USER MOD reduce.3.24.130724 H: found=0, std=0, add=1006, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 1000 hydrogens (45 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -125:sc= 0.0637 (180deg=-0.468) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.0635 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 HIS : no HD1:sc= -0.0173 X(o=-0.017,f=-0.25) USER MOD Single : A 39 THR OG1 : rot 113:sc= 0.879 USER MOD Single : A 49 ASN : amide:sc= -0.936 X(o=-0.94,f=-0.69) USER MOD Single : A 54 GLN : amide:sc= -3.59! C(o=-3.6!,f=-5.9!) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= -0.0104 X(o=-0.01,f=0) USER MOD Single : A 72 HIS : no HE2:sc= -1.94! C(o=-1.9!,f=-2.6!) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -3.83! C(o=-3.8!,f=-1.8!) USER MOD Single : A 92 HIS : no HE2:sc= -3.05! C(o=-3.1!,f=-4.8!) USER MOD Single : A 99 GLN : amide:sc= -4.18! C(o=-4.2!,f=-11!) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot -34:sc= 0.58 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 113 ASN : amide:sc= 0.0317 X(o=0.032,f=-0.28) USER MOD Single : A 121 THR OG1 : rot 73:sc= 0.43! USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 77.191 24.284 -22.085 1.00 1.00 N ATOM 2 CA MET A 1 77.593 22.864 -22.294 1.00 1.00 C ATOM 3 C MET A 1 76.374 21.961 -22.111 1.00 1.00 C ATOM 4 O MET A 1 75.342 22.390 -21.600 1.00 1.00 O ATOM 5 CB MET A 1 78.682 22.492 -21.284 1.00 1.00 C ATOM 6 CG MET A 1 79.964 23.269 -21.601 1.00 1.00 C ATOM 7 SD MET A 1 81.218 22.897 -20.350 1.00 1.00 S ATOM 8 CE MET A 1 82.391 24.202 -20.793 1.00 1.00 C ATOM 0 H1 MET A 1 77.458 24.847 -22.918 1.00 1.00 H new ATOM 0 H2 MET A 1 76.161 24.337 -21.947 1.00 1.00 H new ATOM 0 H3 MET A 1 77.672 24.661 -21.244 1.00 1.00 H new ATOM 0 HA MET A 1 77.984 22.734 -23.303 1.00 1.00 H new ATOM 0 HB2 MET A 1 78.347 22.720 -20.272 1.00 1.00 H new ATOM 0 HB3 MET A 1 78.876 21.420 -21.321 1.00 1.00 H new ATOM 0 HG2 MET A 1 80.331 22.998 -22.591 1.00 1.00 H new ATOM 0 HG3 MET A 1 79.759 24.339 -21.619 1.00 1.00 H new ATOM 0 HE1 MET A 1 83.257 24.153 -20.132 1.00 1.00 H new ATOM 0 HE2 MET A 1 82.714 24.066 -21.825 1.00 1.00 H new ATOM 0 HE3 MET A 1 81.910 25.174 -20.689 1.00 1.00 H new ATOM 18 N SER A 2 76.504 20.705 -22.542 1.00 1.00 N ATOM 19 CA SER A 2 75.419 19.723 -22.440 1.00 1.00 C ATOM 20 C SER A 2 75.679 18.745 -21.292 1.00 1.00 C ATOM 21 O SER A 2 74.944 17.777 -21.117 1.00 1.00 O ATOM 22 CB SER A 2 75.304 18.948 -23.755 1.00 1.00 C ATOM 23 OG SER A 2 76.513 18.238 -23.989 1.00 1.00 O ATOM 0 H SER A 2 77.356 20.340 -22.968 1.00 1.00 H new ATOM 0 HA SER A 2 74.488 20.254 -22.241 1.00 1.00 H new ATOM 0 HB2 SER A 2 74.464 18.254 -23.709 1.00 1.00 H new ATOM 0 HB3 SER A 2 75.106 19.634 -24.579 1.00 1.00 H new ATOM 0 HG SER A 2 76.442 17.739 -24.830 1.00 1.00 H new ATOM 29 N ASP A 3 76.714 19.029 -20.503 1.00 1.00 N ATOM 30 CA ASP A 3 77.063 18.187 -19.355 1.00 1.00 C ATOM 31 C ASP A 3 78.444 18.556 -18.825 1.00 1.00 C ATOM 32 O ASP A 3 79.464 18.125 -19.366 1.00 1.00 O ATOM 33 CB ASP A 3 77.037 16.697 -19.743 1.00 1.00 C ATOM 34 CG ASP A 3 77.575 16.518 -21.157 1.00 1.00 C ATOM 35 OD1 ASP A 3 78.198 17.442 -21.654 1.00 1.00 O ATOM 36 OD2 ASP A 3 77.358 15.458 -21.723 1.00 1.00 O ATOM 0 H ASP A 3 77.326 19.834 -20.636 1.00 1.00 H new ATOM 0 HA ASP A 3 76.323 18.359 -18.573 1.00 1.00 H new ATOM 0 HB2 ASP A 3 77.638 16.119 -19.041 1.00 1.00 H new ATOM 0 HB3 ASP A 3 76.018 16.314 -19.681 1.00 1.00 H new ATOM 41 N PHE A 4 78.471 19.340 -17.752 1.00 1.00 N ATOM 42 CA PHE A 4 79.735 19.748 -17.146 1.00 1.00 C ATOM 43 C PHE A 4 79.551 19.966 -15.653 1.00 1.00 C ATOM 44 O PHE A 4 78.493 20.414 -15.208 1.00 1.00 O ATOM 45 CB PHE A 4 80.243 21.040 -17.797 1.00 1.00 C ATOM 46 CG PHE A 4 81.730 21.170 -17.560 1.00 1.00 C ATOM 47 CD1 PHE A 4 82.212 21.805 -16.408 1.00 1.00 C ATOM 48 CD2 PHE A 4 82.627 20.642 -18.495 1.00 1.00 C ATOM 49 CE1 PHE A 4 83.592 21.913 -16.196 1.00 1.00 C ATOM 50 CE2 PHE A 4 84.005 20.750 -18.283 1.00 1.00 C ATOM 51 CZ PHE A 4 84.489 21.387 -17.133 1.00 1.00 C ATOM 0 H PHE A 4 77.639 19.704 -17.287 1.00 1.00 H new ATOM 0 HA PHE A 4 80.468 18.958 -17.306 1.00 1.00 H new ATOM 0 HB2 PHE A 4 80.034 21.028 -18.867 1.00 1.00 H new ATOM 0 HB3 PHE A 4 79.720 21.901 -17.380 1.00 1.00 H new ATOM 0 HD1 PHE A 4 81.520 22.211 -15.685 1.00 1.00 H new ATOM 0 HD2 PHE A 4 82.255 20.150 -19.382 1.00 1.00 H new ATOM 0 HE1 PHE A 4 83.965 22.403 -15.308 1.00 1.00 H new ATOM 0 HE2 PHE A 4 84.696 20.342 -19.006 1.00 1.00 H new ATOM 0 HZ PHE A 4 85.553 21.472 -16.970 1.00 1.00 H new ATOM 61 N ASP A 5 80.583 19.651 -14.880 1.00 1.00 N ATOM 62 CA ASP A 5 80.519 19.826 -13.438 1.00 1.00 C ATOM 63 C ASP A 5 81.937 19.944 -12.863 1.00 1.00 C ATOM 64 O ASP A 5 82.901 19.460 -13.454 1.00 1.00 O ATOM 65 CB ASP A 5 79.737 18.654 -12.811 1.00 1.00 C ATOM 66 CG ASP A 5 80.652 17.480 -12.505 1.00 1.00 C ATOM 67 OD1 ASP A 5 81.339 17.557 -11.511 1.00 1.00 O ATOM 68 OD2 ASP A 5 80.647 16.525 -13.265 1.00 1.00 O ATOM 0 H ASP A 5 81.467 19.276 -15.225 1.00 1.00 H new ATOM 0 HA ASP A 5 79.990 20.748 -13.196 1.00 1.00 H new ATOM 0 HB2 ASP A 5 79.251 18.988 -11.894 1.00 1.00 H new ATOM 0 HB3 ASP A 5 78.948 18.335 -13.492 1.00 1.00 H new ATOM 73 N THR A 6 82.053 20.625 -11.729 1.00 1.00 N ATOM 74 CA THR A 6 83.363 20.842 -11.102 1.00 1.00 C ATOM 75 C THR A 6 83.885 19.569 -10.414 1.00 1.00 C ATOM 76 O THR A 6 83.219 18.556 -10.397 1.00 1.00 O ATOM 77 CB THR A 6 83.269 22.005 -10.085 1.00 1.00 C ATOM 78 OG1 THR A 6 82.127 22.801 -10.383 1.00 1.00 O ATOM 79 CG2 THR A 6 84.519 22.891 -10.146 1.00 1.00 C ATOM 0 H THR A 6 81.267 21.035 -11.224 1.00 1.00 H new ATOM 0 HA THR A 6 84.074 21.101 -11.887 1.00 1.00 H new ATOM 0 HB THR A 6 83.188 21.579 -9.085 1.00 1.00 H new ATOM 0 HG1 THR A 6 82.064 23.537 -9.739 1.00 1.00 H new ATOM 0 HG21 THR A 6 84.427 23.700 -9.422 1.00 1.00 H new ATOM 0 HG22 THR A 6 85.400 22.293 -9.913 1.00 1.00 H new ATOM 0 HG23 THR A 6 84.619 23.310 -11.147 1.00 1.00 H new ATOM 87 N GLU A 7 85.111 19.653 -9.894 1.00 1.00 N ATOM 88 CA GLU A 7 85.786 18.524 -9.219 1.00 1.00 C ATOM 89 C GLU A 7 84.944 18.050 -8.029 1.00 1.00 C ATOM 90 O GLU A 7 84.598 16.878 -7.915 1.00 1.00 O ATOM 91 CB GLU A 7 87.197 18.982 -8.729 1.00 1.00 C ATOM 92 CG GLU A 7 87.315 20.513 -8.800 1.00 1.00 C ATOM 93 CD GLU A 7 88.591 20.976 -8.105 1.00 1.00 C ATOM 94 OE1 GLU A 7 88.984 20.338 -7.142 1.00 1.00 O ATOM 95 OE2 GLU A 7 89.158 21.965 -8.545 1.00 1.00 O ATOM 0 H GLU A 7 85.672 20.504 -9.925 1.00 1.00 H new ATOM 0 HA GLU A 7 85.900 17.697 -9.920 1.00 1.00 H new ATOM 0 HB2 GLU A 7 87.361 18.645 -7.706 1.00 1.00 H new ATOM 0 HB3 GLU A 7 87.970 18.522 -9.344 1.00 1.00 H new ATOM 0 HG2 GLU A 7 87.321 20.837 -9.841 1.00 1.00 H new ATOM 0 HG3 GLU A 7 86.447 20.974 -8.328 1.00 1.00 H new ATOM 102 N ARG A 8 84.663 18.985 -7.144 1.00 1.00 N ATOM 103 CA ARG A 8 83.898 18.636 -5.939 1.00 1.00 C ATOM 104 C ARG A 8 82.672 17.847 -6.419 1.00 1.00 C ATOM 105 O ARG A 8 82.393 16.727 -6.007 1.00 1.00 O ATOM 106 CB ARG A 8 83.408 19.907 -5.188 1.00 1.00 C ATOM 107 CG ARG A 8 84.037 21.177 -5.776 1.00 1.00 C ATOM 108 CD ARG A 8 83.337 22.395 -5.175 1.00 1.00 C ATOM 109 NE ARG A 8 81.958 22.473 -5.674 1.00 1.00 N ATOM 110 CZ ARG A 8 81.552 23.419 -6.531 1.00 1.00 C ATOM 111 NH1 ARG A 8 82.376 24.335 -6.967 1.00 1.00 N ATOM 112 NH2 ARG A 8 80.316 23.417 -6.950 1.00 1.00 N ATOM 0 H ARG A 8 84.937 19.965 -7.220 1.00 1.00 H new ATOM 0 HA ARG A 8 84.524 18.065 -5.253 1.00 1.00 H new ATOM 0 HB2 ARG A 8 82.322 19.973 -5.251 1.00 1.00 H new ATOM 0 HB3 ARG A 8 83.662 19.828 -4.131 1.00 1.00 H new ATOM 0 HG2 ARG A 8 85.104 21.207 -5.555 1.00 1.00 H new ATOM 0 HG3 ARG A 8 83.936 21.181 -6.861 1.00 1.00 H new ATOM 0 HD2 ARG A 8 83.336 22.326 -4.087 1.00 1.00 H new ATOM 0 HD3 ARG A 8 83.880 23.303 -5.436 1.00 1.00 H new ATOM 0 HE ARG A 8 81.282 21.779 -5.355 1.00 1.00 H new ATOM 0 HH11 ARG A 8 83.347 24.338 -6.655 1.00 1.00 H new ATOM 0 HH12 ARG A 8 82.048 25.047 -7.619 1.00 1.00 H new ATOM 0 HH21 ARG A 8 79.668 22.699 -6.625 1.00 1.00 H new ATOM 0 HH22 ARG A 8 79.998 24.133 -7.603 1.00 1.00 H new ATOM 126 N VAL A 9 81.991 18.506 -7.309 1.00 1.00 N ATOM 127 CA VAL A 9 80.788 17.941 -7.890 1.00 1.00 C ATOM 128 C VAL A 9 81.155 16.677 -8.678 1.00 1.00 C ATOM 129 O VAL A 9 80.486 15.698 -8.550 1.00 1.00 O ATOM 130 CB VAL A 9 80.021 18.952 -8.761 1.00 1.00 C ATOM 131 CG1 VAL A 9 78.518 18.609 -8.731 1.00 1.00 C ATOM 132 CG2 VAL A 9 80.235 20.365 -8.214 1.00 1.00 C ATOM 0 H VAL A 9 82.239 19.433 -7.654 1.00 1.00 H new ATOM 0 HA VAL A 9 80.108 17.676 -7.080 1.00 1.00 H new ATOM 0 HB VAL A 9 80.387 18.904 -9.787 1.00 1.00 H new ATOM 0 HG11 VAL A 9 77.970 19.322 -9.346 1.00 1.00 H new ATOM 0 HG12 VAL A 9 78.367 17.602 -9.120 1.00 1.00 H new ATOM 0 HG13 VAL A 9 78.154 18.660 -7.705 1.00 1.00 H new ATOM 0 HG21 VAL A 9 79.692 21.080 -8.831 1.00 1.00 H new ATOM 0 HG22 VAL A 9 79.868 20.418 -7.189 1.00 1.00 H new ATOM 0 HG23 VAL A 9 81.298 20.605 -8.231 1.00 1.00 H new ATOM 142 N SER A 10 82.204 16.737 -9.503 1.00 1.00 N ATOM 143 CA SER A 10 82.587 15.557 -10.323 1.00 1.00 C ATOM 144 C SER A 10 83.158 14.412 -9.479 1.00 1.00 C ATOM 145 O SER A 10 82.620 13.324 -9.499 1.00 1.00 O ATOM 146 CB SER A 10 83.612 15.897 -11.418 1.00 1.00 C ATOM 147 OG SER A 10 84.221 14.687 -11.855 1.00 1.00 O ATOM 0 H SER A 10 82.795 17.559 -9.628 1.00 1.00 H new ATOM 0 HA SER A 10 81.655 15.238 -10.788 1.00 1.00 H new ATOM 0 HB2 SER A 10 83.123 16.398 -12.253 1.00 1.00 H new ATOM 0 HB3 SER A 10 84.366 16.583 -11.032 1.00 1.00 H new ATOM 0 HG SER A 10 84.877 14.885 -12.555 1.00 1.00 H new ATOM 153 N ARG A 11 84.293 14.630 -8.815 1.00 1.00 N ATOM 154 CA ARG A 11 84.938 13.544 -8.047 1.00 1.00 C ATOM 155 C ARG A 11 84.045 13.089 -6.892 1.00 1.00 C ATOM 156 O ARG A 11 83.733 11.913 -6.759 1.00 1.00 O ATOM 157 CB ARG A 11 86.308 14.030 -7.513 1.00 1.00 C ATOM 158 CG ARG A 11 87.436 13.608 -8.477 1.00 1.00 C ATOM 159 CD ARG A 11 87.873 12.164 -8.158 1.00 1.00 C ATOM 160 NE ARG A 11 88.446 11.523 -9.336 1.00 1.00 N ATOM 161 CZ ARG A 11 89.705 11.734 -9.703 1.00 1.00 C ATOM 162 NH1 ARG A 11 90.470 12.533 -9.011 1.00 1.00 N ATOM 163 NH2 ARG A 11 90.177 11.130 -10.757 1.00 1.00 N ATOM 0 H ARG A 11 84.782 15.524 -8.787 1.00 1.00 H new ATOM 0 HA ARG A 11 85.092 12.690 -8.707 1.00 1.00 H new ATOM 0 HB2 ARG A 11 86.300 15.114 -7.404 1.00 1.00 H new ATOM 0 HB3 ARG A 11 86.490 13.611 -6.523 1.00 1.00 H new ATOM 0 HG2 ARG A 11 87.091 13.675 -9.509 1.00 1.00 H new ATOM 0 HG3 ARG A 11 88.284 14.286 -8.380 1.00 1.00 H new ATOM 0 HD2 ARG A 11 88.605 12.171 -7.350 1.00 1.00 H new ATOM 0 HD3 ARG A 11 87.016 11.589 -7.807 1.00 1.00 H new ATOM 0 HE ARG A 11 87.865 10.896 -9.893 1.00 1.00 H new ATOM 0 HH11 ARG A 11 90.102 13.000 -8.182 1.00 1.00 H new ATOM 0 HH12 ARG A 11 91.436 12.690 -9.299 1.00 1.00 H new ATOM 0 HH21 ARG A 11 89.581 10.500 -11.294 1.00 1.00 H new ATOM 0 HH22 ARG A 11 91.143 11.287 -11.045 1.00 1.00 H new ATOM 177 N ALA A 12 83.666 14.032 -6.059 1.00 1.00 N ATOM 178 CA ALA A 12 82.833 13.660 -4.916 1.00 1.00 C ATOM 179 C ALA A 12 81.656 12.844 -5.484 1.00 1.00 C ATOM 180 O ALA A 12 81.399 11.725 -5.062 1.00 1.00 O ATOM 181 CB ALA A 12 82.364 14.884 -4.122 1.00 1.00 C ATOM 0 H ALA A 12 83.903 15.021 -6.135 1.00 1.00 H new ATOM 0 HA ALA A 12 83.400 13.066 -4.199 1.00 1.00 H new ATOM 0 HB1 ALA A 12 81.749 14.559 -3.283 1.00 1.00 H new ATOM 0 HB2 ALA A 12 83.231 15.428 -3.747 1.00 1.00 H new ATOM 0 HB3 ALA A 12 81.779 15.536 -4.770 1.00 1.00 H new ATOM 187 N VAL A 13 81.008 13.402 -6.497 1.00 1.00 N ATOM 188 CA VAL A 13 79.912 12.663 -7.151 1.00 1.00 C ATOM 189 C VAL A 13 80.461 11.364 -7.734 1.00 1.00 C ATOM 190 O VAL A 13 79.943 10.323 -7.448 1.00 1.00 O ATOM 191 CB VAL A 13 79.214 13.480 -8.263 1.00 1.00 C ATOM 192 CG1 VAL A 13 78.448 12.584 -9.248 1.00 1.00 C ATOM 193 CG2 VAL A 13 78.214 14.444 -7.615 1.00 1.00 C ATOM 0 H VAL A 13 81.203 14.327 -6.880 1.00 1.00 H new ATOM 0 HA VAL A 13 79.159 12.457 -6.391 1.00 1.00 H new ATOM 0 HB VAL A 13 79.987 14.013 -8.816 1.00 1.00 H new ATOM 0 HG11 VAL A 13 77.975 13.203 -10.010 1.00 1.00 H new ATOM 0 HG12 VAL A 13 79.141 11.890 -9.723 1.00 1.00 H new ATOM 0 HG13 VAL A 13 77.684 12.023 -8.710 1.00 1.00 H new ATOM 0 HG21 VAL A 13 77.715 15.026 -8.390 1.00 1.00 H new ATOM 0 HG22 VAL A 13 77.472 13.876 -7.054 1.00 1.00 H new ATOM 0 HG23 VAL A 13 78.743 15.117 -6.940 1.00 1.00 H new ATOM 203 N ALA A 14 81.519 11.414 -8.529 1.00 1.00 N ATOM 204 CA ALA A 14 82.034 10.159 -9.099 1.00 1.00 C ATOM 205 C ALA A 14 82.407 9.188 -7.983 1.00 1.00 C ATOM 206 O ALA A 14 81.860 8.112 -7.904 1.00 1.00 O ATOM 207 CB ALA A 14 83.261 10.413 -9.977 1.00 1.00 C ATOM 0 H ALA A 14 82.024 12.261 -8.790 1.00 1.00 H new ATOM 0 HA ALA A 14 81.246 9.726 -9.716 1.00 1.00 H new ATOM 0 HB1 ALA A 14 83.619 9.467 -10.384 1.00 1.00 H new ATOM 0 HB2 ALA A 14 82.991 11.081 -10.795 1.00 1.00 H new ATOM 0 HB3 ALA A 14 84.048 10.872 -9.378 1.00 1.00 H new ATOM 213 N ALA A 15 83.364 9.569 -7.154 1.00 1.00 N ATOM 214 CA ALA A 15 83.817 8.684 -6.072 1.00 1.00 C ATOM 215 C ALA A 15 82.616 8.208 -5.249 1.00 1.00 C ATOM 216 O ALA A 15 82.391 7.015 -5.058 1.00 1.00 O ATOM 217 CB ALA A 15 84.767 9.453 -5.148 1.00 1.00 C ATOM 0 H ALA A 15 83.842 10.469 -7.200 1.00 1.00 H new ATOM 0 HA ALA A 15 84.328 7.826 -6.509 1.00 1.00 H new ATOM 0 HB1 ALA A 15 85.104 8.797 -4.345 1.00 1.00 H new ATOM 0 HB2 ALA A 15 85.629 9.799 -5.719 1.00 1.00 H new ATOM 0 HB3 ALA A 15 84.246 10.310 -4.722 1.00 1.00 H new ATOM 223 N ALA A 16 81.878 9.174 -4.759 1.00 1.00 N ATOM 224 CA ALA A 16 80.707 8.865 -3.939 1.00 1.00 C ATOM 225 C ALA A 16 79.704 8.050 -4.779 1.00 1.00 C ATOM 226 O ALA A 16 79.247 6.976 -4.387 1.00 1.00 O ATOM 227 CB ALA A 16 80.059 10.167 -3.429 1.00 1.00 C ATOM 0 H ALA A 16 82.054 10.168 -4.904 1.00 1.00 H new ATOM 0 HA ALA A 16 81.009 8.276 -3.073 1.00 1.00 H new ATOM 0 HB1 ALA A 16 79.188 9.926 -2.820 1.00 1.00 H new ATOM 0 HB2 ALA A 16 80.780 10.721 -2.828 1.00 1.00 H new ATOM 0 HB3 ALA A 16 79.750 10.776 -4.278 1.00 1.00 H new ATOM 233 N LEU A 17 79.358 8.630 -5.915 1.00 1.00 N ATOM 234 CA LEU A 17 78.361 7.988 -6.804 1.00 