USER MOD reduce.3.24.130724 H: found=0, std=0, add=758, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 756 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 44 ASN : amide:sc= 0.267 K(o=-0.017,f=-9.2!) USER MOD Set 1.2: A 76 SER OG : rot 73:sc= -0.284 USER MOD Single : A 1 GLY N :NH3+ -174:sc= 0 (180deg=-0.0285) USER MOD Single : A 2 SER OG : rot 180:sc=-0.00993 USER MOD Single : A 3 SER OG : rot 34:sc= 0.756 USER MOD Single : A 5 SER OG : rot 2:sc= 0.357 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 155:sc= -0.394 (180deg=-1.3) USER MOD Single : A 18 TYR OH : rot 180:sc= -0.0721 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ -157:sc= -1.17 (180deg=-1.93!) USER MOD Single : A 40 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00457) USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 SER OG : rot 30:sc= 0.865 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 139:sc= 0.329 (180deg=-0.155) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 HIS : no HE2:sc= -0.0689 X(o=-0.069,f=-0.089) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 CYS SG : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -12.8! C(o=-13!,f=-17!) USER MOD Single : A 68 ASN : amide:sc= 0.39 K(o=0.39,f=-5.3!) USER MOD Single : A 69 ASN : amide:sc= -0.106 K(o=-0.11,f=-1.7!) USER MOD Single : A 70 CYS SG : rot 43:sc= -3.8! USER MOD Single : A 71 GLN : amide:sc= -1.05 K(o=-1.1,f=-2) USER MOD Single : A 72 MET CE :methyl -176:sc= -2.52 (180deg=-2.59) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 30:sc= -0.0248 USER MOD Single : A 79 TYR OH : rot 92:sc= 0.113 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 CYS SG : rot -160:sc= -3.35 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot 173:sc= 0.347 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -23.680 -2.336 -18.382 1.00 0.00 N ATOM 2 CA GLY A 1 -24.467 -3.494 -18.766 1.00 0.00 C ATOM 3 C GLY A 1 -25.685 -3.685 -17.884 1.00 0.00 C ATOM 4 O GLY A 1 -26.769 -4.004 -18.372 1.00 0.00 O ATOM 0 H1 GLY A 1 -22.918 -2.189 -19.074 1.00 0.00 H new ATOM 0 H2 GLY A 1 -24.291 -1.495 -18.356 1.00 0.00 H new ATOM 0 H3 GLY A 1 -23.267 -2.494 -17.441 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -24.786 -3.385 -19.803 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -23.843 -4.386 -18.717 1.00 0.00 H new ATOM 8 N SER A 2 -25.507 -3.490 -16.581 1.00 0.00 N ATOM 9 CA SER A 2 -26.599 -3.648 -15.628 1.00 0.00 C ATOM 10 C SER A 2 -26.461 -2.659 -14.474 1.00 0.00 C ATOM 11 O SER A 2 -25.437 -1.990 -14.335 1.00 0.00 O ATOM 12 CB SER A 2 -26.630 -5.079 -15.088 1.00 0.00 C ATOM 13 OG SER A 2 -26.646 -6.023 -16.145 1.00 0.00 O ATOM 0 H SER A 2 -24.617 -3.222 -16.161 1.00 0.00 H new ATOM 0 HA SER A 2 -27.535 -3.444 -16.148 1.00 0.00 H new ATOM 0 HB2 SER A 2 -25.759 -5.251 -14.456 1.00 0.00 H new ATOM 0 HB3 SER A 2 -27.511 -5.215 -14.461 1.00 0.00 H new ATOM 0 HG SER A 2 -26.664 -6.930 -15.774 1.00 0.00 H new ATOM 19 N SER A 3 -27.499 -2.574 -13.648 1.00 0.00 N ATOM 20 CA SER A 3 -27.496 -1.666 -12.508 1.00 0.00 C ATOM 21 C SER A 3 -26.317 -1.956 -11.585 1.00 0.00 C ATOM 22 O SER A 3 -26.312 -2.949 -10.858 1.00 0.00 O ATOM 23 CB SER A 3 -28.808 -1.785 -11.731 1.00 0.00 C ATOM 24 OG SER A 3 -28.999 -3.105 -11.251 1.00 0.00 O ATOM 0 H SER A 3 -28.353 -3.123 -13.747 1.00 0.00 H new ATOM 0 HA SER A 3 -27.397 -0.648 -12.886 1.00 0.00 H new ATOM 0 HB2 SER A 3 -28.803 -1.087 -10.893 1.00 0.00 H new ATOM 0 HB3 SER A 3 -29.642 -1.504 -12.374 1.00 0.00 H new ATOM 0 HG SER A 3 -28.131 -3.499 -11.023 1.00 0.00 H new ATOM 30 N GLY A 4 -25.316 -1.081 -11.619 1.00 0.00 N ATOM 31 CA GLY A 4 -24.144 -1.260 -10.782 1.00 0.00 C ATOM 32 C GLY A 4 -22.860 -0.886 -11.495 1.00 0.00 C ATOM 33 O GLY A 4 -22.772 0.173 -12.116 1.00 0.00 O ATOM 0 H GLY A 4 -25.296 -0.251 -12.212 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -24.247 -0.652 -9.883 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -24.087 -2.300 -10.459 1.00 0.00 H new ATOM 37 N SER A 5 -21.859 -1.757 -11.404 1.00 0.00 N ATOM 38 CA SER A 5 -20.571 -1.510 -12.041 1.00 0.00 C ATOM 39 C SER A 5 -19.847 -2.822 -12.328 1.00 0.00 C ATOM 40 O SER A 5 -20.303 -3.895 -11.933 1.00 0.00 O ATOM 41 CB SER A 5 -19.702 -0.618 -11.152 1.00 0.00 C ATOM 42 OG SER A 5 -20.275 0.669 -11.005 1.00 0.00 O ATOM 0 H SER A 5 -21.916 -2.639 -10.895 1.00 0.00 H new ATOM 0 HA SER A 5 -20.752 -1.001 -12.988 1.00 0.00 H new ATOM 0 HB2 SER A 5 -19.584 -1.081 -10.172 1.00 0.00 H new ATOM 0 HB3 SER A 5 -18.706 -0.529 -11.585 1.00 0.00 H new ATOM 0 HG SER A 5 -21.127 0.705 -11.488 1.00 0.00 H new ATOM 48 N SER A 6 -18.715 -2.727 -13.019 1.00 0.00 N ATOM 49 CA SER A 6 -17.929 -3.905 -13.363 1.00 0.00 C ATOM 50 C SER A 6 -16.752 -4.071 -12.407 1.00 0.00 C ATOM 51 O SER A 6 -16.569 -5.130 -11.807 1.00 0.00 O ATOM 52 CB SER A 6 -17.420 -3.802 -14.802 1.00 0.00 C ATOM 53 OG SER A 6 -16.734 -4.981 -15.186 1.00 0.00 O ATOM 0 H SER A 6 -18.322 -1.846 -13.351 1.00 0.00 H new ATOM 0 HA SER A 6 -18.573 -4.780 -13.274 1.00 0.00 H new ATOM 0 HB2 SER A 6 -18.259 -3.630 -15.476 1.00 0.00 H new ATOM 0 HB3 SER A 6 -16.755 -2.944 -14.895 1.00 0.00 H new ATOM 0 HG SER A 6 -16.420 -4.891 -16.110 1.00 0.00 H new ATOM 59 N GLY A 7 -15.955 -3.015 -12.269 1.00 0.00 N ATOM 60 CA GLY A 7 -14.805 -3.064 -11.385 1.00 0.00 C ATOM 61 C GLY A 7 -14.290 -1.684 -11.028 1.00 0.00 C ATOM 62 O GLY A 7 -15.016 -0.872 -10.453 1.00 0.00 O ATOM 0 H GLY A 7 -16.085 -2.127 -12.754 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -15.074 -3.595 -10.472 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.008 -3.634 -11.862 1.00 0.00 H new ATOM 66 N ALA A 8 -13.033 -1.417 -11.366 1.00 0.00 N ATOM 67 CA ALA A 8 -12.422 -0.125 -11.078 1.00 0.00 C ATOM 68 C ALA A 8 -12.480 0.189 -9.587 1.00 0.00 C ATOM 69 O ALA A 8 -12.707 1.332 -9.192 1.00 0.00 O ATOM 70 CB ALA A 8 -13.107 0.973 -11.878 1.00 0.00 C ATOM 0 H ALA A 8 -12.418 -2.078 -11.840 1.00 0.00 H new ATOM 0 HA ALA A 8 -11.374 -0.173 -11.372 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -12.641 1.932 -11.653 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -13.009 0.763 -12.943 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -14.163 1.012 -11.612 1.00 0.00 H new ATOM 76 N ALA A 9 -12.274 -0.834 -8.763 1.00 0.00 N ATOM 77 CA ALA A 9 -12.301 -0.666 -7.316 1.00 0.00 C ATOM 78 C ALA A 9 -11.238 0.326 -6.858 1.00 0.00 C ATOM 79 O ALA A 9 -11.368 0.950 -5.804 1.00 0.00 O ATOM 80 CB ALA A 9 -12.106 -2.008 -6.625 1.00 0.00 C ATOM 0 H ALA A 9 -12.087 -1.787 -9.074 1.00 0.00 H new ATOM 0 HA ALA A 9 -13.277 -0.266 -7.040 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -12.128 -1.867 -5.544 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -12.905 -2.688 -6.919 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -11.144 -2.431 -6.916 1.00 0.00 H new ATOM 86 N PHE A 10 -10.185 0.468 -7.656 1.00 0.00 N ATOM 87 CA PHE A 10 -9.097 1.384 -7.331 1.00 0.00 C ATOM 88 C PHE A 10 -9.141 2.619 -8.226 1.00 0.00 C ATOM 89 O PHE A 10 -8.874 2.540 -9.425 1.00 0.00 O ATOM 90 CB PHE A 10 -7.747 0.680 -7.480 1.00 0.00 C ATOM 91 CG PHE A 10 -7.409 -0.219 -6.325 1.00 0.00 C ATOM 92 CD1 PHE A 10 -6.986 0.313 -5.118 1.00 0.00 C ATOM 93 CD2 PHE A 10 -7.515 -1.595 -6.447 1.00 0.00 C ATOM 94 CE1 PHE A 10 -6.673 -0.512 -4.054 1.00 0.00 C ATOM 95 CE2 PHE A 10 -7.204 -2.425 -5.386 1.00 0.00 C ATOM 96 CZ PHE A 10 -6.784 -1.882 -4.188 1.00 0.00 C ATOM 0 H PHE A 10 -10.062 -0.039 -8.532 1.00 0.00 H new ATOM 0 HA PHE A 10 -9.220 1.702 -6.296 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -7.752 0.092 -8.398 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -6.964 1.431 -7.587 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -6.900 1.384 -5.007 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -7.844 -2.024 -7.382 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -6.342 -0.086 -3.119 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -7.289 -3.496 -5.494 1.00 0.00 H new ATOM 0 HZ PHE A 10 -6.543 -2.528 -3.357 1.00 0.00 H new ATOM 106 N ALA A 11 -9.480 3.760 -7.634 1.00 0.00 N ATOM 107 CA ALA A 11 -9.558 5.012 -8.376 1.00 0.00 C ATOM 108 C ALA A 11 -8.169 5.596 -8.614 1.00 0.00 C ATOM 109 O ALA A 11 -7.948 6.326 -9.581 1.00 0.00 O ATOM 110 CB ALA A 11 -10.433 6.012 -7.635 1.00 0.00 C ATOM 0 H ALA A 11 -9.705 3.843 -6.643 1.00 0.00 H new ATOM 0 HA ALA A 11 -10.007 4.803 -9.347 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -10.482 6.942 -8.201 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -11.437 5.603 -7.522 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -10.008 6.208 -6.651 1.00 0.00 H new ATOM 116 N LYS A 12 -7.236 5.271 -7.726 1.00 0.00 N ATOM 117 CA LYS A 12 -5.868 5.763 -7.839 1.00 0.00 C ATOM 118 C LYS A 12 -4.873 4.724 -7.333 1.00 0.00 C ATOM 119 O LYS A 12 -4.781 4.473 -6.131 1.00 0.00 O ATOM 120 CB LYS A 12 -5.706 7.066 -7.053 1.00 0.00 C ATOM 121 CG LYS A 12 -4.301 7.281 -6.515 1.00 0.00 C ATOM 122 CD LYS A 12 -4.044 8.745 -6.198 1.00 0.00 C ATOM 123 CE LYS A 12 -3.476 9.484 -7.399 1.00 0.00 C ATOM 124 NZ LYS A 12 -4.539 9.858 -8.374 1.00 0.00 N ATOM 0 H LYS A 12 -7.402 4.669 -6.920 1.00 0.00 H new ATOM 0 HA LYS A 12 -5.663 5.954 -8.892 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -5.972 7.904 -7.697 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -6.409 7.068 -6.220 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -4.159 6.682 -5.615 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -3.573 6.933 -7.247 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -4.974 9.219 -5.884 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -3.350 8.821 -5.361 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -2.960 10.383 -7.062 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -2.734 8.857 -7.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -4.228 10.682 -8.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -4.720 9.059 -9.