USER MOD reduce.3.24.130724 H: found=0, std=0, add=977, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 973 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 70 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 65 HIS : no HD1:sc= -2.06 K(o=-2,f=-2.5!) USER MOD Set 2.2: A 87 TYR OH : rot -69:sc= 0.0971 USER MOD Set 3.1: A 62 GLN :FLIP amide:sc= -4.03! C(o=-9!,f=-5.6!) USER MOD Set 3.2: A 103 THR OG1 : rot 180:sc= -1.61 USER MOD Single : A 1 GLY N :NH3+ -126:sc= 0.122 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 69:sc=0.000721 USER MOD Single : A 13 SER OG : rot 57:sc= 0.291 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 HIS : no HD1:sc= -0.189 X(o=-0.19,f=-0.013) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot -108:sc= 0.128 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc=-0.00687 X(o=-0.0069,f=-0.053) USER MOD Single : A 55 ASN : amide:sc= -0.925 K(o=-0.93,f=-2.2!) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 THR OG1 : rot 41:sc= -2.16! USER MOD Single : A 68 ASN : amide:sc= -5.33! C(o=-5.3!,f=-6.4!) USER MOD Single : A 69 THR OG1 : rot 72:sc= 1.07 USER MOD Single : A 71 THR OG1 : rot 43:sc= 0.42! USER MOD Single : A 73 ASN : amide:sc=-0.00982 X(o=-0.0098,f=0) USER MOD Single : A 74 THR OG1 : rot 59:sc= 0.0951 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 86 GLN : amide:sc= -0.119 K(o=-0.12,f=-0.77) USER MOD Single : A 88 THR OG1 : rot 180:sc= -0.935 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 5:sc= -0.865 USER MOD Single : A 98 TYR OH : rot 180:sc= 1.02 USER MOD Single : A 105 GLN : amide:sc= -0.345 K(o=-0.34,f=-3.4!) USER MOD Single : A 106 THR OG1 : rot 73:sc= -1.51 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 THR OG1 : rot 180:sc= 0.89 USER MOD Single : A 121 THR OG1 : rot 180:sc= -0.431 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 69.454 -41.705 14.284 1.00 0.00 N ATOM 2 CA GLY A 1 68.580 -41.310 13.192 1.00 0.00 C ATOM 3 C GLY A 1 67.670 -40.153 13.609 1.00 0.00 C ATOM 4 O GLY A 1 67.859 -39.562 14.671 1.00 0.00 O ATOM 0 H1 GLY A 1 70.443 -41.687 13.961 1.00 0.00 H new ATOM 0 H2 GLY A 1 69.337 -41.044 15.079 1.00 0.00 H new ATOM 0 H3 GLY A 1 69.209 -42.667 14.595 1.00 0.00 H new ATOM 0 HA2 GLY A 1 69.179 -41.014 12.331 1.00 0.00 H new ATOM 0 HA3 GLY A 1 67.973 -42.161 12.881 1.00 0.00 H new ATOM 8 N SER A 2 66.703 -39.864 12.751 1.00 0.00 N ATOM 9 CA SER A 2 65.763 -38.788 13.017 1.00 0.00 C ATOM 10 C SER A 2 64.745 -38.690 11.879 1.00 0.00 C ATOM 11 O SER A 2 64.890 -39.351 10.852 1.00 0.00 O ATOM 12 CB SER A 2 66.490 -37.454 13.195 1.00 0.00 C ATOM 13 OG SER A 2 66.005 -36.728 14.321 1.00 0.00 O ATOM 0 H SER A 2 66.550 -40.356 11.871 1.00 0.00 H new ATOM 0 HA SER A 2 65.239 -39.012 13.946 1.00 0.00 H new ATOM 0 HB2 SER A 2 67.558 -37.636 13.314 1.00 0.00 H new ATOM 0 HB3 SER A 2 66.368 -36.851 12.295 1.00 0.00 H new ATOM 0 HG SER A 2 66.495 -35.883 14.402 1.00 0.00 H new ATOM 19 N SER A 3 63.737 -37.859 12.101 1.00 0.00 N ATOM 20 CA SER A 3 62.694 -37.666 11.107 1.00 0.00 C ATOM 21 C SER A 3 61.916 -36.384 11.408 1.00 0.00 C ATOM 22 O SER A 3 62.079 -35.790 12.473 1.00 0.00 O ATOM 23 CB SER A 3 61.745 -38.865 11.064 1.00 0.00 C ATOM 24 OG SER A 3 60.822 -38.855 12.150 1.00 0.00 O ATOM 0 H SER A 3 63.620 -37.312 12.954 1.00 0.00 H new ATOM 0 HA SER A 3 63.166 -37.576 10.129 1.00 0.00 H new ATOM 0 HB2 SER A 3 61.197 -38.860 10.122 1.00 0.00 H new ATOM 0 HB3 SER A 3 62.325 -39.787 11.090 1.00 0.00 H new ATOM 0 HG SER A 3 60.233 -39.635 12.086 1.00 0.00 H new ATOM 30 N GLY A 4 61.086 -35.995 10.451 1.00 0.00 N ATOM 31 CA GLY A 4 60.282 -34.794 10.601 1.00 0.00 C ATOM 32 C GLY A 4 59.226 -34.701 9.498 1.00 0.00 C ATOM 33 O GLY A 4 59.035 -35.646 8.735 1.00 0.00 O ATOM 0 H GLY A 4 60.953 -36.490 9.569 1.00 0.00 H new ATOM 0 HA2 GLY A 4 59.795 -34.797 11.576 1.00 0.00 H new ATOM 0 HA3 GLY A 4 60.925 -33.915 10.569 1.00 0.00 H new ATOM 37 N SER A 5 58.567 -33.552 9.449 1.00 0.00 N ATOM 38 CA SER A 5 57.534 -33.323 8.453 1.00 0.00 C ATOM 39 C SER A 5 57.094 -31.858 8.483 1.00 0.00 C ATOM 40 O SER A 5 57.242 -31.182 9.499 