1.00 C ATOM 235 C LEU A 17 78.851 6.591 -7.187 1.00 1.00 C ATOM 236 O LEU A 17 78.136 5.612 -6.994 1.00 1.00 O ATOM 237 CB LEU A 17 78.039 8.800 -8.072 1.00 1.00 C ATOM 238 CG LEU A 17 76.862 8.154 -8.856 1.00 1.00 C ATOM 239 CD1 LEU A 17 75.938 9.245 -9.415 1.00 1.00 C ATOM 240 CD2 LEU A 17 77.405 7.327 -10.031 1.00 1.00 C ATOM 0 H LEU A 17 79.730 9.518 -6.251 1.00 1.00 H new ATOM 0 HA LEU A 17 77.430 7.932 -6.241 1.00 1.00 H new ATOM 0 HB2 LEU A 17 77.782 9.823 -7.799 1.00 1.00 H new ATOM 0 HB3 LEU A 17 78.921 8.853 -8.710 1.00 1.00 H new ATOM 0 HG LEU A 17 76.306 7.512 -8.173 1.00 1.00 H new ATOM 0 HD11 LEU A 17 75.117 8.781 -9.962 1.00 1.00 H new ATOM 0 HD12 LEU A 17 75.537 9.838 -8.593 1.00 1.00 H new ATOM 0 HD13 LEU A 17 76.503 9.891 -10.087 1.00 1.00 H new ATOM 0 HD21 LEU A 17 76.574 6.878 -10.575 1.00 1.00 H new ATOM 0 HD22 LEU A 17 77.970 7.975 -10.702 1.00 1.00 H new ATOM 0 HD23 LEU A 17 78.057 6.541 -9.652 1.00 1.00 H new ATOM 252 N VAL A 18 80.066 6.489 -7.717 1.00 1.00 N ATOM 253 CA VAL A 18 80.582 5.165 -8.077 1.00 1.00 C ATOM 254 C VAL A 18 80.848 4.358 -6.795 1.00 1.00 C ATOM 255 O VAL A 18 80.336 3.250 -6.635 1.00 1.00 O ATOM 256 CB VAL A 18 81.857 5.250 -8.979 1.00 1.00 C ATOM 257 CG1 VAL A 18 81.687 6.342 -10.075 1.00 1.00 C ATOM 258 CG2 VAL A 18 83.129 5.537 -8.149 1.00 1.00 C ATOM 0 H VAL A 18 80.694 7.271 -7.903 1.00 1.00 H new ATOM 0 HA VAL A 18 79.827 4.652 -8.673 1.00 1.00 H new ATOM 0 HB VAL A 18 81.975 4.278 -9.457 1.00 1.00 H new ATOM 0 HG11 VAL A 18 82.586 6.383 -10.690 1.00 1.00 H new ATOM 0 HG12 VAL A 18 80.829 6.098 -10.702 1.00 1.00 H new ATOM 0 HG13 VAL A 18 81.527 7.311 -9.602 1.00 1.00 H new ATOM 0 HG21 VAL A 18 83.992 5.588 -8.812 1.00 1.00 H new ATOM 0 HG22 VAL A 18 83.016 6.487 -7.626 1.00 1.00 H new ATOM 0 HG23 VAL A 18 83.277 4.738 -7.422 1.00 1.00 H new ATOM 268 N GLY A 19 81.677 4.903 -5.903 1.00 1.00 N ATOM 269 CA GLY A 19 82.053 4.231 -4.661 1.00 1.00 C ATOM 270 C GLY A 19 80.881 4.067 -3.685 1.00 1.00 C ATOM 271 O GLY A 19 79.720 4.100 -4.091 1.00 1.00 O ATOM 0 H GLY A 19 82.105 5.821 -6.022 1.00 1.00 H new ATOM 0 HA2 GLY A 19 82.462 3.248 -4.896 1.00 1.00 H new ATOM 0 HA3 GLY A 19 82.846 4.798 -4.174 1.00 1.00 H new ATOM 275 N PRO A 20 81.177 3.843 -2.410 1.00 1.00 N ATOM 276 CA PRO A 20 80.141 3.606 -1.348 1.00 1.00 C ATOM 277 C PRO A 20 79.458 4.879 -0.803 1.00 1.00 C ATOM 278 O PRO A 20 78.328 4.822 -0.346 1.00 1.00 O ATOM 279 CB PRO A 20 80.944 2.922 -0.234 1.00 1.00 C ATOM 280 CG PRO A 20 82.312 3.512 -0.340 1.00 1.00 C ATOM 281 CD PRO A 20 82.541 3.805 -1.830 1.00 1.00 C ATOM 0 HA PRO A 20 79.309 3.027 -1.750 1.00 1.00 H new ATOM 0 HB2 PRO A 20 80.505 3.112 0.745 1.00 1.00 H new ATOM 0 HB3 PRO A 20 80.967 1.841 -0.368 1.00 1.00 H new ATOM 0 HG2 PRO A 20 82.389 4.424 0.252 1.00 1.00 H new ATOM 0 HG3 PRO A 20 83.064 2.821 0.040 1.00 1.00 H new ATOM 0 HD2 PRO A 20 83.061 4.752 -1.974 1.00 1.00 H new ATOM 0 HD3 PRO A 20 83.151 3.032 -2.298 1.00 1.00 H new ATOM 289 N GLY A 21 80.181 5.991 -0.806 1.00 1.00 N ATOM 290 CA GLY A 21 79.626 7.231 -0.225 1.00 1.00 C ATOM 291 C GLY A 21 78.341 7.683 -0.928 1.00 1.00 C ATOM 292 O GLY A 21 77.299 7.864 -0.297 1.00 1.00 O ATOM 0 H GLY A 21 81.123 6.073 -1.188 1.00 1.00 H new ATOM 0 HA2 GLY A 21 79.421 7.073 0.834 1.00 1.00 H new ATOM 0 HA3 GLY A 21 80.371 8.024 -0.290 1.00 1.00 H new ATOM 296 N GLY A 22 78.442 7.908 -2.217 1.00 1.00 N ATOM 297 CA GLY A 22 77.275 8.401 -2.949 1.00 1.00 C ATOM 298 C GLY A 22 76.160 7.400 -2.796 1.00 1.00 C ATOM 299 O GLY A 22 75.062 7.731 -2.353 1.00 1.00 O ATOM 0 H GLY A 22 79.284 7.767 -2.775 1.00 1.00 H new ATOM 0 HA2 GLY A 22 76.968 9.373 -2.563 1.00 1.00 H new ATOM 0 HA3 GLY A 22 77.519 8.539 -4.002 1.00 1.00 H new ATOM 303 N VAL A 23 76.447 6.174 -3.181 1.00 1.00 N ATOM 304 CA VAL A 23 75.440 5.124 -3.089 1.00 1.00 C ATOM 305 C VAL A 23 75.000 4.960 -1.641 1.00 1.00 C ATOM 306 O VAL A 23 73.838 4.667 -1.370 1.00 1.00 O ATOM 307 CB VAL A 23 75.959 3.791 -3.638 1.00 1.00 C ATOM 308 CG1 VAL A 23 76.316 3.945 -5.123 1.00 1.00 C ATOM 309 CG2 VAL A 23 77.196 3.382 -2.852 1.00 1.00 C ATOM 0 H VAL A 23 77.349 5.878 -3.554 1.00 1.00 H new ATOM 0 HA VAL A 23 74.587 5.421 -3.699 1.00 1.00 H new ATOM 0 HB VAL A 23 75.189 3.026 -3.537 1.00 1.00 H new ATOM 0 HG11 VAL A 23 76.685 2.995 -5.509 1.00 1.00 H new ATOM 0 HG12 VAL A 23 75.429 4.244 -5.681 1.00 1.00 H new ATOM 0 HG13 VAL A 23 77.088 4.706 -5.235 1.00 1.00 H new ATOM 0 HG21 VAL A 23 77.573 2.434 -3.235 1.00 1.00 H new ATOM 0 HG22 VAL A 23 77.964 4.148 -2.958 1.00 1.00 H new ATOM 0 HG23 VAL A 23 76.938 3.271 -1.799 1.00 1.00 H new ATOM 319 N ALA A 24 75.935 5.154 -0.706 1.00 1.00 N ATOM 320 CA ALA A 24 75.549 5.008 0.689 1.00 1.00 C ATOM 321 C ALA A 24 74.396 5.973 0.992 1.00 1.00 C ATOM 322 O ALA A 24 73.314 5.528 1.374 1.00 1.00 O ATOM 323 CB ALA A 24 76.722 5.276 1.643 1.00 1.00 C ATOM 0 H ALA A 24 76.910 5.399 -0.879 1.00 1.00 H new ATOM 0 HA ALA A 24 75.233 3.977 0.849 1.00 1.00 H new ATOM 0 HB1 ALA A 24 76.388 5.156 2.673 1.00 1.00 H new ATOM 0 HB2 ALA A 24 77.527 4.570 1.438 1.00 1.00 H new ATOM 0 HB3 ALA A 24 77.085 6.293 1.496 1.00 1.00 H new ATOM 329 N LEU A 25 74.616 7.294 0.850 1.00 1.00 N ATOM 330 CA LEU A 25 73.559 8.252 1.156 1.00 1.00 C ATOM 331 C LEU A 25 72.358 8.100 0.229 1.00 1.00 C ATOM 332 O LEU A 25 71.226 8.164 0.698 1.00 1.00 O ATOM 333 CB LEU A 25 74.092 9.696 1.072 1.00 1.00 C ATOM 334 CG LEU A 25 74.975 10.020 2.303 1.00 1.00 C ATOM 335 CD1 LEU A 25 76.435 9.659 2.016 1.00 1.00 C ATOM 336 CD2 LEU A 25 74.888 11.512 2.626 1.00 1.00 C ATOM 0 H LEU A 25 75.494 7.705 0.534 1.00 1.00 H new ATOM 0 HA LEU A 25 73.229 8.042 2.173 1.00 1.00 H new ATOM 0 HB2 LEU A 25 74.671 9.824 0.158 1.00 1.00 H new ATOM 0 HB3 LEU A 25 73.258 10.396 1.021 1.00 1.00 H new ATOM 0 HG LEU A 25 74.616 9.436 3.151 1.00 1.00 H new ATOM 0 HD11 LEU A 25 77.046 9.891 2.889 1.00 1.00 H new ATOM 0 HD12 LEU A 25 76.510 8.594 1.794 1.00 1.00 H new ATOM 0 HD13 LEU A 25 76.791 10.234 1.161 1.00 1.00 H new ATOM 0 HD21 LEU A 25 75.511 11.734 3.493 1.00 1.00 H new ATOM 0 HD22 LEU A 25 75.237 12.090 1.771 1.00 1.00 H new ATOM 0 HD23 LEU A 25 73.854 11.777 2.845 1.00 1.00 H new ATOM 348 N VAL A 26 72.573 7.940 -1.081 1.00 1.00 N ATOM 349 CA VAL A 26 71.424 7.839 -1.974 1.00 1.00 C ATOM 350 C VAL A 26 70.578 6.626 -1.593 1.00 1.00 C ATOM 351 O VAL A 26 69.394 6.770 -1.299 1.00 1.00 O ATOM 352 CB VAL A 26 71.912 7.714 -3.421 1.00 1.00 C ATOM 353 CG1 VAL A 26 70.735 7.409 -4.354 1.00 1.00 C ATOM 354 CG2 VAL A 26 72.566 9.031 -3.848 1.00 1.00 C ATOM 0 H VAL A 26 73.488 7.880 -1.527 1.00 1.00 H new ATOM 0 HA VAL A 26 70.810 8.735 -1.882 1.00 1.00 H new ATOM 0 HB VAL A 26 72.634 6.900 -3.483 1.00 1.00 H new ATOM 0 HG11 VAL A 26 71.096 7.323 -5.379 1.00 1.00 H new ATOM 0 HG12 VAL A 26 70.267 6.472 -4.054 1.00 1.00 H new ATOM 0 HG13 VAL A 26 70.004 8.215 -4.293 1.00 1.00 H new ATOM 0 HG21 VAL A 26 72.915 8.947 -4.877 1.00 1.00 H new ATOM 0 HG22 VAL A 26 71.838 9.839 -3.777 1.00 1.00 H new ATOM 0 HG23 VAL A 26 73.412 9.246 -3.195 1.00 1.00 H new ATOM 364 N VAL A 27 71.163 5.426 -1.632 1.00 1.00 N ATOM 365 CA VAL A 27 70.424 4.203 -1.317 1.00 1.00 C ATOM 366 C VAL A 27 69.864 4.218 0.099 1.00 1.00 C ATOM 367 O VAL A 27 68.755 3.749 0.342 1.00 1.00 O ATOM 368 CB VAL A 27 71.360 2.996 -1.456 1.00 1.00 C ATOM 369 CG1 VAL A 27 70.604 1.716 -1.105 1.00 1.00 C ATOM 370 CG2 VAL A 27 71.879 2.908 -2.894 1.00 1.00 C ATOM 0 H VAL A 27 72.142 5.276 -1.878 1.00 1.00 H new ATOM 0 HA VAL A 27 69.589 4.137 -2.014 1.00 1.00 H new ATOM 0 HB VAL A 27 72.203 3.115 -0.775 1.00 1.00 H new ATOM 0 HG11 VAL A 27 71.272 0.860 -1.205 1.00 1.00 H new ATOM 0 HG12 VAL A 27 70.243 1.777 -0.078 1.00 1.00 H new ATOM 0 HG13 VAL A 27 69.757 1.596 -1.781 1.00 1.00 H new ATOM 0 HG21 VAL A 27 72.544 2.049 -2.989 1.00 1.00 H new ATOM 0 HG22 VAL A 27 71.038 2.793 -3.578 1.00 1.00 H new ATOM 0 HG23 VAL A 27 72.425 3.819 -3.140 1.00 1.00 H new ATOM 380 N LYS A 28 70.636 4.739 1.033 1.00 1.00 N ATOM 381 CA LYS A 28 70.184 4.777 2.415 1.00 1.00 C ATOM 382 C LYS A 28 68.991 5.706 2.517 1.00 1.00 C ATOM 383 O LYS A 28 67.936 5.348 3.047 1.00 1.00 O ATOM 384 CB LYS A 28 71.342 5.253 3.301 1.00 1.00 C ATOM 385 CG LYS A 28 70.890 5.416 4.752 1.00 1.00 C ATOM 386 CD LYS A 28 72.129 5.628 5.641 1.00 1.00 C ATOM 387 CE LYS A 28 71.740 6.317 6.958 1.00 1.00 C ATOM 388 NZ LYS A 28 71.803 7.795 6.771 1.00 1.00 N ATOM 0 H LYS A 28 71.561 5.135 0.868 1.00 1.00 H new ATOM 0 HA LYS A 28 69.877 3.787 2.752 1.00 1.00 H new ATOM 0 HB2 LYS A 28 72.162 4.537 3.250 1.00 1.00 H new ATOM 0 HB3 LYS A 28 71.725 6.203 2.927 1.00 1.00 H new ATOM 0 HG2 LYS A 28 70.212 6.265 4.842 1.00 1.00 H new ATOM 0 HG3 LYS A 28 70.340 4.533 5.077 1.00 1.00 H new ATOM 0 HD2 LYS A 28 72.600 4.668 5.852 1.00 1.00 H new ATOM 0 HD3 LYS A 28 72.864 6.234 5.111 1.00 1.00 H new ATOM 0 HE2 LYS A 28 70.735 6.018 7.257 1.00 1.00 H new ATOM 0 HE3 LYS A 28 72.415 6.010 7.757 1.00 1.00 H new ATOM 0 HZ1 LYS A 28 71.541 8.269 7.659 1.00 1.00 H new ATOM 0 HZ2 LYS A 28 72.770 8.070 6.504 1.00 1.00 H new ATOM 0 HZ3 LYS A 28 71.142 8.078 6.019 1.00 1.00 H new ATOM 402 N VAL A 29 69.198 6.918 2.045 1.00 1.00 N ATOM 403 CA VAL A 29 68.151 7.932 2.120 1.00 1.00 C ATOM 404 C VAL A 29 66.951 7.523 1.285 1.00 1.00 C ATOM 405 O VAL A 29 65.816 7.593 1.755 1.00 1.00 O ATOM 406 CB VAL A 29 68.663 9.316 1.693 1.00 1.00 C ATOM 407 CG1 VAL A 29 67.480 10.288 1.574 1.00 1.00 C ATOM 408 CG2 VAL A 29 69.626 9.842 2.762 1.00 1.00 C ATOM 0 H VAL A 29 70.067 7.228 1.610 1.00 1.00 H new ATOM 0 HA VAL A 29 67.842 8.007 3.163 1.00 1.00 H new ATOM 0 HB VAL A 29 69.171 9.235 0.732 1.00 1.00 H new ATOM 0 HG11 VAL A 29 67.845 11.270 1.271 1.00 1.00 H new ATOM 0 HG12 VAL A 29 66.777 9.916 0.829 1.00 1.00 H new ATOM 0 HG13 VAL A 29 66.978 10.369 2.538 1.00 1.00 H new ATOM 0 HG21 VAL A 29 69.995 10.824 2.468 1.00 1.00 H new ATOM 0 HG22 VAL A 29 69.103 9.921 3.715 1.00 1.00 H new ATOM 0 HG23 VAL A 29 70.466 9.155 2.865 1.00 1.00 H new ATOM 418 N CYS A 30 67.182 7.109 0.045 1.00 1.00 N ATOM 419 CA CYS A 30 66.067 6.720 -0.789 1.00 1.00 C ATOM 420 C CYS A 30 65.400 5.483 -0.204 1.00 1.00 C ATOM 421 O CYS A 30 64.207 5.499 0.095 1.00 1.00 O ATOM 422 CB CYS A 30 66.599 6.426 -2.195 1.00 1.00 C ATOM 423 SG CYS A 30 65.319 5.691 -3.244 1.00 1.00 S ATOM 0 H CYS A 30 68.102 7.037 -0.389 1.00 1.00 H new ATOM 0 HA CYS A 30 65.327 7.519 -0.836 1.00 1.00 H new ATOM 0 HB2 CYS A 30 66.959 7.349 -2.650 1.00 1.00 H new ATOM 0 HB3 CYS A 30 67.451 5.749 -2.129 1.00 1.00 H new ATOM 428 N ALA A 31 66.146 4.387 -0.107 1.00 1.00 N ATOM 429 CA ALA A 31 65.596 3.126 0.360 1.00 1.00 C ATOM 430 C ALA A 31 65.140 3.163 1.821 1.00 1.00 C ATOM 431 O ALA A 31 63.999 2.812 2.122 1.00 1.00 O ATOM 432 CB ALA A 31 66.666 2.040 0.148 1.00 1.00 C ATOM 0 H ALA A 31 67.137 4.350 -0.347 1.00 1.00 H new ATOM 0 HA ALA A 31 64.695 2.909 -0.215 1.00 1.00 H new ATOM 0 HB1 ALA A 31 66.282 1.079 0.490 1.00 1.00 H new ATOM 0 HB2 ALA A 31 66.914 1.975 -0.911 1.00 1.00 H new ATOM 0 HB3 ALA A 31 67.561 2.295 0.715 1.00 1.00 H new ATOM 438 N GLY A 32 66.013 3.579 2.730 1.00 1.00 N ATOM 439 CA GLY A 32 65.640 3.632 4.141 1.00 1.00 C ATOM 440 C GLY A 32 65.831 2.278 4.821 1.00 1.00 C ATOM 441 O GLY A 32 64.872 1.533 5.009 1.00 1.00 O ATOM 0 H GLY A 32 66.966 3.879 2.524 1.00 1.00 H new ATOM 0 HA2 GLY A 32 66.243 4.384 4.650 1.00 1.00 H new ATOM 0 HA3 GLY A 32 64.599 3.943 4.232 1.00 1.00 H new ATOM 445 N LEU A 33 67.094 1.968 5.140 1.00 1.00 N ATOM 446 CA LEU A 33 67.475 0.700 5.783 1.00 1.00 C ATOM 447 C LEU A 33 67.305 -0.476 4.791 1.00 1.00 C ATOM 448 O LEU A 33 66.184 -0.922 4.580 1.00 1.00 O ATOM 449 CB LEU A 33 66.630 0.432 7.061 1.00 1.00 C ATOM 450 CG LEU A 33 67.306 1.030 8.305 1.00 1.00 C ATOM 451 CD1 LEU A 33 67.387 2.554 8.177 1.00 1.00 C ATOM 452 CD2 LEU A 33 66.477 0.665 9.540 1.00 1.00 C ATOM 0 H LEU A 33 67.883 2.589 4.960 1.00 1.00 H new ATOM 0 HA LEU A 33 68.522 0.781 6.077 1.00 1.00 H new ATOM 0 HB2 LEU A 33 65.636 0.863 6.941 1.00 1.00 H new ATOM 0 HB3 LEU A 33 66.498 -0.642 7.195 1.00 1.00 H new ATOM 0 HG LEU A 33 68.316 0.630 8.399 1.00 1.00 H new ATOM 0 HD11 LEU A 33 67.867 2.969 9.063 1.00 1.00 H new ATOM 0 HD12 LEU A 33 67.969 2.814 7.293 1.00 1.00 H new ATOM 0 HD13 LEU A 33 66.382 2.965 8.083 1.00 1.00 H new ATOM 0 HD21 LEU A 33 66.946 1.084 10.430 1.00 1.00 H new ATOM 0 HD22 LEU A 33 65.471 1.071 9.436 1.00 1.00 H new ATOM 0 HD23 LEU A 33 66.423 -0.420 9.634 1.00 1.00 H new ATOM 464 N PRO A 34 68.364 -0.988 4.171 1.00 1.00 N ATOM 465 CA PRO A 34 68.245 -2.117 3.189 1.00 1.00 C ATOM 466 C PRO A 34 67.335 -3.275 3.642 1.00 1.00 C ATOM 467 O PRO A 34 67.053 -4.175 2.852 1.00 1.00 O ATOM 468 CB PRO A 34 69.698 -2.617 2.978 1.00 1.00 C ATOM 469 CG PRO A 34 70.563 -1.826 3.918 1.00 1.00 C ATOM 470 CD PRO A 34 69.783 -0.570 4.302 1.00 1.00 C ATOM 0 HA PRO A 34 67.768 -1.756 2.278 1.00 1.00 H new ATOM 0 HB2 PRO A 34 69.775 -3.684 3.186 1.00 1.00 H new ATOM 0 HB3 PRO A 34 70.013 -2.470 1.945 1.00 1.00 H new ATOM 0 HG2 PRO A 34 70.806 -2.413 4.803 1.00 1.00 H new ATOM 0 HG3 PRO A 34 71.507 -1.562 3.442 1.00 1.00 H new ATOM 0 HD2 PRO A 34 70.014 -0.249 5.318 1.00 1.00 H new ATOM 0 HD3 PRO A 34 70.018 0.265 3.642 1.00 1.00 H new ATOM 478 N GLY A 35 66.910 -3.287 4.903 1.00 1.00 N ATOM 479 CA GLY A 35 66.079 -4.414 5.345 1.00 1.00 C ATOM 480 C GLY A 35 64.794 -4.472 4.523 1.00 1.00 C ATOM 481 O GLY A 35 64.526 -5.472 3.855 1.00 1.00 O ATOM 0 H GLY A 35 67.110 -2.575 5.606 1.00 1.00 H new ATOM 0 HA2 GLY A 35 66.631 -5.347 5.237 1.00 1.00 H new ATOM 0 HA3 GLY A 35 65.839 -4.306 6.403 1.00 1.00 H new ATOM 485 N VAL A 36 64.002 -3.405 4.573 1.00 1.00 N ATOM 486 CA VAL A 36 62.747 -3.372 3.817 1.00 1.00 C ATOM 487 C VAL A 36 63.033 -2.938 2.385 1.00 1.00 C ATOM 488 O VAL A 36 64.088 -3.278 1.858 1.00 1.00 O ATOM 489 CB VAL A 36 61.733 -2.433 4.503 1.00 1.00 C ATOM 490 CG1 VAL A 36 62.141 -0.959 4.304 1.00 1.00 C ATOM 491 CG2 VAL A 36 60.303 -2.676 3.929 1.00 1.00 C ATOM 0 H VAL A 36 64.198 -2.565 5.117 1.00 1.00 H new ATOM 0 HA VAL A 36 62.305 -4.368 3.794 1.00 1.00 H new ATOM 0 HB VAL A 36 61.727 -2.650 5.571 1.00 