 -0.248 -7.360 1.00 0.00 N ATOM 233 CA LYS A 16 -1.710 0.054 -8.168 1.00 0.00 C ATOM 234 C LYS A 16 -2.313 -1.158 -8.894 1.00 0.00 C ATOM 235 O LYS A 16 -3.352 -1.031 -9.539 1.00 0.00 O ATOM 236 CB LYS A 16 -1.334 1.150 -9.186 1.00 0.00 C ATOM 237 CG LYS A 16 -1.428 2.550 -8.569 1.00 0.00 C ATOM 238 CD LYS A 16 -0.563 3.594 -9.284 1.00 0.00 C ATOM 239 CE LYS A 16 -1.141 5.004 -9.130 1.00 0.00 C ATOM 240 NZ LYS A 16 -1.861 5.416 -10.345 1.00 0.00 N ATOM 0 H LYS A 16 0.278 0.334 -7.624 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.488 0.387 -7.481 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -0.320 0.979 -9.548 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -1.996 1.087 -10.050 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -2.468 2.877 -8.587 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -1.129 2.498 -7.522 1.00 0.00 H new ATOM 0 HD2 LYS A 16 0.449 3.568 -8.879 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -0.489 3.344 -10.342 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -1.817 5.032 -8.276 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -0.337 5.710 -8.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -2.243 6.375 -10.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -1.208 5.411 -11.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -2.642 4.754 -10.527 1.00 0.00 H new ATOM 254 N ASN A 17 -1.684 -2.326 -8.815 1.00 0.00 N ATOM 255 CA ASN A 17 -2.080 -3.565 -9.478 1.00 0.00 C ATOM 256 C ASN A 17 -2.762 -4.511 -8.490 1.00 0.00 C ATOM 257 O ASN A 17 -3.588 -5.322 -8.907 1.00 0.00 O ATOM 258 CB ASN A 17 -0.839 -4.278 -10.028 1.00 0.00 C ATOM 259 CG ASN A 17 -0.143 -3.540 -11.166 1.00 0.00 C ATOM 260 OD1 ASN A 17 -0.490 -3.647 -12.339 1.00 0.00 O ATOM 261 ND2 ASN A 17 0.916 -2.819 -10.850 1.00 0.00 N ATOM 0 H ASN A 17 -0.838 -2.441 -8.257 1.00 0.00 H new ATOM 0 HA ASN A 17 -2.769 -3.310 -10.283 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -0.127 -4.422 -9.215 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -1.129 -5.269 -10.377 1.00 0.00 H new ATOM 0 HD21 ASN A 17 1.449 -2.348 -11.581 1.00 0.00 H new ATOM 0 HD22 ASN A 17 1.201 -2.732 -9.875 1.00 0.00 H new ATOM 268 N VAL A 18 -2.405 -4.441 -7.204 1.00 0.00 N ATOM 269 CA VAL A 18 -3.007 -5.230 -6.138 1.00 0.00 C ATOM 270 C VAL A 18 -4.428 -4.721 -5.910 1.00 0.00 C ATOM 271 O VAL A 18 -4.770 -3.612 -6.320 1.00 0.00 O ATOM 272 CB VAL A 18 -2.086 -5.130 -4.896 1.00 0.00 C ATOM 273 CG1 VAL A 18 -2.711 -5.480 -3.538 1.00 0.00 C ATOM 274 CG2 VAL A 18 -0.903 -6.074 -5.119 1.00 0.00 C ATOM 0 H VAL A 18 -1.670 -3.816 -6.873 1.00 0.00 H new ATOM 0 HA VAL A 18 -3.094 -6.288 -6.385 1.00 0.00 H new ATOM 0 HB VAL A 18 -1.821 -4.075 -4.823 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.962 -5.370 -2.754 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -3.547 -4.809 -3.339 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -3.068 -6.510 -3.556 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -0.233 -6.027 -4.260 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -1.269 -7.094 -5.239 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -0.363 -5.774 -6.017 1.00 0.00 H new ATOM 284 N ILE A 19 -5.257 -5.531 -5.256 1.00 0.00 N ATOM 285 CA ILE A 19 -6.560 -5.162 -4.751 1.00 0.00 C ATOM 286 C ILE A 19 -6.696 -5.757 -3.351 1.00 0.00 C ATOM 287 O ILE A 19 -6.343 -6.924 -3.136 1.00 0.00 O ATOM 288 CB ILE A 19 -7.645 -5.702 -5.697 1.00 0.00 C ATOM 289 CG1 ILE A 19 -7.525 -5.159 -7.134 1.00 0.00 C ATOM 290 CG2 ILE A 19 -9.034 -5.387 -5.151 1.00 0.00 C ATOM 291 CD1 ILE A 19 -7.915 -3.685 -7.319 1.00 0.00 C ATOM 0 H ILE A 19 -5.020 -6.503 -5.059 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.676 -4.079 -4.699 1.00 0.00 H new ATOM 0 HB ILE A 19 -7.494 -6.780 -5.745 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.496 -5.289 -7.468 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -8.151 -5.767 -7.787 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -9.790 -5.776 -5.833 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -9.154 -5.852 -4.172 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -9.152 -4.307 -5.057 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.794 -3.405 -8.366 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -8.955 -3.544 -7.023 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -7.273 -3.058 -6.700 1.00 0.00 H new ATOM 303 N ASP A 20 -7.252 -4.964 -2.441 1.00 0.00 N ATOM 304 CA ASP A 20 -7.731 -5.387 -1.131 1.00 0.00 C ATOM 305 C ASP A 20 -9.047 -6.120 -1.339 1.00 0.00 C ATOM 306 O ASP A 20 -10.038 -5.491 -1.717 1.00 0.00 O ATOM 307 CB ASP A 20 -8.010 -4.180 -0.214 1.00 0.00 C ATOM 308 CG ASP A 20 -6.863 -3.842 0.730 1.00 0.00 C ATOM 309 OD1 ASP A 20 -7.138 -3.601 1.925 1.00 0.00 O ATOM 310 OD2 ASP A 20 -5.709 -3.693 0.274 1.00 0.00 O ATOM 0 H ASP A 20 -7.387 -3.966 -2.604 1.00 0.00 H new ATOM 0 HA ASP A 20 -6.971 -6.013 -0.664 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -8.227 -3.309 -0.833 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -8.904 -4.383 0.375 1.00 0.00 H new ATOM 316 N PHE A 21 -9.100 -7.415 -1.032 1.00 0.00 N ATOM 317 CA PHE A 21 -10.340 -8.192 -1.017 1.00 0.00 C ATOM 318 C PHE A 21 -11.344 -7.706 0.037 1.00 0.00 C ATOM 319 O PHE A 21 -12.477 -8.184 0.079 1.00 0.00 O ATOM 320 CB PHE A 21 -10.012 -9.677 -0.814 1.00 0.00 C ATOM 321 CG PHE A 21 -10.032 -10.468 -2.103 1.00 0.00 C ATOM 322 CD1 PHE A 21 -9.023 -10.284 -3.065 1.00 0.00 C ATOM 323 CD2 PHE A 21 -11.092 -11.353 -2.365 1.00 0.00 C ATOM 324 CE1 PHE A 21 -9.068 -10.993 -4.279 1.00 0.00 C ATOM 325 CE2 PHE A 21 -11.130 -12.069 -3.571 1.00 0.00 C ATOM 326 CZ PHE A 21 -10.118 -11.895 -4.523 1.00 0.00 C ATOM 0 H PHE A 21 -8.275 -7.961 -0.784 1.00 0.00 H new ATOM 0 HA PHE A 21 -10.826 -8.049 -1.982 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -9.028 -9.767 -0.354 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -10.730 -10.110 -0.117 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -8.212 -9.597 -2.871 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -11.879 -11.482 -1.637 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -8.298 -10.845 -5.022 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -11.941 -12.755 -3.765 1.00 0.00 H new ATOM 0 HZ PHE A 21 -10.144 -12.455 -5.446 1.00 0.00 H new ATOM 336 N GLU A 22 -10.957 -6.796 0.928 1.00 0.00 N ATOM 337 CA GLU A 22 -11.871 -6.067 1.773 1.00 0.00 C ATOM 338 C GLU A 22 -12.750 -5.109 0.949 1.00 0.00 C ATOM 339 O GLU A 22 -13.919 -4.928 1.306 1.00 0.00 O ATOM 340 CB GLU A 22 -11.008 -5.359 2.827 1.00 0.00 C ATOM 341 CG GLU A 22 -11.867 -4.740 3.927 1.00 0.00 C ATOM 342 CD GLU A 22 -11.060 -4.152 5.095 1.00 0.00 C ATOM 343 OE1 GLU A 22 -9.885 -3.774 4.884 1.00 0.00 O ATOM 344 OE2 GLU A 22 -11.603 -4.070 6.226 1.00 0.00 O ATOM 0 H GLU A 22 -9.979 -6.547 1.078 1.00 0.00 H new ATOM 0 HA GLU A 22 -12.583 -6.726 2.269 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -10.310 -6.072 3.266 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -10.411 -4.582 2.349 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -12.484 -3.953 3.493 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -12.546 -5.500 4.314 1.00 0.00 H new ATOM 352 N LEU A 23 -12.245 -4.512 -0.142 1.00 0.00 N ATOM 353 CA LEU A 23 -12.851 -3.346 -0.793 1.00 0.00 C ATOM 354 C LEU A 23 -13.096 -3.513 -2.293 1.00 0.00 C ATOM 355 O LEU A 23 -14.111 -3.011 -2.791 1.00 0.00 O ATOM 356 CB LEU A 23 -11.972 -2.093 -0.557 1.00 0.00 C ATOM 357 CG LEU A 23 -12.575 -1.048 0.397 1.00 0.00 C ATOM 358 CD1 LEU A 23 -13.883 -0.454 -0.140 1.00 0.00 C ATOM 359 CD2 LEU A 23 -12.767 -1.604 1.809 1.00 0.00 C ATOM 0 H LEU A 23 -11.392 -4.832 -0.601 1.00 0.00 H new ATOM 0 HA LEU A 23 -13.833 -3.232 -0.333 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -11.009 -2.413 -0.160 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -11.778 -1.617 -1.518 1.00 0.00 H new ATOM 0 HG LEU A 23 -11.849 -0.237 0.456 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -14.269 0.278 0.570 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -13.696 0.032 -1.097 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -14.616 -1.250 -0.274 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -13.195 -0.832 2.449 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -13.440 -2.461 1.774 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -11.803 -1.916 2.212 1.00 0.00 H new ATOM 371 N GLY A 24 -12.203 -4.177 -3.024 1.00 0.00 N ATOM 372 CA GLY A 24 -12.250 -4.242 -4.481 1.00 0.00 C ATOM 373 C GLY A 24 -11.502 -3.082 -5.147 1.00 0.00 C ATOM 374 O GLY A 24 -11.709 -2.830 -6.340 1.00 0.00 O ATOM 0 H GLY A 24 -11.420 -4.689 -2.617 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -11.818 -5.186 -4.813 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -13.290 -4.234 -4.808 1.00 0.00 H new ATOM 378 N LEU A 25 -10.647 -2.369 -4.406 1.00 0.00 N ATOM 379 CA LEU A 25 -9.782 -1.293 -4.889 1.00 0.00 C ATOM 380 C LEU A 25 -8.350 -1.551 -4.440 1.00 0.00 C ATOM 381 O LEU A 25 -8.107 -2.360 -3.545 1.00 0.00 O ATOM 382 CB LEU A 25 -10.251 0.057 -4.321 1.00 0.00 C ATOM 383 CG LEU A 25 -11.521 0.659 -4.931 1.00 0.00 C ATOM 384 CD1 LEU A 25 -11.867 1.937 -4.161 1.00 0.00 C ATOM 385 CD2 LEU A 25 -11.332 1.020 -6.403 1.00 0.00 C ATOM 0 H LEU A 25 -10.536 -2.536 -3.406 1.00 0.00 H new ATOM 0 HA LEU A 25 -9.830 -1.263 -5.978 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -10.412 -0.063 -3.250 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -9.441 0.777 -4.443 1.00 0.00 H new ATOM 0 HG LEU A 25 -12.317 -0.083 -4.862 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -12.770 2.381 -4.581 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -12.036 1.695 -3.112 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -11.042 2.645 -4.242 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -12.257 1.443 -6.795 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -10.529 1.751 -6.498 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -11.075 0.124 -6.967 