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -5.412 10.095 -7.861 1.00 0.00 H new ATOM 138 N ILE A 13 -4.129 4.124 -8.256 1.00 0.00 N ATOM 139 CA ILE A 13 -3.139 3.114 -7.902 1.00 0.00 C ATOM 140 C ILE A 13 -1.835 3.759 -7.445 1.00 0.00 C ATOM 141 O ILE A 13 -1.685 4.981 -7.490 1.00 0.00 O ATOM 142 CB ILE A 13 -2.846 2.173 -9.085 1.00 0.00 C ATOM 143 CG1 ILE A 13 -2.370 2.976 -10.297 1.00 0.00 C ATOM 144 CG2 ILE A 13 -4.085 1.361 -9.434 1.00 0.00 C ATOM 145 CD1 ILE A 13 -1.520 2.173 -11.257 1.00 0.00 C ATOM 0 H ILE A 13 -4.193 4.320 -9.255 1.00 0.00 H new ATOM 0 HA ILE A 13 -3.561 2.533 -7.082 1.00 0.00 H new ATOM 0 HB ILE A 13 -2.053 1.484 -8.795 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -3.238 3.364 -10.830 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -1.798 3.837 -9.951 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -3.863 0.700 -10.272 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -4.384 0.765 -8.572 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -4.896 2.035 -9.709 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.218 2.805 -12.092 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.633 1.807 -10.739 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -2.096 1.327 -11.632 1.00 0.00 H new ATOM 157 N LEU A 14 -0.893 2.931 -7.008 1.00 0.00 N ATOM 158 CA LEU A 14 0.401 3.420 -6.545 1.00 0.00 C ATOM 159 C LEU A 14 1.369 3.588 -7.711 1.00 0.00 C ATOM 160 O LEU A 14 1.230 2.934 -8.745 1.00 0.00 O ATOM 161 CB LEU A 14 0.991 2.459 -5.512 1.00 0.00 C ATOM 162 CG LEU A 14 0.079 2.086 -4.343 1.00 0.00 C ATOM 163 CD1 LEU A 14 -0.714 0.829 -4.664 1.00 0.00 C ATOM 164 CD2 LEU A 14 0.892 1.895 -3.071 1.00 0.00 C ATOM 0 H LEU A 14 -1.001 1.918 -6.964 1.00 0.00 H new ATOM 0 HA LEU A 14 0.248 4.394 -6.081 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.285 1.543 -6.024 1.00 0.00 H new ATOM 0 HB3 LEU A 14 1.901 2.904 -5.109 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.624 2.903 -4.182 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -1.357 0.579 -3.820 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -1.327 1.001 -5.549 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -0.027 0.004 -4.853 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.226 1.630 -2.250 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.619 1.097 -3.220 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.414 2.821 -2.830 1.00 0.00 H new ATOM 176 N ASP A 15 2.350 4.467 -7.537 1.00 0.00 N ATOM 177 CA ASP A 15 3.344 4.719 -8.574 1.00 0.00 C ATOM 178 C ASP A 15 3.992 3.416 -9.034 1.00 0.00 C ATOM 179 O ASP A 15 4.058 2.433 -8.296 1.00 0.00 O ATOM 180 CB ASP A 15 4.415 5.682 -8.061 1.00 0.00 C ATOM 181 CG ASP A 15 3.855 6.711 -7.098 1.00 0.00 C ATOM 182 OD1 ASP A 15 2.647 7.016 -7.191 1.00 0.00 O ATOM 183 OD2 ASP A 15 4.624 7.210 -6.250 1.00 0.00 O ATOM 0 H ASP A 15 2.478 5.017 -6.688 1.00 0.00 H new ATOM 0 HA ASP A 15 2.837 5.172 -9.426 1.00 0.00 H new ATOM 0 HB2 ASP A 15 5.202 5.114 -7.564 1.00 0.00 H new ATOM 0 HB3 ASP A 15 4.875 6.193 -8.907 1.00 0.00 H new ATOM 188 N PRO A 16 4.481 3.407 -10.282 1.00 0.00 N ATOM 189 CA PRO A 16 5.132 2.231 -10.869 1.00 0.00 C ATOM 190 C PRO A 16 6.486 1.941 -10.231 1.00 0.00 C ATOM 191 O PRO A 16 7.103 0.911 -10.504 1.00 0.00 O ATOM 192 CB PRO A 16 5.305 2.619 -12.340 1.00 0.00 C ATOM 193 CG PRO A 16 5.342 4.108 -12.337 1.00 0.00 C ATOM 194 CD PRO A 16 4.437 4.543 -11.218 1.00 0.00 C ATOM 0 HA PRO A 16 4.547 1.323 -10.720 1.00 0.00 H new ATOM 0 HB2 PRO A 16 6.222 2.201 -12.754 1.00 0.00 H new ATOM 0 HB3 PRO A 16 4.481 2.245 -12.948 1.00 0.00 H new ATOM 0 HG2 PRO A 16 6.357 4.473 -12.182 1.00 0.00 H new ATOM 0 HG3 PRO A 16 5.002 4.509 -13.292 1.00 0.00 H new ATOM 0 HD2 PRO A 16 4.789 5.463 -10.751 1.00 0.00 H new ATOM 0 HD3 PRO A 16 3.424 4.733 -11.572 1.00 0.00 H new ATOM 202 N ALA A 17 6.943 2.854 -9.380 1.00 0.00 N ATOM 203 CA ALA A 17 8.223 2.693 -8.702 1.00 0.00 C ATOM 204 C ALA A 17 8.455 3.814 -7.694 1.00 0.00 C ATOM 205 O ALA A 17 8.331 4.994 -8.024 1.00 0.00 O ATOM 206 CB ALA A 17 9.356 2.651 -9.717 1.00 0.00 C ATOM 0 H ALA A 17 6.446 3.713 -9.144 1.00 0.00 H new ATOM 0 HA ALA A 17 8.202 1.749 -8.158 1.00 0.00 H new ATOM 0 HB1 ALA A 17 10.306 2.530 -9.197 1.00 0.00 H new ATOM 0 HB2 ALA A 17 9.205 1.812 -10.396 1.00 0.00 H new ATOM 0 HB3 ALA A 17 9.369 3.581 -10.286 1.00 0.00 H new ATOM 212 N TYR A 18 8.790 3.438 -6.465 1.00 0.00 N ATOM 213 CA TYR A 18 9.036 4.411 -5.408 1.00 0.00 C ATOM 214 C TYR A 18 10.524 4.500 -5.084 1.00 0.00 C ATOM 215 O TYR A 18 11.295 3.597 -5.409 1.00 0.00 O ATOM 216 CB TYR A 18 8.249 4.039 -4.150 1.00 0.00 C ATOM 217 CG TYR A 18 6.768 4.321 -4.257 1.00 0.00 C ATOM 218 CD1 TYR A 18 5.961 3.589 -5.120 1.00 0.00 C ATOM 219 CD2 TYR A 18 6.174 5.318 -3.493 1.00 0.00 C ATOM 220 CE1 TYR A 18 4.607 3.844 -5.220 1.00 0.00 C ATOM 221 CE2 TYR A 18 4.820 5.579 -3.586 1.00 0.00 C ATOM 222 CZ TYR A 18 4.042 4.839 -4.452 1.00 0.00 C ATOM 223 OH TYR A 18 2.693 5.095 -4.548 1.00 0.00 O ATOM 0 H TYR A 18 8.897 2.466 -6.176 1.00 0.00 H new ATOM 0 HA TYR A 18 8.702 5.386 -5.762 1.00 0.00 H new ATOM 0 HB2 TYR A 18 8.394 2.979 -3.941 1.00 0.00 H new ATOM 0 HB3 TYR A 18 8.655 4.590 -3.302 1.00 0.00 H new ATOM 0 HD1 TYR A 18 6.400 2.808 -5.723 1.00 0.00 H new ATOM 0 HD2 TYR A 18 6.781 5.899 -2.815 1.00 0.00 H new ATOM 0 HE1 TYR A 18 3.994 3.267 -5.897 1.00 0.00 H new ATOM 0 HE2 TYR A 18 4.374 6.357 -2.985 1.00 0.00 H new ATOM 0 HH TYR A 18 2.455 5.826 -3.940 1.00 0.00 H new ATOM 233 N GLN A 19 10.919 5.594 -4.441 1.00 0.00 N ATOM 234 CA GLN A 19 12.314 5.801 -4.072 1.00 0.00 C ATOM 235 C GLN A 19 12.422 6.513 -2.728 1.00 0.00 C ATOM 236 O GLN A 19 11.803 7.555 -2.514 1.00 0.00 O ATOM 237 CB GLN A 19 13.034 6.612 -5.151 1.00 0.00 C ATOM 238 CG GLN A 19 13.169 5.878 -6.476 1.00 0.00 C ATOM 239 CD GLN A 19 13.381 6.819 -7.645 1.00 0.00 C ATOM 240 OE1 GLN A 19 14.002 7.873 -7.504 1.00 0.00 O ATOM 241 NE2 GLN A 19 12.867 6.442 -8.810 1.00 0.00 N ATOM 0 H GLN A 19 10.293 6.350 -4.165 1.00 0.00 H new ATOM 0 HA GLN A 19 12.789 4.824 -3.984 1.00 0.00 H new ATOM 0 HB2 GLN A 19 12.493 7.544 -5.315 1.00 0.00 H new ATOM 0 HB3 GLN A 19 14.027 6.879 -4.791 1.00 0.00 H new ATOM 0 HG2 GLN A 19 14.006 5.182 -6.418 1.00 0.00 H new ATOM 0 HG3 GLN A 19 12.272 5.284 -6.651 1.00 0.00 H new ATOM 0 HE21 GLN A 19 12.359 5.560 -8.882 1.00 0.00 H new ATOM 0 HE22 GLN A 19 12.980 7.034 -9.633 1.00 0.00 H new ATOM 250 N VAL A 20 13.212 5.942 -1.823 1.00 0.00 N ATOM 251 CA VAL A 20 13.401 6.522 -0.499 1.00 0.00 C ATOM 252 C VAL A 20 14.831 6.319 -0.010 1.00 0.00 C ATOM 253 O VAL A 20 15.579 5.512 -0.563 1.00 0.00 O ATOM 254 CB VAL A 20 12.428 5.910 0.526 1.00 0.00 C ATOM 255 CG1 VAL A 20 12.906 4.533 0.960 1.00 0.00 C ATOM 256 CG2 VAL A 20 12.271 6.832 1.726 1.00 0.00 C ATOM 0 H VAL A 20 13.731 5.079 -1.983 1.00 0.00 H new ATOM 0 HA VAL A 20 13.198 7.589 -0.589 1.00 0.00 H new ATOM 0 HB VAL A 20 11.452 5.797 0.053 1.00 0.00 H new ATOM 0 HG11 VAL A 20 12.206 4.116 1.684 1.00 0.00 H new ATOM 0 HG12 VAL A 20 12.963 3.877 0.091 1.00 0.00 H new ATOM 0 HG13 VAL A 20 13.892 4.617 1.416 1.00 0.00 H new ATOM 0 HG21 VAL A 20 11.580 6.385 2.441 1.00 0.00 H new ATOM 0 HG22 VAL A 20 13.241 6.978 2.202 1.00 0.00 H new ATOM 0 HG23 VAL A 20 11.879 7.794 1.397 1.00 0.00 H new ATOM 266 N ASP A 21 15.205 7.057 1.029 1.00 0.00 N ATOM 267 CA ASP A 21 16.545 6.957 1.595 1.00 0.00 C ATOM 268 C ASP A 21 16.628 5.811 2.598 1.00 0.00 C ATOM 269 O ASP A 21 15.620 5.399 3.172 1.00 0.00 O ATOM 270 CB ASP A 21 16.935 8.272 2.272 1.00 0.00 C ATOM 271 CG ASP A 21 17.312 9.348 1.272 1.00 0.00 C ATOM 272 OD1 ASP A 21 16.539 9.568 0.318 1.00 0.00 O ATOM 273 OD2 ASP A 21 18.382 9.970 1.445 1.00 0.00 O ATOM 0 H ASP A 21 14.599 7.731 1.497 1.00 0.00 H new ATOM 0 HA ASP A 21 17.242 6.755 0.781 1.00 0.00 H new ATOM 0 HB2 ASP A 21 16.104 8.623 2.883 1.00 0.00 H new ATOM 0 HB3 ASP A 21 17.774 8.096 2.946 1.00 0.00 H new ATOM 278 N LYS A 22 17.837 5.298 2.803 1.00 0.00 N ATOM 279 CA LYS A 22 18.053 4.198 3.737 1.00 0.00 C ATOM 280 C LYS A 22 17.507 4.542 5.119 1.00 0.00 C ATOM 281 O LYS A 22 17.403 5.713 5.482 1.00 0.00 O ATOM 282 CB LYS A 22 19.545 3.871 3.833 1.00 0.00 C ATOM 283 CG LYS A 22 19.837 2.584 4.587 1.00 0.00 C ATOM 284 CD LYS A 22 20.026 2.839 6.073 1.00 0.00 C ATOM 285 CE LYS A 22 21.471 3.182 6.400 1.00 0.00 C ATOM 286 NZ LYS A 22 21.703 3.261 7.869 1.00 0.00 N ATOM 0 H LYS A 22 18.682 5.626 2.335 1.00 0.00 H new ATOM 0 HA LYS A 22 17.518 3.325 3.362 1.00 0.00 H new ATOM 0 HB2 LYS A 22 19.957 3.795 2.827 1.00 0.00 H new ATOM 0 HB3 LYS A 22 20.059 4.696 4.326 1.00 0.00 H new ATOM 0 HG2 LYS A 22 19.018 1.881 4.439 1.00 0.00 H new ATOM 0 HG3 LYS A 22 20.734 2.118 4.180 1.00 0.00 H new ATOM 0 HD2 LYS A 22 19.377 3.656 6.389 1.00 0.00 H new ATOM 0 HD3 LYS A 22 19.724 1.956 6.636 1.00 0.00 H new ATOM 0 HE2 LYS A 22 22.130 2.429 5.968 1.00 0.00 H new ATOM 0 HE3 LYS A 22 21.731 4.135 5.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 22.699 3.497 8.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 21.093 3.997 8.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 21.479 2.344 8.306 1.00 0.00 H new ATOM 300 N GLY A 23 17.160 3.513 5.886 1.00 0.00 N ATOM 301 CA GLY A 23 16.630 3.728 7.220 1.00 0.00 C ATOM 302 C GLY A 23 15.652 4.885 7.276 1.00 0.00 C ATOM 303 O GLY A 23 15.513 5.540 8.308 1.00 0.00 O ATOM 0 H GLY A 23 17.236 2.535 5.608 1.00 0.00 H new ATOM 0 HA2 GLY A 23 16.133 2.820 7.561 1.00 0.00 H new ATOM 0 HA3 GLY A 23 17.453 3.919 7.908 1.00 0.00 H new ATOM 307 N GLY A 24 14.973 5.139 6.161 1.00 0.00 N ATOM 308 CA GLY A 24 14.014 6.227 6.108 1.00 0.00 C ATOM 309 C GLY A 24 12.582 5.742 6.214 1.00 0.00 C ATOM 310 O GLY A 24 12.299 4.767 6.910 1.00 0.00 O ATOM 0 H GLY A 24 15.070 4.611 5.294 1.00 0.00 H new ATOM 0 HA2 GLY A 24 14.218 6.927 6.918 1.00 0.00 H new ATOM 0 HA3 GLY A 24 14.141 6.774 5.174 1.00 0.00 H new ATOM 314 N ARG A 25 11.674 6.426 5.524 1.00 0.00 N ATOM 315 CA ARG A 25 10.263 6.061 5.546 1.00 0.00 C ATOM 316 C ARG A 25 9.608 6.340 4.197 1.00 0.00 C ATOM 317 O ARG A 25 9.723 7.439 3.655 1.00 0.00 O ATOM 318 CB ARG A 25 9.533 6.830 6.649 1.00 0.00 C ATOM 319 CG ARG A 25 8.098 6.375 6.861 1.00 0.00 C ATOM 320 CD ARG A 25 7.263 7.458 7.525 1.00 0.00 C ATOM 321 NE ARG A 25 7.655 7.676 8.915 1.00 0.00 N ATOM 322 CZ ARG A 25 6.859 8.226 9.826 1.00 0.00 C ATOM 323 NH1 ARG A 25 5.634 8.611 9.494 1.00 0.00 N ATOM 324 NH2 ARG A 25 7.287 8.390 11.071 1.00 0.00 N ATOM 0 H ARG A 25 11.891 7.236 4.943 1.00 0.00 H new ATOM 0 HA ARG A 25 10.193 4.993 5.750 1.00 0.00 H new ATOM 0 HB2 ARG A 25 10.083 6.718 7.583 1.00 0.00 H new ATOM 0 HB3 ARG A 25 9.536 7.892 6.403 1.00 0.00 H new ATOM 0 HG2 ARG A 25 7.654 6.109 5.902 1.00 0.00 H new ATOM 0 HG3 ARG A 25 8.087 5.476 7.478 1.00 0.00 H new ATOM 0 HD2 ARG A 25 7.368 8.389 6.968 1.00 0.00 H new ATOM 0 HD3 ARG A 25 6.210 7.180 7.485 1.00 0.00 H new ATOM 0 HE ARG A 25 8.591 7.390 9.202 1.00 0.00 H new ATOM 0 HH11 ARG A 25 5.301 8.485 8.538 1.00 0.00 H new ATOM 0 HH12 ARG A 25 5.025 9.033 10.195 1.00 0.00 H new ATOM 0 HH21 ARG A 25 8.228 8.094 11.330 1.00 0.00 H new ATOM 0 HH22 ARG A 25 6.675 8.812 11.769 1.00 0.00 H new ATOM 338 N VAL A 26 8.921 5.337 3.659 1.00 0.00 N ATOM 339 CA VAL A 26 8.247 5.474 2.374 1.00 0.00 C ATOM 340 C VAL A 26 6.785 5.866 2.559 1.00 0.00 C ATOM 341 O VAL A 26 6.257 5.824 3.670 1.00 0.00 O ATOM 342 CB VAL A 26 8.318 4.168 1.561 1.00 0.00 C ATOM 343 CG1 VAL A 26 9.750 3.880 1.137 1.00 0.00 C ATOM 344 CG2 VAL A 26 7.747 3.009 2.364 1.00 0.00 C ATOM 0 H VAL A 26 8.817 4.420 4.094 1.00 0.00 H new ATOM 0 HA VAL A 26 8.765 6.262 1.827 1.00 0.00 H new ATOM 0 HB VAL A 26 7.715 4.288 0.661 1.00 0.00 H new ATOM 0 HG11 VAL A 26 9.780 2.953 0.564 1.00 0.00 H new ATOM 0 HG12 VAL A 26 10.119 4.700 0.521 1.00 0.00 H new ATOM 0 HG13 VAL A 26 10.378 3.780 2.022 1.00 0.00 H new ATOM 0 HG21 VAL A 26 7.805 2.094 1.774 1.00 0.00 H new ATOM 0 HG22 VAL A 26 8.320 2.886 3.283 1.00 0.00 H new ATOM 0 HG23 VAL A 26 6.706 3.216 2.611 1.00 0.00 H new ATOM 354 N ARG A 27 6.137 6.248 1.463 1.00 0.00 N ATOM 355 CA ARG A 27 4.736 6.648 1.504 1.00 0.00 C ATOM 356 C ARG A 27 3.947 5.983 0.380 1.00 0.00 C ATOM 357 O ARG A 27 4.266 6.147 -0.798 1.00 0.00 O ATOM 358 CB ARG A 27 4.615 8.169 1.395 1.00 0.00 C ATOM 359 CG ARG A 27 3.194 8.681 1.565 1.00 0.00 C ATOM 360 CD ARG A 27 3.080 10.147 1.180 1.00 0.00 C ATOM 361 NE ARG A 27 3.751 11.019 2.141 1.00 0.00 N ATOM 362 CZ ARG A 27 3.593 12.338 2.172 1.00 0.00 C ATOM 363 NH1 