1.00 H new ATOM 0 HG11 VAL A 36 61.415 -0.311 4.794 1.00 1.00 H new ATOM 0 HG12 VAL A 36 63.127 -0.793 4.738 1.00 1.00 H new ATOM 0 HG13 VAL A 36 62.170 -0.730 3.239 1.00 1.00 H new ATOM 0 HG21 VAL A 36 59.595 -2.008 4.420 1.00 1.00 H new ATOM 0 HG22 VAL A 36 60.303 -2.480 2.857 1.00 1.00 H new ATOM 0 HG23 VAL A 36 60.010 -3.710 4.108 1.00 1.00 H new ATOM 501 N ILE A 37 62.105 -2.213 1.753 1.00 1.00 N ATOM 502 CA ILE A 37 62.292 -1.758 0.364 1.00 1.00 C ATOM 503 C ILE A 37 62.136 -2.895 -0.619 1.00 1.00 C ATOM 504 O ILE A 37 63.123 -3.389 -1.164 1.00 1.00 O ATOM 505 CB ILE A 37 63.681 -1.126 0.148 1.00 1.00 C ATOM 506 CG1 ILE A 37 63.962 -0.050 1.238 1.00 1.00 C ATOM 507 CG2 ILE A 37 63.725 -0.494 -1.254 1.00 1.00 C ATOM 508 CD1 ILE A 37 65.207 -0.430 2.048 1.00 1.00 C ATOM 0 H ILE A 37 61.221 -1.928 2.174 1.00 1.00 H new ATOM 0 HA ILE A 37 61.520 -1.009 0.189 1.00 1.00 H new ATOM 0 HB ILE A 37 64.450 -1.894 0.227 1.00 1.00 H new ATOM 0 HG12 ILE A 37 64.107 0.923 0.770 1.00 1.00 H new ATOM 0 HG13 ILE A 37 63.101 0.040 1.901 1.00 1.00 H new ATOM 0 HG21 ILE A 37 64.703 -0.043 -1.419 1.00 1.00 H new ATOM 0 HG22 ILE A 37 63.548 -1.263 -2.006 1.00 1.00 H new ATOM 0 HG23 ILE A 37 62.954 0.273 -1.332 1.00 1.00 H new ATOM 0 HD11 ILE A 37 65.393 0.330 2.807 1.00 1.00 H new ATOM 0 HD12 ILE A 37 65.047 -1.394 2.531 1.00 1.00 H new ATOM 0 HD13 ILE A 37 66.068 -0.497 1.382 1.00 1.00 H new ATOM 520 N HIS A 38 60.898 -3.294 -0.884 1.00 1.00 N ATOM 521 CA HIS A 38 60.629 -4.345 -1.848 1.00 1.00 C ATOM 522 C HIS A 38 59.473 -3.867 -2.712 1.00 1.00 C ATOM 523 O HIS A 38 58.433 -3.463 -2.190 1.00 1.00 O ATOM 524 CB HIS A 38 60.251 -5.642 -1.125 1.00 1.00 C ATOM 525 CG HIS A 38 61.407 -6.091 -0.275 1.00 1.00 C ATOM 526 ND1 HIS A 38 62.519 -6.716 -0.814 1.00 1.00 N ATOM 527 CD2 HIS A 38 61.645 -6.001 1.076 1.00 1.00 C ATOM 528 CE1 HIS A 38 63.369 -6.976 0.195 1.00 1.00 C ATOM 529 NE2 HIS A 38 62.885 -6.563 1.369 1.00 1.00 N ATOM 0 H HIS A 38 60.066 -2.903 -0.442 1.00 1.00 H new ATOM 0 HA HIS A 38 61.510 -4.551 -2.456 1.00 1.00 H new ATOM 0 HB2 HIS A 38 59.369 -5.483 -0.505 1.00 1.00 H new ATOM 0 HB3 HIS A 38 59.996 -6.415 -1.850 1.00 1.00 H new ATOM 0 HD2 HIS A 38 60.974 -5.562 1.799 1.00 1.00 H new ATOM 0 HE1 HIS A 38 64.327 -7.460 0.071 1.00 1.00 H new ATOM 0 HE2 HIS A 38 63.328 -6.642 2.284 1.00 1.00 H new ATOM 537 N THR A 39 59.656 -3.895 -4.027 1.00 1.00 N ATOM 538 CA THR A 39 58.617 -3.438 -4.951 1.00 1.00 C ATOM 539 C THR A 39 58.021 -4.633 -5.682 1.00 1.00 C ATOM 540 O THR A 39 58.721 -5.610 -5.945 1.00 1.00 O ATOM 541 CB THR A 39 59.219 -2.457 -5.955 1.00 1.00 C ATOM 542 OG1 THR A 39 60.062 -3.159 -6.856 1.00 1.00 O ATOM 543 CG2 THR A 39 60.033 -1.407 -5.198 1.00 1.00 C ATOM 0 H THR A 39 60.508 -4.227 -4.479 1.00 1.00 H new ATOM 0 HA THR A 39 57.829 -2.935 -4.391 1.00 1.00 H new ATOM 0 HB THR A 39 58.424 -1.968 -6.517 1.00 1.00 H new ATOM 0 HG1 THR A 39 59.667 -3.144 -7.753 1.00 1.00 H new ATOM 0 HG21 THR A 39 60.467 -0.702 -5.907 1.00 1.00 H new ATOM 0 HG22 THR A 39 59.383 -0.872 -4.506 1.00 1.00 H new ATOM 0 HG23 THR A 39 60.831 -1.898 -4.640 1.00 1.00 H new ATOM 551 N PRO A 40 56.755 -4.600 -6.003 1.00 1.00 N ATOM 552 CA PRO A 40 56.100 -5.739 -6.694 1.00 1.00 C ATOM 553 C PRO A 40 56.637 -5.963 -8.107 1.00 1.00 C ATOM 554 O PRO A 40 56.580 -7.080 -8.621 1.00 1.00 O ATOM 555 CB PRO A 40 54.611 -5.340 -6.718 1.00 1.00 C ATOM 556 CG PRO A 40 54.614 -3.851 -6.642 1.00 1.00 C ATOM 557 CD PRO A 40 55.806 -3.493 -5.759 1.00 1.00 C ATOM 0 HA PRO A 40 56.286 -6.684 -6.184 1.00 1.00 H new ATOM 0 HB2 PRO A 40 54.123 -5.689 -7.628 1.00 1.00 H new ATOM 0 HB3 PRO A 40 54.071 -5.778 -5.879 1.00 1.00 H new ATOM 0 HG2 PRO A 40 54.712 -3.407 -7.633 1.00 1.00 H new ATOM 0 HG3 PRO A 40 53.683 -3.477 -6.216 1.00 1.00 H new ATOM 0 HD2 PRO A 40 56.234 -2.529 -6.033 1.00 1.00 H new ATOM 0 HD3 PRO A 40 55.523 -3.430 -4.708 1.00 1.00 H new ATOM 565 N ALA A 41 57.179 -4.914 -8.732 1.00 1.00 N ATOM 566 CA ALA A 41 57.743 -5.018 -10.072 1.00 1.00 C ATOM 567 C ALA A 41 59.161 -4.482 -10.069 1.00 1.00 C ATOM 568 O ALA A 41 59.389 -3.366 -9.601 1.00 1.00 O ATOM 569 CB ALA A 41 56.897 -4.212 -11.061 1.00 1.00 C ATOM 0 H ALA A 41 57.237 -3.980 -8.325 1.00 1.00 H new ATOM 0 HA ALA A 41 57.748 -6.065 -10.375 1.00 1.00 H new ATOM 0 HB1 ALA A 41 57.326 -4.296 -12.059 1.00 1.00 H new ATOM 0 HB2 ALA A 41 55.879 -4.601 -11.070 1.00 1.00 H new ATOM 0 HB3 ALA A 41 56.883 -3.165 -10.759 1.00 1.00 H new ATOM 575 N ARG A 42 60.109 -5.223 -10.607 1.00 1.00 N ATOM 576 CA ARG A 42 61.477 -4.725 -10.662 1.00 1.00 C ATOM 577 C ARG A 42 62.240 -5.480 -11.737 1.00 1.00 C ATOM 578 O ARG A 42 61.896 -6.608 -12.086 1.00 1.00 O ATOM 579 CB ARG A 42 62.171 -4.875 -9.281 1.00 1.00 C ATOM 580 CG ARG A 42 63.227 -3.752 -9.032 1.00 1.00 C ATOM 581 CD ARG A 42 64.642 -4.240 -9.377 1.00 1.00 C ATOM 582 NE ARG A 42 64.999 -5.392 -8.554 1.00 1.00 N ATOM 583 CZ ARG A 42 65.612 -5.248 -7.380 1.00 1.00 C ATOM 584 NH1 ARG A 42 65.900 -4.057 -6.928 1.00 1.00 N ATOM 585 NH2 ARG A 42 65.919 -6.304 -6.677 1.00 1.00 N ATOM 0 H ARG A 42 59.968 -6.151 -11.005 1.00 1.00 H new ATOM 0 HA ARG A 42 61.465 -3.664 -10.911 1.00 1.00 H new ATOM 0 HB2 ARG A 42 61.419 -4.847 -8.492 1.00 1.00 H new ATOM 0 HB3 ARG A 42 62.657 -5.849 -9.223 1.00 1.00 H new ATOM 0 HG2 ARG A 42 62.983 -2.878 -9.636 1.00 1.00 H new ATOM 0 HG3 ARG A 42 63.191 -3.439 -7.989 1.00 1.00 H new ATOM 0 HD2 ARG A 42 64.693 -4.509 -10.432 1.00 1.00 H new ATOM 0 HD3 ARG A 42 65.360 -3.435 -9.218 1.00 1.00 H new ATOM 0 HE ARG A 42 64.774 -6.330 -8.886 1.00 1.00 H new ATOM 0 HH11 ARG A 42 65.655 -3.231 -7.475 1.00 1.00 H new ATOM 0 HH12 ARG A 42 66.369 -3.953 -6.028 1.00 1.00 H new ATOM 0 HH21 ARG A 42 65.690 -7.234 -7.027 1.00 1.00 H new ATOM 0 HH22 ARG A 42 66.388 -6.199 -5.778 1.00 1.00 H new ATOM 599 N ARG A 43 63.286 -4.858 -12.248 1.00 1.00 N ATOM 600 CA ARG A 43 64.105 -5.482 -13.269 1.00 1.00 C ATOM 601 C ARG A 43 64.766 -6.745 -12.715 1.00 1.00 C ATOM 602 O ARG A 43 65.722 -7.249 -13.295 1.00 1.00 O ATOM 603 CB ARG A 43 65.188 -4.492 -13.721 1.00 1.00 C ATOM 604 CG ARG A 43 65.853 -4.958 -15.061 1.00 1.00 C ATOM 605 CD ARG A 43 65.648 -3.932 -16.210 1.00 1.00 C ATOM 606 NE ARG A 43 66.913 -3.717 -16.905 1.00 1.00 N ATOM 607 CZ ARG A 43 67.351 -4.565 -17.831 1.00 1.00 C ATOM 608 NH1 ARG A 43 66.645 -5.616 -18.142 1.00 1.00 N ATOM 609 NH2 ARG A 43 68.492 -4.349 -18.426 1.00 1.00 N ATOM 0 H ARG A 43 63.588 -3.923 -11.973 1.00 1.00 H new ATOM 0 HA ARG A 43 63.476 -5.756 -14.116 1.00 1.00 H new ATOM 0 HB2 ARG A 43 64.749 -3.503 -13.854 1.00 1.00 H new ATOM 0 HB3 ARG A 43 65.949 -4.401 -12.946 1.00 1.00 H new ATOM 0 HG2 ARG A 43 66.920 -5.111 -14.900 1.00 1.00 H new ATOM 0 HG3 ARG A 43 65.434 -5.920 -15.357 1.00 1.00 H new ATOM 0 HD2 ARG A 43 64.895 -4.298 -16.908 1.00 1.00 H new ATOM 0 HD3 ARG A 43 65.278 -2.989 -15.808 1.00 1.00 H new ATOM 0 HE ARG A 43 67.474 -2.897 -16.675 1.00 1.00 H new ATOM 0 HH11 ARG A 43 65.755 -5.789 -17.675 1.00 1.00 H new ATOM 0 HH12 ARG A 43 66.983 -6.265 -18.853 1.00 1.00 H new ATOM 0 HH21 ARG A 43 69.048 -3.530 -18.181 1.00 1.00 H new ATOM 0 HH22 ARG A 43 68.828 -4.999 -19.136 1.00 1.00 H new ATOM 623 N GLY A 44 64.230 -7.261 -11.604 1.00 1.00 N ATOM 624 CA GLY A 44 64.754 -8.468 -10.980 1.00 1.00 C ATOM 625 C GLY A 44 66.035 -8.181 -10.210 1.00 1.00 C ATOM 626 O GLY A 44 66.362 -8.878 -9.248 1.00 1.00 O ATOM 0 H GLY A 44 63.429 -6.855 -11.120 1.00 1.00 H new ATOM 0 HA2 GLY A 44 64.007 -8.885 -10.305 1.00 1.00 H new ATOM 0 HA3 GLY A 44 64.947 -9.221 -11.744 1.00 1.00 H new ATOM 630 N PHE A 45 66.768 -7.153 -10.633 1.00 1.00 N ATOM 631 CA PHE A 45 68.019 -6.793 -9.972 1.00 1.00 C ATOM 632 C PHE A 45 68.332 -5.298 -10.221 1.00 1.00 C ATOM 633 O PHE A 45 67.867 -4.746 -11.215 1.00 1.00 O ATOM 634 CB PHE A 45 69.164 -7.687 -10.498 1.00 1.00 C ATOM 635 CG PHE A 45 68.636 -9.058 -10.926 1.00 1.00 C ATOM 636 CD1 PHE A 45 67.872 -9.185 -12.094 1.00 1.00 C ATOM 637 CD2 PHE A 45 68.908 -10.200 -10.155 1.00 1.00 C ATOM 638 CE1 PHE A 45 67.381 -10.443 -12.486 1.00 1.00 C ATOM 639 CE2 PHE A 45 68.419 -11.454 -10.548 1.00 1.00 C ATOM 640 CZ PHE A 45 67.657 -11.576 -11.713 1.00 1.00 C ATOM 0 H PHE A 45 66.519 -6.559 -11.424 1.00 1.00 H new ATOM 0 HA PHE A 45 67.922 -6.951 -8.898 1.00 1.00 H new ATOM 0 HB2 PHE A 45 69.651 -7.201 -11.343 1.00 1.00 H new ATOM 0 HB3 PHE A 45 69.920 -7.810 -9.722 1.00 1.00 H new ATOM 0 HD1 PHE A 45 67.660 -8.313 -12.695 1.00 1.00 H new ATOM 0 HD2 PHE A 45 69.497 -10.112 -9.254 1.00 1.00 H new ATOM 0 HE1 PHE A 45 66.790 -10.535 -13.385 1.00 1.00 H new ATOM 0 HE2 PHE A 45 68.632 -12.327 -9.949 1.00 1.00 H new ATOM 0 HZ PHE A 45 67.282 -12.542 -12.016 1.00 1.00 H new ATOM 650 N PHE A 46 69.145 -4.706 -9.309 1.00 1.00 N ATOM 651 CA PHE A 46 69.611 -3.280 -9.330 1.00 1.00 C ATOM 652 C PHE A 46 69.585 -2.715 -7.878 1.00 1.00 C ATOM 653 O PHE A 46 68.612 -2.080 -7.516 1.00 1.00 O ATOM 654 CB PHE A 46 68.745 -2.329 -10.246 1.00 1.00 C ATOM 655 CG PHE A 46 69.496 -1.901 -11.516 1.00 1.00 C ATOM 656 CD1 PHE A 46 69.893 -2.844 -12.480 1.00 1.00 C ATOM 657 CD2 PHE A 46 69.768 -0.534 -11.738 1.00 1.00 C ATOM 658 CE1 PHE A 46 70.556 -2.425 -13.647 1.00 1.00 C ATOM 659 CE2 PHE A 46 70.433 -0.122 -12.903 1.00 1.00 C ATOM 660 CZ PHE A 46 70.825 -1.065 -13.855 1.00 1.00 C ATOM 0 H PHE A 46 69.511 -5.220 -8.507 1.00 1.00 H new ATOM 0 HA PHE A 46 70.617 -3.297 -9.750 1.00 1.00 H new ATOM 0 HB2 PHE A 46 67.823 -2.839 -10.526 1.00 1.00 H new ATOM 0 HB3 PHE A 46 68.460 -1.443 -9.679 1.00 1.00 H new ATOM 0 HD1 PHE A 46 69.688 -3.893 -12.324 1.00 1.00 H new ATOM 0 HD2 PHE A 46 69.462 0.200 -11.007 1.00 1.00 H new ATOM 0 HE1 PHE A 46 70.859 -3.153 -14.385 1.00 1.00 H new ATOM 0 HE2 PHE A 46 70.642 0.925 -13.063 1.00 1.00 H new ATOM 0 HZ PHE A 46 71.336 -0.747 -14.752 1.00 1.00 H new ATOM 670 N ARG A 47 70.666 -2.932 -7.084 1.00 1.00 N ATOM 671 CA ARG A 47 70.820 -2.432 -5.673 1.00 1.00 C ATOM 672 C ARG A 47 71.285 -3.561 -4.770 1.00 1.00 C ATOM 673 O ARG A 47 70.804 -4.682 -4.867 1.00 1.00 O ATOM 674 CB ARG A 47 69.547 -1.781 -5.007 1.00 1.00 C ATOM 675 CG ARG A 47 69.702 -0.250 -4.979 1.00 1.00 C ATOM 676 CD ARG A 47 68.346 0.431 -4.705 1.00 1.00 C ATOM 677 NE ARG A 47 67.349 -0.037 -5.654 1.00 1.00 N ATOM 678 CZ ARG A 47 67.517 0.138 -6.951 1.00 1.00 C ATOM 679 NH1 ARG A 47 68.508 0.857 -7.386 1.00 1.00 N ATOM 680 NH2 ARG A 47 66.661 -0.369 -7.793 1.00 1.00 N ATOM 0 H ARG A 47 71.474 -3.467 -7.402 1.00 1.00 H new ATOM 0 HA ARG A 47 71.551 -1.629 -5.769 1.00 1.00 H new ATOM 0 HB2 ARG A 47 68.652 -2.055 -5.565 1.00 1.00 H new ATOM 0 HB3 ARG A 47 69.420 -2.162 -3.994 1.00 1.00 H new ATOM 0 HG2 ARG A 47 70.419 0.034 -4.209 1.00 1.00 H new ATOM 0 HG3 ARG A 47 70.103 0.097 -5.931 1.00 1.00 H new ATOM 0 HD2 ARG A 47 68.021 0.214 -3.688 1.00 1.00 H new ATOM 0 HD3 ARG A 47 68.452 1.513 -4.782 1.00 1.00 H new ATOM 0 HE ARG A 47 66.510 -0.506 -5.313 1.00 1.00 H new ATOM 0 HH11 ARG A 47 69.156 1.286 -6.725 1.00 1.00 H new ATOM 0 HH12 ARG A 47 68.638 0.993 -8.389 1.00 1.00 H new ATOM 0 HH21 ARG A 47 65.861 -0.901 -7.449 1.00 1.00 H new ATOM 0 HH22 ARG A 47 66.791 -0.234 -8.796 1.00 1.00 H new ATOM 694 N CYS A 48 72.216 -3.254 -3.878 1.00 1.00 N ATOM 695 CA CYS A 48 72.735 -4.248 -2.954 1.00 1.00 C ATOM 696 C CYS A 48 73.686 -5.172 -3.703 1.00 1.00 C ATOM 697 O CYS A 48 73.371 -6.328 -3.927 1.00 1.00 O ATOM 698 CB CYS A 48 71.593 -5.088 -2.301 1.00 1.00 C ATOM 699 SG CYS A 48 69.991 -4.237 -2.321 1.00 1.00 S ATOM 0 H CYS A 48 72.626 -2.326 -3.776 1.00 1.00 H new ATOM 0 HA CYS A 48 73.260 -3.728 -2.153 1.00 1.00 H new ATOM 0 HB2 CYS A 48 71.501 -6.038 -2.828 1.00 1.00 H new ATOM 0 HB3 CYS A 48 71.863 -5.320 -1.271 1.00 1.00 H new ATOM 704 N ASN A 49 74.859 -4.692 -4.095 1.00 1.00 N ATOM 705 CA ASN A 49 75.804 -5.531 -4.820 1.00 1.00 C ATOM 706 C ASN A 49 77.219 -5.161 -4.356 1.00 1.00 C ATOM 707 O ASN A 49 77.616 -4.021 -4.560 1.00 1.00 O ATOM 708 CB ASN A 49 75.668 -5.238 -6.316 1.00 1.00 C ATOM 709 CG ASN A 49 75.441 -3.743 -6.525 1.00 1.00 C ATOM 710 OD1 ASN A 49 74.311 -3.262 -6.418 1.00 1.00 O ATOM 711 ND2 ASN A 49 76.455 -2.977 -6.815 1.00 1.00 N ATOM 0 H ASN A 49 75.176 -3.738 -3.926 1.00 1.00 H new ATOM 0 HA ASN A 49 75.611 -6.587 -4.634 1.00 1.00 H new ATOM 0 HB2 ASN A 49 76.567 -5.557 -6.843 1.00 1.00 H new ATOM 0 HB3 ASN A 49 74.836 -5.805 -6.734 1.00 1.00 H new ATOM 0 HD21 ASN A 49 76.315 -1.976 -6.954 1.00 1.00 H new ATOM 0 HD22 ASN A 49 77.389 -3.378 -6.903 1.00 1.00 H new ATOM 718 N PRO A 50 77.967 -6.057 -3.723 1.00 1.00 N ATOM 719 CA PRO A 50 79.355 -5.749 -3.218 1.00 1.00 C ATOM 720 C PRO A 50 80.269 -5.041 -4.234 1.00 1.00 C ATOM 721 O PRO A 50 81.287 -5.594 -4.651 1.00 1.00 O ATOM 722 CB PRO A 50 79.921 -7.130 -2.852 1.00 1.00 C ATOM 723 CG PRO A 50 78.727 -7.962 -2.521 1.00 1.00 C ATOM 724 CD PRO A 50 77.587 -7.450 -3.407 1.00 1.00 C ATOM 0 HA PRO A 50 79.309 -5.044 -2.388 1.00 1.00 H new ATOM 0 HB2 PRO A 50 80.483 -7.559 -3.682 1.00 1.00 H new ATOM 0 HB3 PRO A 50 80.604 -7.065 -2.005 1.00 1.00 H new ATOM 0 HG2 PRO A 50 78.923 -9.017 -2.711 1.00 1.00 H new ATOM 0 HG3 PRO A 50 78.470 -7.871 -1.466 1.00 1.00 H new ATOM 0 HD2 PRO A 50 77.486 -8.050 -4.312 1.00 1.00 H new ATOM 0 HD3 PRO A 50 76.630 -7.493 -2.888 1.00 1.00 H new ATOM 732 N GLU A 51 79.890 -3.830 -4.628 1.00 1.00 N ATOM 733 CA GLU A 51 80.659 -3.048 -5.594 1.00 1.00 C ATOM 734 C GLU A 51 80.735 -3.762 -6.942 1.00 1.00 C ATOM 735 O GLU A 51 81.680 -3.568 -7.703 1.00 1.00 O ATOM 736 CB GLU A 51 82.075 -2.756 -5.054 1.00 1.00 C ATOM 737 CG GLU A 51 82.036 -1.562 -4.093 1.00 1.00 C ATOM 738 CD GLU A 51 81.209 -1.909 -2.860 1.00 1.00 C ATOM 739 OE1 GLU A 51 81.274 -3.049 -2.430 1.00 1.00 O ATOM 740 OE2 GLU A 51 80.520 -1.032 -2.370 1.00 1.00 O ATOM 0 H GLU A 51 79.048 -3.364 -4.291 1.00 1.00 H new ATOM 0 HA GLU A 51 80.144 -2.099 -5.744 1.00 1.00 H new ATOM 0 HB2 GLU A 51 82.465 -3.634 -4.540 1.00 1.00 H new ATOM 0 HB3 GLU A 51 82.752 -2.545 -5.882 1.00 1.00 H new ATOM 0 HG2 GLU A 51 83.049 -1.291 -3.796 1.00 1.00 H new ATOM 0 HG3 GLU A 51 81.608 -0.695 -4.595 1.00 1.00 H new ATOM 747 N ARG A 52 79.715 -4.566 -7.243 1.00 1.00 