1.00 0.00 H new ATOM 397 N ASP A 26 -7.410 -0.856 -5.078 1.00 0.00 N ATOM 398 CA ASP A 26 -5.985 -0.942 -4.795 1.00 0.00 C ATOM 399 C ASP A 26 -5.594 0.076 -3.716 1.00 0.00 C ATOM 400 O ASP A 26 -6.235 1.121 -3.584 1.00 0.00 O ATOM 401 CB ASP A 26 -5.192 -0.704 -6.092 1.00 0.00 C ATOM 402 CG ASP A 26 -5.064 0.769 -6.484 1.00 0.00 C ATOM 403 OD1 ASP A 26 -5.868 1.252 -7.325 1.00 0.00 O ATOM 404 OD2 ASP A 26 -4.164 1.442 -5.948 1.00 0.00 O ATOM 0 H ASP A 26 -7.629 -0.199 -5.827 1.00 0.00 H new ATOM 0 HA ASP A 26 -5.748 -1.936 -4.416 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -4.194 -1.127 -5.978 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -5.676 -1.245 -6.905 1.00 0.00 H new ATOM 410 N VAL A 27 -4.500 -0.167 -2.994 1.00 0.00 N ATOM 411 CA VAL A 27 -4.029 0.644 -1.873 1.00 0.00 C ATOM 412 C VAL A 27 -3.675 2.096 -2.204 1.00 0.00 C ATOM 413 O VAL A 27 -3.628 2.945 -1.302 1.00 0.00 O ATOM 414 CB VAL A 27 -2.809 -0.023 -1.233 1.00 0.00 C ATOM 415 CG1 VAL A 27 -3.088 -1.385 -0.584 1.00 0.00 C ATOM 416 CG2 VAL A 27 -1.671 -0.209 -2.234 1.00 0.00 C ATOM 0 H VAL A 27 -3.894 -0.966 -3.182 1.00 0.00 H new ATOM 0 HA VAL A 27 -4.879 0.695 -1.193 1.00 0.00 H new ATOM 0 HB VAL A 27 -2.526 0.673 -0.444 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.166 -1.780 -0.157 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.831 -1.267 0.204 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -3.465 -2.077 -1.337 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -0.825 -0.686 -1.739 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.010 -0.837 -3.058 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -1.364 0.763 -2.621 1.00 0.00 H new ATOM 426 N VAL A 28 -3.365 2.418 -3.459 1.00 0.00 N ATOM 427 CA VAL A 28 -3.087 3.786 -3.874 1.00 0.00 C ATOM 428 C VAL A 28 -4.429 4.482 -4.085 1.00 0.00 C ATOM 429 O VAL A 28 -4.591 5.628 -3.656 1.00 0.00 O ATOM 430 CB VAL A 28 -2.145 3.811 -5.097 1.00 0.00 C ATOM 431 CG1 VAL A 28 -1.706 5.245 -5.408 1.00 0.00 C ATOM 432 CG2 VAL A 28 -0.886 2.963 -4.818 1.00 0.00 C ATOM 0 H VAL A 28 -3.300 1.736 -4.214 1.00 0.00 H new ATOM 0 HA VAL A 28 -2.542 4.340 -3.109 1.00 0.00 H new ATOM 0 HB VAL A 28 -2.689 3.401 -5.948 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -1.043 5.243 -6.273 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.583 5.855 -5.625 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.180 5.659 -4.548 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -0.230 2.989 -5.688 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.359 3.368 -3.954 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -1.179 1.933 -4.615 1.00 0.00 H new ATOM 442 N SER A 29 -5.432 3.766 -4.598 1.00 0.00 N ATOM 443 CA SER A 29 -6.803 4.265 -4.626 1.00 0.00 C ATOM 444 C SER A 29 -7.350 4.421 -3.201 1.00 0.00 C ATOM 445 O SER A 29 -8.022 5.407 -2.917 1.00 0.00 O ATOM 446 CB SER A 29 -7.710 3.378 -5.484 1.00 0.00 C ATOM 447 OG SER A 29 -7.273 3.390 -6.833 1.00 0.00 O ATOM 0 H SER A 29 -5.317 2.836 -5.000 1.00 0.00 H new ATOM 0 HA SER A 29 -6.792 5.250 -5.092 1.00 0.00 H new ATOM 0 HB2 SER A 29 -7.701 2.358 -5.100 1.00 0.00 H new ATOM 0 HB3 SER A 29 -8.739 3.732 -5.424 1.00 0.00 H new ATOM 0 HG SER A 29 -6.560 2.728 -6.952 1.00 0.00 H new ATOM 453 N LEU A 30 -7.033 3.496 -2.288 1.00 0.00 N ATOM 454 CA LEU A 30 -7.358 3.586 -0.864 1.00 0.00 C ATOM 455 C LEU A 30 -6.476 4.587 -0.103 1.00 0.00 C ATOM 456 O LEU A 30 -6.754 4.849 1.061 1.00 0.00 O ATOM 457 CB LEU A 30 -7.304 2.200 -0.202 1.00 0.00 C ATOM 458 CG LEU A 30 -8.704 1.619 0.038 1.00 0.00 C ATOM 459 CD1 LEU A 30 -9.194 0.843 -1.176 1.00 0.00 C ATOM 460 CD2 LEU A 30 -8.780 0.796 1.309 1.00 0.00 C ATOM 0 H LEU A 30 -6.530 2.642 -2.528 1.00 0.00 H new ATOM 0 HA LEU A 30 -8.377 3.968 -0.807 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -6.733 1.519 -0.833 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -6.775 2.273 0.748 1.00 0.00 H new ATOM 0 HG LEU A 30 -9.380 2.462 0.183 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -10.188 0.444 -0.976 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -9.237 1.507 -2.039 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -8.508 0.022 -1.384 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -9.791 0.408 1.432 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -8.078 -0.035 1.247 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -8.526 1.423 2.164 1.00 0.00 H new ATOM 472 N GLY A 31 -5.414 5.161 -0.673 1.00 0.00 N ATOM 473 CA GLY A 31 -4.628 6.176 0.031 1.00 0.00 C ATOM 474 C GLY A 31 -3.993 5.703 1.355 1.00 0.00 C ATOM 475 O GLY A 31 -3.780 6.533 2.241 1.00 0.00 O ATOM 0 H GLY A 31 -5.081 4.943 -1.612 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -3.835 6.525 -0.631 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -5.270 7.032 0.238 1.00 0.00 H new ATOM 479 N LEU A 32 -3.769 4.393 1.546 1.00 0.00 N ATOM 480 CA LEU A 32 -3.330 3.792 2.822 1.00 0.00 C ATOM 481 C LEU A 32 -1.870 4.069 3.166 1.00 0.00 C ATOM 482 O LEU A 32 -1.459 3.885 4.310 1.00 0.00 O ATOM 483 CB LEU A 32 -3.508 2.267 2.781 1.00 0.00 C ATOM 484 CG LEU A 32 -4.979 1.828 2.826 1.00 0.00 C ATOM 485 CD1 LEU A 32 -5.129 0.536 2.027 1.00 0.00 C ATOM 486 CD2 LEU A 32 -5.525 1.616 4.238 1.00 0.00 C ATOM 0 H LEU A 32 -3.890 3.705 0.803 1.00 0.00 H new ATOM 0 HA LEU A 32 -3.955 4.256 3.585 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -3.047 1.878 1.873 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -2.977 1.823 3.623 1.00 0.00 H new ATOM 0 HG LEU A 32 -5.563 2.641 2.395 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -6.170 0.212 2.050 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -4.826 0.710 0.994 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -4.498 -0.238 2.465 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -6.569 1.308 4.182 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -4.944 0.842 4.740 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -5.451 2.547 4.800 1.00 0.00 H new ATOM 498 N VAL A 33 -1.065 4.441 2.178 1.00 0.00 N ATOM 499 CA VAL A 33 0.361 4.650 2.350 1.00 0.00 C ATOM 500 C VAL A 33 0.566 5.958 3.125 1.00 0.00 C ATOM 501 O VAL A 33 0.232 7.042 2.629 1.00 0.00 O ATOM 502 CB VAL A 33 1.031 4.618 0.961 1.00 0.00 C ATOM 503 CG1 VAL A 33 2.530 4.857 1.074 1.00 0.00 C ATOM 504 CG2 VAL A 33 0.823 3.277 0.222 1.00 0.00 C ATOM 0 H VAL A 33 -1.391 4.607 1.226 1.00 0.00 H new ATOM 0 HA VAL A 33 0.835 3.864 2.937 1.00 0.00 H new ATOM 0 HB VAL A 33 0.552 5.413 0.389 1.00 0.00 H new ATOM 0 HG11 VAL A 33 2.979 4.829 0.081 1.00 0.00 H new ATOM 0 HG12 VAL A 33 2.710 5.832 1.527 1.00 0.00 H new ATOM 0 HG13 VAL A 33 2.976 4.081 1.695 1.00 0.00 H new ATOM 0 HG21 VAL A 33 1.317 3.316 -0.749 1.00 0.00 H new ATOM 0 HG22 VAL A 33 1.248 2.466 0.813 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -0.243 3.102 0.079 1.00 0.00 H new ATOM 514 N TYR A 34 1.092 5.868 4.346 1.00 0.00 N ATOM 515 CA TYR A 34 1.539 7.029 5.100 1.00 0.00 C ATOM 516 C TYR A 34 2.832 7.568 4.487 1.00 0.00 C ATOM 517 O TYR A 34 2.891 8.758 4.182 1.00 0.00 O ATOM 518 CB TYR A 34 1.705 6.694 6.594 1.00 0.00 C ATOM 519 CG TYR A 34 0.417 6.481 7.376 1.00 0.00 C ATOM 520 CD1 TYR A 34 -0.644 7.407 7.272 1.00 0.00 C ATOM 521 CD2 TYR A 34 0.309 5.398 8.273 1.00 0.00 C ATOM 522 CE1 TYR A 34 -1.804 7.246 8.049 1.00 0.00 C ATOM 523 CE2 TYR A 34 -0.847 5.235 9.059 1.00 0.00 C ATOM 524 CZ TYR A 34 -1.907 6.164 8.951 1.00 0.00 C ATOM 525 OH TYR A 34 -3.032 6.050 9.706 1.00 0.00 O ATOM 0 H TYR A 34 1.219 4.983 4.838 1.00 0.00 H new ATOM 0 HA TYR A 34 0.779 7.809 5.040 1.00 0.00 H new ATOM 0 HB2 TYR A 34 2.312 5.792 6.679 1.00 0.00 H new ATOM 0 HB3 TYR A 34 2.265 7.501 7.067 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -0.564 8.243 6.592 1.00 0.00 H new ATOM 0 HD2 TYR A 34 1.119 4.689 8.357 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -2.617 7.950 7.956 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -0.924 4.403 9.743 1.00 0.00 H new ATOM 0 HH TYR A 34 -2.905 5.348 10.378 1.00 0.00 H new ATOM 535 N ASP A 35 3.838 6.717 4.253 1.00 0.00 N ATOM 536 CA ASP A 35 5.141 7.151 3.734 1.00 0.00 C ATOM 537 C ASP A 35 5.754 6.086 2.834 1.00 0.00 C ATOM 538 O ASP A 35 5.394 4.914 2.942 1.00 0.00 O ATOM 539 CB ASP A 35 6.125 7.386 4.885 1.00 0.00 C ATOM 540 CG ASP A 35 7.110 8.522 4.563 1.00 0.00 C ATOM 541 OD1 ASP A 35 7.310 9.407 5.426 1.00 0.00 O ATOM 542 OD2 ASP A 35 7.665 8.586 3.444 1.00 0.00 O ATOM 0 H ASP A 35 3.773 5.712 4.417 1.00 0.00 H new ATOM 0 HA ASP A 35 4.969 8.070 3.173 1.00 0.00 H new ATOM 0 HB2 ASP A 35 5.573 7.629 5.793 1.00 0.00 H new ATOM 0 HB3 ASP A 35 6.679 6.469 5.084 1.00 0.00 H new ATOM 548 N ILE A 36 6.714 6.481 1.998 1.00 0.00 N ATOM 549 CA ILE A 36 7.487 5.665 1.079 1.00 0.00 C ATOM 550 C ILE A 36 8.901 6.264 1.034 1.00 0.00 C ATOM 551 O ILE A 36 9.098 7.332 0.442 1.00 0.00 O ATOM 552 CB ILE A 36 6.852 5.645 -0.336 1.00 0.00 C ATOM 553 CG1 ILE A 36 5.480 6.346 -0.408 1.00 0.00 C ATOM 554 CG2 ILE A 36 6.824 4.213 -0.895 1.00 0.00 C ATOM 555 CD1 ILE A 36 4.830 6.349 -1.778 1.00 0.00 C ATOM 0 H ILE A 36 6.989 7.462 1.947 1.00 0.00 H new ATOM 0 HA ILE A 36 7.511 4.630 1.419 1.00 0.00 H new ATOM 0 HB ILE A 36 7.494 6.243 -0.983 1.00 0.00 H new ATOM 0 HG12 ILE A 36 4.804 5.861 0.297 1.00 0.00 H new ATOM 0 HG13 ILE A 36 5.599 7.378 -0.077 1.00 0.00 H new ATOM 0 HG21 ILE A 36 6.375 4.219 -1.888 1.00 0.00 H new ATOM 0 HG22 ILE A 36 7.842 3.827 -0.959 1.00 0.00 H new ATOM 0 HG23 ILE A 36 6.235 3.576 -0.235 1.00 0.00 H new ATOM 0 HD11 ILE A 36 3.871 6.864 -1.725 1.00 0.00 H new ATOM 0 HD12 ILE A 36 5.479 6.862 -2.487 1.00 0.00 H new ATOM 0 HD13 ILE A 36 4.672 5.322 -2.108 1.00 0.00 H new ATOM 567 N GLN A 37 9.876 5.609 1.662 1.00 0.00 N ATOM 568 CA GLN A 37 11.282 5.981 1.683 1.00 0.00 C ATOM 569 C GLN A 37 12.093 4.885 1.019 1.00 0.00 C ATOM 570 O GLN A 37 12.016 3.737 1.449 1.00 0.00 O ATOM 571 CB GLN A 37 11.725 6.135 3.138 1.00 0.00 C ATOM 572 CG GLN A 37 10.962 7.291 3.796 1.00 0.00 C ATOM 573 CD GLN A 37 10.244 