1.00 0.00 O ATOM 41 CB SER A 5 56.334 -34.244 8.682 1.00 0.00 C ATOM 42 OG SER A 5 55.454 -33.735 9.680 1.00 0.00 O ATOM 0 H SER A 5 58.729 -32.770 10.083 1.00 0.00 H new ATOM 0 HA SER A 5 57.949 -33.550 7.471 1.00 0.00 H new ATOM 0 HB2 SER A 5 55.788 -34.368 7.747 1.00 0.00 H new ATOM 0 HB3 SER A 5 56.686 -35.232 8.979 1.00 0.00 H new ATOM 0 HG SER A 5 54.700 -34.350 9.796 1.00 0.00 H new ATOM 48 N SER A 6 56.560 -31.411 7.355 1.00 0.00 N ATOM 49 CA SER A 6 56.096 -30.039 7.240 1.00 0.00 C ATOM 50 C SER A 6 55.705 -29.739 5.792 1.00 0.00 C ATOM 51 O SER A 6 56.068 -30.481 4.880 1.00 0.00 O ATOM 52 CB SER A 6 57.166 -29.054 7.716 1.00 0.00 C ATOM 53 OG SER A 6 56.728 -28.288 8.834 1.00 0.00 O ATOM 0 H SER A 6 56.439 -31.975 6.514 1.00 0.00 H new ATOM 0 HA SER A 6 55.221 -29.919 7.878 1.00 0.00 H new ATOM 0 HB2 SER A 6 58.069 -29.602 7.984 1.00 0.00 H new ATOM 0 HB3 SER A 6 57.430 -28.383 6.898 1.00 0.00 H new ATOM 0 HG SER A 6 56.644 -28.871 9.617 1.00 0.00 H new ATOM 59 N GLY A 7 54.970 -28.649 5.624 1.00 0.00 N ATOM 60 CA GLY A 7 54.526 -28.242 4.302 1.00 0.00 C ATOM 61 C GLY A 7 53.283 -27.353 4.391 1.00 0.00 C ATOM 62 O GLY A 7 52.230 -27.796 4.846 1.00 0.00 O ATOM 0 H GLY A 7 54.671 -28.035 6.382 1.00 0.00 H new ATOM 0 HA2 GLY A 7 55.327 -27.704 3.795 1.00 0.00 H new ATOM 0 HA3 GLY A 7 54.305 -29.124 3.701 1.00 0.00 H new ATOM 66 N ARG A 8 53.448 -26.115 3.948 1.00 0.00 N ATOM 67 CA ARG A 8 52.353 -25.160 3.972 1.00 0.00 C ATOM 68 C ARG A 8 52.271 -24.414 2.639 1.00 0.00 C ATOM 69 O ARG A 8 53.293 -24.021 2.079 1.00 0.00 O ATOM 70 CB ARG A 8 52.530 -24.148 5.105 1.00 0.00 C ATOM 71 CG ARG A 8 53.958 -23.597 5.131 1.00 0.00 C ATOM 72 CD ARG A 8 54.877 -24.496 5.960 1.00 0.00 C ATOM 73 NE ARG A 8 55.392 -23.752 7.131 1.00 0.00 N ATOM 74 CZ ARG A 8 56.107 -22.622 7.047 1.00 0.00 C ATOM 75 NH1 ARG A 8 56.398 -22.100 5.848 1.00 0.00 N ATOM 76 NH2 ARG A 8 56.533 -22.014 8.163 1.00 0.00 N ATOM 0 H ARG A 8 54.323 -25.751 3.571 1.00 0.00 H new ATOM 0 HA ARG A 8 51.431 -25.717 4.138 1.00 0.00 H new ATOM 0 HB2 ARG A 8 51.823 -23.328 4.979 1.00 0.00 H new ATOM 0 HB3 ARG A 8 52.302 -24.622 6.060 1.00 0.00 H new ATOM 0 HG2 ARG A 8 54.340 -23.520 4.113 1.00 0.00 H new ATOM 0 HG3 ARG A 8 53.956 -22.590 5.548 1.00 0.00 H new ATOM 0 HD2 ARG A 8 54.332 -25.380 6.291 1.00 0.00 H new ATOM 0 HD3 ARG A 8 55.708 -24.845 5.347 1.00 0.00 H new ATOM 0 HE ARG A 8 55.190 -24.122 8.060 1.00 0.00 H new ATOM 0 HH11 ARG A 8 56.075 -22.563 4.998 1.00 0.00 H new ATOM 0 HH12 ARG A 8 56.942 -21.240 5.785 1.00 0.00 H new ATOM 0 HH21 ARG A 8 56.313 -22.412 9.076 1.00 0.00 H new ATOM 0 HH22 ARG A 8 57.077 -21.154 8.099 1.00 0.00 H new ATOM 90 N ILE A 9 51.044 -24.241 2.169 1.00 0.00 N ATOM 91 CA ILE A 9 50.815 -23.549 0.912 1.00 0.00 C ATOM 92 C ILE A 9 49.920 -22.333 1.160 1.00 0.00 C ATOM 93 O ILE A 9 49.435 -22.132 2.272 1.00 0.00 O ATOM 94 CB ILE A 9 50.263 -24.515 -0.139 1.00 0.00 C ATOM 95 CG1 ILE A 9 49.038 -25.262 0.393 1.00 0.00 C ATOM 96 CG2 ILE A 9 51.351 -25.473 -0.627 1.00 0.00 C ATOM 97 CD1 ILE A 9 48.026 -25.520 -0.725 1.00 0.00 C ATOM 0 H ILE A 9 50.198 -24.568 2.636 1.00 0.00 H new ATOM 0 HA ILE A 9 51.755 -23.176 0.506 1.00 0.00 H new ATOM 0 HB ILE A 9 49.936 -23.933 -1.001 1.00 0.00 H new ATOM 0 HG12 ILE A 9 49.348 -26.210 0.834 1.00 0.00 H new ATOM 0 HG13 ILE A 9 48.569 -24.680 1.186 1.00 0.00 H new ATOM 0 HG21 ILE A 9 50.933 -26.149 -1.373 1.00 0.00 H new ATOM 0 HG22 ILE A 9 52.166 -24.902 -1.071 1.00 0.00 H new ATOM 0 HG23 ILE A 9 51.730 -26.052 0.215 1.00 0.00 H new ATOM 0 HD11 ILE A 9 47.165 -26.052 -0.321 1.00 0.00 H new ATOM 0 HD12 ILE A 9 47.700 -24.569 -1.147 1.00 0.00 H new ATOM 0 HD13 ILE A 9 48.491 -26.123 -1.505 1.00 0.00 H new ATOM 109 N GLY A 10 49.728 -21.555 0.105 1.00 0.00 N ATOM 110 CA GLY A 10 48.900 -20.364 0.195 1.00 0.00 C ATOM 111 C GLY A 10 49.591 -19.276 1.020 1.00 0.00 C ATOM 112 O GLY A 10 50.092 -19.544 2.111 1.00 0.00 O ATOM 0 H GLY A 10 50.131 -21.726 -0.816 1.00 0.00 H new ATOM 0 HA2 GLY A 10 48.689 -19.987 -0.806 1.00 0.00 H new ATOM 0 HA3 GLY A 10 47.942 -20.616 0.649 1.00 0.00 H new ATOM 