N ATOM 748 CA ARG A 52 79.656 -5.282 -8.519 1.00 1.00 C ATOM 749 C ARG A 52 78.681 -4.577 -9.442 1.00 1.00 C ATOM 750 O ARG A 52 77.596 -4.176 -9.023 1.00 1.00 O ATOM 751 CB ARG A 52 79.222 -6.741 -8.284 1.00 1.00 C ATOM 752 CG ARG A 52 80.438 -7.579 -7.775 1.00 1.00 C ATOM 753 CD ARG A 52 80.117 -8.316 -6.466 1.00 1.00 C ATOM 754 NE ARG A 52 81.371 -8.623 -5.778 1.00 1.00 N ATOM 755 CZ ARG A 52 81.533 -9.723 -5.049 1.00 1.00 C ATOM 756 NH1 ARG A 52 80.568 -10.593 -4.933 1.00 1.00 N ATOM 757 NH2 ARG A 52 82.671 -9.934 -4.447 1.00 1.00 N ATOM 0 H ARG A 52 78.922 -4.738 -6.625 1.00 1.00 H new ATOM 0 HA ARG A 52 80.643 -5.289 -8.982 1.00 1.00 H new ATOM 0 HB2 ARG A 52 78.413 -6.776 -7.554 1.00 1.00 H new ATOM 0 HB3 ARG A 52 78.836 -7.169 -9.209 1.00 1.00 H new ATOM 0 HG2 ARG A 52 80.725 -8.302 -8.538 1.00 1.00 H new ATOM 0 HG3 ARG A 52 81.293 -6.921 -7.621 1.00 1.00 H new ATOM 0 HD2 ARG A 52 79.480 -7.699 -5.832 1.00 1.00 H new ATOM 0 HD3 ARG A 52 79.567 -9.233 -6.675 1.00 1.00 H new ATOM 0 HE ARG A 52 82.150 -7.969 -5.861 1.00 1.00 H new ATOM 0 HH11 ARG A 52 79.678 -10.433 -5.404 1.00 1.00 H new ATOM 0 HH12 ARG A 52 80.704 -11.433 -4.371 1.00 1.00 H new ATOM 0 HH21 ARG A 52 83.429 -9.257 -4.537 1.00 1.00 H new ATOM 0 HH22 ARG A 52 82.803 -10.776 -3.886 1.00 1.00 H new ATOM 771 N ILE A 53 79.089 -4.387 -10.691 1.00 1.00 N ATOM 772 CA ILE A 53 78.256 -3.686 -11.651 1.00 1.00 C ATOM 773 C ILE A 53 76.893 -4.357 -11.827 1.00 1.00 C ATOM 774 O ILE A 53 76.765 -5.581 -11.886 1.00 1.00 O ATOM 775 CB ILE A 53 78.994 -3.580 -12.987 1.00 1.00 C ATOM 776 CG1 ILE A 53 78.088 -2.918 -14.029 1.00 1.00 C ATOM 777 CG2 ILE A 53 79.405 -4.972 -13.462 1.00 1.00 C ATOM 778 CD1 ILE A 53 78.923 -2.521 -15.250 1.00 1.00 C ATOM 0 H ILE A 53 79.985 -4.707 -11.058 1.00 1.00 H new ATOM 0 HA ILE A 53 78.062 -2.685 -11.267 1.00 1.00 H new ATOM 0 HB ILE A 53 79.888 -2.971 -12.856 1.00 1.00 H new ATOM 0 HG12 ILE A 53 77.294 -3.604 -14.325 1.00 1.00 H new ATOM 0 HG13 ILE A 53 77.607 -2.038 -13.602 1.00 1.00 H new ATOM 0 HG21 ILE A 53 79.930 -4.891 -14.414 1.00 1.00 H new ATOM 0 HG22 ILE A 53 80.062 -5.429 -12.722 1.00 1.00 H new ATOM 0 HG23 ILE A 53 78.516 -5.590 -13.589 1.00 1.00 H new ATOM 0 HD11 ILE A 53 78.280 -2.050 -15.993 1.00 1.00 H new ATOM 0 HD12 ILE A 53 79.701 -1.820 -14.947 1.00 1.00 H new ATOM 0 HD13 ILE A 53 79.383 -3.410 -15.681 1.00 1.00 H new ATOM 790 N GLN A 54 75.889 -3.507 -11.904 1.00 1.00 N ATOM 791 CA GLN A 54 74.520 -3.990 -12.068 1.00 1.00 C ATOM 792 C GLN A 54 74.413 -4.662 -13.449 1.00 1.00 C ATOM 793 O GLN A 54 73.908 -4.073 -14.405 1.00 1.00 O ATOM 794 CB GLN A 54 73.501 -2.824 -11.917 1.00 1.00 C ATOM 795 CG GLN A 54 74.193 -1.579 -11.335 1.00 1.00 C ATOM 796 CD GLN A 54 73.159 -0.635 -10.738 1.00 1.00 C ATOM 797 OE1 GLN A 54 72.571 0.170 -11.455 1.00 1.00 O ATOM 798 NE2 GLN A 54 72.895 -0.688 -9.463 1.00 1.00 N ATOM 0 H GLN A 54 75.985 -2.493 -11.857 1.00 1.00 H new ATOM 0 HA GLN A 54 74.280 -4.716 -11.292 1.00 1.00 H new ATOM 0 HB2 GLN A 54 73.065 -2.586 -12.887 1.00 1.00 H new ATOM 0 HB3 GLN A 54 72.682 -3.130 -11.266 1.00 1.00 H new ATOM 0 HG2 GLN A 54 74.910 -1.877 -10.569 1.00 1.00 H new ATOM 0 HG3 GLN A 54 74.755 -1.068 -12.116 1.00 1.00 H new ATOM 0 HE21 GLN A 54 73.384 -1.357 -8.868 1.00 1.00 H new ATOM 0 HE22 GLN A 54 72.199 -0.060 -9.060 1.00 1.00 H new ATOM 807 N ILE A 55 74.874 -5.926 -13.525 1.00 1.00 N ATOM 808 CA ILE A 55 74.822 -6.724 -14.761 1.00 1.00 C ATOM 809 C ILE A 55 74.668 -8.218 -14.413 1.00 1.00 C ATOM 810 O ILE A 55 74.998 -8.637 -13.304 1.00 1.00 O ATOM 811 CB ILE A 55 76.106 -6.500 -15.608 1.00 1.00 C ATOM 812 CG1 ILE A 55 75.956 -5.223 -16.459 1.00 1.00 C ATOM 813 CG2 ILE A 55 76.362 -7.704 -16.542 1.00 1.00 C ATOM 814 CD1 ILE A 55 77.279 -4.910 -17.162 1.00 1.00 C ATOM 0 H ILE A 55 75.290 -6.418 -12.735 1.00 1.00 H new ATOM 0 HA ILE A 55 73.962 -6.404 -15.349 1.00 1.00 H new ATOM 0 HB ILE A 55 76.950 -6.394 -14.927 1.00 1.00 H new ATOM 0 HG12 ILE A 55 75.165 -5.357 -17.196 1.00 1.00 H new ATOM 0 HG13 ILE A 55 75.663 -4.385 -15.826 1.00 1.00 H new ATOM 0 HG21 ILE A 55 77.265 -7.526 -17.126 1.00 1.00 H new ATOM 0 HG22 ILE A 55 76.488 -8.607 -15.945 1.00 1.00 H new ATOM 0 HG23 ILE A 55 75.514 -7.829 -17.215 1.00 1.00 H new ATOM 0 HD11 ILE A 55 77.167 -4.007 -17.762 1.00 1.00 H new ATOM 0 HD12 ILE A 55 78.060 -4.757 -16.417 1.00 1.00 H new ATOM 0 HD13 ILE A 55 77.554 -5.743 -17.809 1.00 1.00 H new ATOM 826 N GLY A 56 74.163 -9.012 -15.362 1.00 1.00 N ATOM 827 CA GLY A 56 73.967 -10.451 -15.146 1.00 1.00 C ATOM 828 C GLY A 56 72.483 -10.778 -15.102 1.00 1.00 C ATOM 829 O GLY A 56 72.087 -11.937 -14.973 1.00 1.00 O ATOM 0 H GLY A 56 73.882 -8.684 -16.286 1.00 1.00 H new ATOM 0 HA2 GLY A 56 74.448 -11.015 -15.946 1.00 1.00 H new ATOM 0 HA3 GLY A 56 74.441 -10.754 -14.213 1.00 1.00 H new ATOM 833 N ASP A 57 71.674 -9.740 -15.216 1.00 1.00 N ATOM 834 CA ASP A 57 70.230 -9.912 -15.200 1.00 1.00 C ATOM 835 C ASP A 57 69.734 -10.390 -16.558 1.00 1.00 C ATOM 836 O ASP A 57 69.581 -9.602 -17.490 1.00 1.00 O ATOM 837 CB ASP A 57 69.591 -8.573 -14.888 1.00 1.00 C ATOM 838 CG ASP A 57 70.201 -8.021 -13.616 1.00 1.00 C ATOM 839 OD1 ASP A 57 70.567 -8.815 -12.762 1.00 1.00 O ATOM 840 OD2 ASP A 57 70.307 -6.810 -13.511 1.00 1.00 O ATOM 0 H ASP A 57 71.988 -8.775 -15.320 1.00 1.00 H new ATOM 0 HA ASP A 57 69.965 -10.654 -14.447 1.00 1.00 H new ATOM 0 HB2 ASP A 57 69.749 -7.879 -15.713 1.00 1.00 H new ATOM 0 HB3 ASP A 57 68.514 -8.688 -14.770 1.00 1.00 H new ATOM 845 N TRP A 58 69.525 -11.692 -16.683 1.00 1.00 N ATOM 846 CA TRP A 58 69.093 -12.272 -17.946 1.00 1.00 C ATOM 847 C TRP A 58 67.562 -12.281 -18.099 1.00 1.00 C ATOM 848 O TRP A 58 66.798 -11.950 -17.197 1.00 1.00 O ATOM 849 CB TRP A 58 69.683 -13.688 -18.104 1.00 1.00 C ATOM 850 CG TRP A 58 71.061 -13.620 -18.712 1.00 1.00 C ATOM 851 CD1 TRP A 58 71.987 -12.679 -18.413 1.00 1.00 C ATOM 852 CD2 TRP A 58 71.681 -14.500 -19.699 1.00 1.00 C ATOM 853 NE1 TRP A 58 73.131 -12.924 -19.150 1.00 1.00 N ATOM 854 CE2 TRP A 58 72.994 -14.033 -19.956 1.00 1.00 C ATOM 855 CE3 TRP A 58 71.243 -15.645 -20.390 1.00 1.00 C ATOM 856 CZ2 TRP A 58 73.838 -14.675 -20.864 1.00 1.00 C ATOM 857 CZ3 TRP A 58 72.091 -16.294 -21.303 1.00 1.00 C ATOM 858 CH2 TRP A 58 73.385 -15.809 -21.541 1.00 1.00 C ATOM 0 H TRP A 58 69.647 -12.366 -15.927 1.00 1.00 H new ATOM 0 HA TRP A 58 69.473 -11.639 -18.748 1.00 1.00 H new ATOM 0 HB2 TRP A 58 69.732 -14.179 -17.132 1.00 1.00 H new ATOM 0 HB3 TRP A 58 69.030 -14.292 -18.734 1.00 1.00 H new ATOM 0 HD1 TRP A 58 71.854 -11.868 -17.712 1.00 1.00 H new ATOM 0 HE1 TRP A 58 73.975 -12.353 -19.103 1.00 1.00 H new ATOM 0 HE3 TRP A 58 70.248 -16.028 -20.217 1.00 1.00 H new ATOM 0 HZ2 TRP A 58 74.834 -14.297 -21.041 1.00 1.00 H new ATOM 0 HZ3 TRP A 58 71.744 -17.173 -21.825 1.00 1.00 H new ATOM 0 HH2 TRP A 58 74.030 -16.312 -22.247 1.00 1.00 H new ATOM 869 N ARG A 59 67.199 -12.654 -19.302 1.00 1.00 N ATOM 870 CA ARG A 59 65.780 -12.726 -19.694 1.00 1.00 C ATOM 871 C ARG A 59 65.104 -14.037 -19.253 1.00 1.00 C ATOM 872 O ARG A 59 64.125 -14.029 -18.507 1.00 1.00 O ATOM 873 CB ARG A 59 65.621 -12.572 -21.213 1.00 1.00 C ATOM 874 CG ARG A 59 66.611 -11.529 -21.745 1.00 1.00 C ATOM 875 CD ARG A 59 68.037 -12.112 -21.863 1.00 1.00 C ATOM 876 NE ARG A 59 68.620 -11.718 -23.139 1.00 1.00 N ATOM 877 CZ ARG A 59 69.628 -12.397 -23.671 1.00 1.00 C ATOM 878 NH1 ARG A 59 70.127 -13.424 -23.039 1.00 1.00 N ATOM 879 NH2 ARG A 59 70.120 -12.037 -24.824 1.00 1.00 N ATOM 0 H ARG A 59 67.854 -12.916 -20.039 1.00 1.00 H new ATOM 0 HA ARG A 59 65.287 -11.901 -19.180 1.00 1.00 H new ATOM 0 HB2 ARG A 59 65.793 -13.530 -21.703 1.00 1.00 H new ATOM 0 HB3 ARG A 59 64.601 -12.270 -21.451 1.00 1.00 H new ATOM 0 HG2 ARG A 59 66.279 -11.175 -22.721 1.00 1.00 H new ATOM 0 HG3 ARG A 59 66.624 -10.665 -21.080 1.00 1.00 H new ATOM 0 HD2 ARG A 59 68.657 -11.753 -21.042 1.00 1.00 H new ATOM 0 HD3 ARG A 59 68.004 -13.199 -21.786 1.00 1.00 H new ATOM 0 HE ARG A 59 68.247 -10.906 -23.631 1.00 1.00 H new ATOM 0 HH11 ARG A 59 69.742 -13.704 -22.137 1.00 1.00 H new ATOM 0 HH12 ARG A 59 70.902 -13.947 -23.447 1.00 1.00 H new ATOM 0 HH21 ARG A 59 69.730 -11.234 -25.317 1.00 1.00 H new ATOM 0 HH22 ARG A 59 70.895 -12.559 -25.233 1.00 1.00 H new ATOM 893 N TYR A 60 65.626 -15.142 -19.744 1.00 1.00 N ATOM 894 CA TYR A 60 65.101 -16.488 -19.449 1.00 1.00 C ATOM 895 C TYR A 60 65.762 -17.157 -18.243 1.00 1.00 C ATOM 896 O TYR A 60 65.262 -18.162 -17.708 1.00 1.00 O ATOM 897 CB TYR A 60 65.225 -17.388 -20.677 1.00 1.00 C ATOM 898 CG TYR A 60 64.413 -18.646 -20.455 1.00 1.00 C ATOM 899 CD1 TYR A 60 63.012 -18.591 -20.508 1.00 1.00 C ATOM 900 CD2 TYR A 60 65.054 -19.859 -20.184 1.00 1.00 C ATOM 901 CE1 TYR A 60 62.258 -19.751 -20.293 1.00 1.00 C ATOM 902 CE2 TYR A 60 64.299 -21.018 -19.966 1.00 1.00 C ATOM 903 CZ TYR A 60 62.900 -20.963 -20.021 1.00 1.00 C ATOM 904 OH TYR A 60 62.154 -22.103 -19.799 1.00 1.00 O ATOM 0 H TYR A 60 66.434 -15.147 -20.366 1.00 1.00 H new ATOM 0 HA TYR A 60 64.051 -16.351 -19.189 1.00 1.00 H new ATOM 0 HB2 TYR A 60 64.871 -16.864 -21.564 1.00 1.00 H new ATOM 0 HB3 TYR A 60 66.270 -17.642 -20.853 1.00 1.00 H new ATOM 0 HD1 TYR A 60 62.515 -17.654 -20.715 1.00 1.00 H new ATOM 0 HD2 TYR A 60 66.132 -19.902 -20.143 1.00 1.00 H new ATOM 0 HE1 TYR A 60 61.180 -19.710 -20.337 1.00 1.00 H new ATOM 0 HE2 TYR A 60 64.795 -21.954 -19.756 1.00 1.00 H new ATOM 0 HH TYR A 60 62.754 -22.858 -19.626 1.00 1.00 H new ATOM 914 N GLU A 61 66.881 -16.615 -17.794 1.00 1.00 N ATOM 915 CA GLU A 61 67.586 -17.183 -16.664 1.00 1.00 C ATOM 916 C GLU A 61 66.938 -16.757 -15.363 1.00 1.00 C ATOM 917 O GLU A 61 67.266 -17.280 -14.318 1.00 1.00 O ATOM 918 CB GLU A 61 69.061 -16.711 -16.686 1.00 1.00 C ATOM 919 CG GLU A 61 70.012 -17.823 -16.230 1.00 1.00 C ATOM 920 CD GLU A 61 71.441 -17.289 -16.196 1.00 1.00 C ATOM 921 OE1 GLU A 61 71.618 -16.165 -15.751 1.00 1.00 O ATOM 922 OE2 GLU A 61 72.336 -18.008 -16.608 1.00 1.00 O ATOM 0 H GLU A 61 67.318 -15.785 -18.195 1.00 1.00 H new ATOM 0 HA GLU A 61 67.544 -18.270 -16.736 1.00 1.00 H new ATOM 0 HB2 GLU A 61 69.328 -16.393 -17.694 1.00 1.00 H new ATOM 0 HB3 GLU A 61 69.176 -15.843 -16.037 1.00 1.00 H new ATOM 0 HG2 GLU A 61 69.723 -18.181 -15.242 1.00 1.00 H new ATOM 0 HG3 GLU A 61 69.946 -18.673 -16.909 1.00 1.00 H new ATOM 929 N VAL A 62 66.075 -15.750 -15.394 1.00 1.00 N ATOM 930 CA VAL A 62 65.507 -15.257 -14.141 1.00 1.00 C ATOM 931 C VAL A 62 65.042 -16.409 -13.283 1.00 1.00 C ATOM 932 O VAL A 62 65.416 -16.509 -12.135 1.00 1.00 O ATOM 933 CB VAL A 62 64.339 -14.308 -14.426 1.00 1.00 C ATOM 934 CG1 VAL A 62 64.870 -13.069 -15.146 1.00 1.00 C ATOM 935 CG2 VAL A 62 63.291 -15.002 -15.312 1.00 1.00 C ATOM 0 H VAL A 62 65.760 -15.272 -16.238 1.00 1.00 H new ATOM 0 HA VAL A 62 66.281 -14.711 -13.602 1.00 1.00 H new ATOM 0 HB VAL A 62 63.870 -14.023 -13.484 1.00 1.00 H new ATOM 0 HG11 VAL A 62 64.045 -12.387 -15.353 1.00 1.00 H new ATOM 0 HG12 VAL A 62 65.605 -12.569 -14.515 1.00 1.00 H new ATOM 0 HG13 VAL A 62 65.339 -13.366 -16.084 1.00 1.00 H new ATOM 0 HG21 VAL A 62 62.467 -14.316 -15.506 1.00 1.00 H new ATOM 0 HG22 VAL A 62 63.750 -15.295 -16.256 1.00 1.00 H new ATOM 0 HG23 VAL A 62 62.913 -15.888 -14.802 1.00 1.00 H new ATOM 945 N ALA A 63 64.212 -17.268 -13.804 1.00 1.00 N ATOM 946 CA ALA A 63 63.749 -18.381 -13.020 1.00 1.00 C ATOM 947 C ALA A 63 64.914 -19.315 -12.754 1.00 1.00 C ATOM 948 O ALA A 63 65.146 -19.714 -11.618 1.00 1.00 O ATOM 949 CB ALA A 63 62.648 -19.138 -13.766 1.00 1.00 C ATOM 0 H ALA A 63 63.845 -17.222 -14.755 1.00 1.00 H new ATOM 0 HA ALA A 63 63.342 -18.012 -12.079 1.00 1.00 H new ATOM 0 HB1 ALA A 63 62.308 -19.977 -13.159 1.00 1.00 H new ATOM 0 HB2 ALA A 63 61.811 -18.467 -13.958 1.00 1.00 H new ATOM 0 HB3 ALA A 63 63.039 -19.510 -14.713 1.00 1.00 H new ATOM 955 N HIS A 64 65.655 -19.641 -13.821 1.00 1.00 N ATOM 956 CA HIS A 64 66.795 -20.544 -13.657 1.00 1.00 C ATOM 957 C HIS A 64 67.696 -20.030 -12.517 1.00 1.00 C ATOM 958 O HIS A 64 67.924 -20.712 -11.520 1.00 1.00 O ATOM 959 CB HIS A 64 67.590 -20.637 -14.964 1.00 1.00 C ATOM 960 CG HIS A 64 68.445 -21.879 -14.957 1.00 1.00 C ATOM 961 ND1 HIS A 64 69.831 -21.831 -14.976 1.00 1.00 N ATOM 962 CD2 HIS A 64 68.118 -23.213 -14.937 1.00 1.00 C ATOM 963 CE1 HIS A 64 70.280 -23.100 -14.970 1.00 1.00 C ATOM 964 NE2 HIS A 64 69.277 -23.981 -14.946 1.00 1.00 N ATOM 0 H HIS A 64 65.493 -19.307 -14.771 1.00 1.00 H new ATOM 0 HA HIS A 64 66.432 -21.540 -13.405 1.00 1.00 H new ATOM 0 HB2 HIS A 64 66.908 -20.659 -15.814 1.00 1.00 H new ATOM 0 HB3 HIS A 64 68.218 -19.754 -15.082 1.00 1.00 H new ATOM 0 HD2 HIS A 64 67.112 -23.606 -14.917 1.00 1.00 H new ATOM 0 HE1 HIS A 64 71.325 -23.373 -14.983 1.00 1.00 H new ATOM 0 HE2 HIS A 64 69.346 -24.999 -14.936 1.00 1.00 H new ATOM 972 N ASP A 65 68.170 -18.807 -12.668 1.00 1.00 N ATOM 973 CA ASP A 65 69.018 -18.180 -11.654 1.00 1.00 C ATOM 974 C ASP A 65 68.190 -17.725 -10.438 1.00 1.00 C ATOM 975 O ASP A 65 68.456 -18.120 -9.288 1.00 1.00 O ATOM 976 CB ASP A 65 69.758 -16.982 -12.273 1.00 1.00 C ATOM 977 CG ASP A 65 70.994 -17.460 -13.034 1.00 1.00 C ATOM 978 OD1 ASP A 65 71.094 -18.653 -13.270 1.00 1.00 O ATOM 979 OD2 ASP A 65 71.821 -16.628 -13.367 1.00 1.00 O ATOM 0 H ASP A 65 67.985 -18.222 -13.483 1.00 1.00 H new ATOM 0 HA ASP A 65 69.743 -18.916 -11.306 1.00 1.00 H new ATOM 0 HB2 ASP A 65 69.092 -16.443 -12.948 1.00 1.00 H new ATOM 0 HB3 ASP A 65 70.052 -16.283 -11.490 1.00 1.00 H new ATOM 984 N GLY A 66 67.125 -16.968 -10.656 1.00 1.00 N ATOM 985 CA GLY A 66 66.267 -16.549 -9.560 1.00 1.00 C ATOM 986 C GLY A 66 65.459 -17.729 -9.040 1.00 1.00 C ATOM 987 O GLY A 66 64.427 -17.555 -8.391 1.00 1.00 O ATOM 0 H GLY A 66 66.836 -16.634 -11.575 1.00 1.00 H new ATOM 0 HA2 GLY A 66 66.872 -16.131 -8.755 1.00 1.00 H new ATOM 0 HA3 GLY A 66 65.595 -15.760 -9.897 1.00 1.00 H new ATOM 991 N ARG A 67 66.010 -18.922 -9.236 1.00 1.00 N ATOM 992 CA ARG A 67 65.434 -20.145 -8.701 1.00 1.00 C ATOM 993 C ARG A 67 65.670 -20.105 -7.213 1.00 1.00 C ATOM 994 O ARG A 67 65.457 -21.108 -6.532 1.00 1.00 O ATOM 995 CB ARG A 