6.930 5.101 1.00 0.00 C ATOM 574 OE1 GLN A 37 9.858 5.796 5.372 1.00 0.00 O ATOM 575 NE2 GLN A 37 10.051 7.912 5.961 1.00 0.00 N ATOM 0 H GLN A 37 9.692 4.760 2.197 1.00 0.00 H new ATOM 0 HA GLN A 37 11.434 6.919 1.149 1.00 0.00 H new ATOM 0 HB2 GLN A 37 11.541 5.209 3.683 1.00 0.00 H new ATOM 0 HB3 GLN A 37 12.798 6.324 3.183 1.00 0.00 H new ATOM 0 HG2 GLN A 37 11.662 8.102 3.996 1.00 0.00 H new ATOM 0 HG3 GLN A 37 10.227 7.672 3.087 1.00 0.00 H new ATOM 0 HE21 GLN A 37 10.371 8.855 5.739 1.00 0.00 H new ATOM 0 HE22 GLN A 37 9.582 7.728 6.848 1.00 0.00 H new ATOM 584 N ILE A 38 12.843 5.219 -0.031 1.00 0.00 N ATOM 585 CA ILE A 38 13.606 4.233 -0.771 1.00 0.00 C ATOM 586 C ILE A 38 15.060 4.683 -0.808 1.00 0.00 C ATOM 587 O ILE A 38 15.370 5.743 -1.357 1.00 0.00 O ATOM 588 CB ILE A 38 13.008 4.016 -2.164 1.00 0.00 C ATOM 589 CG1 ILE A 38 11.476 4.174 -2.212 1.00 0.00 C ATOM 590 CG2 ILE A 38 13.486 2.680 -2.754 1.00 0.00 C ATOM 591 CD1 ILE A 38 10.555 3.109 -1.656 1.00 0.00 C ATOM 0 H ILE A 38 12.934 6.172 -0.384 1.00 0.00 H new ATOM 0 HA ILE A 38 13.561 3.262 -0.278 1.00 0.00 H new ATOM 0 HB ILE A 38 13.384 4.818 -2.799 1.00 0.00 H new ATOM 0 HG12 ILE A 38 11.237 5.103 -1.694 1.00 0.00 H new ATOM 0 HG13 ILE A 38 11.204 4.314 -3.258 1.00 0.00 H new ATOM 0 HG21 ILE A 38 13.051 2.543 -3.744 1.00 0.00 H new ATOM 0 HG22 ILE A 38 14.573 2.685 -2.833 1.00 0.00 H new ATOM 0 HG23 ILE A 38 13.174 1.863 -2.104 1.00 0.00 H new ATOM 0 HD11 ILE A 38 9.518 3.418 -1.790 1.00 0.00 H new ATOM 0 HD12 ILE A 38 10.725 2.170 -2.183 1.00 0.00 H new ATOM 0 HD13 ILE A 38 10.758 2.971 -0.594 1.00 0.00 H new ATOM 603 N ASP A 39 15.937 3.910 -0.179 1.00 0.00 N ATOM 604 CA ASP A 39 17.367 4.210 -0.111 1.00 0.00 C ATOM 605 C ASP A 39 18.066 3.803 -1.418 1.00 0.00 C ATOM 606 O ASP A 39 17.482 3.071 -2.225 1.00 0.00 O ATOM 607 CB ASP A 39 17.953 3.467 1.096 1.00 0.00 C ATOM 608 CG ASP A 39 18.985 4.299 1.834 1.00 0.00 C ATOM 609 OD1 ASP A 39 18.579 5.352 2.386 1.00 0.00 O ATOM 610 OD2 ASP A 39 20.138 3.836 1.963 1.00 0.00 O ATOM 0 H ASP A 39 15.676 3.050 0.303 1.00 0.00 H new ATOM 0 HA ASP A 39 17.525 5.281 0.012 1.00 0.00 H new ATOM 0 HB2 ASP A 39 17.149 3.198 1.781 1.00 0.00 H new ATOM 0 HB3 ASP A 39 18.411 2.536 0.761 1.00 0.00 H new ATOM 616 N ASP A 40 19.325 4.199 -1.640 1.00 0.00 N ATOM 617 CA ASP A 40 20.008 3.923 -2.920 1.00 0.00 C ATOM 618 C ASP A 40 20.279 2.441 -3.122 1.00 0.00 C ATOM 619 O ASP A 40 20.319 1.933 -4.241 1.00 0.00 O ATOM 620 CB ASP A 40 21.355 4.643 -3.062 1.00 0.00 C ATOM 621 CG ASP A 40 21.366 5.332 -4.429 1.00 0.00 C ATOM 622 OD1 ASP A 40 20.642 6.349 -4.579 1.00 0.00 O ATOM 623 OD2 ASP A 40 22.021 4.820 -5.362 1.00 0.00 O ATOM 0 H ASP A 40 19.891 4.707 -0.960 1.00 0.00 H new ATOM 0 HA ASP A 40 19.312 4.296 -3.671 1.00 0.00 H new ATOM 0 HB2 ASP A 40 21.486 5.373 -2.263 1.00 0.00 H new ATOM 0 HB3 ASP A 40 22.179 3.934 -2.983 1.00 0.00 H new ATOM 629 N GLN A 41 20.397 1.716 -2.012 1.00 0.00 N ATOM 630 CA GLN A 41 20.525 0.267 -1.970 1.00 0.00 C ATOM 631 C GLN A 41 19.156 -0.403 -2.158 1.00 0.00 C ATOM 632 O GLN A 41 18.959 -1.569 -1.806 1.00 0.00 O ATOM 633 CB GLN A 41 21.259 -0.107 -0.673 1.00 0.00 C ATOM 634 CG GLN A 41 22.670 0.514 -0.622 1.00 0.00 C ATOM 635 CD GLN A 41 23.507 0.191 -1.863 1.00 0.00 C ATOM 636 OE1 GLN A 41 24.085 1.052 -2.520 1.00 0.00 O ATOM 637 NE2 GLN A 41 23.536 -1.072 -2.245 1.00 0.00 N ATOM 0 H GLN A 41 20.406 2.140 -1.084 1.00 0.00 H new ATOM 0 HA GLN A 41 21.125 -0.111 -2.798 1.00 0.00 H new ATOM 0 HB2 GLN A 41 20.679 0.233 0.185 1.00 0.00 H new ATOM 0 HB3 GLN A 41 21.335 -1.192 -0.597 1.00 0.00 H new ATOM 0 HG2 GLN A 41 22.582 1.596 -0.520 1.00 0.00 H new ATOM 0 HG3 GLN A 41 23.189 0.152 0.265 1.00 0.00 H new ATOM 0 HE21 GLN A 41 23.054 -1.782 -1.695 1.00 0.00 H new ATOM 0 HE22 GLN A 41 24.041 -1.338 -3.091 1.00 0.00 H new ATOM 646 N ASN A 42 18.215 0.361 -2.708 1.00 0.00 N ATOM 647 CA ASN A 42 16.854 0.094 -3.125 1.00 0.00 C ATOM 648 C ASN A 42 15.929 -0.213 -1.986 1.00 0.00 C ATOM 649 O ASN A 42 14.789 -0.554 -2.263 1.00 0.00 O ATOM 650 CB ASN A 42 16.781 -1.011 -4.173 1.00 0.00 C ATOM 651 CG ASN A 42 17.520 -0.645 -5.432 1.00 0.00 C ATOM 652 OD1 ASN A 42 17.792 0.518 -5.705 1.00 0.00 O ATOM 653 ND2 ASN A 42 17.800 -1.641 -6.241 1.00 0.00 N ATOM 0 H ASN A 42 18.437 1.338 -2.898 1.00 0.00 H new ATOM 0 HA ASN A 42 16.511 1.025 -3.575 1.00 0.00 H new ATOM 0 HB2 ASN A 42 17.200 -1.929 -3.761 1.00 0.00 H new ATOM 0 HB3 ASN A 42 15.737 -1.216 -4.412 1.00 0.00 H new ATOM 0 HD21 ASN A 42 18.260 -1.460 -7.133 1.00 0.00 H new ATOM 0 HD22 ASN A 42 17.557 -2.596 -5.977 1.00 0.00 H new ATOM 660 N ASN A 43 16.402 -0.131 -0.745 1.00 0.00 N ATOM 661 CA ASN A 43 15.723 -0.503 0.487 1.00 0.00 C ATOM 662 C ASN A 43 14.328 0.111 0.458 1.00 0.00 C ATOM 663 O ASN A 43 14.193 1.301 0.730 1.00 0.00 O ATOM 664 CB ASN A 43 16.525 0.066 1.673 1.00 0.00 C ATOM 665 CG ASN A 43 17.928 -0.467 1.940 1.00 0.00 C ATOM 666 OD1 ASN A 43 18.476 -0.233 3.010 1.00 0.00 O ATOM 667 ND2 ASN A 43 18.591 -1.147 1.022 1.00 0.00 N ATOM 0 H ASN A 43 17.341 0.224 -0.564 1.00 0.00 H new ATOM 0 HA ASN A 43 15.647 -1.586 0.588 1.00 0.00 H new ATOM 0 HB2 ASN A 43 16.604 1.144 1.530 1.00 0.00 H new ATOM 0 HB3 ASN A 43 15.935 -0.093 2.576 1.00 0.00 H new ATOM 0 HD21 ASN A 43 19.541 -1.467 1.211 1.00 0.00 H new ATOM 0 HD22 ASN A 43 18.153 -1.353 0.124 1.00 0.00 H new ATOM 674 N VAL A 44 13.310 -0.652 0.055 1.00 0.00 N ATOM 675 CA VAL A 44 11.968 -0.133 -0.105 1.00 0.00 C ATOM 676 C VAL A 44 11.364 -0.111 1.281 1.00 0.00 C ATOM 677 O VAL A 44 11.251 -1.164 1.923 1.00 0.00 O ATOM 678 CB VAL A 44 11.185 -1.004 -1.115 1.00 0.00 C ATOM 679 CG1 VAL A 44 9.693 -0.642 -1.142 1.00 0.00 C ATOM 680 CG2 VAL A 44 11.731 -0.856 -2.537 1.00 0.00 C ATOM 0 H VAL A 44 13.402 -1.643 -0.167 1.00 0.00 H new ATOM 0 HA VAL A 44 11.944 0.874 -0.520 1.00 0.00 H new ATOM 0 HB VAL A 44 11.310 -2.033 -0.778 1.00 0.00 H new ATOM 0 HG11 VAL A 44 9.178 -1.276 -1.864 1.00 0.00 H new ATOM 0 HG12 VAL A 44 9.263 -0.796 -0.152 1.00 0.00 H new ATOM 0 HG13 VAL A 44 9.577 0.403 -1.429 1.00 0.00 H new ATOM 0 HG21 VAL A 44 11.154 -1.484 -3.216 1.00 0.00 H new ATOM 0 HG22 VAL A 44 11.652 0.185 -2.850 1.00 0.00 H new ATOM 0 HG23 VAL A 44 12.776 -1.163 -2.559 1.00 0.00 H new ATOM 690 N LYS A 45 11.024 1.078 1.777 1.00 0.00 N ATOM 691 CA LYS A 45 10.359 1.211 3.052 1.00 0.00 C ATOM 692 C LYS A 45 9.051 1.894 2.815 1.00 0.00 C ATOM 693 O LYS A 45 8.994 2.927 2.148 1.00 0.00 O ATOM 694 CB LYS A 45 11.204 1.977 4.058 1.00 0.00 C ATOM 695 CG LYS A 45 10.625 1.795 5.474 1.00 0.00 C ATOM 696 CD LYS A 45 11.668 1.438 6.529 1.00 0.00 C ATOM 697 CE LYS A 45 12.454 2.669 6.974 1.00 0.00 C ATOM 698 NZ LYS A 45 13.033 2.433 8.305 1.00 0.00 N ATOM 0 H LYS A 45 11.204 1.963 1.303 1.00 0.00 H new ATOM 0 HA LYS A 45 10.199 0.223 3.484 1.00 0.00 H new ATOM 0 HB2 LYS A 45 12.234 1.620 4.028 1.00 0.00 H new ATOM 0 HB3 LYS A 45 11.225 3.035 3.797 1.00 0.00 H new ATOM 0 HG2 LYS A 45 10.123 2.716 5.771 1.00 0.00 H new ATOM 0 HG3 LYS A 45 9.867 1.012 5.448 1.00 0.00 H new ATOM 0 HD2 LYS A 45 11.176 0.987 7.391 1.00 0.00 H new ATOM 0 HD3 LYS A 45 12.354 0.692 6.127 1.00 0.00 H new ATOM 0 HE2 LYS A 45 13.245 2.886 6.256 1.00 0.00 H new ATOM 0 HE3 LYS A 45 11.799 3.540 7.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 13.568 3.273 8.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 12.271 2.246 8.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 13.671 1.613 8.266 1.00 0.00 H new ATOM 712 N VAL A 46 8.011 1.293 3.361 1.00 0.00 N ATOM 713 CA VAL A 46 6.673 1.823 3.243 1.00 0.00 C ATOM 714 C VAL A 46 6.014 1.742 4.604 1.00 0.00 C ATOM 715 O VAL A 46 5.795 0.648 5.126 1.00 0.00 O ATOM 716 CB VAL A 46 5.873 1.105 2.142 1.00 0.00 C ATOM 717 CG1 VAL A 46 4.677 2.001 1.799 1.00 0.00 C ATOM 718 CG2 VAL A 46 6.711 0.839 0.878 1.00 0.00 C ATOM 0 H VAL A 46 8.073 0.427 3.896 1.00 0.00 H new ATOM 0 HA VAL A 46 6.707 2.867 2.931 1.00 0.00 H new ATOM 0 HB VAL A 46 5.557 0.128 2.508 1.00 0.00 H new ATOM 0 HG11 VAL A 46 4.080 1.528 1.019 1.00 0.00 H new ATOM 0 HG12 VAL A 46 4.064 2.145 2.688 1.00 0.00 H new ATOM 0 HG13 VAL A 46 5.036 2.968 1.445 1.00 0.00 H new ATOM 0 HG21 VAL A 46 6.097 0.331 0.135 1.00 0.00 H new ATOM 0 HG22 VAL A 46 7.065 1.786 0.470 1.00 0.00 H new ATOM 0 HG23 VAL A 46 7.565 0.212 1.133 1.00 0.00 H new ATOM 728 N LEU A 47 5.691 2.902 5.167 1.00 0.00 N ATOM 729 CA LEU A 47 4.770 2.988 6.285 1.00 0.00 C ATOM 730 C LEU A 47 3.389 2.892 5.665 1.00 0.00 C ATOM 731 O LEU A 47 2.939 3.823 4.990 1.00 0.00 O ATOM 732 CB LEU A 47 4.954 4.299 7.065 1.00 0.00 C ATOM 733 CG LEU A 47 5.858 4.125 8.292 1.00 0.00 C ATOM 734 CD1 LEU A 47 7.269 3.659 7.924 1.00 0.00 C ATOM 735 CD2 LEU A 47 5.941 5.450 9.051 1.00 0.00 C ATOM 0 H LEU A 47 6.060 3.802 4.860 1.00 0.00 H new ATOM 0 HA LEU A 47 4.939 2.195 7.014 1.00 0.00 H new ATOM 0 HB2 LEU A 47 5.382 5.054 6.406 1.00 0.00 H new ATOM 0 HB3 LEU A 47 3.980 4.669 7.384 1.00 0.00 H new ATOM 0 HG LEU A 47 5.414 3.350 8.916 1.00 0.00 H new ATOM 0 HD11 LEU A 47 7.865 3.553 8.830 1.00 0.00 H new ATOM 0 HD12 LEU A 47 7.213 2.699 7.412 1.00 0.00 H new ATOM 0 HD13 LEU A 47 7.735 4.394 7.267 1.00 0.00 H new ATOM 0 HD21 LEU A 47 6.583 5.330 9.924 1.00 0.00 H new ATOM 0 HD22 LEU A 47 6.356 6.218 8.398 1.00 0.00 H new ATOM 0 HD23 LEU A 47 4.943 5.748 9.373 1.00 0.00 H new ATOM 747 N MET A 48 2.729 1.756 5.855 1.00 0.00 N ATOM 748 CA MET A 48 1.353 1.544 5.435 1.00 0.00 C ATOM 749 C MET A 48 0.524 1.166 6.657 1.00 0.00 C ATOM 750 O MET A 48 1.020 1.166 7.787 1.00 0.00 O ATOM 751 CB MET A 48 1.287 0.492 4.311 1.00 0.00 C ATOM 752 CG MET A 48 0.302 0.958 3.236 1.00 0.00 C ATOM 753 SD MET A 48 -0.172 -0.270 2.002 1.00 0.00 S ATOM 754 CE MET A 48 -1.511 -1.076 2.919 1.00 0.00 C ATOM 0 H MET A 48 3.143 0.944 6.313 1.00 0.00 H new ATOM 0 HA MET A 48 0.934 2.458 5.014 1.00 0.00 H new ATOM 0 HB2 MET A 48 2.276 0.346 3.876 1.00 0.00 H new ATOM 0 HB3 MET A 48 0.972 -0.470 4.716 1.00 0.00 H new ATOM 0 HG2 MET A 48 -0.602 1.313 3.731 1.00 0.00 