116 N ASP A 11 49.595 -18.072 0.467 1.00 0.00 N ATOM 117 CA ASP A 11 50.216 -16.943 1.138 1.00 0.00 C ATOM 118 C ASP A 11 50.316 -15.768 0.163 1.00 0.00 C ATOM 119 O ASP A 11 50.783 -15.930 -0.963 1.00 0.00 O ATOM 120 CB ASP A 11 51.630 -17.290 1.607 1.00 0.00 C ATOM 121 CG ASP A 11 52.452 -18.123 0.621 1.00 0.00 C ATOM 122 OD1 ASP A 11 52.044 -18.170 -0.560 1.00 0.00 O ATOM 123 OD2 ASP A 11 53.469 -18.693 1.070 1.00 0.00 O ATOM 0 H ASP A 11 49.178 -17.854 -0.438 1.00 0.00 H new ATOM 0 HA ASP A 11 49.603 -16.686 2.002 1.00 0.00 H new ATOM 0 HB2 ASP A 11 52.166 -16.363 1.812 1.00 0.00 H new ATOM 0 HB3 ASP A 11 51.561 -17.833 2.549 1.00 0.00 H new ATOM 128 N GLY A 12 49.869 -14.612 0.631 1.00 0.00 N ATOM 129 CA GLY A 12 49.903 -13.410 -0.185 1.00 0.00 C ATOM 130 C GLY A 12 48.640 -13.294 -1.042 1.00 0.00 C ATOM 131 O GLY A 12 48.592 -13.813 -2.156 1.00 0.00 O ATOM 0 H GLY A 12 49.481 -14.482 1.565 1.00 0.00 H new ATOM 0 HA2 GLY A 12 49.994 -12.533 0.456 1.00 0.00 H new ATOM 0 HA3 GLY A 12 50.783 -13.427 -0.828 1.00 0.00 H new ATOM 135 N SER A 13 47.649 -12.611 -0.489 1.00 0.00 N ATOM 136 CA SER A 13 46.390 -12.420 -1.188 1.00 0.00 C ATOM 137 C SER A 13 45.438 -11.581 -0.333 1.00 0.00 C ATOM 138 O SER A 13 44.546 -12.120 0.320 1.00 0.00 O ATOM 139 CB SER A 13 45.745 -13.763 -1.538 1.00 0.00 C ATOM 140 OG SER A 13 45.616 -14.606 -0.396 1.00 0.00 O ATOM 0 H SER A 13 47.692 -12.183 0.436 1.00 0.00 H new ATOM 0 HA SER A 13 46.593 -11.891 -2.119 1.00 0.00 H new ATOM 0 HB2 SER A 13 44.761 -13.590 -1.974 1.00 0.00 H new ATOM 0 HB3 SER A 13 46.345 -14.267 -2.295 1.00 0.00 H new ATOM 0 HG SER A 13 45.096 -14.144 0.294 1.00 0.00 H new ATOM 146 N PRO A 14 45.667 -10.241 -0.366 1.00 0.00 N ATOM 147 CA PRO A 14 44.841 -9.321 0.398 1.00 0.00 C ATOM 148 C PRO A 14 43.471 -9.139 -0.260 1.00 0.00 C ATOM 149 O PRO A 14 42.443 -9.429 0.348 1.00 0.00 O ATOM 150 CB PRO A 14 45.644 -8.033 0.465 1.00 0.00 C ATOM 151 CG PRO A 14 46.673 -8.125 -0.650 1.00 0.00 C ATOM 152 CD PRO A 14 46.715 -9.567 -1.128 1.00 0.00 C ATOM 0 HA PRO A 14 44.619 -9.688 1.400 1.00 0.00 H new ATOM 0 HB2 PRO A 14 45.000 -7.164 0.331 1.00 0.00 H new ATOM 0 HB3 PRO A 14 46.128 -7.925 1.435 1.00 0.00 H new ATOM 0 HG2 PRO A 14 46.407 -7.459 -1.471 1.00 0.00 H new ATOM 0 HG3 PRO A 14 47.654 -7.813 -0.291 1.00 0.00 H new ATOM 0 HD2 PRO A 14 46.531 -9.634 -2.200 1.00 0.00 H new ATOM 0 HD3 PRO A 14 47.690 -10.017 -0.944 1.00 0.00 H new ATOM 160 N SER A 15 43.503 -8.659 -1.495 1.00 0.00 N ATOM 161 CA SER A 15 42.277 -8.434 -2.242 1.00 0.00 C ATOM 162 C SER A 15 41.196 -7.871 -1.318 1.00 0.00 C ATOM 163 O SER A 15 40.429 -8.626 -0.722 1.00 0.00 O ATOM 164 CB SER A 15 41.791 -9.726 -2.903 1.00 0.00 C ATOM 165 OG SER A 15 40.634 -9.511 -3.708 1.00 0.00 O ATOM 0 H SER A 15 44.358 -8.420 -1.997 1.00 0.00 H new ATOM 0 HA SER A 15 42.484 -7.710 -3.030 1.00 0.00 H new ATOM 0 HB2 SER A 15 42.589 -10.141 -3.519 1.00 0.00 H new ATOM 0 HB3 SER A 15 41.565 -10.464 -2.134 1.00 0.00 H new ATOM 0 HG SER A 15 40.356 -10.359 -4.114 1.00 0.00 H new ATOM 171 N HIS A 16 41.171 -6.550 -1.226 1.00 0.00 N ATOM 172 CA HIS A 16 40.197 -5.877 -0.384 1.00 0.00 C ATOM 173 C HIS A 16 38.861 -5.777 -1.123 1.00 0.00 C ATOM 174 O HIS A 16 38.832 -5.628 -2.344 1.00 0.00 O ATOM 175 CB HIS A 16 40.723 -4.515 0.075 1.00 0.00 C ATOM 176 CG HIS A 16 40.955 -3.536 -1.051 1.00 0.00 C ATOM 177 ND1 HIS A 16 40.035 -2.563 -1.399 1.00 0.00 N ATOM 178 CD2 HIS A 16 42.012 -3.388 -1.901 1.00 0.00 C ATOM 179 CE1 HIS A 16 40.525 -1.868 -2.415 1.00 0.00 C ATOM 180 NE2 HIS A 16 41.750 -2.381 -2.725 1.00 0.00 N ATOM 0 H HIS A 16 41.810 -5.927 -1.721 1.00 0.00 H new ATOM 0 HA HIS A 16 40.030 -6.461 0.521 1.00 0.00 H new ATOM 0 HB2 HIS A 16 40.013 -4.081 0.780 1.00 0.00 H new ATOM 0 HB3 HIS A 16 41.659 -4.661 0.614 1.00 0.00 H new ATOM 0 HD2 HIS A 16 42.910 -3.988 -1.903 1.00 0.00 H new ATOM 0 HE1 HIS A 16 40.039 -1.040 -2.911 1.00 0.00 H new ATOM 0 HE2 HIS A 16 42.364 -2.046 -3.468 1.00 0.00 H new ATOM 188 N PRO A 17 37.758 -5.866 -0.332 1.00 0.00 N ATOM 189 CA PRO A 17 36.423 -5.787 -0.898 1.00 0.00 C ATOM 190 C PRO A 