ARG A 27 2.791 12.933 1.300 1.00 0.00 N ATOM 364 NH2 ARG A 27 4.238 13.063 3.076 1.00 0.00 N ATOM 0 H ARG A 27 6.560 6.289 0.536 1.00 0.00 H new ATOM 0 HA ARG A 27 4.320 6.324 2.458 1.00 0.00 H new ATOM 0 HB2 ARG A 27 5.251 8.631 2.150 1.00 0.00 H new ATOM 0 HB3 ARG A 27 4.993 8.486 0.423 1.00 0.00 H new ATOM 0 HG2 ARG A 27 2.517 8.089 0.950 1.00 0.00 H new ATOM 0 HG3 ARG A 27 2.881 8.550 2.601 1.00 0.00 H new ATOM 0 HD2 ARG A 27 3.513 10.297 0.191 1.00 0.00 H new ATOM 0 HD3 ARG A 27 2.028 10.423 1.113 1.00 0.00 H new ATOM 0 HE ARG A 27 4.375 10.592 2.826 1.00 0.00 H new ATOM 0 HH11 ARG A 27 2.294 12.378 0.603 1.00 0.00 H new ATOM 0 HH12 ARG A 27 2.671 13.946 1.326 1.00 0.00 H new ATOM 0 HH21 ARG A 27 4.856 12.608 3.748 1.00 0.00 H new ATOM 0 HH22 ARG A 27 4.116 14.075 3.099 1.00 0.00 H new ATOM 378 N PHE A 28 2.917 5.230 0.753 1.00 0.00 N ATOM 379 CA PHE A 28 2.083 4.538 -0.224 1.00 0.00 C ATOM 380 C PHE A 28 0.621 4.952 -0.080 1.00 0.00 C ATOM 381 O PHE A 28 -0.051 4.575 0.879 1.00 0.00 O ATOM 382 CB PHE A 28 2.216 3.023 -0.056 1.00 0.00 C ATOM 383 CG PHE A 28 3.582 2.500 -0.394 1.00 0.00 C ATOM 384 CD1 PHE A 28 4.063 2.568 -1.692 1.00 0.00 C ATOM 385 CD2 PHE A 28 4.386 1.939 0.585 1.00 0.00 C ATOM 386 CE1 PHE A 28 5.320 2.088 -2.007 1.00 0.00 C ATOM 387 CE2 PHE A 28 5.644 1.457 0.277 1.00 0.00 C ATOM 388 CZ PHE A 28 6.111 1.531 -1.021 1.00 0.00 C ATOM 0 H PHE A 28 2.640 5.083 1.724 1.00 0.00 H new ATOM 0 HA PHE A 28 2.425 4.817 -1.221 1.00 0.00 H new ATOM 0 HB2 PHE A 28 1.979 2.758 0.974 1.00 0.00 H new ATOM 0 HB3 PHE A 28 1.480 2.529 -0.690 1.00 0.00 H new ATOM 0 HD1 PHE A 28 3.448 3.001 -2.467 1.00 0.00 H new ATOM 0 HD2 PHE A 28 4.025 1.878 1.601 1.00 0.00 H new ATOM 0 HE1 PHE A 28 5.683 2.148 -3.022 1.00 0.00 H new ATOM 0 HE2 PHE A 28 6.261 1.023 1.050 1.00 0.00 H new ATOM 0 HZ PHE A 28 7.093 1.154 -1.265 1.00 0.00 H new ATOM 398 N VAL A 29 0.136 5.730 -1.042 1.00 0.00 N ATOM 399 CA VAL A 29 -1.246 6.195 -1.025 1.00 0.00 C ATOM 400 C VAL A 29 -2.076 5.490 -2.092 1.00 0.00 C ATOM 401 O VAL A 29 -1.607 5.257 -3.205 1.00 0.00 O ATOM 402 CB VAL A 29 -1.329 7.717 -1.247 1.00 0.00 C ATOM 403 CG1 VAL A 29 -2.769 8.195 -1.138 1.00 0.00 C ATOM 404 CG2 VAL A 29 -0.439 8.449 -0.255 1.00 0.00 C ATOM 0 H VAL A 29 0.679 6.052 -1.843 1.00 0.00 H new ATOM 0 HA VAL A 29 -1.648 5.957 -0.040 1.00 0.00 H new ATOM 0 HB VAL A 29 -0.973 7.940 -2.253 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -2.808 9.273 -1.298 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -3.377 7.694 -1.892 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -3.156 7.961 -0.146 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -0.510 9.523 -0.426 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -0.762 8.221 0.761 1.00 0.00 H new ATOM 0 HG23 VAL A 29 0.594 8.128 -0.387 1.00 0.00 H new ATOM 414 N VAL A 30 -3.314 5.154 -1.744 1.00 0.00 N ATOM 415 CA VAL A 30 -4.212 4.477 -2.672 1.00 0.00 C ATOM 416 C VAL A 30 -5.663 4.871 -2.419 1.00 0.00 C ATOM 417 O VAL A 30 -6.106 4.942 -1.274 1.00 0.00 O ATOM 418 CB VAL A 30 -4.082 2.946 -2.563 1.00 0.00 C ATOM 419 CG1 VAL A 30 -2.707 2.493 -3.033 1.00 0.00 C ATOM 420 CG2 VAL A 30 -4.344 2.489 -1.137 1.00 0.00 C ATOM 0 H VAL A 30 -3.718 5.340 -0.826 1.00 0.00 H new ATOM 0 HA VAL A 30 -3.923 4.789 -3.676 1.00 0.00 H new ATOM 0 HB VAL A 30 -4.831 2.488 -3.210 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -2.633 1.409 -2.949 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -2.563 2.787 -4.073 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -1.940 2.958 -2.414 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -4.248 1.405 -1.079 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.621 2.954 -0.467 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -5.352 2.780 -0.841 1.00 0.00 H new ATOM 430 N GLU A 31 -6.398 5.126 -3.498 1.00 0.00 N ATOM 431 CA GLU A 31 -7.799 5.514 -3.392 1.00 0.00 C ATOM 432 C GLU A 31 -8.715 4.341 -3.731 1.00 0.00 C ATOM 433 O GLU A 31 -8.287 3.360 -4.340 1.00 0.00 O ATOM 434 CB GLU A 31 -8.097 6.692 -4.321 1.00 0.00 C ATOM 435 CG GLU A 31 -9.233 7.577 -3.837 1.00 0.00 C ATOM 436 CD GLU A 31 -9.201 8.960 -4.459 1.00 0.00 C ATOM 437 OE1 GLU A 31 -9.195 9.050 -5.704 1.00 0.00 O ATOM 438 OE2 GLU A 31 -9.183 9.952 -3.700 1.00 0.00 O ATOM 0 H GLU A 31 -6.046 5.071 -4.454 1.00 0.00 H new ATOM 0 HA GLU A 31 -7.989 5.816 -2.362 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -7.196 7.297 -4.427 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -8.343 6.309 -5.312 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -10.185 7.100 -4.070 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -9.180 7.669 -2.752 1.00 0.00 H new ATOM 445 N LEU A 32 -9.978 4.450 -3.332 1.00 0.00 N ATOM 446 CA LEU A 32 -10.955 3.399 -3.593 1.00 0.00 C ATOM 447 C LEU A 32 -12.242 3.982 -4.167 1.00 0.00 C ATOM 448 O LEU A 32 -12.823 4.907 -3.600 1.00 0.00 O ATOM 449 CB LEU A 32 -11.261 2.629 -2.306 1.00 0.00 C ATOM 450 CG LEU A 32 -10.049 2.153 -1.505 1.00 0.00 C ATOM 451 CD1 LEU A 32 -10.396 2.040 -0.029 1.00 0.00 C ATOM 452 CD2 LEU A 32 -9.545 0.821 -2.040 1.00 0.00 C ATOM 0 H LEU A 32 -10.349 5.255 -2.827 1.00 0.00 H new ATOM 0 HA LEU A 32 -10.529 2.715 -4.327 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -11.870 3.264 -1.663 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -11.867 1.760 -2.562 1.00 0.00 H new ATOM 0 HG LEU A 32 -9.253 2.890 -1.615 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.521 1.700 0.525 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -10.708 3.014 0.347 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -11.208 1.325 0.100 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -8.682 0.498 -1.458 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -10.336 0.075 -1.962 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -9.256 0.935 -3.085 1.00 0.00 H new ATOM 464 N ALA A 33 -12.682 3.434 -5.295 1.00 0.00 N ATOM 465 CA ALA A 33 -13.902 3.897 -5.945 1.00 0.00 C ATOM 466 C ALA A 33 -15.070 3.925 -4.964 1.00 0.00 C ATOM 467 O ALA A 33 -16.066 4.612 -5.188 1.00 0.00 O ATOM 468 CB ALA A 33 -14.233 3.014 -7.138 1.00 0.00 C ATOM 0 H ALA A 33 -12.212 2.669 -5.778 1.00 0.00 H new ATOM 0 HA ALA A 33 -13.733 4.915 -6.297 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -15.146 3.372 -7.613 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -13.413 3.049 -7.855 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -14.377 1.987 -6.802 1.00 0.00 H new ATOM 474 N ASP A 34 -14.940 3.172 -3.877 1.00 0.00 N ATOM 475 CA ASP A 34 -15.985 3.110 -2.861 1.00 0.00 C ATOM 476 C ASP A 34 -15.417 2.639 -1.526 1.00 0.00 C ATOM 477 O ASP A 34 -14.518 1.800 -1.467 1.00 0.00 O ATOM 478 CB ASP A 34 -17.108 2.174 -3.311 1.00 0.00 C ATOM 479 CG ASP A 34 -17.814 2.673 -4.556 1.00 0.00 C ATOM 480 OD1 ASP A 34 -18.251 3.843 -4.562 1.00 0.00 O ATOM 481 OD2 ASP A 34 -17.928 1.894 -5.525 1.00 0.00 O ATOM 0 H ASP A 34 -14.122 2.596 -3.677 1.00 0.00 H new ATOM 0 HA ASP A 34 -16.390 4.113 -2.729 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -16.696 1.183 -3.503 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -17.833 2.067 -2.504 1.00 0.00 H new ATOM 486 N PRO A 35 -15.953 3.191 -0.427 1.00 0.00 N ATOM 487 CA PRO A 35 -15.515 2.843 0.928 1.00 0.00 C ATOM 488 C PRO A 35 -15.920 1.427 1.323 1.00 0.00 C ATOM 489 O PRO A 35 -15.243 0.775 2.117 1.00 0.00 O ATOM 490 CB PRO A 35 -16.232 3.870 1.808 1.00 0.00 C ATOM 491 CG PRO A 35 -17.435 4.266 1.023 1.00 0.00 C ATOM 492 CD PRO A 35 -17.028 4.197 -0.422 1.00 0.00 C ATOM 0 HA PRO A 35 -14.429 2.864 1.023 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -16.511 3.441 2.770 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -15.594 4.729 2.015 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -18.271 3.596 1.225 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -17.761 5.272 1.289 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -17.860 3.899 -1.060 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -16.677 5.162 -0.787 1.00 0.00 H new ATOM 500 N LYS A 36 -17.029 0.956 0.762 1.00 0.00 N ATOM 501 CA LYS A 36 -17.525 -0.384 1.053 1.00 0.00 C ATOM 502 C LYS A 36 -16.479 -1.438 0.707 1.00 0.00 C ATOM 503 O LYS A 36 -16.486 -2.539 1.260 1.00 0.00 O ATOM 504 CB LYS A 36 -18.814 -0.653 0.273 1.00 0.00 C ATOM 505 CG LYS A 36 -20.058 -0.099 0.944 1.00 0.00 C ATOM 506 CD LYS A 36 -21.305 -0.860 0.524 1.00 0.00 C ATOM 507 CE LYS A 36 -21.534 -2.081 1.401 1.00 0.00 C ATOM 508 NZ LYS A 36 -20.533 -3.151 1.134 1.00 0.00 N ATOM 0 H LYS A 36 -17.602 1.483 0.103 1.00 0.00 H new ATOM 0 HA LYS A 36 -17.735 -0.443 2.121 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -18.724 -0.218 -0.722 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -18.931 -1.729 0.141 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -19.944 -0.155 2.027 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -20.171 0.955 0.690 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -22.171 -0.201 0.582 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -21.210 -1.171 -0.516 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -21.483 -1.789 2.450 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -22.537 -2.470 1.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -20.920 -4.070 1.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -20.316 -3.178 0.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -19.663 -2.953 1.668 1.00 0.00 H new ATOM 522 N LEU A 37 -15.579 -1.095 -0.208 1.00 0.00 N ATOM 523 CA LEU A 37 -14.525 -2.012 -0.627 1.00 0.00 C ATOM 524 C LEU A 37 -13.446 -2.127 0.446 1.00 0.00 C ATOM 525 O LEU A 37 -13.078 -1.137 1.076 1.00 0.00 O ATOM 526 CB LEU A 37 -13.904 -1.540 -1.943 1.00 0.00 C ATOM 527 CG LEU A 37 -14.791 -1.656 -3.183 1.00 0.00 C ATOM 528 CD1 LEU A 37 -14.408 -0.604 -4.213 1.00 0.00 C ATOM 529 CD2 LEU A 37 -14.692 -3.052 -3.781 1.00 0.00 C ATOM 0 H LEU A 37 -15.558 -0.188 -0.674 1.00 0.00 H new ATOM 0 HA LEU A 37 -14.971 -2.996 -0.776 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -13.608 -0.497 -1.829 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -12.993 -2.112 -2.118 1.00 0.00 H new ATOM 0 HG LEU A 37 -15.825 -1.483 -2.884 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -15.050 -0.702 -5.089 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -14.531 0.389 -3.782 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -13.368 -0.745 -4.508 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -15.330 -3.116 -4.663 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -13.659 -3.254 -4.065 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -15.016 -3.787 -3.044 1.00 0.00 H new ATOM 541 N GLU A 38 -12.943 -3.341 0.644 1.00 0.00 N ATOM 542 CA GLU A 38 -11.905 -3.584 1.639 1.00 0.00 C ATOM 543 C GLU A 38 -10.517 -3.409 1.031 1.00 0.00 C ATOM 544 O GLU A 38 -10.360 -3.383 -0.190 1.00 0.00 O ATOM 545 CB GLU A 38 -12.045 -4.992 2.222 1.00 0.00 C ATOM 546 CG GLU A 38 -11.568 -6.088 1.285 1.00 0.00 C ATOM 547 CD GLU A 38 -12.285 -7.405 1.514 1.00 0.00 C ATOM 548 OE1 GLU A 38 -12.346 -7.854 2.677 1.00 0.00 O ATOM 549 OE2 GLU A 38 -12.787 -7.985 0.528 1.00 0.00 O ATOM 0 H GLU A 38 -13.237 -4.171 0.129 1.00 0.00 H new