H new ATOM 0 HG3 MET A 48 0.739 1.812 2.719 1.00 0.00 H new ATOM 0 HE1 MET A 48 -1.878 -1.931 2.351 1.00 0.00 H new ATOM 0 HE2 MET A 48 -1.137 -1.415 3.885 1.00 0.00 H new ATOM 0 HE3 MET A 48 -2.324 -0.367 3.073 1.00 0.00 H new ATOM 764 N THR A 49 -0.758 0.900 6.454 1.00 0.00 N ATOM 765 CA THR A 49 -1.682 0.442 7.474 1.00 0.00 C ATOM 766 C THR A 49 -2.841 -0.249 6.747 1.00 0.00 C ATOM 767 O THR A 49 -2.923 -0.180 5.520 1.00 0.00 O ATOM 768 CB THR A 49 -2.075 1.655 8.346 1.00 0.00 C ATOM 769 OG1 THR A 49 -2.826 1.268 9.476 1.00 0.00 O ATOM 770 CG2 THR A 49 -2.817 2.757 7.585 1.00 0.00 C ATOM 0 H THR A 49 -1.197 1.002 5.539 1.00 0.00 H new ATOM 0 HA THR A 49 -1.262 -0.290 8.164 1.00 0.00 H new ATOM 0 HB THR A 49 -1.125 2.078 8.671 1.00 0.00 H new ATOM 0 HG1 THR A 49 -2.260 1.311 10.275 1.00 0.00 H new ATOM 0 HG21 THR A 49 -3.057 3.572 8.268 1.00 0.00 H new ATOM 0 HG22 THR A 49 -2.185 3.132 6.780 1.00 0.00 H new ATOM 0 HG23 THR A 49 -3.738 2.352 7.165 1.00 0.00 H new ATOM 778 N MET A 50 -3.729 -0.907 7.484 1.00 0.00 N ATOM 779 CA MET A 50 -5.016 -1.385 6.981 1.00 0.00 C ATOM 780 C MET A 50 -6.079 -0.383 7.443 1.00 0.00 C ATOM 781 O MET A 50 -5.819 0.404 8.358 1.00 0.00 O ATOM 782 CB MET A 50 -5.275 -2.791 7.551 1.00 0.00 C ATOM 783 CG MET A 50 -4.419 -3.855 6.850 1.00 0.00 C ATOM 784 SD MET A 50 -5.206 -4.500 5.360 1.00 0.00 S ATOM 785 CE MET A 50 -3.756 -5.145 4.507 1.00 0.00 C ATOM 0 H MET A 50 -3.573 -1.128 8.467 1.00 0.00 H new ATOM 0 HA MET A 50 -5.035 -1.457 5.894 1.00 0.00 H new ATOM 0 HB2 MET A 50 -5.059 -2.796 8.619 1.00 0.00 H new ATOM 0 HB3 MET A 50 -6.330 -3.041 7.438 1.00 0.00 H new ATOM 0 HG2 MET A 50 -3.452 -3.425 6.590 1.00 0.00 H new ATOM 0 HG3 MET A 50 -4.227 -4.676 7.541 1.00 0.00 H new ATOM 0 HE1 MET A 50 -3.906 -5.073 3.430 1.00 0.00 H new ATOM 0 HE2 MET A 50 -2.878 -4.564 4.791 1.00 0.00 H new ATOM 0 HE3 MET A 50 -3.605 -6.189 4.784 1.00 0.00 H new ATOM 795 N THR A 51 -7.295 -0.405 6.885 1.00 0.00 N ATOM 796 CA THR A 51 -8.379 0.384 7.484 1.00 0.00 C ATOM 797 C THR A 51 -8.606 -0.080 8.928 1.00 0.00 C ATOM 798 O THR A 51 -8.784 0.754 9.824 1.00 0.00 O ATOM 799 CB THR A 51 -9.673 0.359 6.639 1.00 0.00 C ATOM 800 OG1 THR A 51 -10.769 0.928 7.333 1.00 0.00 O ATOM 801 CG2 THR A 51 -10.045 -1.015 6.096 1.00 0.00 C ATOM 0 H THR A 51 -7.549 -0.938 6.053 1.00 0.00 H new ATOM 0 HA THR A 51 -8.077 1.431 7.500 1.00 0.00 H new ATOM 0 HB THR A 51 -9.442 0.977 5.771 1.00 0.00 H new ATOM 0 HG1 THR A 51 -10.784 1.896 7.183 1.00 0.00 H new ATOM 0 HG21 THR A 51 -10.965 -0.940 5.516 1.00 0.00 H new ATOM 0 HG22 THR A 51 -9.242 -1.383 5.457 1.00 0.00 H new ATOM 0 HG23 THR A 51 -10.195 -1.706 6.926 1.00 0.00 H new ATOM 809 N THR A 52 -8.550 -1.392 9.172 1.00 0.00 N ATOM 810 CA THR A 52 -8.989 -2.012 10.408 1.00 0.00 C ATOM 811 C THR A 52 -7.948 -3.052 10.840 1.00 0.00 C ATOM 812 O THR A 52 -7.283 -3.631 9.980 1.00 0.00 O ATOM 813 CB THR A 52 -10.378 -2.639 10.152 1.00 0.00 C ATOM 814 OG1 THR A 52 -10.296 -3.697 9.208 1.00 0.00 O ATOM 815 CG2 THR A 52 -11.408 -1.614 9.662 1.00 0.00 C ATOM 0 H THR A 52 -8.188 -2.062 8.494 1.00 0.00 H new ATOM 0 HA THR A 52 -9.080 -1.289 11.219 1.00 0.00 H new ATOM 0 HB THR A 52 -10.713 -3.026 11.114 1.00 0.00 H new ATOM 0 HG1 THR A 52 -10.820 -3.467 8.413 1.00 0.00 H new ATOM 0 HG21 THR A 52 -12.365 -2.110 9.498 1.00 0.00 H new ATOM 0 HG22 THR A 52 -11.528 -0.832 10.412 1.00 0.00 H new ATOM 0 HG23 THR A 52 -11.064 -1.171 8.727 1.00 0.00 H new ATOM 823 N PRO A 53 -7.815 -3.349 12.143 1.00 0.00 N ATOM 824 CA PRO A 53 -7.080 -4.522 12.613 1.00 0.00 C ATOM 825 C PRO A 53 -7.891 -5.815 12.433 1.00 0.00 C ATOM 826 O PRO A 53 -7.347 -6.912 12.570 1.00 0.00 O ATOM 827 CB PRO A 53 -6.795 -4.228 14.086 1.00 0.00 C ATOM 828 CG PRO A 53 -8.024 -3.428 14.513 1.00 0.00 C ATOM 829 CD PRO A 53 -8.381 -2.617 13.268 1.00 0.00 C ATOM 0 HA PRO A 53 -6.165 -4.688 12.044 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -6.686 -5.143 14.668 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -5.876 -3.657 14.214 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -8.843 -4.082 14.813 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -7.805 -2.781 15.363 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -9.461 -2.514 13.164 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -7.969 -1.609 13.326 1.00 0.00 H new ATOM 837 N MET A 54 -9.187 -5.687 12.136 1.00 0.00 N ATOM 838 CA MET A 54 -10.111 -6.770 11.858 1.00 0.00 C ATOM 839 C MET A 54 -9.689 -7.494 10.579 1.00 0.00 C ATOM 840 O MET A 54 -9.366 -8.680 10.652 1.00 0.00 O ATOM 841 CB MET A 54 -11.519 -6.170 11.748 1.00 0.00 C ATOM 842 CG MET A 54 -12.616 -7.178 11.387 1.00 0.00 C ATOM 843 SD MET A 54 -14.021 -6.408 10.543 1.00 0.00 S ATOM 844 CE MET A 54 -13.314 -6.099 8.895 1.00 0.00 C ATOM 0 H MET A 54 -9.636 -4.773 12.082 1.00 0.00 H new ATOM 0 HA MET A 54 -10.106 -7.511 12.657 1.00 0.00 H new ATOM 0 HB2 MET A 54 -11.774 -5.700 12.698 1.00 0.00 H new ATOM 0 HB3 MET A 54 -11.506 -5.382 10.995 1.00 0.00 H new ATOM 0 HG2 MET A 54 -12.195 -7.954 10.748 1.00 0.00 H new ATOM 0 HG3 MET A 54 -12.967 -7.668 12.295 1.00 0.00 H new ATOM 0 HE1 MET A 54 -13.405 -5.040 8.653 1.00 0.00 H new ATOM 0 HE2 MET A 54 -12.262 -6.383 8.892 1.00 0.00 H new ATOM 0 HE3 MET A 54 -13.851 -6.689 8.152 1.00 0.00 H new ATOM 854 N CYS A 55 -9.722 -6.784 9.438 1.00 0.00 N ATOM 855 CA CYS A 55 -9.621 -7.291 8.069 1.00 0.00 C ATOM 856 C CYS A 55 -10.632 -8.420 7.762 1.00 0.00 C ATOM 857 O CYS A 55 -11.260 -8.972 8.668 1.00 0.00 O ATOM 858 CB CYS A 55 -8.178 -7.753 7.821 1.00 0.00 C ATOM 859 SG CYS A 55 -6.995 -6.434 8.229 1.00 0.00 S ATOM 0 H CYS A 55 -9.828 -5.770 9.456 1.00 0.00 H new ATOM 0 HA CYS A 55 -9.878 -6.480 7.387 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -7.966 -8.636 8.424 1.00 0.00 H new ATOM 0 HB3 CYS A 55 -8.059 -8.043 6.777 1.00 0.00 H new ATOM 0 HG CYS A 55 -7.587 -5.528 8.950 1.00 0.00 H new ATOM 865 N PRO A 56 -10.825 -8.824 6.495 1.00 0.00 N ATOM 866 CA PRO A 56 -11.432 -10.109 6.180 1.00 0.00 C ATOM 867 C PRO A 56 -10.392 -11.218 6.407 1.00 0.00 C ATOM 868 O PRO A 56 -10.559 -12.040 7.312 1.00 0.00 O ATOM 869 CB PRO A 56 -11.921 -9.990 4.737 1.00 0.00 C ATOM 870 CG PRO A 56 -11.009 -8.939 4.115 1.00 0.00 C ATOM 871 CD PRO A 56 -10.555 -8.063 5.288 1.00 0.00 C ATOM 0 HA PRO A 56 -12.278 -10.371 6.815 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -11.846 -10.942 4.212 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -12.966 -9.684 4.695 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -10.158 -9.401 3.615 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -11.538 -8.351 3.365 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -9.494 -7.825 5.208 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -11.094 -7.116 5.297 1.00 0.00 H new ATOM 879 N LEU A 57 -9.306 -11.200 5.625 1.00 0.00 N ATOM 880 CA LEU A 57 -8.230 -12.186 5.553 1.00 0.00 C ATOM 881 C LEU A 57 -6.888 -11.446 5.505 1.00 0.00 C ATOM 882 O LEU A 57 -6.202 -11.455 4.484 1.00 0.00 O ATOM 883 CB LEU A 57 -8.424 -13.156 4.359 1.00 0.00 C ATOM 884 CG LEU A 57 -9.105 -12.631 3.072 1.00 0.00 C ATOM 885 CD1 LEU A 57 -8.460 -11.404 2.416 1.00 0.00 C ATOM 886 CD2 LEU A 57 -9.156 -13.754 2.031 1.00 0.00 C ATOM 0 H LEU A 57 -9.148 -10.431 4.974 1.00 0.00 H new ATOM 0 HA LEU A 57 -8.246 -12.815 6.443 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -7.441 -13.536 4.080 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -9.005 -14.006 4.716 1.00 0.00 H new ATOM 0 HG LEU A 57 -10.092 -12.306 3.401 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -9.024 -11.129 1.524 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -8.464 -10.571 3.119 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -7.433 -11.638 2.138 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -9.635 -13.387 1.123 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -8.143 -14.082 1.799 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -9.727 -14.593 2.429 1.00 0.00 H new ATOM 898 N ALA A 58 -6.537 -10.773 6.607 1.00 0.00 N ATOM 899 CA ALA A 58 -5.390 -9.872 6.691 1.00 0.00 C ATOM 900 C ALA A 58 -4.127 -10.454 6.063 1.00 0.00 C ATOM 901 O ALA A 58 -3.513 -9.786 5.241 1.00 0.00 O ATOM 902 CB ALA A 58 -5.059 -9.538 8.145 1.00 0.00 C ATOM 0 H ALA A 58 -7.056 -10.844 7.482 1.00 0.00 H new ATOM 0 HA ALA A 58 -5.687 -8.980 6.139 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -4.201 -8.866 8.178 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -5.917 -9.054 8.612 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -4.822 -10.455 8.684 1.00 0.00 H new ATOM 908 N GLY A 59 -3.729 -11.664 6.467 1.00 0.00 N ATOM 909 CA GLY A 59 -2.450 -12.245 6.078 1.00 0.00 C ATOM 910 C GLY A 59 -2.320 -12.363 4.568 1.00 0.00 C ATOM 911 O GLY A 59 -1.236 -12.158 4.030 1.00 0.00 O ATOM 0 H GLY A 59 -4.288 -12.265 7.073 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -1.638 -11.630 6.466 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -2.346 -13.231 6.530 1.00 0.00 H new ATOM 915 N MET A 60 -3.427 -12.642 3.882 1.00 0.00 N ATOM 916 CA MET A 60 -3.446 -12.706 2.435 1.00 0.00 C ATOM 917 C MET A 60 -3.235 -11.318 1.848 1.00 0.00 C ATOM 918 O MET A 60 -2.330 -11.154 1.039 1.00 0.00 O ATOM 919 CB MET A 60 -4.753 -13.338 1.950 1.00 0.00 C ATOM 920 CG MET A 60 -4.458 -14.640 1.204 1.00 0.00 C ATOM 921 SD MET A 60 -3.760 -16.002 2.183 1.00 0.00 S ATOM 922 CE MET A 60 -5.139 -16.369 3.300 1.00 0.00 C ATOM 0 H MET A 60 -4.330 -12.828 4.319 1.00 0.00 H new ATOM 0 HA MET A 60 -2.628 -13.339 2.090 1.00 0.00 H new ATOM 0 HB2 MET A 60 -5.408 -13.536 2.799 1.00 0.00 H new ATOM 0 HB3 MET A 60 -5.281 -12.645 1.295 1.00 0.00 H new ATOM 0 HG2 MET A 60 -5.385 -14.989 0.749 1.00 0.00 H new ATOM 0 HG3 MET A 60 -3.767 -14.417 0.391 1.00 0.00 H new ATOM 0 HE1 MET A 60 -4.918 -17.274 3.866 1.00 0.00 H new ATOM 0 HE2 MET A 60 -5.281 -15.536 3.988 1.00 0.00 H new ATOM 0 HE3 MET A 60 -6.049 -16.518 2.718 1.00 0.00 H new ATOM 932 N ILE A 61 -4.028 -10.323 2.261 1.00 0.00 N ATOM 933 CA ILE