17 36.074 -4.348 -1.282 1.00 0.00 C ATOM 191 O PRO A 17 36.580 -3.401 -0.682 1.00 0.00 O ATOM 192 CB PRO A 17 35.507 -6.354 0.174 1.00 0.00 C ATOM 193 CG PRO A 17 36.298 -6.298 1.471 1.00 0.00 C ATOM 194 CD PRO A 17 37.754 -6.042 1.117 1.00 0.00 C ATOM 0 HA PRO A 17 36.326 -6.351 -1.826 1.00 0.00 H new ATOM 0 HB2 PRO A 17 34.589 -5.772 0.251 1.00 0.00 H new ATOM 0 HB3 PRO A 17 35.216 -7.378 -0.062 1.00 0.00 H new ATOM 0 HG2 PRO A 17 35.917 -5.507 2.117 1.00 0.00 H new ATOM 0 HG3 PRO A 17 36.197 -7.234 2.020 1.00 0.00 H new ATOM 0 HD2 PRO A 17 38.135 -5.156 1.625 1.00 0.00 H new ATOM 0 HD3 PRO A 17 38.387 -6.877 1.416 1.00 0.00 H new ATOM 202 N PRO A 18 35.188 -4.225 -2.307 1.00 0.00 N ATOM 203 CA PRO A 18 34.766 -2.917 -2.779 1.00 0.00 C ATOM 204 C PRO A 18 33.778 -2.276 -1.803 1.00 0.00 C ATOM 205 O PRO A 18 33.149 -2.969 -1.004 1.00 0.00 O ATOM 206 CB PRO A 18 34.165 -3.170 -4.152 1.00 0.00 C ATOM 207 CG PRO A 18 33.850 -4.656 -4.203 1.00 0.00 C ATOM 208 CD PRO A 18 34.568 -5.324 -3.042 1.00 0.00 C ATOM 0 HA PRO A 18 35.590 -2.207 -2.844 1.00 0.00 H new ATOM 0 HB2 PRO A 18 33.264 -2.575 -4.299 1.00 0.00 H new ATOM 0 HB3 PRO A 18 34.863 -2.892 -4.941 1.00 0.00 H new ATOM 0 HG2 PRO A 18 32.775 -4.821 -4.133 1.00 0.00 H new ATOM 0 HG3 PRO A 18 34.177 -5.083 -5.151 1.00 0.00 H new ATOM 0 HD2 PRO A 18 33.872 -5.878 -2.412 1.00 0.00 H new ATOM 0 HD3 PRO A 18 35.315 -6.035 -3.395 1.00 0.00 H new ATOM 216 N ILE A 19 33.671 -0.958 -1.899 1.00 0.00 N ATOM 217 CA ILE A 19 32.770 -0.215 -1.035 1.00 0.00 C ATOM 218 C ILE A 19 31.415 -0.925 -0.987 1.00 0.00 C ATOM 219 O ILE A 19 31.064 -1.662 -1.906 1.00 0.00 O ATOM 220 CB ILE A 19 32.684 1.246 -1.480 1.00 0.00 C ATOM 221 CG1 ILE A 19 33.965 2.004 -1.126 1.00 0.00 C ATOM 222 CG2 ILE A 19 31.439 1.922 -0.903 1.00 0.00 C ATOM 223 CD1 ILE A 19 34.430 2.871 -2.297 1.00 0.00 C ATOM 0 H ILE A 19 34.194 -0.386 -2.562 1.00 0.00 H new ATOM 0 HA ILE A 19 33.154 -0.191 -0.015 1.00 0.00 H new ATOM 0 HB ILE A 19 32.588 1.267 -2.566 1.00 0.00 H new ATOM 0 HG12 ILE A 19 33.791 2.631 -0.251 1.00 0.00 H new ATOM 0 HG13 ILE A 19 34.749 1.295 -0.859 1.00 0.00 H new ATOM 0 HG21 ILE A 19 31.402 2.960 -1.235 1.00 0.00 H new ATOM 0 HG22 ILE A 19 30.548 1.398 -1.248 1.00 0.00 H new ATOM 0 HG23 ILE A 19 31.479 1.890 0.186 1.00 0.00 H new ATOM 0 HD11 ILE A 19 35.342 3.399 -2.019 1.00 0.00 H new ATOM 0 HD12 ILE A 19 34.626 2.238 -3.163 1.00 0.00 H new ATOM 0 HD13 ILE A 19 33.653 3.594 -2.545 1.00 0.00 H new ATOM 235 N LEU A 20 30.692 -0.677 0.095 1.00 0.00 N ATOM 236 CA LEU A 20 29.383 -1.283 0.275 1.00 0.00 C ATOM 237 C LEU A 20 28.430 -0.756 -0.799 1.00 0.00 C ATOM 238 O LEU A 20 28.676 -0.929 -1.992 1.00 0.00 O ATOM 239 CB LEU A 20 28.882 -1.061 1.704 1.00 0.00 C ATOM 240 CG LEU A 20 29.682 -1.752 2.810 1.00 0.00 C ATOM 241 CD1 LEU A 20 30.354 -3.024 2.288 1.00 0.00 C ATOM 242 CD2 LEU A 20 30.690 -0.790 3.440 1.00 0.00 C ATOM 0 H LEU A 20 30.987 -0.065 0.856 1.00 0.00 H new ATOM 0 HA LEU A 20 29.443 -2.364 0.147 1.00 0.00 H new ATOM 0 HB2 LEU A 20 28.875 0.011 1.903 1.00 0.00 H new ATOM 0 HB3 LEU A 20 27.849 -1.403 1.763 1.00 0.00 H new ATOM 0 HG LEU A 20 28.989 -2.053 3.596 1.00 0.00 H new ATOM 0 HD11 LEU A 20 30.916 -3.496 3.094 1.00 0.00 H new ATOM 0 HD12 LEU A 20 29.593 -3.714 1.924 1.00 0.00 H new ATOM 0 HD13 LEU A 20 31.032 -2.769 1.474 1.00 0.00 H new ATOM 0 HD21 LEU A 20 31.245 -1.306 4.223 1.00 0.00 H new ATOM 0 HD22 LEU A 20 31.383 -0.437 2.676 1.00 0.00 H new ATOM 0 HD23 LEU A 20 30.161 0.060 3.871 1.00 0.00 H new ATOM 254 N GLU A 21 27.361 -0.123 -0.338 1.00 0.00 N ATOM 255 CA GLU A 21 26.369 0.430 -1.245 1.00 0.00 C ATOM 256 C GLU A 21 25.736 1.683 -0.638 1.00 0.00 C ATOM 257 O GLU A 21 25.236 1.649 0.485 1.00 0.00 O ATOM 258 CB GLU A 21 25.302 -0.611 -1.592 1.00 0.00 C ATOM 259 CG GLU A 21 24.876 -1.394 -0.348 1.00 0.00 C ATOM 260 CD GLU A 21 25.171 -2.886 -0.512 1.00 0.00 C ATOM 261 OE1 GLU A 21 24.436 -3.527 -1.294 1.00 0.00 O ATOM 262 OE2 GLU A 21 26.124 -3.352 0.148 1.00 0.00 O ATOM 0 H GLU A 21 27.160 0.019 0.652 1.00 0.00 H new ATOM 0 HA GLU A 21 26.869 0.712 -2.172 1.00 