ATOM 0 HA GLU A 38 -12.027 -2.854 2.439 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -11.479 -5.049 3.152 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -13.091 -5.170 2.473 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -11.720 -5.770 0.253 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -10.496 -6.234 1.419 1.00 0.00 H new ATOM 556 N VAL A 39 -9.510 -3.289 1.891 1.00 0.00 N ATOM 557 CA VAL A 39 -8.135 -3.118 1.440 1.00 0.00 C ATOM 558 C VAL A 39 -7.179 -3.990 2.246 1.00 0.00 C ATOM 559 O VAL A 39 -7.359 -4.181 3.449 1.00 0.00 O ATOM 560 CB VAL A 39 -7.687 -1.648 1.550 1.00 0.00 C ATOM 561 CG1 VAL A 39 -8.384 -0.797 0.500 1.00 0.00 C ATOM 562 CG2 VAL A 39 -7.958 -1.112 2.948 1.00 0.00 C ATOM 0 H VAL A 39 -9.622 -3.307 2.905 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.105 -3.423 0.394 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.613 -1.599 1.368 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -8.055 0.238 0.593 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -8.135 -1.169 -0.494 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -9.463 -0.849 0.647 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -7.635 -0.073 3.008 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -9.025 -1.174 3.161 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.408 -1.705 3.678 1.00 0.00 H new ATOM 572 N LYS A 40 -6.161 -4.518 1.575 1.00 0.00 N ATOM 573 CA LYS A 40 -5.174 -5.370 2.228 1.00 0.00 C ATOM 574 C LYS A 40 -3.787 -5.150 1.633 1.00 0.00 C ATOM 575 O LYS A 40 -3.596 -5.266 0.422 1.00 0.00 O ATOM 576 CB LYS A 40 -5.571 -6.842 2.093 1.00 0.00 C ATOM 577 CG LYS A 40 -6.631 -7.280 3.089 1.00 0.00 C ATOM 578 CD LYS A 40 -6.056 -7.425 4.488 1.00 0.00 C ATOM 579 CE LYS A 40 -7.155 -7.564 5.530 1.00 0.00 C ATOM 580 NZ LYS A 40 -7.963 -8.798 5.323 1.00 0.00 N ATOM 0 H LYS A 40 -5.998 -4.371 0.579 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.143 -5.104 3.285 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -5.939 -7.019 1.082 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -4.684 -7.462 2.223 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -7.442 -6.552 3.102 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -7.060 -8.230 2.771 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -5.404 -8.298 4.526 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -5.440 -6.557 4.721 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -6.711 -7.583 6.525 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -7.807 -6.692 5.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -8.679 -8.874 6.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -8.434 -8.753 4.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -7.340 -9.630 5.354 1.00 0.00 H new ATOM 594 N TRP A 41 -2.823 -4.835 2.491 1.00 0.00 N ATOM 595 CA TRP A 41 -1.453 -4.601 2.049 1.00 0.00 C ATOM 596 C TRP A 41 -0.607 -5.859 2.210 1.00 0.00 C ATOM 597 O TRP A 41 -0.665 -6.530 3.240 1.00 0.00 O ATOM 598 CB TRP A 41 -0.831 -3.448 2.838 1.00 0.00 C ATOM 599 CG TRP A 41 -1.553 -2.147 2.658 1.00 0.00 C ATOM 600 CD1 TRP A 41 -2.760 -1.798 3.193 1.00 0.00 C ATOM 601 CD2 TRP A 41 -1.114 -1.023 1.888 1.00 0.00 C ATOM 602 NE1 TRP A 41 -3.097 -0.525 2.802 1.00 0.00 N ATOM 603 CE2 TRP A 41 -2.104 -0.027 2.001 1.00 0.00 C ATOM 604 CE3 TRP A 41 0.020 -0.760 1.115 1.00 0.00 C ATOM 605 CZ2 TRP A 41 -1.992 1.208 1.370 1.00 0.00 C ATOM 606 CZ3 TRP A 41 0.129 0.467 0.488 1.00 0.00 C ATOM 607 CH2 TRP A 41 -0.871 1.439 0.619 1.00 0.00 C ATOM 0 H TRP A 41 -2.965 -4.736 3.496 1.00 0.00 H new ATOM 0 HA TRP A 41 -1.478 -4.336 0.992 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -0.821 -3.706 3.897 1.00 0.00 H new ATOM 0 HB3 TRP A 41 0.207 -3.325 2.530 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -3.361 -2.430 3.830 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -3.949 -0.030 3.066 1.00 0.00 H new ATOM 0 HE3 TRP A 41 0.797 -1.502 1.009 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -2.763 1.958 1.469 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 1.000 0.680 -0.113 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -0.755 2.389 0.118 1.00 0.00 H new ATOM 618 N TYR A 42 0.179 -6.173 1.186 1.00 0.00 N ATOM 619 CA TYR A 42 1.036 -7.352 1.214 1.00 0.00 C ATOM 620 C TYR A 42 2.433 -7.023 0.695 1.00 0.00 C ATOM 621 O TYR A 42 2.603 -6.147 -0.153 1.00 0.00 O ATOM 622 CB TYR A 42 0.421 -8.475 0.378 1.00 0.00 C ATOM 623 CG TYR A 42 -0.933 -8.929 0.875 1.00 0.00 C ATOM 624 CD1 TYR A 42 -1.043 -9.929 1.834 1.00 0.00 C ATOM 625 CD2 TYR A 42 -2.102 -8.358 0.386 1.00 0.00 C ATOM 626 CE1 TYR A 42 -2.278 -10.347 2.291 1.00 0.00 C ATOM 627 CE2 TYR A 42 -3.340 -8.769 0.839 1.00 0.00 C ATOM 628 CZ TYR A 42 -3.423 -9.764 1.791 1.00 0.00 C ATOM 629 OH TYR A 42 -4.656 -10.177 2.243 1.00 0.00 O ATOM 0 H TYR A 42 0.240 -5.627 0.326 1.00 0.00 H new ATOM 0 HA TYR A 42 1.121 -7.683 2.249 1.00 0.00 H new ATOM 0 HB2 TYR A 42 0.325 -8.137 -0.654 1.00 0.00 H new ATOM 0 HB3 TYR A 42 1.101 -9.327 0.373 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -0.148 -10.387 2.229 1.00 0.00 H new ATOM 0 HD2 TYR A 42 -2.041 -7.580 -0.361 1.00 0.00 H new ATOM 0 HE1 TYR A 42 -2.346 -11.126 3.036 1.00 0.00 H new ATOM 0 HE2 TYR A 42 -4.239 -8.314 0.450 1.00 0.00 H new ATOM 0 HH TYR A 42 -5.359 -9.665 1.791 1.00 0.00 H new ATOM 639 N LYS A 43 3.431 -7.733 1.211 1.00 0.00 N ATOM 640 CA LYS A 43 4.814 -7.520 0.800 1.00 0.00 C ATOM 641 C LYS A 43 5.479 -8.840 0.424 1.00 0.00 C ATOM 642 O LYS A 43 5.700 -9.699 1.276 1.00 0.00 O ATOM 643 CB LYS A 43 5.602 -6.841 1.923 1.00 0.00 C ATOM 644 CG LYS A 43 7.107 -6.901 1.731 1.00 0.00 C ATOM 645 CD LYS A 43 7.847 -6.448 2.979 1.00 0.00 C ATOM 646 CE LYS A 43 9.197 -7.136 3.107 1.00 0.00 C ATOM 647 NZ LYS A 43 9.063 -8.530 3.613 1.00 0.00 N ATOM 0 H LYS A 43 3.308 -8.461 1.915 1.00 0.00 H new ATOM 0 HA LYS A 43 4.811 -6.872 -0.077 1.00 0.00 H new ATOM 0 HB2 LYS A 43 5.294 -5.798 1.992 1.00 0.00 H new ATOM 0 HB3 LYS A 43 5.346 -7.312 2.872 1.00 0.00 H new ATOM 0 HG2 LYS A 43 7.403 -7.920 1.481 1.00 0.00 H new ATOM 0 HG3 LYS A 43 7.393 -6.271 0.889 1.00 0.00 H new ATOM 0 HD2 LYS A 43 7.990 -5.368 2.947 1.00 0.00 H new ATOM 0 HD3 LYS A 43 7.243 -6.664 3.860 1.00 0.00 H new ATOM 0 HE2 LYS A 43 9.692 -7.148 2.136 1.00 0.00 H new ATOM 0 HE3 LYS A 43 9.834 -6.564 3.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 10.005 -8.965 3.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 8.614 -8.517 4.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 8.477 -9.083 2.956 1.00 0.00 H new ATOM 661 N ASN A 44 5.796 -8.993 -0.858 1.00 0.00 N ATOM 662 CA ASN A 44 6.437 -10.208 -1.346 1.00 0.00 C ATOM 663 C ASN A 44 5.608 -11.440 -0.994 1.00 0.00 C ATOM 664 O ASN A 44 6.146 -12.530 -0.807 1.00 0.00 O ATOM 665 CB ASN A 44 7.843 -10.341 -0.757 1.00 0.00 C ATOM 666 CG ASN A 44 8.894 -9.659 -1.611 1.00 0.00 C ATOM 667 OD1 ASN A 44 8.578 -8.808 -2.442 1.00 0.00 O ATOM 668 ND2 ASN A 44 10.153 -10.030 -1.408 1.00 0.00 N ATOM 0 H ASN A 44 5.619 -8.291 -1.577 1.00 0.00 H new ATOM 0 HA ASN A 44 6.510 -10.139 -2.431 1.00 0.00 H new ATOM 0 HB2 ASN A 44 7.857 -9.910 0.244 1.00 0.00 H new ATOM 0 HB3 ASN A 44 8.092 -11.397 -0.653 1.00 0.00 H new ATOM 0 HD21 ASN A 44 10.904 -9.605 -1.952 1.00 0.00 H new ATOM 0 HD22 ASN A 44 10.369 -10.740 -0.708 1.00 0.00 H new ATOM 675 N GLY A 45 4.294 -11.257 -0.907 1.00 0.00 N ATOM 676 CA GLY A 45 3.411 -12.361 -0.579 1.00 0.00 C ATOM 677 C GLY A 45 3.261 -12.558 0.917 1.00 0.00 C ATOM 678 O GLY A 45 3.017 -13.671 1.380 1.00 0.00 O ATOM 0 H GLY A 45 3.825 -10.364 -1.058 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.430 -12.181 -1.019 1.00 0.00 H new ATOM 0 HA3 GLY A 45 3.798 -13.277 -1.026 1.00 0.00 H new ATOM 682 N GLN A 46 3.408 -11.474 1.672 1.00 0.00 N ATOM 683 CA GLN A 46 3.288 -11.534 3.124 1.00 0.00 C ATOM 684 C GLN A 46 2.266 -10.521 3.629 1.00 0.00 C ATOM 685 O GLN A 46 2.391 -9.323 3.377 1.00 0.00 O ATOM 686 CB GLN A 46 4.646 -11.276 3.779 1.00 0.00 C ATOM 687 CG GLN A 46 4.831 -12.002 5.102 1.00 0.00 C ATOM 688 CD GLN A 46 5.763 -11.268 6.046 1.00 0.00 C ATOM 689 OE1 GLN A 46 6.903 -11.683 6.259 1.00 0.00 O ATOM 690 NE2 GLN A 46 5.283 -10.169 6.617 1.00 0.00 N ATOM 0 H GLN A 46 3.610 -10.545 1.303 1.00 0.00 H new ATOM 0 HA GLN A 46 2.945 -12.533 3.394 1.00 0.00 H new ATOM 0 HB2 GLN A 46 5.435 -11.582 3.092 1.00 0.00 H new ATOM 0 HB3 GLN A 46 4.764 -10.205 3.942 1.00 0.00 H new ATOM 0 HG2 GLN A 46 3.860 -12.128 5.581 1.00 0.00 H new ATOM 0 HG3 GLN A 46 5.225 -13.000 4.912 1.00 0.00 H new ATOM 0 HE21 GLN A 46 4.332 -9.861 6.412 1.00 0.00 H new ATOM 0 HE22 GLN A 46 5.865 -9.633 7.260 1.00 0.00 H new ATOM 699 N GLU A 47 1.257 -11.011 4.341 1.00 0.00 N ATOM 700 CA GLU A 47 0.213 -10.147 4.880 1.00 0.00 C ATOM 701 C GLU A 47 0.790 -9.160 5.891 1.00 0.00 C ATOM 702 O GLU A 47 1.287 -9.556 6.946 1.00 0.00 O ATOM 703 CB GLU A 47 -0.885 -10.985 5.539 1.00 0.00 C ATOM 704 CG GLU A 47 -2.021 -10.157 6.115 1.00 0.00 C ATOM 705 CD GLU A 47 -3.064 -11.005 6.816 1.00 0.00 C ATOM 706 OE1 GLU A 47 -2.678 -11.845 7.656 1.00 0.00 O ATOM 707 OE2 GLU A 47 -4.265 -10.830 6.525 1.00 0.00 O ATOM 0 H GLU A 47 1.140 -12.001 4.558 1.00 0.00 H new ATOM 0 HA GLU A 47 -0.218 -9.583 4.053 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -1.290 -11.680 4.804 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -0.444 -11.585 6.335 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -1.615 -9.431 6.819 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -2.497 -9.592 5.313 1.00 0.00 H new ATOM 714 N ILE A 48 0.722 -7.875 5.560 1.00 0.00 N ATOM 715 CA ILE A 48 1.237 -6.832 6.438 1.00 0.00 C ATOM 716 C ILE A 48 0.196 -6.423 7.475 1.00 0.00 C ATOM 717 O ILE A 48 -0.983 -6.269 7.158 1.00 0.00 O ATOM 718 CB ILE A 48 1.669 -5.587 5.641 1.00 0.00 C ATOM 719 CG1 ILE A 48 2.702 -5.968 4.579 1.00 0.00 C ATOM 720 CG2 ILE A 48 2.229 -4.527 6.577 1.00 0.00 C ATOM 721 CD1 ILE A 48 2.816 -4.958 3.458 1.00 0.00 C ATOM 0 H ILE A 48 0.315 -7.531 4.690 1.00 0.00 H new ATOM 0 HA ILE A 48 2.108 -7.248 6.945 1.00 0.00 H new ATOM 0 HB ILE A 48 0.795 -5.174 5.138 1.00 0.00 H new ATOM 0 HG12 ILE A 48 3.676 -6.082 5.055 1.00 0.00 H new ATOM 0 HG13 ILE A 48 2.438 -6.938 4.158 1.00 0.00 H new ATOM 0 HG21 ILE A 48 2.530 -3.653 5.999 1.00 0.00 H new ATOM 0 HG22 ILE A 48 1.465 -4.239 7.299 1.00 0.00 H new ATOM 0 HG23 ILE A 48 3.094 -4.928 7.105 1.00 0.00 H new ATOM 0 HD11 ILE A 48 3.566 -5.293 2.742 1.00 0.00 H new ATOM 0 HD12 ILE A 48 1.853 -4.861 2.956 1.00 0.00 H new ATOM 0 HD13 ILE A 48 3.111 -3.992 3.867 1.00 0.00 H new ATOM 733 N ARG A 49 0.642 -6.247 8.715 1.00 0.00 N ATOM 734 CA ARG A 49 -0.251 -5.855 9.799 1.00 0.00 C ATOM 735 C ARG A 49 0.124 -4.478 10.340 1.00 0.00 C ATOM 736 O ARG A 49 1.272 -4.041 10.254 1.00 0.00 O ATOM 737 CB ARG A 49 -0.204 -6.888 10.926 1.00 0.00 C ATOM 738 CG ARG A 49 1.198 -7.165 11.441 1.00 0.00 C ATOM 739 CD ARG A 49 1.885 -8.253 10.630 1.00 0.00 C ATOM 740 NE ARG A 49 1.637 -9.583 11.179 1.00 0.00 N ATOM 741 CZ ARG A 49 2.147 -10.011 12.328 1.00 0.00 C ATOM 742 NH1 ARG A 49 2.929 -9.217 13.047 1.00 0.00 N ATOM 743 NH2 ARG A 49 1.875 -11.235 12.762 1.00 0.00 N ATOM 0 H ARG A 49 1.616 -6.370 8.994 1.00 