A 61 -3.927 -8.966 1.713 1.00 0.00 C ATOM 934 C ILE A 61 -2.513 -8.416 1.941 1.00 0.00 C ATOM 935 O ILE A 61 -1.914 -7.827 1.043 1.00 0.00 O ATOM 936 CB ILE A 61 -4.975 -8.001 2.317 1.00 0.00 C ATOM 937 CG1 ILE A 61 -6.400 -8.585 2.415 1.00 0.00 C ATOM 938 CG2 ILE A 61 -5.010 -6.729 1.454 1.00 0.00 C ATOM 939 CD1 ILE A 61 -7.371 -7.711 3.212 1.00 0.00 C ATOM 0 H ILE A 61 -4.748 -10.433 2.975 1.00 0.00 H new ATOM 0 HA ILE A 61 -4.132 -9.033 0.645 1.00 0.00 H new ATOM 0 HB ILE A 61 -4.665 -7.799 3.342 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -6.795 -8.726 1.409 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -6.348 -9.570 2.878 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -5.743 -6.033 1.862 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -4.026 -6.261 1.455 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -5.286 -6.990 0.432 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -8.352 -8.186 3.237 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -7.000 -7.590 4.230 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -7.454 -6.733 2.737 1.00 0.00 H new ATOM 951 N LEU A 62 -1.967 -8.615 3.142 1.00 0.00 N ATOM 952 CA LEU A 62 -0.631 -8.158 3.499 1.00 0.00 C ATOM 953 C LEU A 62 0.409 -8.817 2.592 1.00 0.00 C ATOM 954 O LEU A 62 1.328 -8.137 2.141 1.00 0.00 O ATOM 955 CB LEU A 62 -0.352 -8.435 4.987 1.00 0.00 C ATOM 956 CG LEU A 62 -1.230 -7.620 5.958 1.00 0.00 C ATOM 957 CD1 LEU A 62 -1.128 -8.168 7.379 1.00 0.00 C ATOM 958 CD2 LEU A 62 -0.883 -6.133 6.009 1.00 0.00 C ATOM 0 H LEU A 62 -2.447 -9.103 3.898 1.00 0.00 H new ATOM 0 HA LEU A 62 -0.566 -7.080 3.349 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -0.504 -9.497 5.182 1.00 0.00 H new ATOM 0 HB3 LEU A 62 0.696 -8.219 5.195 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.242 -7.721 5.566 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -1.757 -7.575 8.044 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -1.462 -9.206 7.394 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -0.093 -8.115 7.716 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.544 -5.629 6.714 1.00 0.00 H new ATOM 0 HD22 LEU A 62 0.151 -6.012 6.331 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -1.008 -5.696 5.018 1.00 0.00 H new ATOM 970 N SER A 63 0.273 -10.111 2.290 1.00 0.00 N ATOM 971 CA SER A 63 1.145 -10.812 1.353 1.00 0.00 C ATOM 972 C SER A 63 0.921 -10.393 -0.110 1.00 0.00 C ATOM 973 O SER A 63 1.830 -10.549 -0.922 1.00 0.00 O ATOM 974 CB SER A 63 0.939 -12.320 1.524 1.00 0.00 C ATOM 975 OG SER A 63 1.464 -12.718 2.783 1.00 0.00 O ATOM 0 H SER A 63 -0.452 -10.703 2.694 1.00 0.00 H new ATOM 0 HA SER A 63 2.175 -10.540 1.585 1.00 0.00 H new ATOM 0 HB2 SER A 63 -0.122 -12.564 1.464 1.00 0.00 H new ATOM 0 HB3 SER A 63 1.437 -12.862 0.720 1.00 0.00 H new ATOM 0 HG SER A 63 0.767 -12.641 3.467 1.00 0.00 H new ATOM 981 N ASP A 64 -0.247 -9.864 -0.465 1.00 0.00 N ATOM 982 CA ASP A 64 -0.597 -9.399 -1.811 1.00 0.00 C ATOM 983 C ASP A 64 0.055 -8.042 -2.065 1.00 0.00 C ATOM 984 O ASP A 64 0.752 -7.853 -3.060 1.00 0.00 O ATOM 985 CB ASP A 64 -2.131 -9.310 -1.918 1.00 0.00 C ATOM 986 CG ASP A 64 -2.691 -9.616 -3.304 1.00 0.00 C ATOM 987 OD1 ASP A 64 -3.863 -10.060 -3.372 1.00 0.00 O ATOM 988 OD2 ASP A 64 -1.998 -9.464 -4.331 1.00 0.00 O ATOM 0 H ASP A 64 -1.009 -9.741 0.202 1.00 0.00 H new ATOM 0 HA ASP A 64 -0.232 -10.096 -2.566 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -2.573 -10.002 -1.201 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -2.445 -8.307 -1.627 1.00 0.00 H new ATOM 994 N ALA A 65 -0.080 -7.108 -1.119 1.00 0.00 N ATOM 995 CA ALA A 65 0.629 -5.834 -1.147 1.00 0.00 C ATOM 996 C ALA A 65 2.139 -6.069 -1.190 1.00 0.00 C ATOM 997 O ALA A 65 2.825 -5.520 -2.056 1.00 0.00 O ATOM 998 CB ALA A 65 0.241 -5.007 0.072 1.00 0.00 C ATOM 0 H ALA A 65 -0.689 -7.219 -0.309 1.00 0.00 H new ATOM 0 HA ALA A 65 0.349 -5.284 -2.045 1.00 0.00 H new ATOM 0 HB1 ALA A 65 0.772 -4.055 0.050 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -0.833 -4.824 0.060 1.00 0.00 H new ATOM 0 HB3 ALA A 65 0.507 -5.549 0.979 1.00 0.00 H new ATOM 1004 N GLU A 66 2.655 -6.923 -0.302 1.00 0.00 N ATOM 1005 CA GLU A 66 4.044 -7.305 -0.288 1.00 0.00 C ATOM 1006 C GLU A 66 4.432 -7.915 -1.636 1.00 0.00 C ATOM 1007 O GLU A 66 5.543 -7.679 -2.097 1.00 0.00 O ATOM 1008 CB GLU A 66 4.256 -8.283 0.871 1.00 0.00 C ATOM 1009 CG GLU A 66 5.729 -8.427 1.234 1.00 0.00 C ATOM 1010 CD GLU A 66 5.933 -9.624 2.159 1.00 0.00 C ATOM 1011 OE1 GLU A 66 5.611 -9.509 3.368 1.00 0.00 O ATOM 1012 OE2 GLU A 66 6.308 -10.707 1.654 1.00 0.00 O ATOM 0 H GLU A 66 2.102 -7.367 0.431 1.00 0.00 H new ATOM 0 HA GLU A 66 4.687 -6.437 -0.137 1.00 0.00 H new ATOM 0 HB2 GLU A 66 3.700 -7.938 1.743 1.00 0.00 H new ATOM 0 HB3 GLU A 66 3.852 -9.259 0.601 1.00 0.00 H new ATOM 0 HG2 GLU A 66 6.323 -8.553 0.329 1.00 0.00 H new ATOM 0 HG3 GLU A 66 6.081 -7.518 1.722 1.00 0.00 H new ATOM 1020 N GLU A 67 3.553 -8.681 -2.293 1.00 0.00 N ATOM 1021 CA GLU A 67 3.803 -9.263 -3.607 1.00 0.00 C ATOM 1022 C GLU A 67 3.978 -8.202 -4.695 1.00 0.00 C ATOM 1023 O GLU A 67 4.830 -8.360 -5.568 1.00 0.00 O ATOM 1024 CB GLU A 67 2.758 -10.331 -3.959 1.00 0.00 C ATOM 1025 CG GLU A 67 2.988 -10.880 -5.370 1.00 0.00 C ATOM 1026 CD GLU A 67 2.243 -12.172 -5.695 1.00 0.00 C ATOM 1027 OE1 GLU A 67 1.913 -12.976 -4.795 1.00 0.00 O ATOM 1028 OE2 GLU A 67 2.018 -12.426 -6.906 1.00 0.00 O ATOM 0 H GLU A 67 2.634 -8.915 -1.916 1.00 0.00 H new ATOM 0 HA GLU A 67 4.762 -9.779 -3.555 1.00 0.00 H new ATOM 0 HB2 GLU A 67 2.807 -11.145 -3.236 1.00 0.00 H new ATOM 0 HB3 GLU A 67 1.758 -9.903 -3.890 1.00 0.00 H new ATOM 0 HG2 GLU A 67 2.693 -10.118 -6.091 1.00 0.00 H new ATOM 0 HG3 GLU A 67 4.056 -11.051 -5.506 1.00 0.00 H new ATOM 1036 N ALA A 68 3.241 -7.092 -4.631 1.00 0.00 N ATOM 1037 CA ALA A 68 3.468 -5.995 -5.558 1.00 0.00 C ATOM 1038 C ALA A 68 4.827 -5.373 -5.272 1.00 0.00 C ATOM 1039 O ALA A 68 5.579 -5.063 -6.189 1.00 0.00 O ATOM 1040 CB ALA A 68 2.375 -4.938 -5.447 1.00 0.00 C ATOM 0 H ALA A 68 2.493 -6.934 -3.955 1.00 0.00 H new ATOM 0 HA ALA A 68 3.445 -6.388 -6.574 1.00 0.00 H new ATOM 0 HB1 ALA A 68 2.575 -4.132 -6.153 1.00 0.00 H new ATOM 0 HB2 ALA A 68 1.409 -5.388 -5.674 1.00 0.00 H new ATOM 0 HB3 ALA A 68 2.359 -4.537 -4.434 1.00 0.00 H new ATOM 1046 N ILE A 69 5.138 -5.181 -3.994 1.00 0.00 N ATOM 1047 CA ILE A 69 6.368 -4.550 -3.560 1.00 0.00 C ATOM 1048 C ILE A 69 7.574 -5.413 -3.960 1.00 0.00 C ATOM 1049 O ILE A 69 8.534 -4.884 -4.516 1.00 0.00 O ATOM 1050 CB ILE A 69 6.258 -4.226 -2.052 1.00 0.00 C ATOM 1051 CG1 ILE A 69 5.214 -3.103 -1.850 1.00 0.00 C ATOM 1052 CG2 ILE A 69 7.619 -3.809 -1.494 1.00 0.00 C ATOM 1053 CD1 ILE A 69 4.848 -2.831 -0.386 1.00 0.00 C ATOM 0 H ILE A 69 4.531 -5.465 -3.225 1.00 0.00 H new ATOM 0 HA ILE A 69 6.531 -3.597 -4.063 1.00 0.00 H new ATOM 0 HB ILE A 69 5.935 -5.116 -1.511 1.00 0.00 H new ATOM 0 HG12 ILE A 69 5.598 -2.184 -2.292 1.00 0.00 H new ATOM 0 HG13 ILE A 69 4.307 -3.365 -2.395 1.00 0.00 H new ATOM 0 HG21 ILE A 69 7.523 -3.585 -0.432 1.00 0.00 H new ATOM 0 HG22 ILE A 69 8.333 -4.622 -1.630 1.00 0.00 H new ATOM 0 HG23 ILE A 69 7.973 -2.923 -2.022 1.00 0.00 H new ATOM 0 HD11 ILE A 69 4.111 -2.030 -0.338 1.00 0.00 H new ATOM 0 HD12 ILE A 69 4.431 -3.735 0.059 1.00 0.00 H new ATOM 0 HD13 ILE A 69 5.742 -2.535 0.164 1.00 0.00 H new ATOM 1065 N LYS A 70 7.560 -6.726 -3.713 1.00 0.00 N ATOM 1066 CA LYS A 70 8.698 -7.611 -3.970 1.00 0.00 C ATOM 1067 C LYS A 70 8.910 -7.883 -5.460 1.00 0.00 C ATOM 1068 O LYS A 70 9.956 -8.426 -5.815 1.00 0.00 O ATOM 1069 CB LYS A 70 8.558 -8.930 -3.183 1.00 0.00 C ATOM 1070 CG LYS A 70 7.489 -9.846 -3.802 1.00 0.00 C ATOM 1071 CD LYS A 70 7.064 -11.062 -2.965 1.00 0.00 C ATOM 1072 CE LYS A 70 6.566 -10.672 -1.571 1.00 0.00 C ATOM 1073 NZ LYS A 70 5.807 -11.741 -0.893 1.00 0.00 N ATOM 0 H LYS A 70 6.750 -7.209 -3.325 1.00 0.00 H new ATOM 0 HA LYS A 70 9.587 -7.088 -3.618 1.00 0.00 H new ATOM 0 HB2 LYS A 70 9.517 -9.448 -3.166 1.00 0.00 H new ATOM 0 HB3 LYS A 70 8.296 -8.711 -2.148 1.00 0.00 H new ATOM 0 HG2 LYS A 70 6.602 -9.246 -4.008 1.00 0.00 H new ATOM 0 HG3 LYS A 70 7.861 -10.205 -4.762 1.00 0.00 H new ATOM 0 HD2 LYS A 70 6.276 -11.603 -3.490 1.00 0.00 H new ATOM 0 HD3 LYS A 70 7.908 -11.744 -2.867 1.00 0.00 H new ATOM 0 HE2 LYS A 70 7.421 -10.397 -0.953 1.00 0.00 H new ATOM 0 HE3 LYS A 70 5.935 -9.787 -1.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 5.836 -11.589 0.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 4.819 -11.725 -1.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 6.230 -12.664 -1.118 1.00 0.00 H new ATOM 1087 N LYS A 71 7.965 -7.543 -6.349 1.00 0.00 N ATOM 1088 CA LYS A 71 8.097 -7.897 -7.757 1.00 0.00 C ATOM 1089 C LYS A 71 8.940 -6.890 -8.529 1.00 0.00 C ATOM 1090 O LYS A 71 9.264 -7.139 -9.688 1.00 0.00 O ATOM 1091 CB LYS A 71 6.737 -8.214 -8.387 1.00 0.00 C ATOM 1092 CG LYS A 71 5.867 -6.980 -8.644 1.00 0.00 C ATOM 1093 CD LYS A 71 5.357 -6.917 -10.087 1.00 0.00 C ATOM 1094 CE LYS A 71 4.374 -8.054 -10.417 1.00 0.00 C ATOM 1095 NZ LYS A 71 2.981 -7.779 -10.013 1.00 0.00 N ATOM 0 H LYS A 71 7.115 -7.030 -6.116 1.00 0.00 H new ATOM 0 HA LYS A 71 8.663 -8.826 -7.821 1.00 0.00 H new ATOM 0 HB2 LYS A 71 6.898 -8.735 -9.331 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.196 -8.898 -7.733 1.00 0.00 H new ATOM 0 HG2 LYS A 71 5.017 -6.989 -7.961 1.00 0.00 H new ATOM 0 HG3 LYS A 71 6.443 -6.081 -8.425 1.00 0.00 H new ATOM 0 HD2 LYS A 71 4.867 -5.958 -10.254 1.00 0.00 H new ATOM 0 HD3 LYS A 71 6.205 -6.965 -10.771 1.00 0.00 H new ATOM 0 HE2 LYS A 71 4.400 -8.243 -11.490 1.00 0.00 H new ATOM 0 HE3 LYS A 71 4.711 -8.966 -9.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 2.380 -8.588 -10.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 2.941 -7.628 -8.