0.00 H new ATOM 0 HB2 GLU A 21 24.435 -0.116 -2.030 1.00 0.00 H new ATOM 0 HB3 GLU A 21 25.690 -1.298 -2.344 1.00 0.00 H new ATOM 0 HG2 GLU A 21 25.402 -1.010 0.526 1.00 0.00 H new ATOM 0 HG3 GLU A 21 23.811 -1.248 -0.169 1.00 0.00 H new ATOM 269 N ARG A 22 25.778 2.760 -1.408 1.00 0.00 N ATOM 270 CA ARG A 22 25.214 4.023 -0.961 1.00 0.00 C ATOM 271 C ARG A 22 25.512 5.127 -1.977 1.00 0.00 C ATOM 272 O ARG A 22 26.440 5.912 -1.793 1.00 0.00 O ATOM 273 CB ARG A 22 25.781 4.427 0.401 1.00 0.00 C ATOM 274 CG ARG A 22 24.690 4.416 1.474 1.00 0.00 C ATOM 275 CD ARG A 22 25.012 5.409 2.593 1.00 0.00 C ATOM 276 NE ARG A 22 23.805 6.195 2.933 1.00 0.00 N ATOM 277 CZ ARG A 22 23.696 6.972 4.020 1.00 0.00 C ATOM 278 NH1 ARG A 22 24.721 7.072 4.877 1.00 0.00 N ATOM 279 NH2 ARG A 22 22.563 7.650 4.248 1.00 0.00 N ATOM 0 H ARG A 22 26.194 2.785 -2.339 1.00 0.00 H new ATOM 0 HA ARG A 22 24.136 3.891 -0.869 1.00 0.00 H new ATOM 0 HB2 ARG A 22 26.581 3.743 0.684 1.00 0.00 H new ATOM 0 HB3 ARG A 22 26.221 5.422 0.335 1.00 0.00 H new ATOM 0 HG2 ARG A 22 23.730 4.668 1.024 1.00 0.00 H new ATOM 0 HG3 ARG A 22 24.594 3.413 1.890 1.00 0.00 H new ATOM 0 HD2 ARG A 22 25.368 4.875 3.474 1.00 0.00 H new ATOM 0 HD3 ARG A 22 25.814 6.076 2.279 1.00 0.00 H new ATOM 0 HE ARG A 22 23.006 6.142 2.301 1.00 0.00 H new ATOM 0 HH11 ARG A 22 25.584 6.557 4.702 1.00 0.00 H new ATOM 0 HH12 ARG A 22 24.638 7.663 5.704 1.00 0.00 H new ATOM 0 HH21 ARG A 22 21.783 7.575 3.595 1.00 0.00 H new ATOM 0 HH22 ARG A 22 22.480 8.241 5.075 1.00 0.00 H new ATOM 293 N THR A 23 24.706 5.152 -3.029 1.00 0.00 N ATOM 294 CA THR A 23 24.871 6.147 -4.075 1.00 0.00 C ATOM 295 C THR A 23 24.356 7.508 -3.603 1.00 0.00 C ATOM 296 O THR A 23 25.143 8.411 -3.325 1.00 0.00 O ATOM 297 CB THR A 23 24.166 5.633 -5.332 1.00 0.00 C ATOM 298 OG1 THR A 23 25.136 4.797 -5.957 1.00 0.00 O ATOM 299 CG2 THR A 23 23.914 6.741 -6.356 1.00 0.00 C ATOM 0 H THR A 23 23.937 4.499 -3.179 1.00 0.00 H new ATOM 0 HA THR A 23 25.924 6.298 -4.314 1.00 0.00 H new ATOM 0 HB THR A 23 23.218 5.173 -5.054 1.00 0.00 H new ATOM 0 HG1 THR A 23 24.761 4.420 -6.780 1.00 0.00 H new ATOM 0 HG21 THR A 23 23.412 6.323 -7.228 1.00 0.00 H new ATOM 0 HG22 THR A 23 23.286 7.512 -5.910 1.00 0.00 H new ATOM 0 HG23 THR A 23 24.865 7.179 -6.660 1.00 0.00 H new ATOM 307 N LEU A 24 23.037 7.612 -3.526 1.00 0.00 N ATOM 308 CA LEU A 24 22.408 8.847 -3.093 1.00 0.00 C ATOM 309 C LEU A 24 21.275 8.522 -2.116 1.00 0.00 C ATOM 310 O LEU A 24 20.745 7.412 -2.123 1.00 0.00 O ATOM 311 CB LEU A 24 21.960 9.673 -4.300 1.00 0.00 C ATOM 312 CG LEU A 24 23.068 10.113 -5.260 1.00 0.00 C ATOM 313 CD1 LEU A 24 22.479 10.717 -6.536 1.00 0.00 C ATOM 314 CD2 LEU A 24 24.043 11.069 -4.570 1.00 0.00 C ATOM 0 H LEU A 24 22.387 6.860 -3.756 1.00 0.00 H new ATOM 0 HA LEU A 24 23.124 9.471 -2.557 1.00 0.00 H new ATOM 0 HB2 LEU A 24 21.229 9.092 -4.862 1.00 0.00 H new ATOM 0 HB3 LEU A 24 21.447 10.563 -3.936 1.00 0.00 H new ATOM 0 HG LEU A 24 23.636 9.231 -5.554 1.00 0.00 H new ATOM 0 HD11 LEU A 24 23.287 11.021 -7.201 1.00 0.00 H new ATOM 0 HD12 LEU A 24 21.857 9.975 -7.037 1.00 0.00 H new ATOM 0 HD13 LEU A 24 21.872 11.586 -6.281 1.00 0.00 H new ATOM 0 HD21 LEU A 24 24.820 11.366 -5.274 1.00 0.00 H new ATOM 0 HD22 LEU A 24 23.505 11.953 -4.228 1.00 0.00 H new ATOM 0 HD23 LEU A 24 24.499 10.569 -3.715 1.00 0.00 H new ATOM 326 N ASP A 25 20.939 9.510 -1.300 1.00 0.00 N ATOM 327 CA ASP A 25 19.879 9.343 -0.320 1.00 0.00 C ATOM 328 C ASP A 25 18.626 10.078 -0.800 1.00 0.00 C ATOM 329 O ASP A 25 18.574 11.307 -0.772 1.00 0.00 O ATOM 330 CB ASP A 25 20.283 9.931 1.033 1.00 0.00 C ATOM 331 CG ASP A 25 21.289 11.082 0.964 1.00 0.00 C ATOM 332 OD1 ASP A 25 21.398 11.675 -0.131 1.00 0.00 O ATOM 333 OD2 ASP A 25 21.925 11.343 2.008 1.00 0.00 O ATOM 0 H ASP A 25 21.382 10.429 -1.297 1.00 0.00 H new ATOM 0 HA ASP A 25 19.689 8.276 -0.207 1.00 0.00 H new ATOM 0 HB2 ASP A 25 19.386 10.283 1.542 1.00 0.00 H new ATOM 0 HB3 ASP A 25 20.706 9.135 1.646 1.00 0.00 H new ATOM 338 N ASP A 26 17.647 9.295 -1.228 1.00 0.00 N ATOM 339 CA ASP A 26 16.397 9.857 -1.713 