0.00 H new ATOM 0 HA ARG A 49 -1.265 -5.807 9.402 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -0.823 -6.539 11.753 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -0.642 -7.821 10.571 1.00 0.00 H new ATOM 0 HG2 ARG A 49 1.789 -6.250 11.399 1.00 0.00 H new ATOM 0 HG3 ARG A 49 1.150 -7.466 12.488 1.00 0.00 H new ATOM 0 HD2 ARG A 49 1.532 -8.215 9.599 1.00 0.00 H new ATOM 0 HD3 ARG A 49 2.958 -8.065 10.607 1.00 0.00 H new ATOM 0 HE ARG A 49 1.039 -10.218 10.651 1.00 0.00 H new ATOM 0 HH11 ARG A 49 3.140 -8.275 12.718 1.00 0.00 H new ATOM 0 HH12 ARG A 49 3.319 -9.548 13.929 1.00 0.00 H new ATOM 0 HH21 ARG A 49 1.273 -11.849 12.213 1.00 0.00 H new ATOM 0 HH22 ARG A 49 2.268 -11.562 13.645 1.00 0.00 H new ATOM 757 N PRO A 50 -0.866 -3.777 10.912 1.00 0.00 N ATOM 758 CA PRO A 50 -0.665 -2.441 11.479 1.00 0.00 C ATOM 759 C PRO A 50 0.179 -2.470 12.749 1.00 0.00 C ATOM 760 O PRO A 50 -0.179 -3.123 13.729 1.00 0.00 O ATOM 761 CB PRO A 50 -2.087 -1.971 11.794 1.00 0.00 C ATOM 762 CG PRO A 50 -2.868 -3.226 11.983 1.00 0.00 C ATOM 763 CD PRO A 50 -2.259 -4.236 11.050 1.00 0.00 C ATOM 0 HA PRO A 50 -0.126 -1.786 10.795 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -2.110 -1.352 12.691 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -2.494 -1.370 10.981 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -2.814 -3.567 13.017 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -3.922 -3.068 11.754 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -2.311 -5.245 11.460 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -2.773 -4.256 10.089 1.00 0.00 H new ATOM 771 N SER A 51 1.302 -1.759 12.724 1.00 0.00 N ATOM 772 CA SER A 51 2.200 -1.707 13.872 1.00 0.00 C ATOM 773 C SER A 51 3.117 -0.491 13.790 1.00 0.00 C ATOM 774 O SER A 51 3.182 0.185 12.763 1.00 0.00 O ATOM 775 CB SER A 51 3.035 -2.986 13.952 1.00 0.00 C ATOM 776 OG SER A 51 2.316 -4.027 14.589 1.00 0.00 O ATOM 0 H SER A 51 1.612 -1.211 11.921 1.00 0.00 H new ATOM 0 HA SER A 51 1.593 -1.622 14.773 1.00 0.00 H new ATOM 0 HB2 SER A 51 3.322 -3.300 12.948 1.00 0.00 H new ATOM 0 HB3 SER A 51 3.956 -2.788 14.500 1.00 0.00 H new ATOM 0 HG SER A 51 1.357 -3.914 14.420 1.00 0.00 H new ATOM 782 N THR A 52 3.826 -0.218 14.881 1.00 0.00 N ATOM 783 CA THR A 52 4.739 0.917 14.935 1.00 0.00 C ATOM 784 C THR A 52 5.461 1.105 13.606 1.00 0.00 C ATOM 785 O THR A 52 5.698 2.232 13.170 1.00 0.00 O ATOM 786 CB THR A 52 5.784 0.745 16.054 1.00 0.00 C ATOM 787 OG1 THR A 52 5.134 0.708 17.329 1.00 0.00 O ATOM 788 CG2 THR A 52 6.797 1.880 16.027 1.00 0.00 C ATOM 0 H THR A 52 3.785 -0.768 15.739 1.00 0.00 H new ATOM 0 HA THR A 52 4.134 1.799 15.145 1.00 0.00 H new ATOM 0 HB THR A 52 6.311 -0.195 15.888 1.00 0.00 H new ATOM 0 HG1 THR A 52 5.805 0.597 18.035 1.00 0.00 H new ATOM 0 HG21 THR A 52 7.525 1.737 16.826 1.00 0.00 H new ATOM 0 HG22 THR A 52 7.310 1.887 15.065 1.00 0.00 H new ATOM 0 HG23 THR A 52 6.283 2.830 16.170 1.00 0.00 H new ATOM 796 N LYS A 53 5.808 -0.005 12.964 1.00 0.00 N ATOM 797 CA LYS A 53 6.502 0.036 11.682 1.00 0.00 C ATOM 798 C LYS A 53 5.543 0.409 10.556 1.00 0.00 C ATOM 799 O LYS A 53 5.873 1.217 9.688 1.00 0.00 O ATOM 800 CB LYS A 53 7.151 -1.318 11.386 1.00 0.00 C ATOM 801 CG LYS A 53 8.172 -1.270 10.263 1.00 0.00 C ATOM 802 CD LYS A 53 8.490 -2.661 9.738 1.00 0.00 C ATOM 803 CE LYS A 53 9.220 -2.601 8.405 1.00 0.00 C ATOM 804 NZ LYS A 53 10.685 -2.407 8.584 1.00 0.00 N ATOM 0 H LYS A 53 5.620 -0.946 13.311 1.00 0.00 H new ATOM 0 HA LYS A 53 7.279 0.799 11.742 1.00 0.00 H new ATOM 0 HB2 LYS A 53 7.635 -1.685 12.291 1.00 0.00 H new ATOM 0 HB3 LYS A 53 6.373 -2.036 11.128 1.00 0.00 H new ATOM 0 HG2 LYS A 53 7.791 -0.652 9.450 1.00 0.00 H new ATOM 0 HG3 LYS A 53 9.087 -0.798 10.621 1.00 0.00 H new ATOM 0 HD2 LYS A 53 9.102 -3.194 10.465 1.00 0.00 H new ATOM 0 HD3 LYS A 53 7.566 -3.227 9.623 1.00 0.00 H new ATOM 0 HE2 LYS A 53 9.041 -3.522 7.851 1.00 0.00 H new ATOM 0 HE3 LYS A 53 8.816 -1.785 7.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 11.200 -3.007 7.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 10.926 -1.409 8.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 10.954 -2.669 9.554 1.00 0.00 H new ATOM 818 N TYR A 54 4.354 -0.184 10.577 1.00 0.00 N ATOM 819 CA TYR A 54 3.347 0.086 9.558 1.00 0.00 C ATOM 820 C TYR A 54 2.260 1.010 10.097 1.00 0.00 C ATOM 821 O TYR A 54 1.503 0.639 10.995 1.00 0.00 O ATOM 822 CB TYR A 54 2.724 -1.222 9.068 1.00 0.00 C ATOM 823 CG TYR A 54 3.740 -2.240 8.601 1.00 0.00 C ATOM 824 CD1 TYR A 54 4.436 -2.060 7.412 1.00 0.00 C ATOM 825 CD2 TYR A 54 4.004 -3.381 9.348 1.00 0.00 C ATOM 826 CE1 TYR A 54 5.365 -2.987 6.981 1.00 0.00 C ATOM 827 CE2 TYR A 54 4.932 -4.313 8.926 1.00 0.00 C ATOM 828 CZ TYR A 54 5.610 -4.112 7.741 1.00 0.00 C ATOM 829 OH TYR A 54 6.534 -5.038 7.316 1.00 0.00 O ATOM 0 H TYR A 54 4.064 -0.855 11.289 1.00 0.00 H new ATOM 0 HA TYR A 54 3.838 0.583 8.721 1.00 0.00 H new ATOM 0 HB2 TYR A 54 2.131 -1.656 9.873 1.00 0.00 H new ATOM 0 HB3 TYR A 54 2.038 -1.004 8.249 1.00 0.00 H new ATOM 0 HD1 TYR A 54 4.247 -1.180 6.815 1.00 0.00 H new ATOM 0 HD2 TYR A 54 3.474 -3.542 10.275 1.00 0.00 H new ATOM 0 HE1 TYR A 54 5.897 -2.832 6.054 1.00 0.00 H new ATOM 0 HE2 TYR A 54 5.126 -5.194 9.520 1.00 0.00 H new ATOM 0 HH TYR A 54 6.587 -5.769 7.966 1.00 0.00 H new ATOM 839 N ILE A 55 2.188 2.215 9.541 1.00 0.00 N ATOM 840 CA ILE A 55 1.193 3.193 9.964 1.00 0.00 C ATOM 841 C ILE A 55 -0.004 3.202 9.020 1.00 0.00 C ATOM 842 O ILE A 55 0.066 3.744 7.917 1.00 0.00 O ATOM 843 CB ILE A 55 1.790 4.611 10.032 1.00 0.00 C ATOM 844 CG1 ILE A 55 3.247 4.552 10.494 1.00 0.00 C ATOM 845 CG2 ILE A 55 0.967 5.487 10.965 1.00 0.00 C ATOM 846 CD1 ILE A 55 3.413 4.041 11.908 1.00 0.00 C ATOM 0 H ILE A 55 2.807 2.537 8.797 1.00 0.00 H new ATOM 0 HA ILE A 55 0.865 2.898 10.961 1.00 0.00 H new ATOM 0 HB ILE A 55 1.763 5.050 9.035 1.00 0.00 H new ATOM 0 HG12 ILE A 55 3.809 3.910 9.816 1.00 0.00 H new ATOM 0 HG13 ILE A 55 3.683 5.549 10.423 1.00 0.00 H new ATOM 0 HG21 ILE A 55 1.401 6.486 11.003 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -0.057 5.550 10.596 1.00 0.00 H new ATOM 0 HG23 ILE A 55 0.966 5.053 11.965 1.00 0.00 H new ATOM 0 HD11 ILE A 55 4.472 4.026 12.168 1.00 0.00 H new ATOM 0 HD12 ILE A 55 2.880 4.696 12.597 1.00 0.00 H new ATOM 0 HD13 ILE A 55 3.008 3.032 11.980 1.00 0.00 H new ATOM 858 N PHE A 56 -1.104 2.599 9.461 1.00 0.00 N ATOM 859 CA PHE A 56 -2.318 2.539 8.655 1.00 0.00 C ATOM 860 C PHE A 56 -3.209 3.748 8.922 1.00 0.00 C ATOM 861 O PHE A 56 -3.702 3.935 10.034 1.00 0.00 O ATOM 862 CB PHE A 56 -3.087 1.249 8.950 1.00 0.00 C ATOM 863 CG PHE A 56 -2.503 0.037 8.284 1.00 0.00 C ATOM 864 CD1 PHE A 56 -1.274 -0.465 8.683 1.00 0.00 C ATOM 865 CD2 PHE A 56 -3.182 -0.601 7.258 1.00 0.00 C ATOM 866 CE1 PHE A 56 -0.734 -1.581 8.072 1.00 0.00 C ATOM 867 CE2 PHE A 56 -2.647 -1.718 6.644 1.00 0.00 C ATOM 868 CZ PHE A 56 -1.421 -2.207 7.051 1.00 0.00 C ATOM 0 H PHE A 56 -1.179 2.145 10.371 1.00 0.00 H new ATOM 0 HA PHE A 56 -2.028 2.549 7.604 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -3.108 1.087 10.028 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -4.121 1.369 8.625 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -0.732 0.022 9.481 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -4.140 -0.221 6.935 1.00 0.00 H new ATOM 0 HE1 PHE A 56 0.224 -1.963 8.393 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -3.187 -2.208 5.847 1.00 0.00 H new ATOM 0 HZ PHE A 56 -1.000 -3.078 6.571 1.00 0.00 H new ATOM 878 N GLU A 57 -3.408 4.567 7.894 1.00 0.00 N ATOM 879 CA GLU A 57 -4.238 5.760 8.018 1.00 0.00 C ATOM 880 C GLU A 57 -5.370 5.744 6.995 1.00 0.00 C ATOM 881 O GLU A 57 -5.294 5.053 5.978 1.00 0.00 O ATOM 882 CB GLU A 57 -3.390 7.020 7.836 1.00 0.00 C ATOM 883 CG GLU A 57 -2.233 7.121 8.816 1.00 0.00 C ATOM 884 CD GLU A 57 -2.641 7.738 10.140 1.00 0.00 C ATOM 885 OE1 GLU A 57 -3.834 7.645 10.495 1.00 0.00 O ATOM 886 OE2 GLU A 57 -1.767 8.315 10.820 1.00 0.00 O ATOM 0 H GLU A 57 -3.006 4.427 6.967 1.00 0.00 H new ATOM 0 HA GLU A 57 -4.674 5.765 9.017 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -2.997 7.040 6.819 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -4.028 7.897 7.948 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -1.825 6.126 8.994 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -1.437 7.718 8.372 1.00 0.00 H new ATOM 893 N HIS A 58 -6.421 6.509 7.272 1.00 0.00 N ATOM 894 CA HIS A 58 -7.570 6.584 6.376 1.00 0.00 C ATOM 895 C HIS A 58 -8.101 8.011 6.291 1.00 0.00 C ATOM 896 O HIS A 58 -8.411 8.631 7.309 1.00 0.00 O ATOM 897 CB HIS A 58 -8.677 5.643 6.853 1.00 0.00 C ATOM 898 CG HIS A 58 -9.903 5.677 5.994 1.00 0.00 C ATOM 899 ND1 HIS A 58 -11.157 5.976 6.484 1.00 0.00 N ATOM 900 CD2 HIS A 58 -10.063 5.450 4.669 1.00 0.00 C ATOM 901 CE1 HIS A 58 -12.035 5.929 5.498 1.00 0.00 C ATOM 902 NE2 HIS A 58 -11.397 5.613 4.386 1.00 0.00 N ATOM 0 H HIS A 58 -6.501 7.086 8.109 1.00 0.00 H new ATOM 0 HA HIS A 58 -7.245 6.277 5.382 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -8.290 4.624 6.880 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -8.952 5.907 7.874 1.00 0.00 H new ATOM 0 HD1 HIS A 58 -11.373 6.199 7.456 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -9.286 5.189 3.965 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -13.095 6.117 5.586 1.00 0.00 H new ATOM 911 N LYS A 59 -8.203 8.528 5.071 1.00 0.00 N ATOM 912 CA LYS A 59 -8.696 9.882 4.852 1.00 0.00 C ATOM 913 C LYS A 59 -9.492 9.968 3.553 1.00 0.00 C ATOM 914 O LYS A 59 -8.927 9.892 2.463 1.00 0.00 O ATOM 915 CB LYS A 59 -7.530 10.873 4.815 1.00 0.00 C ATOM 916 CG LYS A 59 -6.955 11.187 6.185 1.00 0.00 C ATOM 917 CD LYS A 59 -5.527 11.696 6.087 1.00 0.00 C ATOM 918 CE LYS A 59 -5.480 13.133 5.590 1.00 0.00 C ATOM 919 NZ LYS A 59 -5.642 14.110 6.702 1.00 0.00 N ATOM 0 H LYS A 59 -7.950 8.029 4.218 1.00 0.00 H new ATOM 0 HA LYS A 59 -9.356 10.139 5.680 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -6.740 10.468 4.183 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -7.866 11.800 4.350 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -7.576 11.935 6.678 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -6.981 10.291 6.806 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -5.049 11.632 7.065 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -4.958 11.058 5.412 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -4.531 13.312 5.085 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -6.268 13.288 4.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -5.604 15.077 6.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -6.559 13.956 7.