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 2.640 -6.927 -10.502 1.00 0.00 H new ATOM 1109 N ILE A 72 9.314 -5.768 -7.911 1.00 0.00 N ATOM 1110 CA ILE A 72 9.841 -4.609 -8.617 1.00 0.00 C ATOM 1111 C ILE A 72 11.364 -4.747 -8.832 1.00 0.00 C ATOM 1112 O ILE A 72 12.113 -3.816 -8.565 1.00 0.00 O ATOM 1113 CB ILE A 72 9.441 -3.284 -7.915 1.00 0.00 C ATOM 1114 CG1 ILE A 72 8.012 -3.290 -7.338 1.00 0.00 C ATOM 1115 CG2 ILE A 72 9.537 -2.123 -8.924 1.00 0.00 C ATOM 1116 CD1 ILE A 72 7.758 -2.104 -6.407 1.00 0.00 C ATOM 0 H ILE A 72 9.258 -5.642 -6.900 1.00 0.00 H new ATOM 0 HA ILE A 72 9.386 -4.570 -9.607 1.00 0.00 H new ATOM 0 HB ILE A 72 10.132 -3.165 -7.081 1.00 0.00 H new ATOM 0 HG12 ILE A 72 7.292 -3.268 -8.156 1.00 0.00 H new ATOM 0 HG13 ILE A 72 7.846 -4.219 -6.793 1.00 0.00 H new ATOM 0 HG21 ILE A 72 9.257 -1.191 -8.434 1.00 0.00 H new ATOM 0 HG22 ILE A 72 10.560 -2.045 -9.293 1.00 0.00 H new ATOM 0 HG23 ILE A 72 8.863 -2.311 -9.760 1.00 0.00 H new ATOM 0 HD11 ILE A 72 6.738 -2.152 -6.026 1.00 0.00 H new ATOM 0 HD12 ILE A 72 8.459 -2.139 -5.573 1.00 0.00 H new ATOM 0 HD13 ILE A 72 7.896 -1.173 -6.957 1.00 0.00 H new ATOM 1128 N GLU A 73 11.823 -5.921 -9.268 1.00 0.00 N ATOM 1129 CA GLU A 73 13.113 -6.251 -9.884 1.00 0.00 C ATOM 1130 C GLU A 73 14.319 -5.425 -9.411 1.00 0.00 C ATOM 1131 O GLU A 73 15.128 -4.929 -10.200 1.00 0.00 O ATOM 1132 CB GLU A 73 12.902 -6.240 -11.407 1.00 0.00 C ATOM 1133 CG GLU A 73 13.876 -7.175 -12.128 1.00 0.00 C ATOM 1134 CD GLU A 73 13.568 -7.330 -13.621 1.00 0.00 C ATOM 1135 OE1 GLU A 73 14.516 -7.410 -14.438 1.00 0.00 O ATOM 1136 OE2 GLU A 73 12.370 -7.448 -13.980 1.00 0.00 O ATOM 0 H GLU A 73 11.239 -6.754 -9.191 1.00 0.00 H new ATOM 0 HA GLU A 73 13.411 -7.243 -9.545 1.00 0.00 H new ATOM 0 HB2 GLU A 73 11.878 -6.539 -11.633 1.00 0.00 H new ATOM 0 HB3 GLU A 73 13.029 -5.225 -11.783 1.00 0.00 H new ATOM 0 HG2 GLU A 73 14.890 -6.794 -12.010 1.00 0.00 H new ATOM 0 HG3 GLU A 73 13.847 -8.156 -11.654 1.00 0.00 H new ATOM 1144 N GLY A 74 14.447 -5.262 -8.095 1.00 0.00 N ATOM 1145 CA GLY A 74 15.332 -4.238 -7.557 1.00 0.00 C ATOM 1146 C GLY A 74 15.225 -4.105 -6.047 1.00 0.00 C ATOM 1147 O GLY A 74 16.219 -3.811 -5.390 1.00 0.00 O ATOM 0 H GLY A 74 13.957 -5.817 -7.394 1.00 0.00 H new ATOM 0 HA2 GLY A 74 16.361 -4.476 -7.825 1.00 0.00 H new ATOM 0 HA3 GLY A 74 15.096 -3.280 -8.020 1.00 0.00 H new ATOM 1151 N VAL A 75 14.028 -4.349 -5.529 1.00 0.00 N ATOM 1152 CA VAL A 75 13.547 -4.500 -4.162 1.00 0.00 C ATOM 1153 C VAL A 75 14.285 -5.563 -3.326 1.00 0.00 C ATOM 1154 O VAL A 75 13.775 -6.604 -2.917 1.00 0.00 O ATOM 1155 CB VAL A 75 12.032 -4.604 -4.205 1.00 0.00 C ATOM 1156 CG1 VAL A 75 11.655 -5.889 -4.928 1.00 0.00 C ATOM 1157 CG2 VAL A 75 11.414 -4.505 -2.811 1.00 0.00 C ATOM 0 H VAL A 75 13.243 -4.464 -6.170 1.00 0.00 H new ATOM 0 HA VAL A 75 13.803 -3.610 -3.586 1.00 0.00 H new ATOM 0 HB VAL A 75 11.622 -3.759 -4.758 1.00 0.00 H new ATOM 0 HG11 VAL A 75 10.569 -5.979 -4.968 1.00 0.00 H new ATOM 0 HG12 VAL A 75 12.055 -5.867 -5.942 1.00 0.00 H new ATOM 0 HG13 VAL A 75 12.071 -6.743 -4.393 1.00 0.00 H new ATOM 0 HG21 VAL A 75 10.330 -4.584 -2.887 1.00 0.00 H new ATOM 0 HG22 VAL A 75 11.794 -5.314 -2.186 1.00 0.00 H new ATOM 0 HG23 VAL A 75 11.677 -3.547 -2.363 1.00 0.00 H new ATOM 1167 N ASN A 76 15.558 -5.289 -3.148 1.00 0.00 N ATOM 1168 CA ASN A 76 16.506 -5.961 -2.283 1.00 0.00 C ATOM 1169 C ASN A 76 15.867 -6.433 -0.976 1.00 0.00 C ATOM 1170 O ASN A 76 15.945 -7.606 -0.624 1.00 0.00 O ATOM 1171 CB ASN A 76 17.554 -4.897 -1.998 1.00 0.00 C ATOM 1172 CG ASN A 76 18.622 -5.384 -1.029 1.00 0.00 C ATOM 1173 OD1 ASN A 76 19.431 -6.227 -1.395 1.00 0.00 O ATOM 1174 ND2 ASN A 76 18.699 -4.848 0.174 1.00 0.00 N ATOM 0 H ASN A 76 15.998 -4.519 -3.651 1.00 0.00 H new ATOM 0 HA ASN A 76 16.908 -6.860 -2.751 1.00 0.00 H new ATOM 0 HB2 ASN A 76 18.025 -4.595 -2.933 1.00 0.00 H new ATOM 0 HB3 ASN A 76 17.068 -4.013 -1.586 1.00 0.00 H new ATOM 0 HD21 ASN A 76 19.440 -5.135 0.814 1.00 0.00 H new ATOM 0 HD22 ASN A 76 18.018 -4.147 0.464 1.00 0.00 H new ATOM 1181 N ASN A 77 15.243 -5.502 -0.259 1.00 0.00 N ATOM 1182 CA ASN A 77 14.505 -5.693 0.974 1.00 0.00 C ATOM 1183 C ASN A 77 13.131 -5.026 0.960 1.00 0.00 C ATOM 1184 O ASN A 77 12.892 -4.065 0.221 1.00 0.00 O ATOM 1185 CB ASN A 77 15.310 -5.161 2.154 1.00 0.00 C ATOM 1186 CG ASN A 77 15.708 -3.714 2.095 1.00 0.00 C ATOM 1187 OD1 ASN A 77 16.650 -3.388 1.384 1.00 0.00 O ATOM 1188 ND2 ASN A 77 15.034 -2.862 2.849 1.00 0.00 N ATOM 0 H ASN A 77 15.244 -4.525 -0.551 1.00 0.00 H new ATOM 0 HA ASN A 77 14.344 -6.766 1.074 1.00 0.00 H new ATOM 0 HB2 ASN A 77 14.729 -5.318 3.062 1.00 0.00 H new ATOM 0 HB3 ASN A 77 16.216 -5.760 2.247 1.00 0.00 H new ATOM 0 HD21 ASN A 77 15.291 -1.875 2.858 1.00 0.00 H new ATOM 0 HD22 ASN A 77 14.257 -3.192 3.422 1.00 0.00 H new ATOM 1195 N VAL A 78 12.250 -5.522 1.829 1.00 0.00 N ATOM 1196 CA VAL A 78 10.834 -5.206 1.893 1.00 0.00 C ATOM 1197 C VAL A 78 10.539 -4.858 3.355 1.00 0.00 C ATOM 1198 O VAL A 78 10.121 -5.708 4.140 1.00 0.00 O ATOM 1199 CB VAL A 78 10.007 -6.402 1.353 1.00 0.00 C ATOM 1200 CG1 VAL A 78 8.516 -6.062 1.317 1.00 0.00 C ATOM 1201 CG2 VAL A 78 10.438 -6.826 -0.061 1.00 0.00 C ATOM 0 H VAL A 78 12.527 -6.193 2.545 1.00 0.00 H new ATOM 0 HA VAL A 78 10.556 -4.358 1.267 1.00 0.00 H new ATOM 0 HB VAL A 78 10.193 -7.229 2.038 1.00 0.00 H new ATOM 0 HG11 VAL A 78 7.957 -6.916 0.935 1.00 0.00 H new ATOM 0 HG12 VAL A 78 8.172 -5.825 2.324 1.00 0.00 H new ATOM 0 HG13 VAL A 78 8.354 -5.202 0.667 1.00 0.00 H new ATOM 0 HG21 VAL A 78 9.827 -7.667 -0.391 1.00 0.00 H new ATOM 0 HG22 VAL A 78 10.306 -5.990 -0.748 1.00 0.00 H new ATOM 0 HG23 VAL A 78 11.487 -7.123 -0.048 1.00 0.00 H new ATOM 1211 N GLU A 79 10.817 -3.612 3.742 1.00 0.00 N ATOM 1212 CA GLU A 79 10.513 -3.099 5.072 1.00 0.00 C ATOM 1213 C GLU A 79 9.122 -2.477 4.953 1.00 0.00 C ATOM 1214 O GLU A 79 8.988 -1.296 4.634 1.00 0.00 O ATOM 1215 CB GLU A 79 11.574 -2.065 5.493 1.00 0.00 C ATOM 1216 CG GLU A 79 12.981 -2.662 5.664 1.00 0.00 C ATOM 1217 CD GLU A 79 13.318 -3.027 7.112 1.00 0.00 C ATOM 1218 OE1 GLU A 79 12.591 -3.834 7.729 1.00 0.00 O ATOM 1219 OE2 GLU A 79 14.341 -2.508 7.626 1.00 0.00 O ATOM 0 H GLU A 79 11.264 -2.927 3.133 1.00 0.00 H new ATOM 0 HA GLU A 79 10.527 -3.875 5.838 1.00 0.00 H new ATOM 0 HB2 GLU A 79 11.613 -1.272 4.746 1.00 0.00 H new ATOM 0 HB3 GLU A 79 11.267 -1.604 6.432 1.00 0.00 H new ATOM 0 HG2 GLU A 79 13.066 -3.554 5.044 1.00 0.00 H new ATOM 0 HG3 GLU A 79 13.717 -1.947 5.297 1.00 0.00 H new ATOM 1227 N VAL A 80 8.062 -3.274 5.036 1.00 0.00 N ATOM 1228 CA VAL A 80 6.717 -2.719 5.146 1.00 0.00 C ATOM 1229 C VAL A 80 6.462 -2.586 6.639 1.00 0.00 C ATOM 1230 O VAL A 80 6.461 -3.591 7.354 1.00 0.00 O ATOM 1231 CB VAL A 80 5.652 -3.578 4.435 1.00 0.00 C ATOM 1232 CG1 VAL A 80 4.283 -2.899 4.580 1.00 0.00 C ATOM 1233 CG2 VAL A 80 5.964 -3.738 2.939 1.00 0.00 C ATOM 0 H VAL A 80 8.105 -4.293 5.029 1.00 0.00 H new ATOM 0 HA VAL A 80 6.645 -1.756 4.641 1.00 0.00 H new ATOM 0 HB VAL A 80 5.650 -4.566 4.896 1.00 0.00 H new ATOM 0 HG11 VAL A 80 3.524 -3.500 4.080 1.00 0.00 H new ATOM 0 HG12 VAL A 80 4.033 -2.805 5.637 1.00 0.00 H new ATOM 0 HG13 VAL A 80 4.318 -1.908 4.126 1.00 0.00 H new ATOM 0 HG21 VAL A 80 5.193 -4.349 2.470 1.00 0.00 H new ATOM 0 HG22 VAL A 80 5.988 -2.757 2.465 1.00 0.00 H new ATOM 0 HG23 VAL A 80 6.933 -4.222 2.819 1.00 0.00 H new ATOM 1243 N GLU A 81 6.308 -1.359 7.126 1.00 0.00 N ATOM 1244 CA GLU A 81 5.904 -1.125 8.497 1.00 0.00 C ATOM 1245 C GLU A 81 4.387 -1.029 8.510 1.00 0.00 C ATOM 1246 O GLU A 81 3.781 -0.245 7.770 1.00 0.00 O ATOM 1247 CB GLU A 81 6.578 0.118 9.066 1.00 0.00 C ATOM 1248 CG GLU A 81 6.452 0.123 10.592 1.00 0.00 C ATOM 1249 CD GLU A 81 7.336 1.168 11.278 1.00 0.00 C ATOM 1250 OE1 GLU A 81 8.507 1.373 10.872 1.00 0.00 O ATOM 1251 OE2 GLU A 81 6.879 1.737 12.298 1.00 0.00 O ATOM 0 H GLU A 81 6.460 -0.509 6.582 1.00 0.00 H new ATOM 0 HA GLU A 81 6.220 -1.944 9.142 1.00 0.00 H new ATOM 0 HB2 GLU A 81 7.629 0.137 8.779 1.00 0.00 H new ATOM 0 HB3 GLU A 81 6.118 1.015 8.651 1.00 0.00 H new ATOM 0 HG2 GLU A 81 5.412 0.306 10.861 1.00 0.00 H new ATOM 0 HG3 GLU A 81 6.710 -0.865 10.973 1.00 0.00 H new ATOM 1259 N LEU A 82 3.779 -1.865 9.341 1.00 0.00 N ATOM 1260 CA LEU A 82 2.339 -2.023 9.422 1.00 0.00 C ATOM 1261 C LEU A 82 1.860 -1.199 10.605 1.00 0.00 C ATOM 1262 O LEU A 82 1.884 -1.643 11.748 1.00 0.00 O ATOM 1263 CB LEU A 82 1.974 -3.512 9.501 1.00 0.00 C ATOM 1264 CG LEU A 82 0.469 -3.789 9.647 1.00 0.00 C ATOM 1265 CD1 LEU A 82 -0.418 -2.980 8.697 1.00 0.00 C ATOM 1266 CD2 LEU A 82 0.221 -5.279 9.413 1.00 0.00 C ATOM 0 H LEU A 82 4.288 -2.464 9.991 1.00 0.00 H new ATOM 0 HA LEU A 82 1.833 -1.656 8.529 1.00 0.00 H new ATOM 0 HB2 LEU A 82 2.338 -4.011 8.603 1.00 0.00 H new ATOM 0 HB3 LEU A 82 2.497 -3.958 10.347 1.00 0.00 H new ATOM 0 HG LEU A 82 0.193 -3.480 10.655 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -1.463 -3.237 8.868 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -0.272 -1.916 8.881 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -0.151 -3.210 7.666 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -0.843 -5.491 9.513 1.00 0.00 H new ATOM 0 HD22 LEU A 82 0.552 -5.550 8.410 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.778 -5.860 10.148 1.00 0.00 H new ATOM 1278 N THR A 83 1.504 0.048 10.326 1.00 0.00 N ATOM 1279 CA THR A 83 1.292 1.087 11.316 1.00 0.00 C ATOM 1280 C THR A 83 -0.090 0.903 11.937 1.00 0.00 C ATOM 1281 O THR A 83 -1.082 1.436 11.427 1.00 0.00 O ATOM 1282 CB THR A 83 1.451 2.461 10.632 1.00 0.00 C ATOM 1283 OG1 THR A 83 2.545 2.484 9.731 1.00 0.00 O ATOM 1284 CG2 THR A 83 1.647 3.579 11.649 1.00 0.00 C ATOM 0 H THR A 83 1.351 0.371 9.371 1.00 0.00 H new ATOM 0 HA THR A 83 2.026 1.027 12.120 1.00 0.00 H new ATOM 0 HB THR A 83 0.525 2.624 10.081 1.00 0.00 H new ATOM 0 HG1 THR A 83 2.280 2.067 8.885 1.00 0.00 H new ATOM 0 HG21 THR A 83 1.755 4.530 11.128 1.00 0.00 H new ATOM 0 HG22 THR A 83 0.782 3.624 12.311 1.00 0.00 H new ATOM 0 HG23 THR A 83 2.544 3.383 12.237 1.00 0.00 H new ATOM 1292 N PHE A 84 -0.190 0.116 13.007 1.00 0.00 N ATOM 1293 CA PHE A 84 -1.458 -0.375 