1.00 0.00 C ATOM 340 C ASP A 26 15.372 8.734 -1.887 1.00 0.00 C ATOM 341 O ASP A 26 15.741 7.578 -2.087 1.00 0.00 O ATOM 342 CB ASP A 26 16.589 10.537 -3.070 1.00 0.00 C ATOM 343 CG ASP A 26 18.031 10.930 -3.398 1.00 0.00 C ATOM 344 OD1 ASP A 26 18.842 9.999 -3.595 1.00 0.00 O ATOM 345 OD2 ASP A 26 18.289 12.152 -3.445 1.00 0.00 O ATOM 0 H ASP A 26 17.693 8.276 -1.249 1.00 0.00 H new ATOM 0 HA ASP A 26 16.053 10.593 -0.986 1.00 0.00 H new ATOM 0 HB2 ASP A 26 16.224 9.868 -3.850 1.00 0.00 H new ATOM 0 HB3 ASP A 26 15.968 11.432 -3.102 1.00 0.00 H new ATOM 350 N VAL A 27 14.106 9.115 -1.805 1.00 0.00 N ATOM 351 CA VAL A 27 13.025 8.155 -1.951 1.00 0.00 C ATOM 352 C VAL A 27 13.022 7.611 -3.381 1.00 0.00 C ATOM 353 O VAL A 27 13.585 8.227 -4.284 1.00 0.00 O ATOM 354 CB VAL A 27 11.696 8.799 -1.553 1.00 0.00 C ATOM 355 CG1 VAL A 27 11.559 8.881 -0.031 1.00 0.00 C ATOM 356 CG2 VAL A 27 11.543 10.181 -2.193 1.00 0.00 C ATOM 0 H VAL A 27 13.804 10.075 -1.639 1.00 0.00 H new ATOM 0 HA VAL A 27 13.173 7.308 -1.281 1.00 0.00 H new ATOM 0 HB VAL A 27 10.892 8.165 -1.927 1.00 0.00 H new ATOM 0 HG11 VAL A 27 10.605 9.343 0.224 1.00 0.00 H new ATOM 0 HG12 VAL A 27 11.601 7.878 0.393 1.00 0.00 H new ATOM 0 HG13 VAL A 27 12.373 9.481 0.376 1.00 0.00 H new ATOM 0 HG21 VAL A 27 10.590 10.617 -1.894 1.00 0.00 H new ATOM 0 HG22 VAL A 27 12.357 10.827 -1.863 1.00 0.00 H new ATOM 0 HG23 VAL A 27 11.573 10.085 -3.278 1.00 0.00 H new ATOM 366 N PRO A 28 12.365 6.432 -3.545 1.00 0.00 N ATOM 367 CA PRO A 28 12.281 5.798 -4.850 1.00 0.00 C ATOM 368 C PRO A 28 11.277 6.523 -5.749 1.00 0.00 C ATOM 369 O PRO A 28 10.644 7.489 -5.325 1.00 0.00 O ATOM 370 CB PRO A 28 11.888 4.357 -4.563 1.00 0.00 C ATOM 371 CG PRO A 28 11.316 4.354 -3.155 1.00 0.00 C ATOM 372 CD PRO A 28 11.686 5.674 -2.498 1.00 0.00 C ATOM 0 HA PRO A 28 13.222 5.839 -5.398 1.00 0.00 H new ATOM 0 HB2 PRO A 28 11.152 4.002 -5.284 1.00 0.00 H new ATOM 0 HB3 PRO A 28 12.751 3.695 -4.636 1.00 0.00 H new ATOM 0 HG2 PRO A 28 10.233 4.232 -3.183 1.00 0.00 H new ATOM 0 HG3 PRO A 28 11.716 3.517 -2.582 1.00 0.00 H new ATOM 0 HD2 PRO A 28 10.801 6.200 -2.139 1.00 0.00 H new ATOM 0 HD3 PRO A 28 12.336 5.519 -1.637 1.00 0.00 H new ATOM 380 N GLY A 29 11.162 6.029 -6.973 1.00 0.00 N ATOM 381 CA GLY A 29 10.246 6.618 -7.935 1.00 0.00 C ATOM 382 C GLY A 29 8.914 5.866 -7.954 1.00 0.00 C ATOM 383 O GLY A 29 8.655 5.032 -7.088 1.00 0.00 O ATOM 0 H GLY A 29 11.688 5.227 -7.321 1.00 0.00 H new ATOM 0 HA2 GLY A 29 10.073 7.665 -7.685 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.694 6.598 -8.929 1.00 0.00 H new ATOM 387 N PRO A 30 8.082 6.197 -8.978 1.00 0.00 N ATOM 388 CA PRO A 30 6.783 5.563 -9.121 1.00 0.00 C ATOM 389 C PRO A 30 6.925 4.135 -9.653 1.00 0.00 C ATOM 390 O PRO A 30 7.710 3.885 -10.567 1.00 0.00 O ATOM 391 CB PRO A 30 6.003 6.471 -10.059 1.00 0.00 C ATOM 392 CG PRO A 30 7.040 7.325 -10.770 1.00 0.00 C ATOM 393 CD PRO A 30 8.355 7.180 -10.022 1.00 0.00 C ATOM 0 HA PRO A 30 6.262 5.453 -8.170 1.00 0.00 H new ATOM 0 HB2 PRO A 30 5.421 5.888 -10.773 1.00 0.00 H new ATOM 0 HB3 PRO A 30 5.299 7.092 -9.505 1.00 0.00 H new ATOM 0 HG2 PRO A 30 7.153 7.005 -11.806 1.00 0.00 H new ATOM 0 HG3 PRO A 30 6.726 8.369 -10.791 1.00 0.00 H new ATOM 0 HD2 PRO A 30 9.152 6.843 -10.685 1.00 0.00 H new ATOM 0 HD3 PRO A 30 8.675 8.131 -9.596 1.00 0.00 H new ATOM 401 N PRO A 31 6.134 3.213 -9.042 1.00 0.00 N ATOM 402 CA PRO A 31 6.165 1.817 -9.445 1.00 0.00 C ATOM 403 C PRO A 31 5.435 1.613 -10.774 1.00 0.00 C ATOM 404 O PRO A 31 4.213 1.739 -10.842 1.00 0.00 O ATOM 405 CB PRO A 31 5.522 1.062 -8.293 1.00 0.00 C ATOM 406 CG PRO A 31 4.740 2.096 -7.501 1.00 0.00 C ATOM 407 CD PRO A 31 5.193 3.474 -7.957 1.00 0.00 C ATOM 0 HA PRO A 31 7.176 1.454 -9.628 1.00 0.00 H new ATOM 0 HB2 PRO A 31 4.865 0.274 -8.661 1.00 0.00 H new ATOM 0 HB3 PRO A 31 6.277 0.583 -7.670 1.00 0.00 H new ATOM 0 HG2 PRO A 31 3.669 1.973 -7.665 1.00 0.00 H new ATOM 0 HG3 PRO A 31 4.915 1.971 -6.432 1.00 0.00 H new ATOM 0 HD2 PRO A 31 4.350 4.075 -8.299 1.00 0.00 H new ATOM 0 HD3 PRO A 31 5.668 4.024 -7.144 1.00 0.00 H new