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -4.876 13.979 7.393 1.00 0.00 H new ATOM 933 N GLY A 60 -10.806 10.129 3.678 1.00 0.00 N ATOM 934 CA GLY A 60 -11.656 10.223 2.506 1.00 0.00 C ATOM 935 C GLY A 60 -11.431 9.083 1.533 1.00 0.00 C ATOM 936 O GLY A 60 -10.612 9.190 0.620 1.00 0.00 O ATOM 0 H GLY A 60 -11.297 10.196 4.570 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -12.700 10.229 2.818 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -11.469 11.170 2.000 1.00 0.00 H new ATOM 940 N CYS A 61 -12.158 7.989 1.729 1.00 0.00 N ATOM 941 CA CYS A 61 -12.033 6.822 0.862 1.00 0.00 C ATOM 942 C CYS A 61 -10.598 6.662 0.371 1.00 0.00 C ATOM 943 O CYS A 61 -10.362 6.390 -0.806 1.00 0.00 O ATOM 944 CB CYS A 61 -12.982 6.942 -0.331 1.00 0.00 C ATOM 945 SG CYS A 61 -14.701 7.270 0.125 1.00 0.00 S ATOM 0 H CYS A 61 -12.840 7.885 2.480 1.00 0.00 H new ATOM 0 HA CYS A 61 -12.301 5.939 1.442 1.00 0.00 H new ATOM 0 HB2 CYS A 61 -12.631 7.742 -0.982 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -12.940 6.019 -0.909 1.00 0.00 H new ATOM 0 HG CYS A 61 -15.426 7.357 -0.950 1.00 0.00 H new ATOM 951 N GLN A 62 -9.644 6.835 1.280 1.00 0.00 N ATOM 952 CA GLN A 62 -8.232 6.712 0.938 1.00 0.00 C ATOM 953 C GLN A 62 -7.438 6.130 2.103 1.00 0.00 C ATOM 954 O GLN A 62 -7.576 6.572 3.243 1.00 0.00 O ATOM 955 CB GLN A 62 -7.659 8.075 0.545 1.00 0.00 C ATOM 956 CG GLN A 62 -6.387 7.986 -0.282 1.00 0.00 C ATOM 957 CD GLN A 62 -5.136 7.962 0.573 1.00 0.00 C ATOM 958 OE1 GLN A 62 -4.402 6.973 0.592 1.00 0.00 O ATOM 959 NE2 GLN A 62 -4.884 9.054 1.286 1.00 0.00 N ATOM 0 H GLN A 62 -9.823 7.061 2.258 1.00 0.00 H new ATOM 0 HA GLN A 62 -8.148 6.033 0.090 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -8.411 8.627 -0.019 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -7.455 8.648 1.449 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -6.420 7.086 -0.896 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -6.341 8.836 -0.963 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -5.519 9.851 1.240 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -4.055 9.096 1.879 1.00 0.00 H new ATOM 968 N ARG A 63 -6.606 5.136 1.808 1.00 0.00 N ATOM 969 CA ARG A 63 -5.791 4.493 2.832 1.00 0.00 C ATOM 970 C ARG A 63 -4.305 4.688 2.546 1.00 0.00 C ATOM 971 O ARG A 63 -3.838 4.433 1.435 1.00 0.00 O ATOM 972 CB ARG A 63 -6.115 2.999 2.907 1.00 0.00 C ATOM 973 CG ARG A 63 -7.576 2.707 3.209 1.00 0.00 C ATOM 974 CD ARG A 63 -7.855 2.745 4.703 1.00 0.00 C ATOM 975 NE ARG A 63 -7.292 1.588 5.394 1.00 0.00 N ATOM 976 CZ ARG A 63 -7.622 1.241 6.634 1.00 0.00 C ATOM 977 NH1 ARG A 63 -8.506 1.958 7.314 1.00 0.00 N ATOM 978 NH2 ARG A 63 -7.067 0.174 7.195 1.00 0.00 N ATOM 0 H ARG A 63 -6.479 4.759 0.869 1.00 0.00 H new ATOM 0 HA ARG A 63 -6.023 4.957 3.790 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -5.848 2.530 1.960 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -5.495 2.540 3.677 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -8.206 3.437 2.701 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.842 1.727 2.813 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.438 3.659 5.127 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.932 2.779 4.870 1.00 0.00 H new ATOM 0 HE ARG A 63 -6.609 1.015 4.898 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -8.935 2.778 6.886 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -8.757 1.689 8.265 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -6.387 -0.380 6.675 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -7.321 -0.092 8.147 1.00 0.00 H new ATOM 992 N ILE A 64 -3.569 5.143 3.554 1.00 0.00 N ATOM 993 CA ILE A 64 -2.137 5.372 3.411 1.00 0.00 C ATOM 994 C ILE A 64 -1.335 4.372 4.237 1.00 0.00 C ATOM 995 O ILE A 64 -1.795 3.899 5.277 1.00 0.00 O ATOM 996 CB ILE A 64 -1.750 6.801 3.837 1.00 0.00 C ATOM 997 CG1 ILE A 64 -2.682 7.822 3.182 1.00 0.00 C ATOM 998 CG2 ILE A 64 -0.301 7.088 3.472 1.00 0.00 C ATOM 999 CD1 ILE A 64 -3.936 8.095 3.982 1.00 0.00 C ATOM 0 H ILE A 64 -3.941 5.360 4.479 1.00 0.00 H new ATOM 0 HA ILE A 64 -1.900 5.240 2.355 1.00 0.00 H new ATOM 0 HB ILE A 64 -1.855 6.883 4.919 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -2.141 8.757 3.040 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -2.963 7.463 2.192 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -0.042 8.101 3.779 1.00 0.00 H new ATOM 0 HG22 ILE A 64 0.350 6.377 3.981 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -0.171 6.991 2.394 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -4.550 8.828 3.458 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -4.499 7.170 4.102 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.664 8.484 4.963 1.00 0.00 H new ATOM 1011 N LEU A 65 -0.133 4.056 3.769 1.00 0.00 N ATOM 1012 CA LEU A 65 0.736 3.113 4.466 1.00 0.00 C ATOM 1013 C LEU A 65 2.162 3.647 4.550 1.00 0.00 C ATOM 1014 O LEU A 65 2.746 4.051 3.544 1.00 0.00 O ATOM 1015 CB LEU A 65 0.727 1.759 3.754 1.00 0.00 C ATOM 1016 CG LEU A 65 1.420 0.611 4.488 1.00 0.00 C ATOM 1017 CD1 LEU A 65 2.930 0.790 4.455 1.00 0.00 C ATOM 1018 CD2 LEU A 65 0.923 0.518 5.923 1.00 0.00 C ATOM 0 H LEU A 65 0.263 4.438 2.910 1.00 0.00 H new ATOM 0 HA LEU A 65 0.355 2.986 5.479 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -0.309 1.474 3.571 1.00 0.00 H new ATOM 0 HB3 LEU A 65 1.201 1.880 2.780 1.00 0.00 H new ATOM 0 HG LEU A 65 1.174 -0.321 3.979 1.00 0.00 H new ATOM 0 HD11 LEU A 65 3.406 -0.037 4.982 1.00 0.00 H new ATOM 0 HD12 LEU A 65 3.272 0.805 3.420 1.00 0.00 H new ATOM 0 HD13 LEU A 65 3.196 1.730 4.939 1.00 0.00 H new ATOM 0 HD21 LEU A 65 1.427 -0.305 6.430 1.00 0.00 H new ATOM 0 HD22 LEU A 65 1.138 1.451 6.444 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.152 0.341 5.925 1.00 0.00 H new ATOM 1030 N PHE A 66 2.719 3.644 5.756 1.00 0.00 N ATOM 1031 CA PHE A 66 4.078 4.126 5.972 1.00 0.00 C ATOM 1032 C PHE A 66 4.968 3.018 6.528 1.00 0.00 C ATOM 1033 O PHE A 66 4.626 2.373 7.520 1.00 0.00 O ATOM 1034 CB PHE A 66 4.072 5.319 6.930 1.00 0.00 C ATOM 1035 CG PHE A 66 3.476 6.563 6.335 1.00 0.00 C ATOM 1036 CD1 PHE A 66 4.203 7.341 5.449 1.00 0.00 C ATOM 1037 CD2 PHE A 66 2.187 6.953 6.662 1.00 0.00 C ATOM 1038 CE1 PHE A 66 3.656 8.486 4.901 1.00 0.00 C ATOM 1039 CE2 PHE A 66 1.635 8.097 6.117 1.00 0.00 C ATOM 1040 CZ PHE A 66 2.370 8.864 5.234 1.00 0.00 C ATOM 0 H PHE A 66 2.250 3.313 6.599 1.00 0.00 H new ATOM 0 HA PHE A 66 4.481 4.442 5.010 1.00 0.00 H new ATOM 0 HB2 PHE A 66 3.514 5.052 7.827 1.00 0.00 H new ATOM 0 HB3 PHE A 66 5.095 5.529 7.242 1.00 0.00 H new ATOM 0 HD1 PHE A 66 5.208 7.050 5.183 1.00 0.00 H new ATOM 0 HD2 PHE A 66 1.607 6.356 7.351 1.00 0.00 H new ATOM 0 HE1 PHE A 66 4.234 9.085 4.213 1.00 0.00 H new ATOM 0 HE2 PHE A 66 0.630 8.391 6.381 1.00 0.00 H new ATOM 0 HZ PHE A 66 1.940 9.757 4.805 1.00 0.00 H new ATOM 1050 N ILE A 67 6.108 2.802 5.882 1.00 0.00 N ATOM 1051 CA ILE A 67 7.046 1.773 6.311 1.00 0.00 C ATOM 1052 C ILE A 67 8.371 2.386 6.753 1.00 0.00 C ATOM 1053 O ILE A 67 9.108 2.946 5.943 1.00 0.00 O ATOM 1054 CB ILE A 67 7.315 0.752 5.190 1.00 0.00 C ATOM 1055 CG1 ILE A 67 5.995 0.209 4.638 1.00 0.00 C ATOM 1056 CG2 ILE A 67 8.188 -0.382 5.704 1.00 0.00 C ATOM 1057 CD1 ILE A 67 6.167 -0.674 3.422 1.00 0.00 C ATOM 0 H ILE A 67 6.405 3.326 5.059 1.00 0.00 H new ATOM 0 HA ILE A 67 6.586 1.260 7.155 1.00 0.00 H new ATOM 0 HB ILE A 67 7.846 1.254 4.381 1.00 0.00 H new ATOM 0 HG12 ILE A 67 5.489 -0.357 5.420 1.00 0.00 H new ATOM 0 HG13 ILE A 67 5.346 1.046 4.380 1.00 0.00 H new ATOM 0 HG21 ILE A 67 8.369 -1.095 4.900 1.00 0.00 H new ATOM 0 HG22 ILE A 67 9.139 0.020 6.053 1.00 0.00 H new ATOM 0 HG23 ILE A 67 7.683 -0.885 6.528 1.00 0.00 H new ATOM 0 HD11 ILE A 67 5.191 -1.023 3.085 1.00 0.00 H new ATOM 0 HD12 ILE A 67 6.645 -0.105 2.624 1.00 0.00 H new ATOM 0 HD13 ILE A 67 6.790 -1.531 3.680 1.00 0.00 H new ATOM 1069 N ASN A 68 8.667 2.274 8.044 1.00 0.00 N ATOM 1070 CA ASN A 68 9.904 2.816 8.595 1.00 0.00 C ATOM 1071 C ASN A 68 11.017 1.773 8.563 1.00 0.00 C ATOM 1072 O ASN A 68 10.754 0.572 8.527 1.00 0.00 O ATOM 1073 CB ASN A 68 9.680 3.297 10.030 1.00 0.00 C ATOM 1074 CG ASN A 68 8.938 4.617 10.089 1.00 0.00 C ATOM 1075 OD1 ASN A 68 9.498 5.672 9.789 1.00 0.00 O ATOM 1076 ND2 ASN A 68 7.669 4.565 10.477 1.00 0.00 N ATOM 0 H ASN A 68 8.067 1.813 8.728 1.00 0.00 H new ATOM 0 HA ASN A 68 10.207 3.663 7.979 1.00 0.00 H new ATOM 0 HB2 ASN A 68 9.117 2.542 10.579 1.00 0.00 H new ATOM 0 HB3 ASN A 68 10.643 3.402 10.529 1.00 0.00 H new ATOM 0 HD21 ASN A 68 7.118 5.421 10.536 1.00 0.00 H new ATOM 0 HD22 ASN A 68 7.245 3.669 10.716 1.00 0.00 H new ATOM 1083 N ASN A 69 12.260 2.242 8.577 1.00 0.00 N ATOM 1084 CA ASN A 69 13.414 1.350 8.549 1.00 0.00 C ATOM 1085 C ASN A 69 13.618 0.767 7.154 1.00 0.00 C ATOM 1086 O ASN A 69 13.901 -0.422 7.003 1.00 0.00 O ATOM 1087 CB ASN A 69 13.235 0.220 9.566 1.00 0.00 C ATOM 1088 CG ASN A 69 14.548 -0.448 9.925 1.00 0.00 C ATOM 1089 OD1 ASN A 69 15.615 -0.023 9.481 1.00 0.00 O ATOM 1090 ND2 ASN A 69 14.476 -1.499 10.732 1.00 0.00 N ATOM 0 H ASN A 69 12.494 3.234 8.608 1.00 0.00 H new ATOM 0 HA ASN A 69 14.298 1.931 8.812 1.00 0.00 H new ATOM 0 HB2 ASN A 69 12.774 0.618 10.470 1.00 0.00 H new ATOM 0 HB3 ASN A 69 12.550 -0.525 9.161 1.00 0.00 H new ATOM 0 HD21 ASN A 69 15.327 -1.989 11.008 1.00 0.00 H new ATOM 0 HD22 ASN A 69 13.570 -1.817 11.076 1.00 0.00 H new ATOM 1097 N CYS A 70 13.473 1.611 6.139 1.00 0.00 N ATOM 1098 CA CYS A 70 13.641 1.180 4.756 1.00 0.00 C ATOM 1099 C CYS A 70 15.086 0.772 4.485 1.00 0.00 C ATOM 1100 O CYS A 70 15.960 1.623 4.320 1.00 0.00 O ATOM 1101 CB CYS A 70 13.226 2.297 3.798 1.00 0.00 C ATOM 1102 SG CYS A 70 11.452 2.647 3.795 1.00 0.00 S ATOM 0 H CYS A 70 13.239 2.598 6.248 1.00 0.00 H new ATOM 0 HA CYS A 70 13.001 0.313 4.591 1.00 0.00 H new ATOM 0 HB2 CYS A 70 13.764 3.207 4.063 1.00 0.00 H new ATOM 0 HB3 CYS A 70 13.534 2.027 2.788 1.00 0.00 H new ATOM 0 HG CYS A 70 11.010 2.661 5.018 1.00 0.00 H new ATOM 1108 N GLN A 71 15.328 -0.534 4.443 1.00 0.00 N ATOM 1109 CA GLN A 71 16.668 -1.054 4.195 1.00 0.00 C ATOM 1110 C GLN A 71 16.771 -1.644 2.793 1.00 0.00 C ATOM 1111 O GLN A 71 15.784 -2.124 2.237 1.00 0.00 O ATOM 1112 CB GLN A 71 17.026 -2.116 5.236 1.00 0.00 C ATOM 1113 CG GLN A 71 18.513 -2.193 5.540 1.00 0.00 C ATOM 1114 CD GLN A 71 19.069 -0.887 6.071 1.00 0.00 C ATOM 1115 OE1 GLN A 71 20.099 -0.401 5.603 1.00 0.00 O ATOM 1116 NE2 GLN A 71 18.389 -0.310 7.055 1.00 0.00 N ATOM 0 H GLN A 71 14.615 -1.251 4.577 1.00 0.00 H new ATOM 0 HA GLN A 71 17.373 -0.226 4.274 1.00 0.00 H new ATOM 0 HB2 GLN A 71 16.485 -1.905 6.159 1.00 0.00 H new ATOM 0 HB3 GLN A 71 16.685 -3.089 4.882 1.00 0.00 H new ATOM 0 HG2 GLN A 71 18.690 -2.982 6.270 1.00 0.00 H new ATOM 0 HG3 GLN A 71 19.051 -2.471 4.634 1.00 0.00 H new ATOM 0 HE21 GLN A 71 17.540 -0.747 7.413 1.00 0.00 H new ATOM 0 HE22 GLN A 71 18.716 0.571 7.453 1.00 0.00 H new ATOM 1125 N MET A 72 17.973 -1.605 2.227 1.00 0.00 N ATOM 1126 CA MET A 72 18.205 -2.137 0.889 1.00 0.00 C ATOM 1127 C MET A 72 17.654 -3.554 0.765 1.00 0.00 C ATOM 1128 O MET A 72 16.972 -3.883 -0.207 1.00 0.00 O ATOM 1129 CB MET A 72 19.701 -2.129 0.567 1.00 0.00 C ATOM 1130 CG MET A 72 20.173 -0.843 -0.093 1.00 0.00 C ATOM 1131 SD MET A 72 20.070 -0.907 -1.892 1.00 0.00 S ATOM 1132 CE MET A 72 20.969 0.578 -2.335 1.00 0.00 C ATOM 0 H MET A 72 18.801 -1.211 2.674 1.00 0.00 H new ATOM 0 HA MET A 72 17.683 -1.499 0.175 1.00 0.00 H new ATOM 0 HB2 MET A 72 20.263 -2.283 1.488 1.00 0.00 H new ATOM 0 HB3 MET A 72 19.928 -2.969 -0.089 1.00 0.00 H new ATOM 0 HG2 MET A 72 19.572 -0.010 0.272 1.00 0.00 H new ATOM 0 HG3 MET A 72 21.204 -0.645 0.201 1.00 0.00 H new ATOM 0 HE1 MET A 72 20.932 0.717 -3.415 