13.506 1.00 0.00 C ATOM 1294 C PHE A 84 -1.843 0.371 14.767 1.00 0.00 C ATOM 1295 O PHE A 84 -1.791 -0.155 15.881 1.00 0.00 O ATOM 1296 CB PHE A 84 -1.427 -1.906 13.662 1.00 0.00 C ATOM 1297 CG PHE A 84 -2.344 -2.631 12.706 1.00 0.00 C ATOM 1298 CD1 PHE A 84 -3.607 -2.111 12.360 1.00 0.00 C ATOM 1299 CD2 PHE A 84 -1.924 -3.854 12.168 1.00 0.00 C ATOM 1300 CE1 PHE A 84 -4.392 -2.758 11.401 1.00 0.00 C ATOM 1301 CE2 PHE A 84 -2.735 -4.535 11.252 1.00 0.00 C ATOM 1302 CZ PHE A 84 -3.959 -3.973 10.848 1.00 0.00 C ATOM 0 H PHE A 84 0.615 -0.196 13.550 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.247 -0.174 12.781 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -0.406 -2.257 13.510 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -1.704 -2.164 14.684 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -3.969 -1.212 12.836 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -0.972 -4.273 12.460 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -5.330 -2.324 11.086 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -2.421 -5.490 10.857 1.00 0.00 H new ATOM 0 HZ PHE A 84 -4.567 -4.477 10.111 1.00 0.00 H new ATOM 1312 N ASP A 85 -2.232 1.630 14.585 1.00 0.00 N ATOM 1313 CA ASP A 85 -2.671 2.478 15.685 1.00 0.00 C ATOM 1314 C ASP A 85 -3.326 3.752 15.165 1.00 0.00 C ATOM 1315 O ASP A 85 -4.477 4.015 15.530 1.00 0.00 O ATOM 1316 CB ASP A 85 -1.482 2.856 16.580 1.00 0.00 C ATOM 1317 CG ASP A 85 -1.714 2.493 18.039 1.00 0.00 C ATOM 1318 OD1 ASP A 85 -2.716 2.990 18.606 1.00 0.00 O ATOM 1319 OD2 ASP A 85 -0.868 1.771 18.612 1.00 0.00 O ATOM 0 H ASP A 85 -2.251 2.088 13.674 1.00 0.00 H new ATOM 0 HA ASP A 85 -3.401 1.913 16.265 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -0.586 2.350 16.221 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -1.297 3.927 16.500 1.00 0.00 H new ATOM 1325 N PRO A 86 -2.647 4.557 14.319 1.00 0.00 N ATOM 1326 CA PRO A 86 -3.195 5.842 13.968 1.00 0.00 C ATOM 1327 C PRO A 86 -4.317 5.639 12.943 1.00 0.00 C ATOM 1328 O PRO A 86 -4.155 4.830 12.019 1.00 0.00 O ATOM 1329 CB PRO A 86 -2.042 6.681 13.425 1.00 0.00 C ATOM 1330 CG PRO A 86 -1.084 5.635 12.862 1.00 0.00 C ATOM 1331 CD PRO A 86 -1.314 4.409 13.744 1.00 0.00 C ATOM 0 HA PRO A 86 -3.636 6.360 14.820 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -2.377 7.376 12.655 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -1.573 7.276 14.209 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -1.299 5.419 11.815 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -0.049 5.974 12.912 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -1.243 3.492 13.159 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -0.558 4.347 14.527 1.00 0.00 H new ATOM 1339 N PRO A 87 -5.439 6.363 13.077 1.00 0.00 N ATOM 1340 CA PRO A 87 -6.564 6.254 12.166 1.00 0.00 C ATOM 1341 C PRO A 87 -6.139 6.734 10.781 1.00 0.00 C ATOM 1342 O PRO A 87 -5.638 7.847 10.640 1.00 0.00 O ATOM 1343 CB PRO A 87 -7.679 7.111 12.767 1.00 0.00 C ATOM 1344 CG PRO A 87 -6.948 8.114 13.660 1.00 0.00 C ATOM 1345 CD PRO A 87 -5.660 7.399 14.068 1.00 0.00 C ATOM 0 HA PRO A 87 -6.914 5.229 12.044 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -8.255 7.616 11.991 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -8.380 6.505 13.341 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -6.735 9.040 13.125 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -7.547 8.380 14.531 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -4.821 8.095 14.097 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -5.753 6.970 15.066 1.00 0.00 H new ATOM 1353 N TRP A 88 -6.337 5.878 9.776 1.00 0.00 N ATOM 1354 CA TRP A 88 -6.040 6.144 8.374 1.00 0.00 C ATOM 1355 C TRP A 88 -6.957 7.271 7.886 1.00 0.00 C ATOM 1356 O TRP A 88 -6.595 8.434 8.063 1.00 0.00 O ATOM 1357 CB TRP A 88 -6.084 4.805 7.613 1.00 0.00 C ATOM 1358 CG TRP A 88 -6.433 4.808 6.163 1.00 0.00 C ATOM 1359 CD1 TRP A 88 -5.680 5.273 5.145 1.00 0.00 C ATOM 1360 CD2 TRP A 88 -7.681 4.347 5.572 1.00 0.00 C ATOM 1361 NE1 TRP A 88 -6.371 5.097 3.959 1.00 0.00 N ATOM 1362 CE2 TRP A 88 -7.627 4.573 4.170 1.00 0.00 C ATOM 1363 CE3 TRP A 88 -8.880 3.828 6.104 1.00 0.00 C ATOM 1364 CZ2 TRP A 88 -8.725 4.317 3.339 1.00 0.00 C ATOM 1365 CZ3 TRP A 88 -9.991 3.585 5.279 1.00 0.00 C ATOM 1366 CH2 TRP A 88 -9.910 3.849 3.904 1.00 0.00 C ATOM 0 H TRP A 88 -6.723 4.946 9.926 1.00 0.00 H new ATOM 0 HA TRP A 88 -5.035 6.526 8.193 1.00 0.00 H new ATOM 0 HB2 TRP A 88 -5.105 4.337 7.715 1.00 0.00 H new ATOM 0 HB3 TRP A 88 -6.800 4.160 8.122 1.00 0.00 H new ATOM 0 HD1 TRP A 88 -4.698 5.711 5.240 1.00 0.00 H new ATOM 0 HE1 TRP A 88 -5.995 5.328 3.039 1.00 0.00 H new ATOM 0 HE3 TRP A 88 -8.945 3.614 7.161 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 -8.654 4.480 2.274 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 -10.905 3.196 5.703 1.00 0.00 H new ATOM 0 HH2 TRP A 88 -10.774 3.688 3.277 1.00 0.00 H new ATOM 1377 N THR A 89 -8.112 6.972 7.282 1.00 0.00 N ATOM 1378 CA THR A 89 -9.355 7.746 7.164 1.00 0.00 C ATOM 1379 C THR A 89 -10.110 7.206 5.935 1.00 0.00 C ATOM 1380 O THR A 89 -9.500 7.124 4.868 1.00 0.00 O ATOM 1381 CB THR A 89 -9.118 9.273 7.119 1.00 0.00 C ATOM 1382 OG1 THR A 89 -8.786 9.748 8.414 1.00 0.00 O ATOM 1383 CG2 THR A 89 -10.327 10.048 6.629 1.00 0.00 C ATOM 0 H THR A 89 -8.210 6.075 6.807 1.00 0.00 H new ATOM 0 HA THR A 89 -9.965 7.614 8.058 1.00 0.00 H new ATOM 0 HB THR A 89 -8.303 9.435 6.414 1.00 0.00 H new ATOM 0 HG1 THR A 89 -7.850 9.536 8.610 1.00 0.00 H new ATOM 0 HG21 THR A 89 -10.097 11.113 6.620 1.00 0.00 H new ATOM 0 HG22 THR A 89 -10.583 9.724 5.620 1.00 0.00 H new ATOM 0 HG23 THR A 89 -11.171 9.864 7.294 1.00 0.00 H new ATOM 1391 N PRO A 90 -11.424 6.912 5.984 1.00 0.00 N ATOM 1392 CA PRO A 90 -12.134 6.378 4.821 1.00 0.00 C ATOM 1393 C PRO A 90 -12.198 7.329 3.620 1.00 0.00 C ATOM 1394 O PRO A 90 -12.258 6.864 2.480 1.00 0.00 O ATOM 1395 CB PRO A 90 -13.520 5.984 5.315 1.00 0.00 C ATOM 1396 CG PRO A 90 -13.724 6.857 6.545 1.00 0.00 C ATOM 1397 CD PRO A 90 -12.317 6.971 7.133 1.00 0.00 C ATOM 0 HA PRO A 90 -11.585 5.523 4.426 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -14.283 6.171 4.559 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -13.571 4.924 5.563 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -14.130 7.834 6.282 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -14.419 6.402 7.251 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -12.193 7.904 7.682 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -12.114 6.160 7.833 1.00 0.00 H new ATOM 1405 N GLU A 91 -12.121 8.645 3.845 1.00 0.00 N ATOM 1406 CA GLU A 91 -12.159 9.653 2.786 1.00 0.00 C ATOM 1407 C GLU A 91 -11.032 9.488 1.757 1.00 0.00 C ATOM 1408 O GLU A 91 -11.147 9.963 0.633 1.00 0.00 O ATOM 1409 CB GLU A 91 -12.179 11.073 3.375 1.00 0.00 C ATOM 1410 CG GLU A 91 -10.789 11.648 3.702 1.00 0.00 C ATOM 1411 CD GLU A 91 -10.240 12.591 2.633 1.00 0.00 C ATOM 1412 OE1 GLU A 91 -9.094 12.365 2.174 1.00 0.00 O ATOM 1413 OE2 GLU A 91 -10.909 13.607 2.355 1.00 0.00 O ATOM 0 H GLU A 91 -12.029 9.042 4.780 1.00 0.00 H new ATOM 0 HA GLU A 91 -13.090 9.495 2.242 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -12.677 11.738 2.670 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -12.779 11.067 4.285 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -10.842 12.182 4.651 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -10.089 10.824 3.839 1.00 0.00 H new ATOM 1421 N ARG A 92 -9.956 8.791 2.130 1.00 0.00 N ATOM 1422 CA ARG A 92 -8.767 8.578 1.315 1.00 0.00 C ATOM 1423 C ARG A 92 -9.058 7.828 0.024 1.00 0.00 C ATOM 1424 O ARG A 92 -8.229 7.875 -0.888 1.00 0.00 O ATOM 1425 CB ARG A 92 -7.795 7.734 2.141 1.00 0.00 C ATOM 1426 CG ARG A 92 -7.190 8.484 3.325 1.00 0.00 C ATOM 1427 CD ARG A 92 -5.970 9.259 2.822 1.00 0.00 C ATOM 1428 NE ARG A 92 -5.480 10.205 3.822 1.00 0.00 N ATOM 1429 CZ ARG A 92 -4.216 10.432 4.177 1.00 0.00 C ATOM 1430 NH1 ARG A 92 -3.217 9.695 3.696 1.00 0.00 N ATOM 1431 NH2 ARG A 92 -3.998 11.417 5.037 1.00 0.00 N ATOM 0 H ARG A 92 -9.891 8.344 3.044 1.00 0.00 H new ATOM 0 HA ARG A 92 -8.364 9.553 1.043 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -8.316 6.850 2.509 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -6.991 7.383 1.494 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -7.922 9.166 3.758 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -6.900 7.786 4.110 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -5.176 8.559 2.563 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -6.231 9.796 1.910 1.00 0.00 H new ATOM 0 HE ARG A 92 -6.189 10.757 4.305 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -3.411 8.938 3.041 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -2.257 9.888 3.982 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -4.781 11.963 5.397 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -3.047 11.629 5.339 1.00 0.00 H new ATOM 1445 N MET A 93 -10.155 7.077 0.003 1.00 0.00 N ATOM 1446 CA MET A 93 -10.626 6.278 -1.110 1.00 0.00 C ATOM 1447 C MET A 93 -10.939 7.118 -2.341 1.00 0.00 C ATOM 1448 O MET A 93 -10.932 8.353 -2.314 1.00 0.00 O ATOM 1449 CB MET A 93 -11.866 5.486 -0.673 1.00 0.00 C ATOM 1450 CG MET A 93 -11.407 4.311 0.179 1.00 0.00 C ATOM 1451 SD MET A 93 -12.632 3.015 0.483 1.00 0.00 S ATOM 1452 CE MET A 93 -13.941 4.001 1.239 1.00 0.00 C ATOM 0 H MET A 93 -10.771 7.010 0.813 1.00 0.00 H new ATOM 0 HA MET A 93 -9.825 5.595 -1.394 1.00 0.00 H new ATOM 0 HB2 MET A 93 -12.544 6.124 -0.106 1.00 0.00 H new ATOM 0 HB3 MET A 93 -12.416 5.131 -1.544 1.00 0.00 H new ATOM 0 HG2 MET A 93 -10.541 3.857 -0.302 1.00 0.00 H new ATOM 0 HG3 MET A 93 -11.071 4.697 1.141 1.00 0.00 H new ATOM 0 HE1 MET A 93 -14.744 3.344 1.573 1.00 0.00 H new ATOM 0 HE2 MET A 93 -13.539 4.546 2.093 1.00 0.00 H new ATOM 0 HE3 MET A 93 -14.331 4.709 0.508 1.00 0.00 H new ATOM 1462 N SER A 94 -11.273 6.420 -3.428 1.00 0.00 N ATOM 1463 CA SER A 94 -11.728 7.063 -4.635 1.00 0.00 C ATOM 1464 C SER A 