67 66.047 -21.453 -9.242 1.00 1.00 C ATOM 996 CG ARG A 67 65.275 -22.035 -10.462 1.00 1.00 C ATOM 997 CD ARG A 67 65.067 -23.557 -10.306 1.00 1.00 C ATOM 998 NE ARG A 67 64.973 -24.195 -11.614 1.00 1.00 N ATOM 999 CZ ARG A 67 64.366 -25.368 -11.766 1.00 1.00 C ATOM 1000 NH1 ARG A 67 63.748 -25.926 -10.758 1.00 1.00 N ATOM 1001 NH2 ARG A 67 64.377 -25.959 -12.929 1.00 1.00 N ATOM 0 H ARG A 67 66.867 -19.066 -9.770 1.00 1.00 H new ATOM 0 HA ARG A 67 64.385 -20.167 -8.997 1.00 1.00 H new ATOM 0 HB2 ARG A 67 67.082 -21.269 -9.530 1.00 1.00 H new ATOM 0 HB3 ARG A 67 66.065 -22.195 -8.444 1.00 1.00 H new ATOM 0 HG2 ARG A 67 64.309 -21.539 -10.556 1.00 1.00 H new ATOM 0 HG3 ARG A 67 65.828 -21.831 -11.379 1.00 1.00 H new ATOM 0 HD2 ARG A 67 65.895 -23.988 -9.743 1.00 1.00 H new ATOM 0 HD3 ARG A 67 64.159 -23.750 -9.735 1.00 1.00 H new ATOM 0 HE ARG A 67 65.380 -23.733 -12.427 1.00 1.00 H new ATOM 0 HH11 ARG A 67 63.730 -25.461 -9.850 1.00 1.00 H new ATOM 0 HH12 ARG A 67 63.284 -26.826 -10.879 1.00 1.00 H new ATOM 0 HH21 ARG A 67 64.851 -25.521 -13.719 1.00 1.00 H new ATOM 0 HH22 ARG A 67 63.912 -26.859 -13.048 1.00 1.00 H new ATOM 1015 N LEU A 68 66.180 -18.957 -6.726 1.00 1.00 N ATOM 1016 CA LEU A 68 66.507 -18.800 -5.299 1.00 1.00 C ATOM 1017 C LEU A 68 65.549 -19.671 -4.474 1.00 1.00 C ATOM 1018 O LEU A 68 65.898 -20.179 -3.413 1.00 1.00 O ATOM 1019 CB LEU A 68 66.319 -17.320 -4.864 1.00 1.00 C ATOM 1020 CG LEU A 68 67.617 -16.497 -5.065 1.00 1.00 C ATOM 1021 CD1 LEU A 68 67.267 -15.034 -5.374 1.00 1.00 C ATOM 1022 CD2 LEU A 68 68.468 -16.530 -3.781 1.00 1.00 C ATOM 0 H LEU A 68 66.372 -18.133 -7.295 1.00 1.00 H new ATOM 0 HA LEU A 68 67.543 -19.098 -5.136 1.00 1.00 H new ATOM 0 HB2 LEU A 68 65.510 -16.871 -5.440 1.00 1.00 H new ATOM 0 HB3 LEU A 68 66.023 -17.283 -3.816 1.00 1.00 H new ATOM 0 HG LEU A 68 68.175 -16.932 -5.894 1.00 1.00 H new ATOM 0 HD11 LEU A 68 68.184 -14.462 -5.514 1.00 1.00 H new ATOM 0 HD12 LEU A 68 66.668 -14.987 -6.284 1.00 1.00 H new ATOM 0 HD13 LEU A 68 66.700 -14.613 -4.544 1.00 1.00 H new ATOM 0 HD21 LEU A 68 69.378 -15.949 -3.932 1.00 1.00 H new ATOM 0 HD22 LEU A 68 67.898 -16.103 -2.956 1.00 1.00 H new ATOM 0 HD23 LEU A 68 68.731 -17.561 -3.545 1.00 1.00 H new ATOM 1034 N LEU A 69 64.343 -19.853 -5.000 1.00 1.00 N ATOM 1035 CA LEU A 69 63.368 -20.706 -4.293 1.00 1.00 C ATOM 1036 C LEU A 69 63.927 -22.144 -4.206 1.00 1.00 C ATOM 1037 O LEU A 69 64.262 -22.611 -3.116 1.00 1.00 O ATOM 1038 CB LEU A 69 62.028 -20.727 -5.058 1.00 1.00 C ATOM 1039 CG LEU A 69 61.172 -19.534 -4.641 1.00 1.00 C ATOM 1040 CD1 LEU A 69 61.927 -18.240 -4.934 1.00 1.00 C ATOM 1041 CD2 LEU A 69 59.861 -19.556 -5.427 1.00 1.00 C ATOM 0 H LEU A 69 64.016 -19.445 -5.876 1.00 1.00 H new ATOM 0 HA LEU A 69 63.200 -20.307 -3.293 1.00 1.00 H new ATOM 0 HB2 LEU A 69 62.212 -20.696 -6.132 1.00 1.00 H new ATOM 0 HB3 LEU A 69 61.497 -21.656 -4.853 1.00 1.00 H new ATOM 0 HG LEU A 69 60.956 -19.590 -3.574 1.00 1.00 H new ATOM 0 HD11 LEU A 69 61.317 -17.387 -4.637 1.00 1.00 H new ATOM 0 HD12 LEU A 69 62.862 -18.230 -4.374 1.00 1.00 H new ATOM 0 HD13 LEU A 69 62.142 -18.178 -6.001 1.00 1.00 H new ATOM 0 HD21 LEU A 69 59.246 -18.706 -5.133 1.00 1.00 H new ATOM 0 HD22 LEU A 69 60.075 -19.497 -6.494 1.00 1.00 H new ATOM 0 HD23 LEU A 69 59.325 -20.482 -5.216 1.00 1.00 H new ATOM 1053 N ALA A 70 64.070 -22.821 -5.362 1.00 1.00 N ATOM 1054 CA ALA A 70 64.640 -24.182 -5.340 1.00 1.00 C ATOM 1055 C ALA A 70 66.148 -24.040 -5.228 1.00 1.00 C ATOM 1056 O ALA A 70 66.710 -24.217 -4.151 1.00 1.00 O ATOM 1057 CB ALA A 70 64.258 -24.956 -6.616 1.00 1.00 C ATOM 0 H ALA A 70 63.812 -22.468 -6.284 1.00 1.00 H new ATOM 0 HA ALA A 70 64.246 -24.746 -4.495 1.00 1.00 H new ATOM 0 HB1 ALA A 70 64.689 -25.956 -6.578 1.00 1.00 H new ATOM 0 HB2 ALA A 70 63.173 -25.031 -6.685 1.00 1.00 H new ATOM 0 HB3 ALA A 70 64.641 -24.429 -7.490 1.00 1.00 H new ATOM 1063 N ALA A 71 66.782 -23.674 -6.336 1.00 1.00 N ATOM 1064 CA ALA A 71 68.217 -23.434 -6.434 1.00 1.00 C ATOM 1065 C ALA A 71 68.773 -22.567 -5.295 1.00 1.00 C ATOM 1066 O ALA A 71 69.941 -22.182 -5.337 1.00 1.00 O ATOM 1067 CB ALA A 71 68.524 -22.831 -7.810 1.00 1.00 C ATOM 0 H ALA A 71 66.295 -23.531 -7.221 1.00 1.00 H new ATOM 0 HA ALA A 71 68.726 -24.392 -6.327 1.00 1.00 H new ATOM 0 HB1 ALA A 71 69.595 -22.647 -7.896 1.00 1.00 H new ATOM 0 HB2 ALA A 71 68.212 -23.526 -8.590 1.00 1.00 H new ATOM 0 HB3 ALA A 71 67.984 -21.891 -7.924 1.00 1.00 H new ATOM 1073 N HIS A 72 67.944 -22.233 -4.296 1.00 1.00 N ATOM 1074 CA HIS A 72 68.360 -21.400 -3.162 1.00 1.00 C ATOM 1075 C HIS A 72 69.852 -21.550 -2.865 1.00 1.00 C ATOM 1076 O HIS A 72 70.610 -20.608 -3.086 1.00 1.00 O ATOM 1077 CB HIS A 72 67.520 -21.855 -1.940 1.00 1.00 C ATOM 1078 CG HIS A 72 67.083 -20.698 -1.068 1.00 1.00 C ATOM 1079 ND1 HIS A 72 67.894 -19.609 -0.786 1.00 1.00 N ATOM 1080 CD2 HIS A 72 65.920 -20.488 -0.362 1.00 1.00 C ATOM 1081 CE1 HIS A 72 67.215 -18.804 0.059 1.00 1.00 C ATOM 1082 NE2 HIS A 72 66.008 -19.297 0.349 1.00 1.00 N ATOM 0 H HIS A 72 66.970 -22.532 -4.252 1.00 1.00 H new ATOM 0 HA HIS A 72 68.194 -20.347 -3.392 1.00 1.00 H new ATOM 0 HB2 HIS A 72 66.639 -22.394 -2.290 1.00 1.00 H new ATOM 0 HB3 HIS A 72 68.105 -22.554 -1.342 1.00 1.00 H new ATOM 0 HD1 HIS A 72 68.833 -19.446 -1.151 1.00 1.00 H new ATOM 0 HD2 HIS A 72 65.067 -21.150 -0.361 1.00 1.00 H new ATOM 0 HE1 HIS A 72 67.601 -17.875 0.452 1.00 1.00 H new ATOM 1090 N MET A 73 70.300 -22.707 -2.390 1.00 1.00 N ATOM 1091 CA MET A 73 71.727 -22.841 -2.134 1.00 1.00 C ATOM 1092 C MET A 73 72.483 -22.792 -3.466 1.00 1.00 C ATOM 1093 O MET A 73 73.513 -22.126 -3.573 1.00 1.00 O ATOM 1094 CB MET A 73 72.037 -24.113 -1.327 1.00 1.00 C ATOM 1095 CG MET A 73 71.924 -25.363 -2.200 1.00 1.00 C ATOM 1096 SD MET A 73 70.253 -25.460 -2.899 1.00 1.00 S ATOM 1097 CE MET A 73 69.632 -26.829 -1.890 1.00 1.00 C ATOM 0 H MET A 73 69.729 -23.527 -2.183 1.00 1.00 H new ATOM 0 HA MET A 73 72.065 -22.008 -1.517 1.00 1.00 H new ATOM 0 HB2 MET A 73 73.042 -24.047 -0.911 1.00 1.00 H new ATOM 0 HB3 MET A 73 71.348 -24.190 -0.486 1.00 1.00 H new ATOM 0 HG2 MET A 73 72.663 -25.329 -3.000 1.00 1.00 H new ATOM 0 HG3 MET A 73 72.135 -26.254 -1.608 1.00 1.00 H new ATOM 0 HE1 MET A 73 68.601 -27.048 -2.169 1.00 1.00 H new ATOM 0 HE2 MET A 73 70.249 -27.712 -2.056 1.00 1.00 H new ATOM 0 HE3 MET A 73 69.671 -26.552 -0.837 1.00 1.00 H new ATOM 1107 N VAL A 74 72.017 -23.560 -4.459 1.00 1.00 N ATOM 1108 CA VAL A 74 72.713 -23.651 -5.741 1.00 1.00 C ATOM 1109 C VAL A 74 73.205 -22.279 -6.212 1.00 1.00 C ATOM 1110 O VAL A 74 74.318 -22.219 -6.724 1.00 1.00 O ATOM 1111 CB VAL A 74 71.787 -24.269 -6.777 1.00 1.00 C ATOM 1112 CG1 VAL A 74 72.429 -24.220 -8.166 1.00 1.00 C ATOM 1113 CG2 VAL A 74 71.485 -25.721 -6.410 1.00 1.00 C ATOM 0 H VAL A 74 71.168 -24.122 -4.397 1.00 1.00 H new ATOM 0 HA VAL A 74 73.591 -24.285 -5.613 1.00 1.00 H new ATOM 0 HB VAL A 74 70.859 -23.697 -6.793 1.00 1.00 H new ATOM 0 HG11 VAL A 74 71.753 -24.666 -8.895 1.00 1.00 H new ATOM 0 HG12 VAL A 74 72.625 -23.183 -8.440 1.00 1.00 H new ATOM 0 HG13 VAL A 74 73.367 -24.775 -8.153 1.00 1.00 H new ATOM 0 HG21 VAL A 74 70.821 -26.155 -7.158 1.00 1.00 H new ATOM 0 HG22 VAL A 74 72.415 -26.289 -6.377 1.00 1.00 H new ATOM 0 HG23 VAL A 74 71.003 -25.757 -5.433 1.00 1.00 H new ATOM 1123 N ASN A 75 72.416 -21.185 -6.067 1.00 1.00 N ATOM 1124 CA ASN A 75 72.840 -19.812 -6.490 1.00 1.00 C ATOM 1125 C ASN A 75 74.364 -19.583 -6.306 1.00 1.00 C ATOM 1126 O ASN A 75 74.949 -18.659 -6.873 1.00 1.00 O ATOM 1127 CB ASN A 75 72.051 -18.784 -5.652 1.00 1.00 C ATOM 1128 CG ASN A 75 71.882 -17.475 -6.418 1.00 1.00 C ATOM 1129 OD1 ASN A 75 72.378 -16.433 -5.988 1.00 1.00 O ATOM 1130 ND2 ASN A 75 71.208 -17.472 -7.535 1.00 1.00 N ATOM 0 H ASN A 75 71.481 -21.220 -5.661 1.00 1.00 H new ATOM 0 HA ASN A 75 72.629 -19.696 -7.553 1.00 1.00 H new ATOM 0 HB2 ASN A 75 71.072 -19.190 -5.397 1.00 1.00 H new ATOM 0 HB3 ASN A 75 72.572 -18.596 -4.713 1.00 1.00 H new ATOM 0 HD21 ASN A 75 71.090 -16.604 -8.057 1.00 1.00 H new ATOM 0 HD22 ASN A 75 70.799 -18.338 -7.886 1.00 1.00 H new ATOM 1137 N GLY A 76 74.968 -20.509 -5.591 1.00 1.00 N ATOM 1138 CA GLY A 76 76.405 -20.531 -5.405 1.00 1.00 C ATOM 1139 C GLY A 76 77.078 -20.372 -6.783 1.00 1.00 C ATOM 1140 O GLY A 76 78.219 -19.941 -6.879 1.00 1.00 O ATOM 0 H GLY A 76 74.476 -21.269 -5.121 1.00 1.00 H new ATOM 0 HA2 GLY A 76 76.713 -19.726 -4.738 1.00 1.00 H new ATOM 0 HA3 GLY A 76 76.713 -21.467 -4.939 1.00 1.00 H new ATOM 1144 N ILE A 77 76.341 -20.715 -7.857 1.00 1.00 N ATOM 1145 CA ILE A 77 76.872 -20.569 -9.218 1.00 1.00 C ATOM 1146 C ILE A 77 76.836 -19.074 -9.587 1.00 1.00 C ATOM 1147 O ILE A 77 77.837 -18.486 -9.961 1.00 1.00 O ATOM 1148 CB ILE A 77 76.059 -21.431 -10.233 1.00 1.00 C ATOM 1149 CG1 ILE A 77 74.601 -21.605 -9.763 1.00 1.00 C ATOM 1150 CG2 ILE A 77 76.694 -22.823 -10.374 1.00 1.00 C ATOM 1151 CD1 ILE A 77 73.709 -22.016 -10.945 1.00 1.00 C ATOM 0 H ILE A 77 75.393 -21.088 -7.807 1.00 1.00 H new ATOM 0 HA ILE A 77 77.900 -20.930 -9.260 1.00 1.00 H new ATOM 0 HB ILE A 77 76.072 -20.913 -11.192 1.00 1.00 H new ATOM 0 HG12 ILE A 77 74.551 -22.362 -8.980 1.00 1.00 H new ATOM 0 HG13 ILE A 77 74.237 -20.673 -9.330 1.00 1.00 H new ATOM 0 HG21 ILE A 77 76.118 -23.415 -11.085 1.00 1.00 H new ATOM 0 HG22 ILE A 77 77.718 -22.721 -10.733 1.00 1.00 H new ATOM 0 HG23 ILE A 77 76.697 -23.321 -9.405 1.00 1.00 H new ATOM 0 HD11 ILE A 77 72.682 -22.136 -10.601 1.00 1.00 H new ATOM 0 HD12 ILE A 77 73.746 -21.245 -11.714 1.00 1.00 H new ATOM 0 HD13 ILE A 77 74.065 -22.959 -11.359 1.00 1.00 H new ATOM 1163 N VAL A 78 75.617 -18.550 -9.557 1.00 1.00 N ATOM 1164 CA VAL A 78 75.368 -17.165 -9.956 1.00 1.00 C ATOM 1165 C VAL A 78 76.595 -16.321 -9.539 1.00 1.00 C ATOM 1166 O VAL A 78 76.945 -15.347 -10.206 1.00 1.00 O ATOM 1167 CB VAL A 78 74.096 -16.601 -9.324 1.00 1.00 C ATOM 1168 CG1 VAL A 78 73.990 -15.114 -9.672 1.00 1.00 C ATOM 1169 CG2 VAL A 78 72.876 -17.335 -9.894 1.00 1.00 C ATOM 0 H VAL A 78 74.785 -19.060 -9.261 1.00 1.00 H new ATOM 0 HA VAL A 78 75.220 -17.129 -11.035 1.00 1.00 H new ATOM 0 HB VAL A 78 74.131 -16.733 -8.243 1.00 1.00 H new ATOM 0 HG11 VAL A 78 73.086 -14.700 -9.226 1.00 1.00 H new ATOM 0 HG12 VAL A 78 74.861 -14.586 -9.283 1.00 1.00 H new ATOM 0 HG13 VAL A 78 73.948 -14.996 -10.755 1.00 1.00 H new ATOM 0 HG21 VAL A 78 71.967 -16.934 -9.444 1.00 1.00 H new ATOM 0 HG22 VAL A 78 72.839 -17.195 -10.974 1.00 1.00 H new ATOM 0 HG23 VAL A 78 72.953 -18.399 -9.669 1.00 1.00 H new ATOM 1179 N ILE A 79 77.251 -16.736 -8.432 1.00 1.00 N ATOM 1180 CA ILE A 79 78.458 -16.060 -7.926 1.00 1.00 C ATOM 1181 C ILE A 79 79.749 -16.745 -8.433 1.00 1.00 C ATOM 1182 O ILE A 79 80.775 -16.095 -8.636 1.00 1.00 O ATOM 1183 CB ILE A 79 78.439 -16.026 -6.378 1.00 1.00 C ATOM 1184 CG1 ILE A 79 78.514 -17.440 -5.775 1.00 1.00 C ATOM 1185 CG2 ILE A 79 77.124 -15.390 -5.909 1.00 1.00 C ATOM 1186 CD1 ILE A 79 78.796 -17.336 -4.267 1.00 1.00 C ATOM 0 H ILE A 79 76.960 -17.539 -7.873 1.00 1.00 H new ATOM 0 HA ILE A 79 78.455 -15.039 -8.307 1.00 1.00 H new ATOM 0 HB ILE A 79 79.306 -15.453 -6.049 1.00 1.00 H new ATOM 0 HG12 ILE A 79 77.577 -17.971 -5.946 1.00 1.00 H new ATOM 0 HG13 ILE A 79 79.300 -18.015 -6.265 1.00 1.00 H new ATOM 0 HG21 ILE A 79 77.102 -15.362 -4.820 1.00 1.00 H new ATOM 0 HG22 ILE A 79 77.051 -14.375 -6.300 1.00 1.00 H new ATOM 0 HG23 ILE A 79 76.284 -15.981 -6.274 1.00 1.00 H new ATOM 0 HD11 ILE A 79 78.850 -18.336 -3.837 1.00 1.00 H new ATOM 0 HD12 ILE A 79 79.744 -16.822 -4.109 1.00 1.00 H new ATOM 0 HD13 ILE A 79 77.995 -16.776 -3.785 1.00 1.00 H new ATOM 1198 N ALA A 80 79.663 -18.061 -8.665 1.00 1.00 N ATOM 1199 CA ALA A 80 80.784 -18.866 -9.183 1.00 1.00 C ATOM 1200 C ALA A 80 80.879 -18.860 -10.728 1.00 1.00 C ATOM 1201 O ALA A 80 81.895 -19.299 -11.273 1.00 1.00 O ATOM 1202 CB ALA A 80 80.745 -20.312 -8.675 1.00 1.00 C ATOM 0 H ALA A 80 78.814 -18.601 -8.499 1.00 1.00 H new ATOM 0 HA ALA A 80 81.679 -18.380 -8.794 1.00 1.00 H new ATOM 0 HB1 ALA A 80 81.591 -20.864 -9.084 1.00 1.00 H new ATOM 0 HB2 ALA A 80 80.801 -20.317 -7.586 1.00 1.00 H new ATOM 0 HB3 ALA A 80 79.815 -20.784 -8.993 1.00 1.00 H new ATOM 1208 N GLU A 81 79.853 -18.341 -11.444 1.00 1.00 N ATOM 1209 CA GLU A 81 79.922 -18.283 -12.898 1.00 1.00 C ATOM 1210 C GLU A 81 80.692 -17.056 -13.305 1.00 1.00 C ATOM 1211 O GLU A 81 81.799 -17.170 -13.835 1.00 1.00 O ATOM 1212 CB GLU A 81 78.534 -18.222 -13.545 1.00 1.00 C ATOM 1213 CG GLU A 81 77.766 -19.535 -13.305 1.00 1.00 C ATOM 1214 CD GLU A 81 76.898 -19.879 -14.514 1.00 1.00 C ATOM 1215 OE1 GLU A 81 77.427 -20.460 -15.447 1.00 1.00 O ATOM 1216 OE2 GLU A 81 75.724 -19.552 -14.489 1.00 1.00 O ATOM 0 H GLU A 81 78.994 -17.969 -11.038 1.00 1.00 H new ATOM 0 HA GLU A 81 80.415 -19.194 -13.239 1.00 1.00 H new ATOM 0 HB2 GLU A 81 77.971 -17.385 -13.133 1.00 1.00 H new ATOM 0 HB3 GLU A 81 78.633 -18.043 -14.616 1.00 1.00 H new ATOM 0 HG2 GLU A 81 78.470 -20.345 -13.114 1.00 1.00 H new ATOM 0 HG3 GLU A 81 77.141 -19.440 -12.417 1.00 1.00 H new ATOM 1223 N ASP A 82 80.133 -15.862 -13.080 1.00 1.00 N ATOM 1224 CA ASP A 82 80.810 -14.644 -13.455 1.00 1.00 C ATOM 1225 C ASP A 82 81.953 -14.309 -12.509 1.00 1.00 C ATOM 1226 O ASP A 82 82.795 -13.487 -12.864 1.00 1.00 O ATOM 1227 CB ASP A 82 79.816 -13.484 -13.485 1.00 1.00 C ATOM 1228 CG ASP A 82 79.321 -13.180 -12.074 1.00 1.00 C ATOM 1229 OD1 ASP A 82 79.671 -13.922 -11.171 1.00 1.00 O ATOM 1230 OD2 ASP A 82 78.600 -12.210 -11.920 1.00 1.00 O ATOM 0 H ASP A 82 79.221 -15.727 -12.643 1.00 1.00 H new ATOM 0 HA ASP A 82 81.234 -14.800 -14.447 1.00 1.00 H new ATOM 0 HB2 ASP A 82 80.290 -12.600 -13.911 1.00 1.00 H new ATOM 0 HB3 ASP A 82 78.973 -13.734 -14.128 1.00 1.00 H new ATOM 1235 N ALA A 83 82.022 -14.960 -11.328 1.00 1.00 N ATOM 1236 CA ALA A 83 83.125 -14.727 -10.380 1.00 1.00 C ATOM 1237 C ALA A 83 84.379 -14.173 -11.079 1.00 1.00 C ATOM 1238 O ALA A 83 84.994 -13.236 -10.584 1.00 1.00 O ATOM 1239 CB ALA A 83 83.461 -16.057 -9.675 1.00 1.00 C ATOM 0 H ALA A 83 81.333 -15.643 -11.013 1.00 1.00 H new ATOM 0 HA ALA A 83 82.804 -13.979 -9.655 1.00 1.00 H new ATOM 0 HB1 ALA A 83 84.277 -15.899 -8.970 1.00 1.00 H new ATOM 0 HB2 ALA A 83 82.583 -16.417 -9.139 1.00 1.00 H new ATOM 0 HB3 ALA A 83 83.761 -16.797 -10.417 1.00 1.00 H new ATOM 1245 N LEU A 84 84.792 -14.779 -12.200 1.00 1.00 N ATOM 1246 CA LEU A 84 86.003 -14.360 -12.911 1.00 1.00 C ATOM 1247 C LEU A 84 86.198 -12.853 -12.907 1.00 1.00 C ATOM 1248 O LEU A 84 87.325 -12.384 -12.780 1.00 1.00 O ATOM 1249 CB LEU A 84 85.893 -14.872 -14.366 1.00 1.00 C ATOM 1250 CG LEU A 84 87.230 -14.688 -15.145 1.00 1.00 C ATOM 1251 CD1 LEU A 84 87.592 -15.981 -15.892 1.00 1.00 C ATOM 1252 CD2 LEU A 84 87.089 -13.568 -16.188 1.00 1.00 C ATOM 0 H LEU A 84 84.303 -15.562 -12.633 1.00 1.00 H new ATOM 0 HA LEU A 84 86.869 -14.782 -12.401 1.00 1.00 H new ATOM 0 HB2 LEU A 84 85.617 -15.927 -14.361 1.00 1.00 H new ATOM 0 HB3 LEU A 84 85.095 -14.336 -14.881 1.00 1.00 H new ATOM 0 HG LEU A 84 88.006 -14.437 -14.422 1.00 1.00 H new ATOM 0 HD11 LEU A 84 88.528 -15.839 -16.432 1.00 1.00 H new ATOM 0 HD12 LEU A 84 87.706 -16.795 -15.176 1.00 1.00 H new ATOM 0 HD13 LEU A 84 86.799 -16.227 -16.598 1.00 1.00 H new ATOM 0 HD21 LEU A 84 88.030 -13.450 -16.725 1.00 1.00 H new ATOM 0 HD22 LEU A 84 86.299 -13.825 -16.893 1.00 1.00 H new ATOM 0 HD23 LEU A 84 86.838 -12.633 -15.687 1.00 1.00 H new ATOM 1264 N ILE A 85 85.111 -12.094 -12.995 1.00 1.00 N ATOM 1265 CA ILE A 85 85.205 -10.634 -12.944 1.00 1.00 C ATOM 1266 C ILE A 85 84.876 -10.179 -11.527 1.00 1.00 C ATOM 1267 O ILE A 85 85.542 -9.320 -10.951 1.00 1.00 O ATOM 1268 CB ILE A 85 84.262 -9.997 -13.974 1.00 1.00 C ATOM 1269 CG1 ILE A 85 82.794 -10.195 -13.572 1.00 1.00 C ATOM 1270 CG2 ILE A 85 84.510 -10.659 -15.333 1.00 1.00 C ATOM 1271 CD1 ILE A 85 81.887 -9.691 -14.698 1.00 1.00 C ATOM 0 H ILE A 85 84.164 -12.457 -13.101 1.00 1.00 H new ATOM 0 HA ILE A 85 86.216 -10.313 -13.197 1.00 1.00 H new ATOM 0 HB ILE A 85 84.460 -8.926 -14.024 1.00 1.00 H new ATOM 0 HG12 ILE A 85 82.598 -11.249 -13.376 1.00 1.00 H new ATOM 0 HG13 ILE A 85 82.582 -9.655 -12.649 1.00 1.00 H new ATOM 0 HG21 ILE A 85 83.848 -10.219 -16.078 1.00 1.00 H new ATOM 0 HG22 ILE A 85 85.547 -10.502 -15.630 1.00 1.00 H new ATOM 0 HG23 ILE A 85 84.312 -11.728 -15.258 1.00 1.00 H new ATOM 0 HD11 ILE A 85 80.844 -9.831 -14.415 1.00 1.00 H new ATOM 0 HD12 ILE A 85 82.077 -8.632 -14.872 1.00 1.00 H new ATOM 0 HD13 ILE A 85 82.094 -10.251 -15.610 1.00 1.00 H new ATOM 1283 N ALA A 86 83.839 -10.798 -10.987 1.00 1.00 N ATOM 1284 CA ALA A 86 83.399 -10.491 -9.636 1.00 1.00 C ATOM 1285 C ALA A 86 84.566 -10.694 -8.658 1.00 1.00 C ATOM 1286 O ALA A 86 84.914 -9.799 -7.907 1.00 1.00 O ATOM 1287 CB ALA A 86 82.185 -11.371 -9.261 1.00 1.00 C ATOM 0 H ALA A 86 83.288 -11.513 -11.461 1.00 1.00 H new ATOM 0 HA ALA A 86 83.083 -9.449 -9.579 1.00 1.00 H new ATOM 0 HB1 ALA A 86 81.863 -11.134 -8.247 1.00 1.00 H new ATOM 0 HB2 ALA A 86 81.368 -11.179 -9.956 1.00 1.00 H new ATOM 0 HB3 ALA A 86 82.467 -12.422 -9.315 1.00 1.00 H new ATOM 1293 N GLU A 87 85.145 -11.885 -8.610 1.00 1.00 N ATOM 1294 CA GLU A 87 86.229 -12.126 -7.665 1.00 1.00 C ATOM 1295 C GLU A 87 87.575 -11.558 -8.164 1.00 1.00 C ATOM 1296 O GLU A 87 88.639 -12.025 -7.760 1.00 1.00 O ATOM 1297 CB GLU A 87 86.338 -13.631 -7.397 1.00 1.00 C ATOM 1298 CG GLU A 87 86.986 -13.874 -6.029 1.00 1.00 C ATOM 1299 CD GLU A 87 87.120 -15.368 -5.769 1.00 1.00 C ATOM 1300 OE1 GLU A 87 88.022 -15.969 -6.328 1.00 1.00 O ATOM 1301 OE2 GLU A 87 86.317 -15.892 -5.015 1.00 1.00 O ATOM 0 H GLU A 87 84.893 -12.681 -9.196 1.00 1.00 H new ATOM 0 HA GLU A 87 85.997 -11.603 -6.737 1.00 1.00 H new ATOM 0 HB2 GLU A 87 85.348 -14.087 -7.426 1.00 1.00 H new ATOM 0 HB3 GLU A 87 86.930 -14.106 -8.179 1.00 1.00 H new ATOM 0 HG2 GLU A 87 87.968 -13.402 -5.995 1.00 1.00 H new ATOM 0 HG3 GLU A 87 86.383 -13.414 -5.246 1.00 1.00 H new ATOM 1308 N ALA A 88 87.522 -10.518 -9.013 1.00 1.00 N ATOM 1309 CA ALA A 88 88.746 -9.845 -9.529 1.00 1.00 C ATOM 1310 C ALA A 88 88.736 -8.394 -9.023 1.00 1.00 C ATOM 1311 O ALA A 88 89.731 -7.676 -9.010 1.00 1.00 O ATOM 1312 CB ALA A 88 88.744 -9.882 -11.065 1.00 1.00 C ATOM 0 H ALA A 88 86.650 -10.119 -9.361 1.00 1.00 H new ATOM 0 HA ALA A 88 89.645 -10.352 -9.178 1.00 1.00 H new ATOM 0 HB1 ALA A 88 89.640 -9.389 -11.442 1.00 1.00 H new ATOM 0 HB2 ALA A 88 88.730 -10.918 -11.404 1.00 1.00 H new ATOM 0 HB3 ALA A 88 87.861 -9.365 -11.440 1.00 1.00 H new ATOM 1318 N VAL A 89 87.540 -8.059 -8.585 1.00 1.00 N ATOM 1319 CA VAL A 89 87.231 -6.751 -8.015 1.00 1.00 C ATOM 1320 C VAL A 89 87.210 -6.837 -6.504 1.00 1.00 C ATOM 1321 O VAL A 89 86.398 -6.203 -5.878 1.00 1.00 O ATOM 1322 CB VAL A 89 85.978 -6.057 -8.617 1.00 1.00 C ATOM 1323 CG1 VAL A 89 86.083 -6.094 -10.146 1.00 1.00 C ATOM 1324 CG2 VAL A 89 84.661 -6.708 -8.180 1.00 1.00 C ATOM 0 H VAL A 89 86.740 -8.691 -8.612 1.00 1.00 H new ATOM 0 HA VAL A 89 88.038 -6.080 -8.307 1.00 1.00 H new ATOM 0 HB VAL A 89 85.960 -5.032 -8.245 1.00 1.00 H new ATOM 0 HG11 VAL A 89 85.209 -5.610 -10.583 1.00 1.00 H new ATOM 0 HG12 VAL A 89 86.984 -5.569 -10.462 1.00 1.00 H new ATOM 0 HG13 VAL A 89 86.130 -7.130 -10.483 1.00 1.00 H new ATOM 0 HG21 VAL A 89 83.824 -6.177 -8.634 1.00 1.00 H new ATOM 0 HG22 VAL A 89 84.646 -7.750 -8.500 1.00 1.00 H new ATOM 0 HG23 VAL A 89 84.574 -6.661 -7.094 1.00 1.00 H new ATOM 1334 N GLY A 90 88.141 -7.608 -5.901 1.00 1.00 N ATOM 1335 CA GLY A 90 88.211 -7.715 -4.453 1.00 1.00 C ATOM 1336 C GLY A 90 88.737 -6.418 -3.831 1.00 1.00 C ATOM 1337 O GLY A 90 88.234 -5.995 -2.789 1.00 1.00 O ATOM 0 H GLY A 90 88.842 -8.155 -6.401 1.00 1.00 H new ATOM 0 HA2 GLY A 90 87.222 -7.939 -4.053 1.00 1.00 H new ATOM 0 HA3 GLY A 90 88.862 -8.545 -4.177 1.00 1.00 H new ATOM 1341 N PRO A 91 89.716 -5.761 -4.440 1.00 1.00 N ATOM 1342 CA PRO A 91 90.248 -4.470 -3.900 1.00 1.00 C ATOM 1343 C PRO A 91 89.101 -3.542 -3.520 1.00 1.00 C ATOM 1344 O PRO A 91 89.286 -2.535 -2.845 1.00 1.00 O ATOM 1345 CB PRO A 91 91.088 -3.918 -5.054 1.00 1.00 C ATOM 1346 CG PRO A 91 91.575 -5.137 -5.763 1.00 1.00 C ATOM 1347 CD PRO A 91 90.430 -6.157 -5.672 1.00 1.00 C ATOM 0 HA PRO A 91 90.836 -4.583 -2.990 1.00 1.00 H new ATOM 0 HB2 PRO A 91 90.494 -3.284 -5.712 1.00 1.00 H new ATOM 0 HB3 PRO A 91 91.917 -3.311 -4.689 1.00 1.00 H new ATOM 0 HG2 PRO A 91 91.819 -4.914 -6.802 1.00 1.00 H new ATOM 0 HG3 PRO A 91 92.482 -5.524 -5.298 1.00 1.00 H new ATOM 0 HD2 PRO A 91 89.780 -6.110 -6.546 1.00 1.00 H new ATOM 0 HD3 PRO A 91 90.806 -7.178 -5.608 1.00 1.00 H new ATOM 1355 N HIS A 92 87.910 -3.918 -3.973 1.00 1.00 N ATOM 1356 CA HIS A 92 86.727 -3.140 -3.686 1.00 1.00 C ATOM 1357 C HIS A 92 86.602 -3.038 -2.185 1.00 1.00 C ATOM 1358 O HIS A 92 85.911 -2.178 -1.693 1.00 1.00 O ATOM 1359 CB HIS A 92 85.446 -3.796 -4.262 1.00 1.00 C ATOM 1360 CG HIS A 92 84.927 -4.862 -3.307 1.00 1.00 C ATOM 1361 ND1 HIS A 92 84.396 -4.524 -2.071 1.00 1.00 N ATOM 1362 CD2 HIS A 92 84.892 -6.241 -3.353 1.00 1.00 C ATOM 1363 CE1 HIS A 92 84.080 -5.663 -1.433 1.00 1.00 C ATOM 1364 NE2 HIS A 92 84.364 -6.738 -2.166 1.00 1.00 N ATOM 0 H HIS A 92 87.746 -4.752 -4.536 1.00 1.00 H new ATOM 0 HA HIS A 92 86.826 -2.159 -4.151 1.00 1.00 H new ATOM 0 HB2 HIS A 92 84.680 -3.037 -4.422 1.00 1.00 H new ATOM 0 HB3 HIS A 92 85.662 -4.241 -5.233 1.00 1.00 H new ATOM 0 HD1 HIS A 92 84.268 -3.578 -1.711 1.00 1.00 H new ATOM 0 HD2 HIS A 92 85.225 -6.843 -4.185 1.00 1.00 H new ATOM 0 HE1 HIS A 92 83.647 -5.702 -0.444 1.00 1.00 H new ATOM 1372 N LEU A 93 87.313 -3.916 -1.466 1.00 1.00 N ATOM 1373 CA LEU A 93 87.280 -3.885 -0.012 1.00 1.00 C ATOM 1374 C LEU A 93 87.960 -2.612 0.467 1.00 1.00 C ATOM 1375 O LEU A 93 87.338 -1.778 1.127 1.00 1.00 O ATOM 1376 CB LEU A 93 87.956 -5.134 0.598 1.00 1.00 C ATOM 1377 CG LEU A 93 89.408 -5.316 0.060 1.00 1.00 C ATOM 1378 CD1 LEU A 93 90.446 -4.782 1.081 1.00 1.00 C ATOM 1379 CD2 LEU A 93 89.693 -6.810 -0.195 1.00 1.00 C ATOM 0 H LEU A 93 87.907 -4.643 -1.866 1.00 1.00 H new ATOM 0 HA LEU A 93 86.242 -3.894 0.320 1.00 1.00 H new ATOM 0 HB2 LEU A 93 87.978 -5.044 1.684 1.00 1.00 H new ATOM 0 HB3 LEU A 93 87.366 -6.020 0.363 1.00 1.00 H new ATOM 0 HG LEU A 93 89.494 -4.753 -0.869 1.00 1.00 H new ATOM 0 HD11 LEU A 93 91.452 -4.920 0.683 1.00 1.00 H new ATOM 0 HD12 LEU A 93 90.269 -3.721 1.259 1.00 1.00 H new ATOM 0 HD13 LEU A 93 90.348 -5.329 2.019 1.00 1.00 H new ATOM 0 HD21 LEU A 93 90.709 -6.928 -0.571 1.00 1.00 H new ATOM 0 HD22 LEU A 93 89.584 -7.365 0.737 1.00 1.00 H new ATOM 0 HD23 LEU A 93 88.987 -7.194 -0.931 1.00 1.00 H new ATOM 1391 N ALA A 94 89.232 -2.442 0.112 1.00 1.00 N ATOM 1392 CA ALA A 94 89.945 -1.238 0.506 1.00 1.00 C ATOM 1393 C ALA A 94 89.181 -0.025 0.000 1.00 1.00 C ATOM 1394 O ALA A 94 88.848 0.871 0.768 1.00 1.00 O ATOM 1395 CB ALA A 94 91.357 -1.234 -0.073 1.00 1.00 C ATOM 0 H ALA A 94 89.777 -3.108 -0.435 1.00 1.00 H new ATOM 0 HA ALA A 94 90.020 -1.207 1.593 1.00 1.00 H new ATOM 0 HB1 ALA A 94 91.873 -0.324 0.234 1.00 1.00 H new ATOM 0 HB2 ALA A 94 91.903 -2.103 0.294 1.00 1.00 H new ATOM 0 HB3 ALA A 94 91.304 -1.272 -1.161 1.00 1.00 H new ATOM 1401 N ARG A 95 88.886 -0.001 -1.297 1.00 1.00 N ATOM 1402 CA ARG A 95 88.133 1.128 -1.824 1.00 1.00 C ATOM 1403 C ARG A 95 86.825 1.213 -1.057 1.00 1.00 C ATOM 1404 O ARG A 95 86.495 2.228 -0.423 1.00 1.00 O ATOM 1405 CB ARG A 95 87.862 0.988 -3.319 1.00 1.00 C ATOM 1406 CG ARG A 95 89.173 1.196 -4.070 1.00 1.00 C ATOM 1407 CD ARG A 95 88.922 1.128 -5.572 1.00 1.00 C ATOM 1408 NE ARG A 95 88.542 -0.228 -5.961 1.00 1.00 N ATOM 1409 CZ ARG A 95 87.269 -0.580 -6.127 1.00 1.00 C ATOM 1410 NH1 ARG A 95 86.308 0.269 -5.868 1.00 1.00 N ATOM 1411 NH2 ARG A 95 86.979 -1.785 -6.530 1.00 1.00 N ATOM 0 H ARG A 95 89.144 -0.718 -1.975 1.00 1.00 H new ATOM 0 HA ARG A 95 88.719 2.039 -1.697 1.00 1.00 H new ATOM 0 HB2 ARG A 95 87.452 0.002 -3.539 1.00 1.00 H new ATOM 0 HB3 ARG A 95 87.121 1.720 -3.640 1.00 1.00 H new ATOM 0 HG2 ARG A 95 89.604 2.162 -3.807 1.00 1.00 H new ATOM 0 HG3 ARG A 95 89.895 0.434 -3.778 1.00 1.00 H new ATOM 0 HD2 ARG A 95 88.133 1.828 -5.848 1.00 1.00 H new ATOM 0 HD3 ARG A 95 89.819 1.431 -6.112 1.00 1.00 H new ATOM 0 HE ARG A 95 89.272 -0.924 -6.110 1.00 1.00 H new ATOM 0 HH11 ARG A 95 86.532 1.207 -5.537 1.00 1.00 H new ATOM 0 HH12 ARG A 95 85.335 -0.007 -5.997 1.00 1.00 H new ATOM 0 HH21 ARG A 95 87.726 -2.454 -6.717 1.00 1.00 H new ATOM 0 HH22 ARG A 95 86.005 -2.059 -6.659 1.00 1.00 H new ATOM 1425 N ALA A 96 86.022 0.170 -1.051 1.00 1.00 N ATOM 1426 CA ALA A 96 84.782 0.278 -0.334 1.00 1.00 C ATOM 1427 C ALA A 96 85.021 0.867 1.058 1.00 1.00 C ATOM 1428 O ALA A 96 84.058 1.040 1.797 1.00 1.00 O ATOM 1429 CB ALA A 96 84.015 -1.047 -0.316 1.00 1.00 C ATOM 0 H ALA A 96 86.198 -0.722 -1.514 1.00 1.00 H new ATOM 0 HA ALA A 96 84.132 0.975 -0.863 1.00 1.00 H new ATOM 0 HB1 ALA A 96 83.084 -0.921 0.236 1.00 1.00 H new ATOM 0 HB2 ALA A 96 83.792 -1.352 -1.338 1.00 1.00 H new ATOM 0 HB3 ALA A 96 84.622 -1.812 0.167 1.00 1.00 H new ATOM 1435 N LEU A 97 86.330 0.937 1.481 1.00 1.00 N ATOM 1436 CA LEU A 97 86.746 1.228 2.871 1.00 1.00 C ATOM 1437 C LEU A 97 85.546 1.290 3.771 1.00 1.00 C ATOM 1438 O LEU A 97 85.543 0.571 4.754 1.00 1.00 O ATOM 1439 CB LEU A 97 87.375 2.634 2.829 1.00 1.00 C ATOM 1440 CG LEU A 97 87.903 3.086 4.204 1.00 1.00 C ATOM 1441 CD1 LEU A 97 89.255 2.426 4.512 1.00 1.00 C ATOM 1442 CD2 LEU A 97 88.067 4.613 4.177 1.00 1.00 C ATOM 0 H LEU A 97 87.118 0.790 0.851 1.00 1.00 H new ATOM 0 HA LEU A 97 87.426 0.462 3.243 1.00 1.00 H new ATOM 0 HB2 LEU A 97 88.193 2.641 2.109 1.00 1.00 H new ATOM 0 HB3 LEU A 97 86.633 3.350 2.475 1.00 1.00 H new ATOM 0 HG LEU A 97 87.198 2.789 4.980 1.00 1.00 H new ATOM 0 HD11 LEU A 97 89.609 2.760 5.488 1.00 1.00 H new ATOM 0 HD12 LEU A 97 89.138 1.342 4.520 1.00 1.00 H new ATOM 0 HD13 LEU A 97 89.980 2.707 3.748 1.00 1.00 H new ATOM 0 HD21 LEU A 97 88.440 4.956 5.142 1.00 1.00 H new ATOM 0 HD22 LEU A 97 88.774 4.889 3.395 1.00 1.00 H new ATOM 0 HD23 LEU A 97 87.103 5.079 3.975 1.00 1.00 H new ATOM 1454 N GLY A 98 84.525 2.050 3.522 1.00 1.00 N ATOM 1455 CA GLY A 98 83.384 1.960 4.392 1.00 1.00 C ATOM 1456 C GLY A 98 83.027 0.468 4.553 1.00 1.00 C ATOM 1457 O GLY A 98 82.465 0.080 5.566 1.00 1.00 O ATOM 0 H GLY A 98 84.452 2.718 2.754 1.00 1.00 H new ATOM 0 HA2 GLY A 98 83.607 2.406 5.361 1.00 1.00 H new ATOM 0 HA3 GLY A 98 82.541 2.511 3.974 1.00 1.00 H new ATOM 1461 N GLN A 99 83.418 -0.394 3.577 1.00 1.00 N ATOM 1462 CA GLN A 99 83.142 -1.830 3.766 1.00 1.00 C ATOM 1463 C GLN A 99 83.931 -2.276 4.963 1.00 1.00 C ATOM 1464 O GLN A 99 83.648 -3.317 5.554 1.00 1.00 O ATOM 1465 CB GLN A 99 83.589 -2.668 2.560 1.00 1.00 C ATOM 1466 CG GLN A 99 82.381 -3.255 1.780 1.00 1.00 C ATOM 1467 CD GLN A 99 81.372 -2.179 1.366 1.00 1.00 C ATOM 1468 OE1 GLN A 99 81.197 -1.177 2.059 1.00 1.00 O ATOM 1469 NE2 GLN A 99 80.715 -2.313 0.242 1.00 1.00 N ATOM 0 H GLN A 99 83.892 -0.139 2.711 1.00 1.00 H new ATOM 0 HA GLN A 99 82.068 -1.970 3.891 1.00 1.00 H new ATOM 0 HB2 GLN A 99 84.187 -2.050 1.891 1.00 1.00 H new ATOM 0 HB3 GLN A 99 84.230 -3.481 2.901 1.00 1.00 H new ATOM 0 HG2 GLN A 99 82.743 -3.771 0.891 1.00 1.00 H new ATOM 0 HG3 GLN A 99 81.880 -4.000 2.399 1.00 1.00 H new ATOM 0 HE21 GLN A 99 80.857 -3.142 -0.336 1.00 1.00 H new ATOM 0 HE22 GLN A 99 80.061 -1.589 -0.056 1.00 1.00 H new ATOM 1478 N ILE A 100 84.915 -1.471 5.333 1.00 1.00 N ATOM 1479 CA ILE A 100 85.733 -1.797 6.499 1.00 1.00 C ATOM 1480 C ILE A 100 84.859 -1.719 7.749 1.00 1.00 C ATOM 1481 O ILE A 100 84.924 -2.599 8.605 1.00 1.00 O ATOM 1482 CB ILE A 100 86.977 -0.857 6.618 1.00 1.00 C ATOM 1483 CG1 ILE A 100 88.139 -1.601 7.326 1.00 1.00 C ATOM 1484 CG2 ILE A 100 86.633 0.411 7.417 1.00 1.00 C ATOM 1485 CD1 ILE A 100 88.950 -2.395 6.298 1.00 1.00 C ATOM 0 H ILE A 100 85.166 -0.604 4.857 1.00 1.00 H new ATOM 0 HA ILE A 100 86.122 -2.809 6.387 1.00 1.00 H new ATOM 0 HB ILE A 100 87.279 -0.570 5.611 1.00 1.00 H new ATOM 0 HG12 ILE A 100 88.783 -0.885 7.837 1.00 1.00 H new ATOM 0 HG13 ILE A 100 87.742 -2.273 8.087 1.00 1.00 H new ATOM 0 HG21 ILE A 100 87.515 1.048 7.486 1.00 1.00 H new ATOM 0 HG22 ILE A 100 85.832 0.952 6.913 1.00 1.00 