1.00 0.00 H new ATOM 0 HE2 MET A 72 20.516 1.438 -1.843 1.00 0.00 H new ATOM 0 HE3 MET A 72 22.007 0.483 -2.017 1.00 0.00 H new ATOM 1142 N THR A 73 17.954 -4.390 1.753 1.00 0.00 N ATOM 1143 CA THR A 73 17.489 -5.772 1.753 1.00 0.00 C ATOM 1144 C THR A 73 15.981 -5.845 1.961 1.00 0.00 C ATOM 1145 O THR A 73 15.322 -6.767 1.480 1.00 0.00 O ATOM 1146 CB THR A 73 18.188 -6.599 2.848 1.00 0.00 C ATOM 1147 OG1 THR A 73 18.014 -5.971 4.123 1.00 0.00 O ATOM 1148 CG2 THR A 73 19.672 -6.749 2.549 1.00 0.00 C ATOM 0 H THR A 73 18.517 -4.135 2.564 1.00 0.00 H new ATOM 0 HA THR A 73 17.738 -6.190 0.778 1.00 0.00 H new ATOM 0 HB THR A 73 17.736 -7.591 2.867 1.00 0.00 H new ATOM 0 HG1 THR A 73 18.460 -6.504 4.814 1.00 0.00 H new ATOM 0 HG21 THR A 73 20.144 -7.337 3.336 1.00 0.00 H new ATOM 0 HG22 THR A 73 19.801 -7.254 1.592 1.00 0.00 H new ATOM 0 HG23 THR A 73 20.136 -5.764 2.504 1.00 0.00 H new ATOM 1156 N ASP A 74 15.440 -4.867 2.680 1.00 0.00 N ATOM 1157 CA ASP A 74 14.008 -4.820 2.951 1.00 0.00 C ATOM 1158 C ASP A 74 13.219 -4.591 1.665 1.00 0.00 C ATOM 1159 O ASP A 74 12.161 -5.186 1.460 1.00 0.00 O ATOM 1160 CB ASP A 74 13.694 -3.715 3.960 1.00 0.00 C ATOM 1161 CG ASP A 74 13.808 -4.192 5.395 1.00 0.00 C ATOM 1162 OD1 ASP A 74 12.871 -4.864 5.873 1.00 0.00 O ATOM 1163 OD2 ASP A 74 14.835 -3.891 6.040 1.00 0.00 O ATOM 0 H ASP A 74 15.972 -4.097 3.085 1.00 0.00 H new ATOM 0 HA ASP A 74 13.711 -5.781 3.372 1.00 0.00 H new ATOM 0 HB2 ASP A 74 14.376 -2.879 3.803 1.00 0.00 H new ATOM 0 HB3 ASP A 74 12.685 -3.341 3.783 1.00 0.00 H new ATOM 1168 N ASP A 75 13.741 -3.725 0.804 1.00 0.00 N ATOM 1169 CA ASP A 75 13.086 -3.416 -0.462 1.00 0.00 C ATOM 1170 C ASP A 75 12.376 -4.646 -1.020 1.00 0.00 C ATOM 1171 O ASP A 75 13.017 -5.608 -1.441 1.00 0.00 O ATOM 1172 CB ASP A 75 14.107 -2.898 -1.476 1.00 0.00 C ATOM 1173 CG ASP A 75 14.772 -4.018 -2.252 1.00 0.00 C ATOM 1174 OD1 ASP A 75 15.336 -4.931 -1.612 1.00 0.00 O ATOM 1175 OD2 ASP A 75 14.729 -3.982 -3.499 1.00 0.00 O ATOM 0 H ASP A 75 14.616 -3.224 0.959 1.00 0.00 H new ATOM 0 HA ASP A 75 12.342 -2.641 -0.279 1.00 0.00 H new ATOM 0 HB2 ASP A 75 13.612 -2.222 -2.173 1.00 0.00 H new ATOM 0 HB3 ASP A 75 14.869 -2.318 -0.956 1.00 0.00 H new ATOM 1180 N SER A 76 11.047 -4.607 -1.018 1.00 0.00 N ATOM 1181 CA SER A 76 10.249 -5.719 -1.519 1.00 0.00 C ATOM 1182 C SER A 76 9.087 -5.215 -2.370 1.00 0.00 C ATOM 1183 O SER A 76 8.815 -4.016 -2.418 1.00 0.00 O ATOM 1184 CB SER A 76 9.717 -6.558 -0.356 1.00 0.00 C ATOM 1185 OG SER A 76 10.730 -7.396 0.174 1.00 0.00 O ATOM 0 H SER A 76 10.501 -3.817 -0.675 1.00 0.00 H new ATOM 0 HA SER A 76 10.891 -6.341 -2.143 1.00 0.00 H new ATOM 0 HB2 SER A 76 9.338 -5.901 0.427 1.00 0.00 H new ATOM 0 HB3 SER A 76 8.879 -7.166 -0.696 1.00 0.00 H new ATOM 0 HG SER A 76 11.372 -6.854 0.678 1.00 0.00 H new ATOM 1191 N GLU A 77 8.407 -6.140 -3.040 1.00 0.00 N ATOM 1192 CA GLU A 77 7.275 -5.790 -3.889 1.00 0.00 C ATOM 1193 C GLU A 77 5.993 -5.677 -3.069 1.00 0.00 C ATOM 1194 O GLU A 77 5.685 -6.548 -2.256 1.00 0.00 O ATOM 1195 CB GLU A 77 7.096 -6.832 -4.995 1.00 0.00 C ATOM 1196 CG GLU A 77 6.277 -8.039 -4.566 1.00 0.00 C ATOM 1197 CD GLU A 77 6.615 -9.285 -5.361 1.00 0.00 C ATOM 1198 OE1 GLU A 77 6.342 -9.304 -6.579 1.00 0.00 O ATOM 1199 OE2 GLU A 77 7.153 -10.242 -4.765 1.00 0.00 O ATOM 0 H GLU A 77 8.620 -7.137 -3.011 1.00 0.00 H new ATOM 0 HA GLU A 77 7.482 -4.821 -4.343 1.00 0.00 H new ATOM 0 HB2 GLU A 77 6.613 -6.361 -5.852 1.00 0.00 H new ATOM 0 HB3 GLU A 77 8.078 -7.169 -5.328 1.00 0.00 H new ATOM 0 HG2 GLU A 77 6.447 -8.231 -3.507 1.00 0.00 H new ATOM 0 HG3 GLU A 77 5.217 -7.814 -4.683 1.00 0.00 H new ATOM 1206 N TYR A 78 5.251 -4.597 -3.288 1.00 0.00 N ATOM 1207 CA TYR A 78 4.004 -4.367 -2.567 1.00 0.00 C ATOM 1208 C TYR A 78 2.812 -4.396 -3.519 1.00 0.00 C ATOM 1209 O TYR A 78 2.904 -3.948 -4.662 1.00 0.00 O ATOM 1210 CB TYR A 78 4.054 -3.026 -1.835 1.00 0.00 C ATOM 1211 CG TYR A 78 5.172 -2.930 -0.822 1.00 0.00 C ATOM 1212 CD1 TYR A 78 6.470 -2.630 -1.218 1.00 0.00 C ATOM 1213 CD2 TYR A 78 4.932 -3.139 0.530 1.00 0.00 C ATOM 1214 CE1 TYR A 78 7.496 -2.542 -0.296 1.00 0.00 C ATOM 1215 CE2 TYR A 78 5.951 -3.052 1.459 1.00 0.00 C ATOM 1216 CZ TYR A 78 7.231 -2.753 1.041 1.00 0.00 C ATOM 1217 OH TYR A 78 8.249 -2.666 1.963 1.00 0.00 O ATOM 0 H TYR A 78 5.491 -3.867 -3.959 1.00 0.00 H new ATOM 0 HA TYR A 78 3.883 -5.167 -1.837 1.00 0.00 H new ATOM 0 HB2 TYR A 78 4.169 -2.226 -2.567 1.00 0.00 H new ATOM 0 HB3 TYR A 78 3.102 -2.862 -1.330 1.00 0.00 H new ATOM 0 HD1 TYR A 78 6.681 -2.463 -2.264 1.00 0.00 H new ATOM 0 HD2 TYR A 78 3.931 -3.374 0.861 1.00 0.00 H new ATOM 0 HE1 TYR A 78 8.499 -2.309 -0.621 1.00 0.00 H new ATOM 0 HE2 TYR A 78 5.746 -3.217 2.507 1.00 0.00 H new ATOM 0 HH TYR A 78 8.921 -2.026 1.649 1.00 0.00 H new ATOM 1227 N TYR A 79 1.693 -4.927 -3.038 1.00 0.00 N ATOM 1228 CA TYR A 79 0.482 -5.017 -3.845 1.00 0.00 C ATOM 1229 C TYR A 79 -0.762 -5.019 -2.962 1.00 0.00 C ATOM 1230 O TYR A 79 -0.911 -5.866 -2.082 1.00 0.00 O ATOM 1231 CB TYR A 79 0.511 -6.280 -4.707 1.00 0.00 C ATOM 1232 CG TYR A 79 0.241 -7.550 -3.931 1.00 0.00 C ATOM 1233 CD1 TYR A 79 1.280 -8.265 -3.349 1.00 0.00 C ATOM 1234 CD2 TYR A 79 -1.053 -8.033 -3.780 1.00 0.00 C ATOM 1235 CE1 TYR A 79 1.038 -9.426 -2.639 1.00 0.00 C ATOM 1236 CE2 TYR A 79 -1.304 -9.191 -3.071 1.00 0.00 C ATOM 1237 CZ TYR A 79 -0.255 -9.884 -2.503 1.00 0.00 C ATOM 1238 OH TYR A 79 -0.501 -11.039 -1.796 1.00 0.00 O ATOM 0 H TYR A 79 1.600 -5.301 -2.094 1.00 0.00 H new ATOM 0 HA TYR A 79 0.443 -4.143 -4.495 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -0.230 -6.185 -5.501 1.00 0.00 H new ATOM 0 HB3 TYR A 79 1.486 -6.359 -5.188 1.00 0.00 H new ATOM 0 HD1 TYR A 79 2.294 -7.908 -3.453 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -1.876 -7.494 -4.225 1.00 0.00 H new ATOM 0 HE1 TYR A 79 1.857 -9.971 -2.193 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -2.316 -9.552 -2.962 1.00 0.00 H new ATOM 0 HH TYR A 79 -0.691 -10.816 -0.861 1.00 0.00 H new ATOM 1248 N VAL A 80 -1.654 -4.064 -3.205 1.00 0.00 N ATOM 1249 CA VAL A 80 -2.887 -3.955 -2.435 1.00 0.00 C ATOM 1250 C VAL A 80 -4.072 -4.515 -3.212 1.00 0.00 C ATOM 1251 O VAL A 80 -4.140 -4.395 -4.436 1.00 0.00 O ATOM 1252 CB VAL A 80 -3.182 -2.492 -2.053 1.00 0.00 C ATOM 1253 CG1 VAL A 80 -3.444 -1.658 -3.297 1.00 0.00 C ATOM 1254 CG2 VAL A 80 -4.362 -2.420 -1.095 1.00 0.00 C ATOM 0 H VAL A 80 -1.545 -3.354 -3.930 1.00 0.00 H new ATOM 0 HA VAL A 80 -2.745 -4.539 -1.526 1.00 0.00 H new ATOM 0 HB VAL A 80 -2.307 -2.083 -1.548 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -3.650 -0.628 -3.007 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -2.567 -1.684 -3.944 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -4.302 -2.063 -3.833 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -4.557 -1.379 -0.835 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -5.244 -2.846 -1.572 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -4.131 -2.983 -0.190 1.00 0.00 H new ATOM 1264 N THR A 81 -5.008 -5.128 -2.493 1.00 0.00 N ATOM 1265 CA THR A 81 -6.191 -5.708 -3.115 1.00 0.00 C ATOM 1266 C THR A 81 -7.462 -5.030 -2.617 1.00 0.00 C ATOM 1267 O THR A 81 -7.564 -4.665 -1.446 1.00 0.00 O ATOM 1268 CB THR A 81 -6.287 -7.220 -2.838 1.00 0.00 C ATOM 1269 OG1 THR A 81 -6.397 -7.455 -1.430 1.00 0.00 O ATOM 1270 CG2 THR A 81 -5.069 -7.949 -3.386 1.00 0.00 C ATOM 0 H THR A 81 -4.969 -5.235 -1.479 1.00 0.00 H new ATOM 0 HA THR A 81 -6.094 -5.548 -4.189 1.00 0.00 H new ATOM 0 HB THR A 81 -7.176 -7.603 -3.339 1.00 0.00 H new ATOM 0 HG1 THR A 81 -6.459 -8.419 -1.263 1.00 0.00 H new ATOM 0 HG21 THR A 81 -5.159 -9.015 -3.178 1.00 0.00 H new ATOM 0 HG22 THR A 81 -5.006 -7.793 -4.463 1.00 0.00 H new ATOM 0 HG23 THR A 81 -4.168 -7.562 -2.910 1.00 0.00 H new ATOM 1278 N ALA A 82 -8.430 -4.865 -3.513 1.00 0.00 N ATOM 1279 CA ALA A 82 -9.696 -4.233 -3.163 1.00 0.00 C ATOM 1280 C ALA A 82 -10.808 -4.672 -4.109 1.00 0.00 C ATOM 1281 O ALA A 82 -10.785 -4.359 -5.299 1.00 0.00 O ATOM 1282 CB ALA A 82 -9.552 -2.718 -3.181 1.00 0.00 C ATOM 0 H ALA A 82 -8.361 -5.160 -4.487 1.00 0.00 H new ATOM 0 HA ALA A 82 -9.966 -4.549 -2.155 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -10.505 -2.259 -2.918 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -8.792 -2.416 -2.460 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -9.256 -2.393 -4.178 1.00 0.00 H new ATOM 1288 N GLY A 83 -11.783 -5.400 -3.572 1.00 0.00 N ATOM 1289 CA GLY A 83 -12.890 -5.870 -4.383 1.00 0.00 C ATOM 1290 C GLY A 83 -12.490 -6.999 -5.312 1.00 0.00 C ATOM 1291 O GLY A 83 -12.221 -8.114 -4.865 1.00 0.00 O ATOM 0 H GLY A 83 -11.825 -5.672 -2.590 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -13.696 -6.208 -3.731 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -13.283 -5.041 -4.972 1.00 0.00 H new ATOM 1295 N ASP A 84 -12.451 -6.711 -6.608 1.00 0.00 N ATOM 1296 CA ASP A 84 -12.082 -7.711 -7.603 1.00 0.00 C ATOM 1297 C ASP A 84 -10.858 -7.262 -8.396 1.00 0.00 C ATOM 1298 O ASP A 84 -10.522 -7.851 -9.422 1.00 0.00 O ATOM 1299 CB ASP A 84 -13.252 -7.974 -8.552 1.00 0.00 C ATOM 1300 CG ASP A 84 -12.960 -9.090 -9.535 1.00 0.00 C ATOM 1301 OD1 ASP A 84 -12.119 -9.958 -9.217 1.00 0.00 O ATOM 1302 OD2 ASP A 84 -13.573 -9.097 -10.623 1.00 0.00 O ATOM 0 H ASP A 84 -12.670 -5.793 -6.994 1.00 0.00 H new ATOM 0 HA ASP A 84 -11.835 -8.635 -7.080 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -14.138 -8.229 -7.970 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -13.483 -7.061 -9.101 1.00 0.00 H new ATOM 1307 N GLU A 85 -10.198 -6.213 -7.913 1.00 0.00 N ATOM 1308 CA GLU A 85 -9.014 -5.685 -8.579 1.00 0.00 C ATOM 1309 C GLU A 85 -7.863 -5.519 -7.591 1.00 0.00 C ATOM 1310 O GLU A 85 -8.055 -5.597 -6.377 1.00 0.00 O ATOM 1311 CB GLU A 85 -9.330 -4.341 -9.240 1.00 0.00 C ATOM 1312 CG GLU A 85 -10.221 -4.461 -10.466 1.00 0.00 C ATOM 1313 CD GLU A 85 -9.507 -5.089 -11.647 1.00 0.00 C ATOM 1314 OE1 GLU A 85 -9.233 -6.306 -11.597 1.00 0.00 O ATOM 1315 OE2 GLU A 85 -9.223 -4.361 -12.622 1.00 0.00 O ATOM 0 H GLU A 85 -10.463 -5.713 -7.064 1.00 0.00 H new ATOM 0 HA GLU A 85 -8.712 -6.398 -9.347 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -9.815 -3.692 -8.511 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -8.396 -3.857 -9.526 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -11.097 -5.059 -10.216 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -10.580 -3.471 -10.748 1.00 0.00 H new ATOM 1322 N LYS A 86 -6.665 -5.290 -8.120 1.00 0.00 N ATOM 1323 CA LYS A 86 -5.482 -5.113 -7.287 1.00 0.00 C ATOM 1324 C LYS A 86 -4.328 -4.533 -8.098 1.00 0.00 C ATOM 1325 O LYS A 86 -4.245 -4.735 -9.310 1.00 0.00 O ATOM 1326 CB LYS A 86 -5.064 -6.448 -6.668 1.00 0.00 C ATOM 1327 CG LYS A 86 -4.358 -7.376 -7.642 1.00 0.00 C ATOM 1328 CD LYS A 86 -3.726 -8.558 -6.927 1.00 0.00 C ATOM 1329 CE LYS A 86 -2.573 -9.142 -7.729 1.00 0.00 C ATOM 1330 NZ LYS A 86 -2.057 -10.401 -7.122 1.00 0.00 N ATOM 0 H LYS A 86 -6.488 -5.223 -9.122 1.00 0.00 H new ATOM 0 HA LYS A 86 -5.731 -4.413 -6.490 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -4.406 -6.256 -5.821 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.949 -6.950 -6.277 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -5.071 -7.737 -8.384 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -3.589 -6.822 -8.181 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -3.366 -8.242 -5.948 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -4.479 -9.327 -6.757 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -2.903 -9.339 -8.749 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -1.767 -8.411 -7.