94 -12.937 7.953 -4.338 1.00 0.00 C ATOM 1465 O SER A 94 -13.778 7.585 -3.507 1.00 0.00 O ATOM 1466 CB SER A 94 -12.130 6.035 -5.687 1.00 0.00 C ATOM 1467 OG SER A 94 -11.191 4.978 -5.822 1.00 0.00 O ATOM 0 H SER A 94 -11.232 5.402 -3.484 1.00 0.00 H new ATOM 0 HA SER A 94 -10.903 7.665 -5.017 1.00 0.00 H new ATOM 0 HB2 SER A 94 -13.102 5.618 -5.425 1.00 0.00 H new ATOM 0 HB3 SER A 94 -12.246 6.535 -6.649 1.00 0.00 H new ATOM 0 HG SER A 94 -11.501 4.350 -6.507 1.00 0.00 H new ATOM 1473 N PRO A 95 -13.093 9.066 -5.069 1.00 0.00 N ATOM 1474 CA PRO A 95 -14.160 10.021 -4.831 1.00 0.00 C ATOM 1475 C PRO A 95 -15.563 9.431 -5.002 1.00 0.00 C ATOM 1476 O PRO A 95 -16.496 9.905 -4.357 1.00 0.00 O ATOM 1477 CB PRO A 95 -13.865 11.182 -5.780 1.00 0.00 C ATOM 1478 CG PRO A 95 -12.966 10.602 -6.868 1.00 0.00 C ATOM 1479 CD PRO A 95 -12.187 9.546 -6.103 1.00 0.00 C ATOM 0 HA PRO A 95 -14.174 10.350 -3.792 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -14.785 11.585 -6.204 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -13.370 12.000 -5.257 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -13.542 10.171 -7.687 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -12.311 11.358 -7.302 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -11.877 8.734 -6.761 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -11.281 9.966 -5.666 1.00 0.00 H new ATOM 1487 N GLU A 96 -15.701 8.353 -5.774 1.00 0.00 N ATOM 1488 CA GLU A 96 -16.944 7.623 -5.926 1.00 0.00 C ATOM 1489 C GLU A 96 -17.342 7.016 -4.581 1.00 0.00 C ATOM 1490 O GLU A 96 -18.497 7.092 -4.179 1.00 0.00 O ATOM 1491 CB GLU A 96 -16.743 6.506 -6.969 1.00 0.00 C ATOM 1492 CG GLU A 96 -17.927 6.369 -7.932 1.00 0.00 C ATOM 1493 CD GLU A 96 -17.914 7.360 -9.106 1.00 0.00 C ATOM 1494 OE1 GLU A 96 -18.885 7.321 -9.899 1.00 0.00 O ATOM 1495 OE2 GLU A 96 -16.921 8.099 -9.317 1.00 0.00 O ATOM 0 H GLU A 96 -14.933 7.961 -6.319 1.00 0.00 H new ATOM 0 HA GLU A 96 -17.734 8.295 -6.261 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -15.838 6.709 -7.541 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -16.589 5.558 -6.454 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -17.939 5.354 -8.330 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -18.852 6.502 -7.371 1.00 0.00 H new ATOM 1503 N LEU A 97 -16.387 6.392 -3.877 1.00 0.00 N ATOM 1504 CA LEU A 97 -16.683 5.664 -2.650 1.00 0.00 C ATOM 1505 C LEU A 97 -16.853 6.587 -1.454 1.00 0.00 C ATOM 1506 O LEU A 97 -17.561 6.220 -0.513 1.00 0.00 O ATOM 1507 CB LEU A 97 -15.628 4.600 -2.325 1.00 0.00 C ATOM 1508 CG LEU A 97 -15.597 3.368 -3.249 1.00 0.00 C ATOM 1509 CD1 LEU A 97 -14.896 2.230 -2.504 1.00 0.00 C ATOM 1510 CD2 LEU A 97 -16.976 2.857 -3.689 1.00 0.00 C ATOM 0 H LEU A 97 -15.402 6.381 -4.143 1.00 0.00 H new ATOM 0 HA LEU A 97 -17.631 5.162 -2.841 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -14.646 5.072 -2.351 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -15.790 4.258 -1.303 1.00 0.00 H new ATOM 0 HG LEU A 97 -15.076 3.681 -4.154 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -14.862 1.345 -3.140 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -13.880 2.533 -2.249 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -15.445 2.000 -1.591 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -16.853 1.989 -4.336 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -17.557 2.575 -2.811 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -17.499 3.644 -4.233 1.00 0.00 H new ATOM 1522 N ARG A 98 -16.245 7.776 -1.489 1.00 0.00 N ATOM 1523 CA ARG A 98 -16.507 8.817 -0.498 1.00 0.00 C ATOM 1524 C ARG A 98 -18.007 9.085 -0.471 1.00 0.00 C ATOM 1525 O ARG A 98 -18.640 8.949 0.574 1.00 0.00 O ATOM 1526 CB ARG A 98 -15.724 10.099 -0.823 1.00 0.00 C ATOM 1527 CG ARG A 98 -14.212 9.906 -0.658 1.00 0.00 C ATOM 1528 CD ARG A 98 -13.421 11.130 -1.126 1.00 0.00 C ATOM 1529 NE ARG A 98 -13.362 12.225 -0.141 1.00 0.00 N ATOM 1530 CZ ARG A 98 -13.224 13.519 -0.450 1.00 0.00 C ATOM 1531 NH1 ARG A 98 -13.643 13.961 -1.630 1.00 0.00 N ATOM 1532 NH2 ARG A 98 -12.649 14.361 0.397 1.00 0.00 N ATOM 0 H ARG A 98 -15.563 8.040 -2.200 1.00 0.00 H new ATOM 0 HA ARG A 98 -16.174 8.482 0.484 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -15.941 10.407 -1.846 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -16.060 10.904 -0.170 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -13.985 9.707 0.389 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -13.895 9.031 -1.225 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -12.405 10.820 -1.369 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -13.868 11.507 -2.046 1.00 0.00 H new ATOM 0 HE ARG A 98 -13.431 11.978 0.846 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -14.068 13.315 -2.295 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -13.540 14.947 -1.871 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -12.306 14.024 1.297 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -12.550 15.345 0.149 1.00 0.00 H new ATOM 1546 N GLU A 99 -18.558 9.410 -1.639 1.00 0.00 N ATOM 1547 CA GLU A 99 -19.942 9.768 -1.826 1.00 0.00 C ATOM 1548 C GLU A 99 -20.864 8.567 -1.595 1.00 0.00 C ATOM 1549 O GLU A 99 -21.814 8.665 -0.821 1.00 0.00 O ATOM 1550 CB GLU A 99 -20.080 10.333 -3.247 1.00 0.00 C ATOM 1551 CG GLU A 99 -21.256 11.298 -3.273 1.00 0.00 C ATOM 1552 CD GLU A 99 -21.746 11.618 -4.683 1.00 0.00 C ATOM 1553 OE1 GLU A 99 -20.919 11.749 -5.618 1.00 0.00 O ATOM 1554 OE2 GLU A 99 -22.982 11.767 -4.847 1.00 0.00 O ATOM 0 H GLU A 99 -18.023 9.429 -2.507 1.00 0.00 H new ATOM 0 HA GLU A 99 -20.245 10.519 -1.097 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -19.164 10.845 -3.541 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -20.237 9.525 -3.962 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -22.079 10.872 -2.698 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -20.967 12.225 -2.778 1.00 0.00 H new ATOM 1562 N LYS A 100 -20.576 7.427 -2.238 1.00 0.00 N ATOM 1563 CA LYS A 100 -21.394 6.213 -2.193 1.00 0.00 C ATOM 1564 C LYS A 100 -21.708 5.822 -0.755 1.00 0.00 C ATOM 1565 O LYS A 100 -22.856 5.504 -0.442 1.00 0.00 O ATOM 1566 CB LYS A 100 -20.669 5.078 -2.939 1.00 0.00 C ATOM 1567 CG LYS A 100 -21.514 3.798 -3.005 1.00 0.00 C ATOM 1568 CD LYS A 100 -20.803 2.620 -3.683 1.00 0.00 C ATOM 1569 CE LYS A 100 -20.420 2.861 -5.153 1.00 0.00 C ATOM 1570 NZ LYS A 100 -21.128 1.953 -6.083 1.00 0.00 N ATOM 0 H LYS A 100 -19.744 7.324 -2.819 1.00 0.00 H new ATOM 0 HA LYS A 100 -22.346 6.404 -2.689 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -20.428 5.405 -3.950 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -19.724 4.863 -2.440 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -21.795 3.507 -1.993 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -22.438 4.011 -3.543 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -19.900 2.386 -3.120 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -21.449 1.744 -3.629 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -20.645 3.894 -5.418 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -19.344 2.729 -5.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -20.834 2.158 -7.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -20.894 0.967 -5.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -22.154 2.096 -5.994 1.00 0.00 H new ATOM 1584 N PHE A 101 -20.688 5.803 0.101 1.00 0.00 N ATOM 1585 CA PHE A 101 -20.860 5.531 1.516 1.00 0.00 C ATOM 1586 C PHE A 101 -21.522 6.749 2.161 1.00 0.00 C ATOM 1587 O PHE A 101 -22.644 6.659 2.662 1.00 0.00 O ATOM 1588 CB PHE A 101 -19.496 5.230 2.147 1.00 0.00 C ATOM 1589 CG PHE A 101 -18.949 3.828 1.912 1.00 0.00 C ATOM 1590 CD1 PHE A 101 -18.786 3.305 0.613 1.00 0.00 C ATOM 1591 CD2 PHE A 101 -18.592 3.036 3.022 1.00 0.00 C ATOM 1592 CE1 PHE A 101 -18.320 1.992 0.426 1.00 0.00 C ATOM 1593 CE2 PHE A 101 -18.121 1.727 2.834 1.00 0.00 C ATOM 1594 CZ PHE A 101 -17.991 1.200 1.539 1.00 0.00 C ATOM 0 H PHE A 101 -19.721 5.977 -0.173 1.00 0.00 H new ATOM 0 HA PHE A 101 -21.496 4.660 1.673 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -18.773 5.950 1.764 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -19.570 5.395 3.222 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -19.021 3.918 -0.245 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -18.681 3.438 4.021 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -18.215 1.593 -0.572 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -17.857 1.123 3.689 1.00 0.00 H new ATOM 0 HZ PHE A 101 -17.639 0.189 1.399 1.00 0.00 H new ATOM 1604 N GLY A 102 -20.847 7.897 2.139 1.00 0.00 N ATOM 1605 CA GLY A 102 -21.163 9.039 2.977 1.00 0.00 C ATOM 1606 C GLY A 102 -20.154 9.065 4.110 1.00 0.00 C ATOM 1607 O GLY A 102 -20.431 8.560 5.204 1.00 0.00 O ATOM 0 H GLY A 102 -20.050 8.057 1.523 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -21.116 9.963 2.400 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -22.177 8.959 3.368 1.00 0.00 H new ATOM 1611 N VAL A 103 -18.964 9.588 3.817 1.00 0.00 N ATOM 1612 CA VAL A 103 -17.888 9.824 4.776 1.00 0.00 C ATOM 1613 C VAL A 103 -17.402 11.253 4.585 1.00 0.00 C ATOM 1614 O VAL A 103 -18.247 12.138 4.308 1.00 0.00 O ATOM 1615 CB VAL A 103 -16.785 8.740 4.663 1.00 0.00 C ATOM 1616 CG1 VAL A 103 -17.309 7.373 5.125 1.00 0.00 C ATOM 1617 CG2 VAL A 103 -16.216 8.577 3.243 1.00 0.00 C ATOM 0 H VAL A 103 -18.715 9.869 2.869 1.00 0.00 H new ATOM 0 HA VAL A 103 -18.241 9.730 5.803 1.00 0.00 H new ATOM 0 HB VAL A 103 -15.981 9.090 5.310 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -16.516 6.630 5.036 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -17.629 7.439 6.165 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -18.154 7.078 4.503 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -15.450 7.801 3.245 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -17.017 8.295 2.560 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -15.777 9.520 2.917 1.00 0.00 H new TER 1627 VAL A 103