H new ATOM 0 HG23 ILE A 100 86.308 0.132 8.419 1.00 1.00 H new ATOM 0 HD11 ILE A 100 89.765 -2.916 6.801 1.00 1.00 H new ATOM 0 HD12 ILE A 100 88.303 -3.122 5.807 1.00 1.00 H new ATOM 0 HD13 ILE A 100 89.360 -1.713 5.553 1.00 1.00 H new ATOM 1497 N VAL A 101 84.013 -0.676 7.855 1.00 1.00 N ATOM 1498 CA VAL A 101 83.140 -0.590 9.031 1.00 1.00 C ATOM 1499 C VAL A 101 82.375 -1.900 9.108 1.00 1.00 C ATOM 1500 O VAL A 101 82.454 -2.620 10.088 1.00 1.00 O ATOM 1501 CB VAL A 101 82.193 0.659 8.990 1.00 1.00 C ATOM 1502 CG1 VAL A 101 80.855 0.365 8.297 1.00 1.00 C ATOM 1503 CG2 VAL A 101 81.877 1.104 10.421 1.00 1.00 C ATOM 0 H VAL A 101 83.919 0.080 7.177 1.00 1.00 H new ATOM 0 HA VAL A 101 83.735 -0.446 9.933 1.00 1.00 H new ATOM 0 HB VAL A 101 82.717 1.431 8.427 1.00 1.00 H new ATOM 0 HG11 VAL A 101 80.240 1.265 8.298 1.00 1.00 H new ATOM 0 HG12 VAL A 101 81.039 0.052 7.269 1.00 1.00 H new ATOM 0 HG13 VAL A 101 80.335 -0.430 8.831 1.00 1.00 H new ATOM 0 HG21 VAL A 101 81.219 1.972 10.395 1.00 1.00 H new ATOM 0 HG22 VAL A 101 81.384 0.291 10.954 1.00 1.00 H new ATOM 0 HG23 VAL A 101 82.803 1.366 10.933 1.00 1.00 H new ATOM 1513 N CYS A 102 81.648 -2.204 8.057 1.00 1.00 N ATOM 1514 CA CYS A 102 80.871 -3.430 8.014 1.00 1.00 C ATOM 1515 C CYS A 102 81.674 -4.638 8.522 1.00 1.00 C ATOM 1516 O CYS A 102 81.100 -5.632 8.941 1.00 1.00 O ATOM 1517 CB CYS A 102 80.443 -3.675 6.572 1.00 1.00 C ATOM 1518 SG CYS A 102 79.185 -4.967 6.526 1.00 1.00 S ATOM 0 H CYS A 102 81.576 -1.624 7.221 1.00 1.00 H new ATOM 0 HA CYS A 102 80.006 -3.316 8.667 1.00 1.00 H new ATOM 0 HB2 CYS A 102 80.051 -2.756 6.137 1.00 1.00 H new ATOM 0 HB3 CYS A 102 81.304 -3.970 5.972 1.00 1.00 H new ATOM 1523 N ARG A 103 82.994 -4.531 8.519 1.00 1.00 N ATOM 1524 CA ARG A 103 83.852 -5.617 9.020 1.00 1.00 C ATOM 1525 C ARG A 103 84.193 -5.426 10.505 1.00 1.00 C ATOM 1526 O ARG A 103 84.126 -6.346 11.319 1.00 1.00 O ATOM 1527 CB ARG A 103 85.139 -5.680 8.147 1.00 1.00 C ATOM 1528 CG ARG A 103 86.405 -6.056 8.963 1.00 1.00 C ATOM 1529 CD ARG A 103 86.236 -7.421 9.674 1.00 1.00 C ATOM 1530 NE ARG A 103 86.692 -7.340 11.062 1.00 1.00 N ATOM 1531 CZ ARG A 103 87.914 -6.911 11.379 1.00 1.00 C ATOM 1532 NH1 ARG A 103 88.745 -6.533 10.445 1.00 1.00 N ATOM 1533 NH2 ARG A 103 88.276 -6.876 12.634 1.00 1.00 N ATOM 0 H ARG A 103 83.500 -3.713 8.180 1.00 1.00 H new ATOM 0 HA ARG A 103 83.316 -6.563 8.944 1.00 1.00 H new ATOM 0 HB2 ARG A 103 84.996 -6.410 7.351 1.00 1.00 H new ATOM 0 HB3 ARG A 103 85.295 -4.713 7.669 1.00 1.00 H new ATOM 0 HG2 ARG A 103 87.269 -6.095 8.299 1.00 1.00 H new ATOM 0 HG3 ARG A 103 86.606 -5.281 9.703 1.00 1.00 H new ATOM 0 HD2 ARG A 103 85.189 -7.724 9.647 1.00 1.00 H new ATOM 0 HD3 ARG A 103 86.803 -8.186 9.144 1.00 1.00 H new ATOM 0 HE ARG A 103 86.056 -7.620 11.809 1.00 1.00 H new ATOM 0 HH11 ARG A 103 88.461 -6.565 9.466 1.00 1.00 H new ATOM 0 HH12 ARG A 103 89.678 -6.206 10.695 1.00 1.00 H new ATOM 0 HH21 ARG A 103 87.626 -7.175 13.361 1.00 1.00 H new ATOM 0 HH22 ARG A 103 89.209 -6.549 12.887 1.00 1.00 H new ATOM 1547 N TYR A 104 84.536 -4.197 10.812 1.00 1.00 N ATOM 1548 CA TYR A 104 84.897 -3.720 12.146 1.00 1.00 C ATOM 1549 C TYR A 104 83.767 -2.872 12.763 1.00 1.00 C ATOM 1550 O TYR A 104 84.023 -2.094 13.679 1.00 1.00 O ATOM 1551 CB TYR A 104 86.291 -3.024 12.143 1.00 1.00 C ATOM 1552 CG TYR A 104 86.205 -1.537 12.391 1.00 1.00 C ATOM 1553 CD1 TYR A 104 85.998 -0.680 11.318 1.00 1.00 C ATOM 1554 CD2 TYR A 104 86.344 -1.020 13.691 1.00 1.00 C ATOM 1555 CE1 TYR A 104 85.925 0.703 11.523 1.00 1.00 C ATOM 1556 CE2 TYR A 104 86.270 0.365 13.905 1.00 1.00 C ATOM 1557 CZ TYR A 104 86.062 1.228 12.819 1.00 1.00 C ATOM 1558 OH TYR A 104 85.999 2.597 13.023 1.00 1.00 O ATOM 0 H TYR A 104 84.576 -3.458 10.110 1.00 1.00 H new ATOM 0 HA TYR A 104 85.006 -4.581 12.806 1.00 1.00 H new ATOM 0 HB2 TYR A 104 86.921 -3.479 12.908 1.00 1.00 H new ATOM 0 HB3 TYR A 104 86.777 -3.200 11.184 1.00 1.00 H new ATOM 0 HD1 TYR A 104 85.893 -1.082 10.321 1.00 1.00 H new ATOM 0 HD2 TYR A 104 86.508 -1.688 14.524 1.00 1.00 H new ATOM 0 HE1 TYR A 104 85.764 1.366 10.686 1.00 1.00 H new ATOM 0 HE2 TYR A 104 86.373 0.765 14.903 1.00 1.00 H new ATOM 0 HH TYR A 104 86.111 2.791 13.977 1.00 1.00 H new ATOM 1568 N GLY A 105 82.506 -3.018 12.320 1.00 1.00 N ATOM 1569 CA GLY A 105 81.457 -2.219 12.938 1.00 1.00 C ATOM 1570 C GLY A 105 80.055 -2.621 12.490 1.00 1.00 C ATOM 1571 O GLY A 105 79.092 -2.113 13.047 1.00 1.00 O ATOM 0 H GLY A 105 82.207 -3.649 11.576 1.00 1.00 H new ATOM 0 HA2 GLY A 105 81.527 -2.314 14.022 1.00 1.00 H new ATOM 0 HA3 GLY A 105 81.621 -1.168 12.699 1.00 1.00 H new ATOM 1575 N ALA A 106 79.949 -3.494 11.471 1.00 1.00 N ATOM 1576 CA ALA A 106 78.647 -3.933 10.935 1.00 1.00 C ATOM 1577 C ALA A 106 77.517 -3.890 11.965 1.00 1.00 C ATOM 1578 O ALA A 106 77.000 -4.922 12.356 1.00 1.00 O ATOM 1579 CB ALA A 106 78.783 -5.372 10.360 1.00 1.00 C ATOM 0 H ALA A 106 80.753 -3.911 11.001 1.00 1.00 H new ATOM 0 HA ALA A 106 78.375 -3.228 10.150 1.00 1.00 H new ATOM 0 HB1 ALA A 106 77.821 -5.698 9.963 1.00 1.00 H new ATOM 0 HB2 ALA A 106 79.525 -5.376 9.562 1.00 1.00 H new ATOM 0 HB3 ALA A 106 79.098 -6.052 11.152 1.00 1.00 H new ATOM 1585 N THR A 107 77.108 -2.700 12.383 1.00 1.00 N ATOM 1586 CA THR A 107 76.010 -2.572 13.317 1.00 1.00 C ATOM 1587 C THR A 107 74.752 -2.418 12.497 1.00 1.00 C ATOM 1588 O THR A 107 73.655 -2.257 13.031 1.00 1.00 O ATOM 1589 CB THR A 107 76.187 -1.341 14.210 1.00 1.00 C ATOM 1590 OG1 THR A 107 75.123 -1.293 15.149 1.00 1.00 O ATOM 1591 CG2 THR A 107 76.173 -0.073 13.345 1.00 1.00 C ATOM 0 H THR A 107 77.522 -1.815 12.088 1.00 1.00 H new ATOM 0 HA THR A 107 75.966 -3.447 13.965 1.00 1.00 H new ATOM 0 HB THR A 107 77.138 -1.402 14.738 1.00 1.00 H new ATOM 0 HG1 THR A 107 74.307 -1.648 14.738 1.00 1.00 H new ATOM 0 HG21 THR A 107 76.299 0.803 13.981 1.00 1.00 H new ATOM 0 HG22 THR A 107 76.988 -0.117 12.622 1.00 1.00 H new ATOM 0 HG23 THR A 107 75.222 -0.004 12.816 1.00 1.00 H new ATOM 1599 N VAL A 108 74.917 -2.489 11.171 1.00 1.00 N ATOM 1600 CA VAL A 108 73.787 -2.388 10.278 1.00 1.00 C ATOM 1601 C VAL A 108 73.131 -3.747 10.093 1.00 1.00 C ATOM 1602 O VAL A 108 71.937 -3.878 10.343 1.00 1.00 O ATOM 1603 CB VAL A 108 74.204 -1.821 8.921 1.00 1.00 C ATOM 1604 CG1 VAL A 108 72.971 -1.705 8.015 1.00 1.00 C ATOM 1605 CG2 VAL A 108 74.821 -0.434 9.111 1.00 1.00 C ATOM 0 H VAL A 108 75.818 -2.615 10.709 1.00 1.00 H new ATOM 0 HA VAL A 108 73.068 -1.704 10.729 1.00 1.00 H new ATOM 0 HB VAL A 108 74.936 -2.486 8.463 1.00 1.00 H new ATOM 0 HG11 VAL A 108 73.267 -1.301 7.047 1.00 1.00 H new ATOM 0 HG12 VAL A 108 72.528 -2.691 7.876 1.00 1.00 H new ATOM 0 HG13 VAL A 108 72.241 -1.041 8.477 1.00 1.00 H new ATOM 0 HG21 VAL A 108 75.118 -0.032 8.142 1.00 1.00 H new ATOM 0 HG22 VAL A 108 74.089 0.230 9.571 1.00 1.00 H new ATOM 0 HG23 VAL A 108 75.697 -0.511 9.755 1.00 1.00 H new ATOM 1615 N ILE A 109 73.872 -4.773 9.623 1.00 1.00 N ATOM 1616 CA ILE A 109 73.295 -6.094 9.380 1.00 1.00 C ATOM 1617 C ILE A 109 72.813 -6.834 10.660 1.00 1.00 C ATOM 1618 O ILE A 109 71.777 -7.485 10.595 1.00 1.00 O ATOM 1619 CB ILE A 109 74.336 -6.960 8.533 1.00 1.00 C ATOM 1620 CG1 ILE A 109 74.606 -8.341 9.180 1.00 1.00 C ATOM 1621 CG2 ILE A 109 75.674 -6.216 8.406 1.00 1.00 C ATOM 1622 CD1 ILE A 109 75.639 -9.162 8.376 1.00 1.00 C ATOM 0 H ILE A 109 74.867 -4.703 9.408 1.00 1.00 H new ATOM 0 HA ILE A 109 72.378 -5.952 8.808 1.00 1.00 H new ATOM 0 HB ILE A 109 73.889 -7.113 7.551 1.00 1.00 H new ATOM 0 HG12 ILE A 109 74.968 -8.200 10.199 1.00 1.00 H new ATOM 0 HG13 ILE A 109 73.672 -8.899 9.248 1.00 1.00 H new ATOM 0 HG21 ILE A 109 76.372 -6.820 7.826 1.00 1.00 H new ATOM 0 HG22 ILE A 109 75.514 -5.263 7.903 1.00 1.00 H new ATOM 0 HG23 ILE A 109 76.087 -6.037 9.399 1.00 1.00 H new ATOM 0 HD11 ILE A 109 75.799 -10.123 8.864 1.00 1.00 H new ATOM 0 HD12 ILE A 109 75.266 -9.326 7.365 1.00 1.00 H new ATOM 0 HD13 ILE A 109 76.582 -8.617 8.331 1.00 1.00 H new ATOM 1634 N PRO A 110 73.495 -6.801 11.802 1.00 1.00 N ATOM 1635 CA PRO A 110 73.021 -7.559 13.011 1.00 1.00 C ATOM 1636 C PRO A 110 71.529 -7.337 13.315 1.00 1.00 C ATOM 1637 O PRO A 110 70.804 -8.291 13.595 1.00 1.00 O ATOM 1638 CB PRO A 110 73.922 -7.067 14.166 1.00 1.00 C ATOM 1639 CG PRO A 110 74.693 -5.905 13.617 1.00 1.00 C ATOM 1640 CD PRO A 110 74.746 -6.090 12.096 1.00 1.00 C ATOM 0 HA PRO A 110 73.100 -8.635 12.854 1.00 1.00 H new ATOM 0 HB2 PRO A 110 73.325 -6.768 15.027 1.00 1.00 H new ATOM 0 HB3 PRO A 110 74.593 -7.857 14.502 1.00 1.00 H new ATOM 0 HG2 PRO A 110 74.209 -4.963 13.876 1.00 1.00 H new ATOM 0 HG3 PRO A 110 75.698 -5.874 14.038 1.00 1.00 H new ATOM 0 HD2 PRO A 110 74.798 -5.134 11.575 1.00 1.00 H new ATOM 0 HD3 PRO A 110 75.619 -6.667 11.790 1.00 1.00 H new ATOM 1648 N ASN A 111 71.069 -6.087 13.319 1.00 1.00 N ATOM 1649 CA ASN A 111 69.663 -5.838 13.642 1.00 1.00 C ATOM 1650 C ASN A 111 68.780 -6.461 12.572 1.00 1.00 C ATOM 1651 O ASN A 111 68.054 -7.421 12.829 1.00 1.00 O ATOM 1652 CB ASN A 111 69.414 -4.331 13.714 1.00 1.00 C ATOM 1653 CG ASN A 111 67.929 -4.052 13.894 1.00 1.00 C ATOM 1654 OD1 ASN A 111 67.267 -4.688 14.712 1.00 1.00 O ATOM 1655 ND2 ASN A 111 67.369 -3.129 13.166 1.00 1.00 N ATOM 0 H ASN A 111 71.624 -5.257 13.111 1.00 1.00 H new ATOM 0 HA ASN A 111 69.424 -6.285 14.607 1.00 1.00 H new ATOM 0 HB2 ASN A 111 69.975 -3.901 14.544 1.00 1.00 H new ATOM 0 HB3 ASN A 111 69.774 -3.852 12.804 1.00 1.00 H new ATOM 0 HD21 ASN A 111 66.374 -2.929 13.272 1.00 1.00 H new ATOM 0 HD22 ASN A 111 67.925 -2.606 12.490 1.00 1.00 H new ATOM 1662 N ILE A 112 68.851 -5.920 11.367 1.00 1.00 N ATOM 1663 CA ILE A 112 68.051 -6.442 10.262 1.00 1.00 C ATOM 1664 C ILE A 112 68.229 -7.957 10.210 1.00 1.00 C ATOM 1665 O ILE A 112 67.316 -8.725 9.916 1.00 1.00 O ATOM 1666 CB ILE A 112 68.588 -5.854 8.958 1.00 1.00 C ATOM 1667 CG1 ILE A 112 68.697 -4.324 9.065 1.00 1.00 C ATOM 1668 CG2 ILE A 112 67.659 -6.224 7.808 1.00 1.00 C ATOM 1669 CD1 ILE A 112 67.370 -3.739 9.541 1.00 1.00 C ATOM 0 H ILE A 112 69.447 -5.128 11.126 1.00 1.00 H new ATOM 0 HA ILE A 112 67.001 -6.183 10.397 1.00 1.00 H new ATOM 0 HB ILE A 112 69.580 -6.264 8.770 1.00 1.00 H new ATOM 0 HG12 ILE A 112 69.493 -4.055 9.760 1.00 1.00 H new ATOM 0 HG13 ILE A 112 68.964 -3.901 8.096 1.00 1.00 H new ATOM 0 HG21 ILE A 112 68.044 -5.803 6.879 1.00 1.00 H new ATOM 0 HG22 ILE A 112 67.604 -7.309 7.720 1.00 1.00 H new ATOM 0 HG23 ILE A 112 66.663 -5.825 8.002 1.00 1.00 H new ATOM 0 HD11 ILE A 112 67.456 -2.655 9.614 1.00 1.00 H new ATOM 0 HD12 ILE A 112 66.584 -3.994 8.830 1.00 1.00 H new ATOM 0 HD13 ILE A 112 67.121 -4.150 10.519 1.00 1.00 H new ATOM 1681 N ASN A 113 69.466 -8.320 10.444 1.00 1.00 N ATOM 1682 CA ASN A 113 69.865 -9.730 10.374 1.00 1.00 C ATOM 1683 C ASN A 113 68.854 -10.538 11.138 1.00 1.00 C ATOM 1684 O ASN A 113 68.317 -11.492 10.592 1.00 1.00 O ATOM 1685 CB ASN A 113 71.265 -10.017 10.928 1.00 1.00 C ATOM 1686 CG ASN A 113 71.443 -11.508 11.239 1.00 1.00 C ATOM 1687 OD1 ASN A 113 71.173 -11.941 12.360 1.00 1.00 O ATOM 1688 ND2 ASN A 113 71.882 -12.321 10.316 1.00 1.00 N ATOM 0 H ASN A 113 70.219 -7.675 10.684 1.00 1.00 H new ATOM 0 HA ASN A 113 69.901 -10.002 9.319 1.00 1.00 H new ATOM 0 HB2 ASN A 113 72.017 -9.701 10.205 1.00 1.00 H new ATOM 0 HB3 ASN A 113 71.428 -9.432 11.833 1.00 1.00 H new ATOM 0 HD21 ASN A 113 72.001 -13.312 10.524 1.00 1.00 H new ATOM 0 HD22 ASN A 113 72.106 -11.964 9.387 1.00 1.00 H new ATOM 1695 N ALA A 114 68.544 -10.173 12.374 1.00 1.00 N ATOM 1696 CA ALA A 114 67.557 -10.921 13.111 1.00 1.00 C ATOM 1697 C ALA A 114 66.207 -10.849 12.411 1.00 1.00 C ATOM 1698 O ALA A 114 65.416 -11.790 12.505 1.00 1.00 O ATOM 1699 CB ALA A 114 67.434 -10.350 14.521 1.00 1.00 C ATOM 0 H ALA A 114 68.954 -9.382 12.871 1.00 1.00 H new ATOM 0 HA ALA A 114 67.870 -11.964 13.163 1.00 1.00 H new ATOM 0 HB1 ALA A 114 66.688 -10.916 15.079 1.00 1.00 H new ATOM 0 HB2 ALA A 114 68.396 -10.421 15.028 1.00 1.00 H new ATOM 0 HB3 ALA A 114 67.130 -9.305 14.465 1.00 1.00 H new ATOM 1705 N ALA A 115 65.910 -9.752 11.688 1.00 1.00 N ATOM 1706 CA ALA A 115 64.637 -9.671 10.996 1.00 1.00 C ATOM 1707 C ALA A 115 64.678 -10.512 9.730 1.00 1.00 C ATOM 1708 O ALA A 115 63.894 -11.439 9.586 1.00 1.00 O ATOM 1709 CB ALA A 115 64.323 -8.225 10.629 1.00 1.00 C ATOM 0 H ALA A 115 66.520 -8.942 11.577 1.00 1.00 H new ATOM 0 HA ALA A 115 63.860 -10.049 11.660 1.00 1.00 H new ATOM 0 HB1 ALA A 115 63.365 -8.181 10.111 1.00 1.00 H new ATOM 0 HB2 ALA A 115 64.273 -7.622 11.536 1.00 1.00 H new ATOM 0 HB3 ALA A 115 65.106 -7.837 9.978 1.00 1.00 H new ATOM 1715 N ILE A 116 65.591 -10.194 8.793 1.00 1.00 N ATOM 1716 CA ILE A 116 65.700 -10.941 7.528 1.00 1.00 C ATOM 1717 C ILE A 116 65.762 -12.438 7.822 1.00 1.00 C ATOM 1718 O ILE A 116 65.044 -13.245 7.241 1.00 1.00 O ATOM 1719 CB ILE A 116 67.005 -10.418 6.796 1.00 1.00 C ATOM 1720 CG1 ILE A 116 66.682 -9.936 5.368 1.00 1.00 C ATOM 1721 CG2 ILE A 116 68.113 -11.473 6.710 1.00 1.00 C ATOM 1722 CD1 ILE A 116 65.893 -8.615 5.413 1.00 1.00 C ATOM 0 H ILE A 116 66.260 -9.429 8.888 1.00 1.00 H new ATOM 0 HA ILE A 116 64.836 -10.784 6.883 1.00 1.00 H new ATOM 0 HB ILE A 116 67.368 -9.591 7.406 1.00 1.00 H new ATOM 0 HG12 ILE A 116 67.606 -9.796 4.807 1.00 1.00 H new ATOM 0 HG13 ILE A 116 66.102 -10.696 4.843 1.00 1.00 H new ATOM 0 HG21 ILE A 116 68.978 -11.051 6.198 1.00 1.00 H new ATOM 0 HG22 ILE A 116 68.401 -11.781 7.715 1.00 1.00 H new ATOM 0 HG23 ILE A 116 67.749 -12.338 6.156 1.00 1.00 H new ATOM 0 HD11 ILE A 116 65.673 -8.288 4.397 1.00 1.00 H new ATOM 0 HD12 ILE A 116 64.960 -8.767 5.956 1.00 1.00 H new ATOM 0 HD13 ILE A 116 66.487 -7.854 5.918 1.00 1.00 H new ATOM 1734 N GLU A 117 66.657 -12.754 8.733 1.00 1.00 N ATOM 1735 CA GLU A 117 66.852 -14.153 9.121 1.00 1.00 C ATOM 1736 C GLU A 117 65.461 -14.755 9.242 1.00 1.00 C ATOM 1737 O GLU A 117 65.133 -15.706 8.546 1.00 1.00 O ATOM 1738 CB GLU A 117 67.676 -14.338 10.410 1.00 1.00 C ATOM 1739 CG GLU A 117 69.193 -14.374 10.073 1.00 1.00 C ATOM 1740 CD GLU A 117 69.982 -15.120 11.145 1.00 1.00 C ATOM 1741 OE1 GLU A 117 