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -1.272 -10.768 -7.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -1.718 -10.208 -6.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -2.820 -11.107 -7.086 1.00 0.00 H new ATOM 1344 N CYS A 87 -3.438 -3.814 -7.422 1.00 0.00 N ATOM 1345 CA CYS A 87 -2.288 -3.205 -8.081 1.00 0.00 C ATOM 1346 C CYS A 87 -0.989 -3.613 -7.393 1.00 0.00 C ATOM 1347 O CYS A 87 -1.006 -4.198 -6.310 1.00 0.00 O ATOM 1348 CB CYS A 87 -2.422 -1.681 -8.083 1.00 0.00 C ATOM 1349 SG CYS A 87 -2.727 -0.965 -6.451 1.00 0.00 S ATOM 0 H CYS A 87 -3.491 -3.639 -6.419 1.00 0.00 H new ATOM 0 HA CYS A 87 -2.260 -3.561 -9.111 1.00 0.00 H new ATOM 0 HB2 CYS A 87 -1.510 -1.247 -8.494 1.00 0.00 H new ATOM 0 HB3 CYS A 87 -3.237 -1.399 -8.750 1.00 0.00 H new ATOM 0 HG CYS A 87 -3.235 0.224 -6.587 1.00 0.00 H new ATOM 1355 N SER A 88 0.135 -3.300 -8.029 1.00 0.00 N ATOM 1356 CA SER A 88 1.443 -3.638 -7.481 1.00 0.00 C ATOM 1357 C SER A 88 2.449 -2.523 -7.748 1.00 0.00 C ATOM 1358 O SER A 88 2.266 -1.707 -8.652 1.00 0.00 O ATOM 1359 CB SER A 88 1.948 -4.951 -8.085 1.00 0.00 C ATOM 1360 OG SER A 88 1.940 -4.897 -9.501 1.00 0.00 O ATOM 0 H SER A 88 0.166 -2.813 -8.925 1.00 0.00 H new ATOM 0 HA SER A 88 1.338 -3.758 -6.403 1.00 0.00 H new ATOM 0 HB2 SER A 88 2.959 -5.153 -7.731 1.00 0.00 H new ATOM 0 HB3 SER A 88 1.321 -5.776 -7.746 1.00 0.00 H new ATOM 0 HG SER A 88 2.268 -5.747 -9.863 1.00 0.00 H new ATOM 1366 N THR A 89 3.514 -2.492 -6.953 1.00 0.00 N ATOM 1367 CA THR A 89 4.549 -1.477 -7.100 1.00 0.00 C ATOM 1368 C THR A 89 5.906 -2.006 -6.648 1.00 0.00 C ATOM 1369 O THR A 89 5.990 -3.038 -5.984 1.00 0.00 O ATOM 1370 CB THR A 89 4.211 -0.209 -6.294 1.00 0.00 C ATOM 1371 OG1 THR A 89 5.330 0.685 -6.295 1.00 0.00 O ATOM 1372 CG2 THR A 89 3.838 -0.561 -4.862 1.00 0.00 C ATOM 0 H THR A 89 3.682 -3.159 -6.200 1.00 0.00 H new ATOM 0 HA THR A 89 4.595 -1.224 -8.159 1.00 0.00 H new ATOM 0 HB THR A 89 3.357 0.278 -6.766 1.00 0.00 H new ATOM 0 HG1 THR A 89 5.073 1.532 -5.874 1.00 0.00 H new ATOM 0 HG21 THR A 89 3.603 0.351 -4.313 1.00 0.00 H new ATOM 0 HG22 THR A 89 2.968 -1.218 -4.864 1.00 0.00 H new ATOM 0 HG23 THR A 89 4.675 -1.069 -4.382 1.00 0.00 H new ATOM 1380 N GLU A 90 6.966 -1.291 -7.013 1.00 0.00 N ATOM 1381 CA GLU A 90 8.319 -1.690 -6.644 1.00 0.00 C ATOM 1382 C GLU A 90 8.979 -0.630 -5.767 1.00 0.00 C ATOM 1383 O GLU A 90 8.962 0.559 -6.090 1.00 0.00 O ATOM 1384 CB GLU A 90 9.164 -1.927 -7.897 1.00 0.00 C ATOM 1385 CG GLU A 90 9.130 -3.364 -8.391 1.00 0.00 C ATOM 1386 CD GLU A 90 10.231 -4.215 -7.789 1.00 0.00 C ATOM 1387 OE1 GLU A 90 10.626 -3.945 -6.635 1.00 0.00 O ATOM 1388 OE2 GLU A 90 10.698 -5.150 -8.472 1.00 0.00 O ATOM 0 H GLU A 90 6.914 -0.434 -7.563 1.00 0.00 H new ATOM 0 HA GLU A 90 8.254 -2.618 -6.076 1.00 0.00 H new ATOM 0 HB2 GLU A 90 8.812 -1.270 -8.692 1.00 0.00 H new ATOM 0 HB3 GLU A 90 10.197 -1.648 -7.687 1.00 0.00 H new ATOM 0 HG2 GLU A 90 8.163 -3.804 -8.149 1.00 0.00 H new ATOM 0 HG3 GLU A 90 9.222 -3.373 -9.477 1.00 0.00 H new ATOM 1395 N LEU A 91 9.558 -1.068 -4.655 1.00 0.00 N ATOM 1396 CA LEU A 91 10.223 -0.158 -3.729 1.00 0.00 C ATOM 1397 C LEU A 91 11.727 -0.129 -3.980 1.00 0.00 C ATOM 1398 O LEU A 91 12.375 -1.173 -4.055 1.00 0.00 O ATOM 1399 CB LEU A 91 9.944 -0.575 -2.284 1.00 0.00 C ATOM 1400 CG LEU A 91 10.559 0.310 -1.199 1.00 0.00 C ATOM 1401 CD1 LEU A 91 12.040 0.005 -1.037 1.00 0.00 C ATOM 1402 CD2 LEU A 91 10.349 1.781 -1.528 1.00 0.00 C ATOM 0 H LEU A 91 9.581 -2.048 -4.372 1.00 0.00 H new ATOM 0 HA LEU A 91 9.826 0.843 -3.895 1.00 0.00 H new ATOM 0 HB2 LEU A 91 8.864 -0.599 -2.136 1.00 0.00 H new ATOM 0 HB3 LEU A 91 10.308 -1.593 -2.144 1.00 0.00 H new ATOM 0 HG LEU A 91 10.059 0.094 -0.255 1.00 0.00 H new ATOM 0 HD11 LEU A 91 12.460 0.644 -0.261 1.00 0.00 H new ATOM 0 HD12 LEU A 91 12.168 -1.040 -0.755 1.00 0.00 H new ATOM 0 HD13 LEU A 91 12.555 0.192 -1.979 1.00 0.00 H new ATOM 0 HD21 LEU A 91 10.793 2.396 -0.745 1.00 0.00 H new ATOM 0 HD22 LEU A 91 10.822 2.011 -2.483 1.00 0.00 H new ATOM 0 HD23 LEU A 91 9.281 1.991 -1.592 1.00 0.00 H new ATOM 1414 N PHE A 92 12.278 1.074 -4.107 1.00 0.00 N ATOM 1415 CA PHE A 92 13.706 1.240 -4.349 1.00 0.00 C ATOM 1416 C PHE A 92 14.344 2.103 -3.265 1.00 0.00 C ATOM 1417 O PHE A 92 14.306 3.332 -3.331 1.00 0.00 O ATOM 1418 CB PHE A 92 13.943 1.870 -5.723 1.00 0.00 C ATOM 1419 CG PHE A 92 13.796 0.899 -6.860 1.00 0.00 C ATOM 1420 CD1 PHE A 92 14.806 -0.003 -7.154 1.00 0.00 C ATOM 1421 CD2 PHE A 92 12.647 0.889 -7.635 1.00 0.00 C ATOM 1422 CE1 PHE A 92 14.673 -0.896 -8.200 1.00 0.00 C ATOM 1423 CE2 PHE A 92 12.509 -0.002 -8.683 1.00 0.00 C ATOM 1424 CZ PHE A 92 13.523 -0.897 -8.965 1.00 0.00 C ATOM 0 H PHE A 92 11.756 1.948 -4.046 1.00 0.00 H new ATOM 0 HA PHE A 92 14.170 0.254 -4.325 1.00 0.00 H new ATOM 0 HB2 PHE A 92 13.240 2.691 -5.864 1.00 0.00 H new ATOM 0 HB3 PHE A 92 14.944 2.299 -5.749 1.00 0.00 H new ATOM 0 HD1 PHE A 92 15.707 -0.008 -6.559 1.00 0.00 H new ATOM 0 HD2 PHE A 92 11.850 1.585 -7.418 1.00 0.00 H new ATOM 0 HE1 PHE A 92 15.468 -1.593 -8.419 1.00 0.00 H new ATOM 0 HE2 PHE A 92 11.609 0.002 -9.281 1.00 0.00 H new ATOM 0 HZ PHE A 92 13.417 -1.596 -9.782 1.00 0.00 H new ATOM 1434 N VAL A 93 14.932 1.451 -2.267 1.00 0.00 N ATOM 1435 CA VAL A 93 15.579 2.157 -1.168 1.00 0.00 C ATOM 1436 C VAL A 93 17.078 2.294 -1.410 1.00 0.00 C ATOM 1437 O VAL A 93 17.782 1.299 -1.584 1.00 0.00 O ATOM 1438 CB VAL A 93 15.351 1.438 0.175 1.00 0.00 C ATOM 1439 CG1 VAL A 93 15.621 -0.053 0.035 1.00 0.00 C ATOM 1440 CG2 VAL A 93 16.224 2.047 1.261 1.00 0.00 C ATOM 0 H VAL A 93 14.973 0.434 -2.197 1.00 0.00 H new ATOM 0 HA VAL A 93 15.128 3.148 -1.121 1.00 0.00 H new ATOM 0 HB VAL A 93 14.308 1.568 0.464 1.00 0.00 H new ATOM 0 HG11 VAL A 93 15.455 -0.544 0.994 1.00 0.00 H new ATOM 0 HG12 VAL A 93 14.948 -0.476 -0.711 1.00 0.00 H new ATOM 0 HG13 VAL A 93 16.654 -0.208 -0.278 1.00 0.00 H new ATOM 0 HG21 VAL A 93 16.050 1.526 2.203 1.00 0.00 H new ATOM 0 HG22 VAL A 93 17.273 1.950 0.982 1.00 0.00 H new ATOM 0 HG23 VAL A 93 15.976 3.102 1.378 1.00 0.00 H new ATOM 1450 N ARG A 94 17.560 3.532 -1.419 1.00 0.00 N ATOM 1451 CA ARG A 94 18.976 3.799 -1.640 1.00 0.00 C ATOM 1452 C ARG A 94 19.770 3.631 -0.348 1.00 0.00 C ATOM 1453 O ARG A 94 19.253 3.864 0.745 1.00 0.00 O ATOM 1454 CB ARG A 94 19.171 5.214 -2.190 1.00 0.00 C ATOM 1455 CG ARG A 94 18.352 5.501 -3.437 1.00 0.00 C ATOM 1456 CD ARG A 94 18.691 6.861 -4.026 1.00 0.00 C ATOM 1457 NE ARG A 94 20.104 6.967 -4.381 1.00 0.00 N ATOM 1458 CZ ARG A 94 21.053 7.317 -3.521 1.00 0.00 C ATOM 1459 NH1 ARG A 94 20.743 7.592 -2.261 1.00 0.00 N ATOM 1460 NH2 ARG A 94 22.317 7.391 -3.919 1.00 0.00 N ATOM 0 H ARG A 94 16.991 4.366 -1.276 1.00 0.00 H new ATOM 0 HA ARG A 94 19.345 3.078 -2.370 1.00 0.00 H new ATOM 0 HB2 ARG A 94 18.905 5.935 -1.417 1.00 0.00 H new ATOM 0 HB3 ARG A 94 20.227 5.364 -2.416 1.00 0.00 H new ATOM 0 HG2 ARG A 94 18.536 4.725 -4.181 1.00 0.00 H new ATOM 0 HG3 ARG A 94 17.290 5.464 -3.193 1.00 0.00 H new ATOM 0 HD2 ARG A 94 18.081 7.035 -4.912 1.00 0.00 H new ATOM 0 HD3 ARG A 94 18.438 7.641 -3.307 1.00 0.00 H new ATOM 0 HE ARG A 94 20.376 6.761 -5.342 1.00 0.00 H new ATOM 0 HH11 ARG A 94 19.773 7.535 -1.950 1.00 0.00 H new ATOM 0 HH12 ARG A 94 21.474 7.861 -1.603 1.00 0.00 H new ATOM 0 HH21 ARG A 94 22.560 7.179 -4.887 1.00 0.00 H new ATOM 0 HH22 ARG A 94 23.045 7.660 -3.257 1.00 0.00 H new ATOM 1474 N SER A 95 21.028 3.224 -0.481 1.00 0.00 N ATOM 1475 CA SER A 95 21.892 3.020 0.676 1.00 0.00 C ATOM 1476 C SER A 95 23.266 3.642 0.445 1.00 0.00 C ATOM 1477 O SER A 95 24.210 2.959 0.050 1.00 0.00 O ATOM 1478 CB SER A 95 22.040 1.526 0.971 1.00 0.00 C ATOM 1479 OG SER A 95 22.919 1.306 2.060 1.00 0.00 O ATOM 0 H SER A 95 21.472 3.029 -1.378 1.00 0.00 H new ATOM 0 HA SER A 95 21.430 3.509 1.534 1.00 0.00 H new ATOM 0 HB2 SER A 95 21.063 1.098 1.196 1.00 0.00 H new ATOM 0 HB3 SER A 95 22.417 1.013 0.086 1.00 0.00 H new ATOM 0 HG SER A 95 22.995 0.344 2.229 1.00 0.00 H new ATOM 1485 N GLY A 96 23.368 4.944 0.694 1.00 0.00 N ATOM 1486 CA GLY A 96 24.629 5.638 0.508 1.00 0.00 C ATOM 1487 C GLY A 96 25.207 6.150 1.812 1.00 0.00 C ATOM 1488 O GLY A 96 24.492 6.658 2.676 1.00 0.00 O ATOM 0 H GLY A 96 22.600 5.530 1.021 1.00 0.00 H new ATOM 0 HA2 GLY A 96 25.345 4.964 0.037 1.00 0.00 H new ATOM 0 HA3 GLY A 96 24.482 6.475 -0.174 1.00 0.00 H new ATOM 1492 N PRO A 97 26.533 6.017 1.970 1.00 0.00 N ATOM 1493 CA PRO A 97 27.235 6.463 3.176 1.00 0.00 C ATOM 1494 C PRO A 97 27.276 7.983 3.295 1.00 0.00 C ATOM 1495 O PRO A 97 26.928 8.544 4.334 1.00 0.00 O ATOM 1496 CB PRO A 97 28.648 5.904 2.991 1.00 0.00 C ATOM 1497 CG PRO A 97 28.810 5.763 1.517 1.00 0.00 C ATOM 1498 CD PRO A 97 27.447 5.420 0.982 1.00 0.00 C ATOM 0 HA PRO A 97 26.741 6.120 4.085 1.00 0.00 H new ATOM 0 HB2 PRO A 97 29.397 6.576 3.409 1.00 0.00 H new ATOM 0 HB3 PRO A 97 28.763 4.945 3.495 1.00 0.00 H new ATOM 0 HG2 PRO A 97 29.182 6.687 1.075 1.00 0.00 H new ATOM 0 HG3 PRO A 97 29.532 4.982 1.277 1.00 0.00 H new ATOM 0 HD2 PRO A 97 27.290 5.835 -0.013 1.00 0.00 H new ATOM 0 HD3 PRO A 97 27.306 4.342 0.904 1.00 0.00 H new ATOM 1506 N SER A 98 27.701 8.645 2.223 1.00 0.00 N ATOM 1507 CA SER A 98 27.789 10.100 2.208 1.00 0.00 C ATOM 1508 C SER A 98 28.222 10.632 3.572 1.00 0.00 C ATOM 1509 O SER A 98 27.724 11.657 4.036 1.00 0.00 O ATOM 1510 CB SER A 98 26.443 10.710 1.814 1.00 0.00 C ATOM 1511 OG SER A 98 25.465 10.475 2.811 1.00 0.00 O ATOM 0 H SER A 98 27.990 8.196 1.354 1.00 0.00 H new ATOM 0 HA SER A 98 28.539 10.386 1.470 1.00 0.00 H new ATOM 0 HB2 SER A 98 26.558 11.783 1.659 1.00 0.00 H new ATOM 0 HB3 SER A 98 26.111 10.285 0.867 1.00 0.00 H new ATOM 0 HG SER A 98 24.614 10.876 2.536 1.00 0.00 H new ATOM 1517 N SER A 99 29.151 9.926 4.208 1.00 0.00 N ATOM 1518 CA SER A 99 29.649 10.323 5.520 1.00 0.00 C ATOM 1519 C SER A 99 31.105 10.771 5.436 1.00 0.00 C ATOM 1520 O SER A 99 31.683 11.228 6.420 1.00 0.00 O ATOM 1521 CB SER A 99 29.515 9.166 6.511 1.00 0.00 C ATOM 1522 OG SER A 99 30.352 8.082 6.146 1.00 0.00 O ATOM 0 H SER A 99 29.574 9.076 3.836 1.00 0.00 H new ATOM 0 HA SER A 99 29.049 11.163 5.870 1.00 0.00 H new ATOM 0 HB2 SER A 99 29.775 9.509 7.512 1.00 0.00 H new ATOM 0 HB3 SER A 99 28.478 8.833 6.547 1.00 0.00 H new ATOM 0 HG SER A 99 30.249 7.356 6.796 1.00 0.00 H new ATOM 1528 N GLY A 100 31.692 10.635 4.250 1.00 0.00 N ATOM 1529 CA GLY A 100 33.075 11.029 4.058 1.00 0.00 C ATOM 1530 C GLY A 100 34.036 9.866 4.211 1.00 0.00 C ATOM 1531 O GLY A 100 33.918 8.860 3.512 1.00 0.00 O ATOM 0 H GLY A 100 31.234 10.259 3.420 1.00 0.00 H new ATOM 0 HA2 GLY A 100 33.191 11.464 3.065 1.00 0.00 H new ATOM 0 HA3 GLY A 100 33.332 11.806 4.778 1.00 0.00 H new TER 1535 GLY A 100