69.373 -15.619 12.075 1.00 1.00 O ATOM 1742 OE2 GLU A 117 71.196 -15.195 11.006 1.00 1.00 O ATOM 0 H GLU A 117 67.255 -12.084 9.216 1.00 1.00 H new ATOM 0 HA GLU A 117 67.448 -14.663 8.364 1.00 1.00 H new ATOM 0 HB2 GLU A 117 67.469 -13.523 11.104 1.00 1.00 H new ATOM 0 HB3 GLU A 117 67.384 -15.263 10.908 1.00 1.00 H new ATOM 0 HG2 GLU A 117 69.342 -14.857 9.107 1.00 1.00 H new ATOM 0 HG3 GLU A 117 69.572 -13.356 9.982 1.00 1.00 H new ATOM 1749 N VAL A 118 64.622 -14.145 10.064 1.00 1.00 N ATOM 1750 CA VAL A 118 63.242 -14.631 10.177 1.00 1.00 C ATOM 1751 C VAL A 118 62.578 -14.569 8.786 1.00 1.00 C ATOM 1752 O VAL A 118 62.010 -15.560 8.322 1.00 1.00 O ATOM 1753 CB VAL A 118 62.449 -13.769 11.177 1.00 1.00 C ATOM 1754 CG1 VAL A 118 60.983 -14.222 11.227 1.00 1.00 C ATOM 1755 CG2 VAL A 118 63.077 -13.895 12.570 1.00 1.00 C ATOM 0 H VAL A 118 64.853 -13.340 10.647 1.00 1.00 H new ATOM 0 HA VAL A 118 63.247 -15.659 10.541 1.00 1.00 H new ATOM 0 HB VAL A 118 62.483 -12.729 10.853 1.00 1.00 H new ATOM 0 HG11 VAL A 118 60.435 -13.604 11.938 1.00 1.00 H new ATOM 0 HG12 VAL A 118 60.537 -14.120 10.238 1.00 1.00 H new ATOM 0 HG13 VAL A 118 60.935 -15.265 11.541 1.00 1.00 H new ATOM 0 HG21 VAL A 118 62.516 -13.285 13.278 1.00 1.00 H new ATOM 0 HG22 VAL A 118 63.051 -14.937 12.888 1.00 1.00 H new ATOM 0 HG23 VAL A 118 64.111 -13.552 12.535 1.00 1.00 H new ATOM 1765 N LEU A 119 62.626 -13.393 8.142 1.00 1.00 N ATOM 1766 CA LEU A 119 61.989 -13.250 6.823 1.00 1.00 C ATOM 1767 C LEU A 119 62.500 -14.391 5.918 1.00 1.00 C ATOM 1768 O LEU A 119 61.764 -15.336 5.646 1.00 1.00 O ATOM 1769 CB LEU A 119 62.381 -11.870 6.230 1.00 1.00 C ATOM 1770 CG LEU A 119 61.299 -11.303 5.280 1.00 1.00 C ATOM 1771 CD1 LEU A 119 60.873 -12.370 4.261 1.00 1.00 C ATOM 1772 CD2 LEU A 119 60.070 -10.802 6.075 1.00 1.00 C ATOM 0 H LEU A 119 63.083 -12.553 8.497 1.00 1.00 H new ATOM 0 HA LEU A 119 60.903 -13.306 6.900 1.00 1.00 H new ATOM 0 HB2 LEU A 119 62.552 -11.164 7.043 1.00 1.00 H new ATOM 0 HB3 LEU A 119 63.322 -11.965 5.688 1.00 1.00 H new ATOM 0 HG LEU A 119 61.728 -10.455 4.746 1.00 1.00 H new ATOM 0 HD11 LEU A 119 60.111 -11.958 3.599 1.00 1.00 H new ATOM 0 HD12 LEU A 119 61.738 -12.677 3.673 1.00 1.00 H new ATOM 0 HD13 LEU A 119 60.467 -13.234 4.787 1.00 1.00 H new ATOM 0 HD21 LEU A 119 59.325 -10.409 5.383 1.00 1.00 H new ATOM 0 HD22 LEU A 119 59.640 -11.629 6.640 1.00 1.00 H new ATOM 0 HD23 LEU A 119 60.378 -10.015 6.763 1.00 1.00 H new ATOM 1784 N GLY A 120 63.764 -14.327 5.470 1.00 1.00 N ATOM 1785 CA GLY A 120 64.277 -15.414 4.617 1.00 1.00 C ATOM 1786 C GLY A 120 64.331 -16.735 5.409 1.00 1.00 C ATOM 1787 O GLY A 120 63.473 -17.602 5.282 1.00 1.00 O ATOM 0 H GLY A 120 64.423 -13.574 5.670 1.00 1.00 H new ATOM 0 HA2 GLY A 120 63.637 -15.532 3.743 1.00 1.00 H new ATOM 0 HA3 GLY A 120 65.272 -15.160 4.252 1.00 1.00 H new ATOM 1791 N THR A 121 65.381 -16.802 6.201 1.00 1.00 N ATOM 1792 CA THR A 121 65.685 -17.956 7.078 1.00 1.00 C ATOM 1793 C THR A 121 67.178 -18.056 7.371 1.00 1.00 C ATOM 1794 O THR A 121 67.571 -18.566 8.419 1.00 1.00 O ATOM 1795 CB THR A 121 65.192 -19.275 6.418 1.00 1.00 C ATOM 1796 OG1 THR A 121 63.788 -19.404 6.587 1.00 1.00 O ATOM 1797 CG2 THR A 121 65.863 -20.511 7.042 1.00 1.00 C ATOM 0 H THR A 121 66.070 -16.053 6.268 1.00 1.00 H new ATOM 0 HA THR A 121 65.162 -17.802 8.022 1.00 1.00 H new ATOM 0 HB THR A 121 65.454 -19.224 5.361 1.00 1.00 H new ATOM 0 HG1 THR A 121 63.328 -18.764 6.004 1.00 1.00 H new ATOM 0 HG21 THR A 121 65.492 -21.412 6.554 1.00 1.00 H new ATOM 0 HG22 THR A 121 66.943 -20.445 6.909 1.00 1.00 H new ATOM 0 HG23 THR A 121 65.630 -20.553 8.106 1.00 1.00 H new ATOM 1805 N GLY A 122 68.006 -17.636 6.420 1.00 1.00 N ATOM 1806 CA GLY A 122 69.456 -17.755 6.560 1.00 1.00 C ATOM 1807 C GLY A 122 69.902 -18.912 5.681 1.00 1.00 C ATOM 1808 O GLY A 122 71.074 -19.034 5.339 1.00 1.00 O ATOM 0 H GLY A 122 67.700 -17.211 5.545 1.00 1.00 H new ATOM 0 HA2 GLY A 122 69.948 -16.831 6.258 1.00 1.00 H new ATOM 0 HA3 GLY A 122 69.728 -17.935 7.600 1.00 1.00 H new ATOM 1812 N THR A 123 68.911 -19.736 5.320 1.00 1.00 N ATOM 1813 CA THR A 123 69.189 -20.883 4.445 1.00 1.00 C ATOM 1814 C THR A 123 69.837 -20.303 3.178 1.00 1.00 C ATOM 1815 O THR A 123 69.198 -20.107 2.143 1.00 1.00 O ATOM 1816 CB THR A 123 67.908 -21.678 4.124 1.00 1.00 C ATOM 1817 OG1 THR A 123 68.257 -22.844 3.390 1.00 1.00 O ATOM 1818 CG2 THR A 123 66.927 -20.826 3.302 1.00 1.00 C ATOM 0 H THR A 123 67.938 -19.637 5.609 1.00 1.00 H new ATOM 0 HA THR A 123 69.854 -21.597 4.931 1.00 1.00 H new ATOM 0 HB THR A 123 67.421 -21.955 5.059 1.00 1.00 H new ATOM 0 HG1 THR A 123 67.447 -23.355 3.184 1.00 1.00 H new ATOM 0 HG21 THR A 123 66.031 -21.408 3.088 1.00 1.00 H new ATOM 0 HG22 THR A 123 66.655 -19.936 3.869 1.00 1.00 H new ATOM 0 HG23 THR A 123 67.399 -20.529 2.366 1.00 1.00 H new ATOM 1826 N ASP A 124 71.141 -20.077 3.322 1.00 1.00 N ATOM 1827 CA ASP A 124 71.995 -19.548 2.261 1.00 1.00 C ATOM 1828 C ASP A 124 73.473 -19.689 2.610 1.00 1.00 C ATOM 1829 O ASP A 124 73.837 -20.081 3.720 1.00 1.00 O ATOM 1830 CB ASP A 124 71.706 -18.059 2.036 1.00 1.00 C ATOM 1831 CG ASP A 124 70.313 -17.858 1.456 1.00 1.00 C ATOM 1832 OD1 ASP A 124 70.112 -18.205 0.304 1.00 1.00 O ATOM 1833 OD2 ASP A 124 69.466 -17.354 2.174 1.00 1.00 O ATOM 0 H ASP A 124 71.641 -20.259 4.192 1.00 1.00 H new ATOM 0 HA ASP A 124 71.777 -20.123 1.361 1.00 1.00 H new ATOM 0 HB2 ASP A 124 71.792 -17.521 2.980 1.00 1.00 H new ATOM 0 HB3 ASP A 124 72.450 -17.638 1.360 1.00 1.00 H new ATOM 1838 N TYR A 125 74.306 -19.264 1.669 1.00 1.00 N ATOM 1839 CA TYR A 125 75.752 -19.215 1.856 1.00 1.00 C ATOM 1840 C TYR A 125 76.260 -17.942 1.163 1.00 1.00 C ATOM 1841 O TYR A 125 75.804 -17.611 0.067 1.00 1.00 O ATOM 1842 CB TYR A 125 76.439 -20.474 1.291 1.00 1.00 C ATOM 1843 CG TYR A 125 77.909 -20.184 1.055 1.00 1.00 C ATOM 1844 CD1 TYR A 125 78.792 -20.079 2.139 1.00 1.00 C ATOM 1845 CD2 TYR A 125 78.376 -19.993 -0.249 1.00 1.00 C ATOM 1846 CE1 TYR A 125 80.143 -19.784 1.912 1.00 1.00 C ATOM 1847 CE2 TYR A 125 79.725 -19.702 -0.475 1.00 1.00 C ATOM 1848 CZ TYR A 125 80.609 -19.597 0.606 1.00 1.00 C ATOM 1849 OH TYR A 125 81.937 -19.302 0.381 1.00 1.00 O ATOM 0 H TYR A 125 73.998 -18.942 0.751 1.00 1.00 H new ATOM 0 HA TYR A 125 75.993 -19.191 2.919 1.00 1.00 H new ATOM 0 HB2 TYR A 125 76.328 -21.305 1.987 1.00 1.00 H new ATOM 0 HB3 TYR A 125 75.962 -20.774 0.358 1.00 1.00 H new ATOM 0 HD1 TYR A 125 78.432 -20.225 3.147 1.00 1.00 H new ATOM 0 HD2 TYR A 125 77.694 -20.070 -1.083 1.00 1.00 H new ATOM 0 HE1 TYR A 125 80.825 -19.701 2.745 1.00 1.00 H new ATOM 0 HE2 TYR A 125 80.085 -19.558 -1.483 1.00 1.00 H new ATOM 0 HH TYR A 125 82.092 -19.205 -0.582 1.00 1.00 H new ATOM 1859 N ARG A 126 77.218 -17.255 1.788 1.00 1.00 N ATOM 1860 CA ARG A 126 77.813 -16.036 1.219 1.00 1.00 C ATOM 1861 C ARG A 126 79.288 -15.948 1.607 1.00 1.00 C ATOM 1862 O ARG A 126 79.682 -16.389 2.688 1.00 1.00 O ATOM 1863 CB ARG A 126 77.093 -14.766 1.725 1.00 1.00 C ATOM 1864 CG ARG A 126 75.706 -14.604 1.072 1.00 1.00 C ATOM 1865 CD ARG A 126 75.831 -13.933 -0.308 1.00 1.00 C ATOM 1866 NE ARG A 126 76.057 -12.494 -0.156 1.00 1.00 N ATOM 1867 CZ ARG A 126 75.077 -11.596 -0.298 1.00 1.00 C ATOM 1868 NH1 ARG A 126 73.865 -11.970 -0.619 1.00 1.00 N ATOM 1869 NH2 ARG A 126 75.333 -10.329 -0.119 1.00 1.00 N ATOM 0 H ARG A 126 77.603 -17.521 2.694 1.00 1.00 H new ATOM 0 HA ARG A 126 77.707 -16.093 0.136 1.00 1.00 H new ATOM 0 HB2 ARG A 126 76.983 -14.816 2.808 1.00 1.00 H new ATOM 0 HB3 ARG A 126 77.703 -13.889 1.507 1.00 1.00 H new ATOM 0 HG2 ARG A 126 75.232 -15.580 0.966 1.00 1.00 H new ATOM 0 HG3 ARG A 126 75.062 -14.005 1.716 1.00 1.00 H new ATOM 0 HD2 ARG A 126 76.655 -14.380 -0.864 1.00 1.00 H new ATOM 0 HD3 ARG A 126 74.924 -14.106 -0.887 1.00 1.00 H new ATOM 0 HE ARG A 126 76.997 -12.165 0.066 1.00 1.00 H new ATOM 0 HH11 ARG A 126 73.658 -12.958 -0.764 1.00 1.00 H new ATOM 0 HH12 ARG A 126 73.127 -11.273 -0.724 1.00 1.00 H new ATOM 0 HH21 ARG A 126 76.276 -10.029 0.128 1.00 1.00 H new ATOM 0 HH22 ARG A 126 74.590 -9.639 -0.226 1.00 1.00 H new ATOM 1883 N PHE A 127 80.094 -15.364 0.730 1.00 1.00 N ATOM 1884 CA PHE A 127 81.520 -15.209 0.998 1.00 1.00 C ATOM 1885 C PHE A 127 81.739 -14.147 2.074 1.00 1.00 C ATOM 1886 O PHE A 127 81.792 -14.513 3.238 1.00 1.00 O ATOM 1887 CB PHE A 127 82.253 -14.813 -0.303 1.00 1.00 C ATOM 1888 CG PHE A 127 81.315 -14.032 -1.198 1.00 1.00 C ATOM 1889 CD1 PHE A 127 80.437 -14.714 -2.048 1.00 1.00 C ATOM 1890 CD2 PHE A 127 81.318 -12.630 -1.177 1.00 1.00 C ATOM 1891 CE1 PHE A 127 79.566 -13.998 -2.874 1.00 1.00 C ATOM 1892 CE2 PHE A 127 80.442 -11.915 -2.006 1.00 1.00 C ATOM 1893 CZ PHE A 127 79.567 -12.600 -2.855 1.00 1.00 C ATOM 1894 OXT PHE A 127 81.847 -12.985 1.718 1.00 1.00 O ATOM 0 H PHE A 127 79.788 -14.991 -0.169 1.00 1.00 H new ATOM 0 HA PHE A 127 81.923 -16.156 1.358 1.00 1.00 H new ATOM 0 HB2 PHE A 127 83.132 -14.212 -0.069 1.00 1.00 H new ATOM 0 HB3 PHE A 127 82.605 -15.706 -0.820 1.00 1.00 H new ATOM 0 HD1 PHE A 127 80.432 -15.794 -2.066 1.00 1.00 H new ATOM 0 HD2 PHE A 127 81.995 -12.101 -0.522 1.00 1.00 H new ATOM 0 HE1 PHE A 127 78.890 -14.527 -3.529 1.00 1.00 H new ATOM 0 HE2 PHE A 127 80.443 -10.835 -1.989 1.00 1.00 H new ATOM 0 HZ PHE A 127 78.893 -12.050 -3.495 1.00 1.00 H new TER 1904 PHE A 127 HETATM 1905 O1 MTN A 128 66.474 4.886 -10.707 1.00 1.00 O HETATM 1906 N1 MTN A 128 66.218 4.370 -9.579 1.00 1.00 N HETATM 1907 C1 MTN A 128 66.365 2.937 -9.302 1.00 1.00 C HETATM 1908 C2 MTN A 128 65.944 2.916 -7.868 1.00 1.00 C HETATM 1909 C3 MTN A 128 65.608 4.097 -7.388 1.00 1.00 C HETATM 1910 C4 MTN A 128 65.140 4.364 -5.984 1.00 1.00 C HETATM 1911 S1 MTN A 128 66.304 5.316 -4.974 1.00 1.00 S HETATM 1912 C5 MTN A 128 65.734 5.188 -8.421 1.00 1.00 C HETATM 1913 C6 MTN A 128 64.419 5.916 -8.663 1.00 1.00 C HETATM 1914 C7 MTN A 128 66.824 6.178 -8.021 1.00 1.00 C HETATM 1915 C8 MTN A 128 65.434 2.077 -10.160 1.00 1.00 C HETATM 1916 C9 MTN A 128 67.826 2.545 -9.504 1.00 1.00 C HETATM 0 H93 MTN A 128 68.120 2.754 -10.532 1.00 1.00 H new HETATM 0 H92 MTN A 128 68.454 3.119 -8.823 1.00 1.00 H new HETATM 0 H91 MTN A 128 67.949 1.481 -9.301 1.00 1.00 H new HETATM 0 H83 MTN A 128 64.398 2.353 -9.962 1.00 1.00 H new HETATM 0 H82 MTN A 128 65.657 2.240 -11.214 1.00 1.00 H new HETATM 0 H81 MTN A 128 65.583 1.025 -9.916 1.00 1.00 H new HETATM 0 H73 MTN A 128 67.723 5.633 -7.735 1.00 1.00 H new HETATM 0 H72 MTN A 128 67.049 6.832 -8.864 1.00 1.00 H new HETATM 0 H71 MTN A 128 66.480 6.778 -7.178 1.00 1.00 H new HETATM 0 H63 MTN A 128 64.530 6.598 -9.506 1.00 1.00 H new HETATM 0 H62 MTN A 128 63.637 5.190 -8.885 1.00 1.00 H new HETATM 0 H61 MTN A 128 64.147 6.482 -7.772 1.00 1.00 H new HETATM 0 H42 MTN A 128 64.192 4.900 -6.026 1.00 1.00 H new HETATM 0 H41 MTN A 128 64.946 3.411 -5.492 1.00 1.00 H new HETATM 0 H2 MTN A 128 65.917 2.004 -7.271 1.00 1.00 H new HETATM 1932 O1 MTN A 129 70.972 -10.437 -4.466 1.00 1.00 O HETATM 1933 N1 MTN A 129 70.489 -9.283 -4.652 1.00 1.00 N HETATM 1934 C1 MTN A 129 70.898 -8.427 -5.767 1.00 1.00 C HETATM 1935 C2 MTN A 129 70.044 -7.236 -5.489 1.00 1.00 C HETATM 1936 C3 MTN A 129 69.277 -7.362 -4.408 1.00 1.00 C HETATM 1937 C4 MTN A 129 68.333 -6.314 -3.879 1.00 1.00 C HETATM 1938 S1 MTN A 129 68.661 -5.762 -2.175 1.00 1.00 S HETATM 1939 C5 MTN A 129 69.457 -8.711 -3.742 1.00 1.00 C HETATM 1940 C6 MTN A 129 69.841 -8.663 -2.267 1.00 1.00 C HETATM 1941 C7 MTN A 129 68.190 -9.545 -3.918 1.00 1.00 C HETATM 1942 C8 MTN A 129 72.410 -8.106 -5.744 1.00 1.00 C HETATM 1943 C9 MTN A 129 70.494 -9.112 -7.066 1.00 1.00 C HETATM 0 H93 MTN A 129 70.990 -10.080 -7.136 1.00 1.00 H new HETATM 0 H92 MTN A 129 69.414 -9.255 -7.081 1.00 1.00 H new HETATM 0 H91 MTN A 129 70.789 -8.491 -7.912 1.00 1.00 H new HETATM 0 H83 MTN A 129 72.658 -7.590 -4.817 1.00 1.00 H new HETATM 0 H82 MTN A 129 72.980 -9.033 -5.807 1.00 1.00 H new HETATM 0 H81 MTN A 129 72.660 -7.469 -6.592 1.00 1.00 H new HETATM 0 H73 MTN A 129 67.860 -9.490 -4.955 1.00 1.00 H new HETATM 0 H72 MTN A 129 68.398 -10.583 -3.658 1.00 1.00 H new HETATM 0 H71 MTN A 129 67.406 -9.158 -3.267 1.00 1.00 H new HETATM 0 H63 MTN A 129 70.041 -9.673 -1.910 1.00 1.00 H new HETATM 0 H62 MTN A 129 70.734 -8.051 -2.143 1.00 1.00 H new HETATM 0 H61 MTN A 129 69.022 -8.230 -1.692 1.00 1.00 H new HETATM 0 H42 MTN A 129 68.372 -5.447 -4.538 1.00 1.00 H new HETATM 0 H41 MTN A 129 67.317 -6.706 -3.928 1.00 1.00 H new HETATM 0 H2 MTN A 129 70.048 -6.343 -6.114 1.00 1.00 H new HETATM 1959 O1 MTN A 130 82.627 -10.261 5.167 1.00 1.00 O HETATM 1960 N1 MTN A 130 81.799 -9.303 5.128 1.00 1.00 N HETATM 1961 C1 MTN A 130 80.586 -9.253 5.973 1.00 1.00 C HETATM 1962 C2 MTN A 130 80.013 -7.964 5.520 1.00 1.00 C HETATM 1963 C3 MTN A 130 80.737 -7.357 4.592 1.00 1.00 C HETATM 1964 C4 MTN A 130 80.406 -6.048 3.958 1.00 1.00 C HETATM 1965 S1 MTN A 130 78.878 -5.275 4.552 1.00 1.00 S HETATM 1966 C5 MTN A 130 81.977 -8.138 4.223 1.00 1.00 C HETATM 1967 C6 MTN A 130 82.061 -8.483 2.742 1.00 1.00 C HETATM 1968 C7 MTN A 130 83.220 -7.374 4.666 1.00 1.00 C HETATM 1969 C8 MTN A 130 79.626 -10.415 5.719 1.00 1.00 C HETATM 1970 C9 MTN A 130 80.978 -9.175 7.440 1.00 1.00 C HETATM 0 H93 MTN A 130 81.565 -10.054 7.707 1.00 1.00 H new HETATM 0 H92 MTN A 130 81.571 -8.277 7.611 1.00 1.00 H new HETATM 0 H91 MTN A 130 80.079 -9.139 8.055 1.00 1.00 H new HETATM 0 H83 MTN A 130 79.302 -10.399 4.678 1.00 1.00 H new HETATM 0 H82 MTN A 130 80.133 -11.358 5.927 1.00 1.00 H new HETATM 0 H81 MTN A 130 78.758 -10.319 6.371 1.00 1.00 H new HETATM 0 H73 MTN A 130 83.091 -7.033 5.693 1.00 1.00 H new HETATM 0 H72 MTN A 130 84.089 -8.029 4.608 1.00 1.00 H new HETATM 0 H71 MTN A 130 83.370 -6.513 4.014 1.00 1.00 H new HETATM 0 H63 MTN A 130 82.910 -9.145 2.570 1.00 1.00 H new HETATM 0 H62 MTN A 130 81.143 -8.982 2.432 1.00 1.00 H new HETATM 0 H61 MTN A 130 82.190 -7.569 2.162 1.00 1.00 H new HETATM 0 H42 MTN A 130 81.234 -5.359 4.128 1.00 1.00 H new HETATM 0 H41 MTN A 130 80.327 -6.193 2.880 1.00 1.00 H new HETATM 0 H2 MTN A 130 79.083 -7.554 5.914 1.00 1.00 H new