ATOM 415 N MET A 32 6.215 1.303 -11.799 1.00 0.00 N ATOM 416 CA MET A 32 5.659 1.080 -13.123 1.00 0.00 C ATOM 417 C MET A 32 5.323 -0.397 -13.335 1.00 0.00 C ATOM 418 O MET A 32 5.823 -1.261 -12.616 1.00 0.00 O ATOM 419 CB MET A 32 6.666 1.533 -14.182 1.00 0.00 C ATOM 420 CG MET A 32 8.001 0.805 -14.016 1.00 0.00 C ATOM 421 SD MET A 32 8.878 0.775 -15.570 1.00 0.00 S ATOM 422 CE MET A 32 10.556 0.631 -14.977 1.00 0.00 C ATOM 0 H MET A 32 7.228 1.201 -11.739 1.00 0.00 H new ATOM 0 HA MET A 32 4.739 1.658 -13.213 1.00 0.00 H new ATOM 0 HB2 MET A 32 6.264 1.341 -15.177 1.00 0.00 H new ATOM 0 HB3 MET A 32 6.822 2.609 -14.104 1.00 0.00 H new ATOM 0 HG2 MET A 32 8.605 1.304 -13.258 1.00 0.00 H new ATOM 0 HG3 MET A 32 7.828 -0.213 -13.667 1.00 0.00 H new ATOM 0 HE1 MET A 32 11.240 0.599 -15.825 1.00 0.00 H new ATOM 0 HE2 MET A 32 10.795 1.490 -14.350 1.00 0.00 H new ATOM 0 HE3 MET A 32 10.658 -0.284 -14.393 1.00 0.00 H new ATOM 432 N GLY A 33 4.477 -0.642 -14.325 1.00 0.00 N ATOM 433 CA GLY A 33 4.068 -2.000 -14.642 1.00 0.00 C ATOM 434 C GLY A 33 2.866 -2.422 -13.794 1.00 0.00 C ATOM 435 O GLY A 33 2.819 -3.545 -13.294 1.00 0.00 O ATOM 0 H GLY A 33 4.063 0.077 -14.918 1.00 0.00 H new ATOM 0 HA2 GLY A 33 3.814 -2.070 -15.700 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.899 -2.684 -14.468 1.00 0.00 H new ATOM 439 N ILE A 34 1.925 -1.500 -13.659 1.00 0.00 N ATOM 440 CA ILE A 34 0.726 -1.762 -12.881 1.00 0.00 C ATOM 441 C ILE A 34 -0.335 -2.394 -13.784 1.00 0.00 C ATOM 442 O ILE A 34 -0.968 -1.703 -14.581 1.00 0.00 O ATOM 443 CB ILE A 34 0.255 -0.488 -12.176 1.00 0.00 C ATOM 444 CG1 ILE A 34 1.445 0.346 -11.697 1.00 0.00 C ATOM 445 CG2 ILE A 34 -0.711 -0.817 -11.036 1.00 0.00 C ATOM 446 CD1 ILE A 34 2.362 -0.478 -10.790 1.00 0.00 C ATOM 0 H ILE A 34 1.968 -0.570 -14.075 1.00 0.00 H new ATOM 0 HA ILE A 34 0.936 -2.478 -12.087 1.00 0.00 H new ATOM 0 HB ILE A 34 -0.293 0.118 -12.897 1.00 0.00 H new ATOM 0 HG12 ILE A 34 2.008 0.709 -12.556 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.086 1.222 -11.158 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -1.030 0.106 -10.552 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -1.582 -1.337 -11.435 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -0.210 -1.454 -10.307 1.00 0.00 H new ATOM 0 HD11 ILE A 34 3.200 0.138 -10.463 1.00 0.00 H new ATOM 0 HD12 ILE A 34 1.802 -0.819 -9.920 1.00 0.00 H new ATOM 0 HD13 ILE A 34 2.739 -1.340 -11.340 1.00 0.00 H new ATOM 458 N LEU A 35 -0.497 -3.699 -13.628 1.00 0.00 N ATOM 459 CA LEU A 35 -1.471 -4.432 -14.420 1.00 0.00 C ATOM 460 C LEU A 35 -2.348 -5.274 -13.491 1.00 0.00 C ATOM 461 O LEU A 35 -1.952 -5.579 -12.366 1.00 0.00 O ATOM 462 CB LEU A 35 -0.772 -5.246 -15.510 1.00 0.00 C ATOM 463 CG LEU A 35 0.019 -4.442 -16.545 1.00 0.00 C ATOM 464 CD1 LEU A 35 -0.899 -3.499 -17.324 1.00 0.00 C ATOM 465 CD2 LEU A 35 1.182 -3.697 -15.887 1.00 0.00 C ATOM 0 H LEU A 35 0.029 -4.268 -12.965 1.00 0.00 H new ATOM 0 HA LEU A 35 -2.132 -3.742 -14.944 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -0.093 -5.951 -15.030 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -1.524 -5.835 -16.034 1.00 0.00 H new ATOM 0 HG LEU A 35 0.449 -5.139 -17.264 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -0.312 -2.940 -18.053 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -1.662 -4.080 -17.842 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -1.378 -2.805 -16.634 1.00 0.00 H new ATOM 0 HD21 LEU A 35 1.728 -3.134 -16.644 1.00 0.00 H new ATOM 0 HD22 LEU A 35 0.795 -3.011 -15.133 1.00 0.00 H new ATOM 0 HD23 LEU A 35 1.853 -4.414 -15.415 1.00 0.00 H new ATOM 477 N PHE A 36 -3.521 -5.626 -13.994 1.00 0.00 N ATOM 478 CA PHE A 36 -4.457 -6.426 -13.224 1.00 0.00 C ATOM 479 C PHE A 36 -4.784 -7.735 -13.946 1.00 0.00 C ATOM 480 O PHE A 36 -5.685 -7.779 -14.781 1.00 0.00 O ATOM 481 CB PHE A 36 -5.739 -5.603 -13.081 1.00 0.00 C ATOM 482 CG PHE A 36 -5.609 -4.408 -12.135 1.00 0.00 C ATOM 483 CD1 PHE A 36 -5.188 -3.206 -12.612 1.00 0.00 C ATOM 484 CD2 PHE A 36 -5.914 -4.547 -10.817 1.00 0.00 C ATOM 485 CE1 PHE A 36 -5.067 -2.096 -11.734 1.00 0.00 C ATOM 486 CE2 PHE A 36 -5.793 -3.438 -9.939 1.00 0.00 C ATOM 487 CZ PHE A 36 -5.372 -2.236 -10.416 1.00 0.00 C ATOM 0 H PHE A 36 -3.845 -5.371 -14.927 1.00 0.00 H new ATOM 0 HA PHE A 36 -4.023 -6.675 -12.255 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -6.039 -5.243 -14.065 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -6.537 -6.252 -12.722 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -4.946 -3.095 -13.659 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -6.248 -5.501 -10.438 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -4.733 -1.141 -12.113 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -6.035 -3.549 -8.892 1.00 0.00 H new ATOM 0 HZ PHE A 36 -5.280 -1.392 -9.748 1.00 0.00 H new ATOM 497 N PRO A 37 -4.012 -8.797 -13.588 1.00 0.00 N ATOM 498 CA PRO A 37 -4.210 -10.103 -14.192 1.00 0.00 C ATOM 499 C PRO A 37 -5.463 -10.781 -13.634 1.00 0.00 C ATOM 500 O PRO A 37 -6.306 -11.257 -14.393 1.00 0.00 O ATOM 501 CB PRO A 37 -2.935 -10.873 -13.891 1.00 0.00 C ATOM 502 CG PRO A 37 -2.266 -10.139 -12.740 1.00 0.00 C ATOM 503 CD PRO A 37 -2.936 -8.781 -12.602 1.00 0.00 C ATOM 0 HA PRO A 37 -4.382 -10.047 -15.267 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -3.157 -11.905 -13.620 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -2.284 -10.906 -14.764 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -2.363 -10.709 -11.816 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -1.199 -10.021 -12.931 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -3.324 -8.632 -11.595 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -2.233 -7.971 -12.796 1.00 0.00 H new ATOM 511 N GLU A 38 -5.546 -10.804 -12.312 1.00 0.00 N ATOM 512 CA GLU A 38 -6.682 -11.416 -11.644 1.00 0.00 C ATOM 513 C GLU A 38 -7.426 -10.376 -10.803 1.00 0.00 C ATOM 514 O GLU A 38 -6.901 -9.892 -9.801 1.00 0.00 O ATOM 515 CB GLU A 38 -6.239 -12.601 -10.784 1.00 0.00 C ATOM 516 CG GLU A 38 -7.424 -13.200 -10.023 1.00 0.00 C ATOM 517 CD GLU A 38 -6.960 -14.295 -9.061 1.00 0.00 C ATOM 518 OE1 GLU A 38 -6.039 -14.001 -8.268 1.00 0.00 O ATOM 519 OE2 GLU A 38 -7.537 -15.401 -9.140 1.00 0.00 O ATOM 0 H GLU A 38 -4.845 -10.409 -11.685 1.00 0.00 H new ATOM 0 HA GLU A 38 -7.364 -11.796 -12.404 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -5.785 -13.364 -11.416 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -5.475 -12.277 -10.077 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -7.938 -12.416 -9.467 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -8.144 -13.613 -10.730 1.00 0.00 H new ATOM 526 N VAL A 39 -8.637 -10.065 -11.240 1.00 0.00 N ATOM 527 CA VAL A 39 -9.458 -9.092 -10.540 1.00 0.00 C ATOM 528 C VAL A 39 -10.909 -9.577 -10.518 1.00 0.00 C ATOM 529 O VAL A 39 -11.521 -9.762 -11.569 1.00 0.00 O ATOM 530 CB VAL A 39 -9.298 -7.713 -11.183 1.00 0.00 C ATOM 531 CG1 VAL A 39 -8.853 -7.836 -12.642 1.00 0.00 C ATOM 532 CG2 VAL A 39 -10.591 -6.902 -11.071 1.00 0.00 C ATOM 0 H VAL A 39 -9.070 -10.470 -12.070 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.133 -8.992 -9.504 1.00 0.00 H new ATOM 0 HB VAL A 39 -8.519 -7.179 -10.639 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -8.747 -6.841 -13.075 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -7.896 -8.356 -12.688 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -9.599 -8.399 -13.204 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -10.450 -5.926 -11.536 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -11.398 -7.432 -11.577 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -10.847 -6.769 -10.020 1.00 0.00 H new ATOM 542 N ARG A 40 -11.417 -9.769 -9.310 1.00 0.00 N ATOM 543 CA ARG A 40 -12.785 -10.229 -9.138 1.00 0.00 C ATOM 544 C ARG A 40 -13.669 -9.088 -8.631 1.00 0.00 C ATOM 545 O ARG A 40 -13.305 -7.918 -8.744 1.00 0.00 O ATOM 546 CB ARG A 40 -12.853 -11.395 -8.150 1.00 0.00 C ATOM 547 CG ARG A 40 -11.530 -12.163 -8.115 1.00 0.00 C ATOM 548 CD ARG A 40 -11.664 -13.450 -7.299 1.00 0.00 C ATOM 549 NE ARG A 40 -12.480 -14.437 -8.040 1.00 0.00 N ATOM 550 CZ ARG A 40 -12.648 -15.710 -7.659 1.00 0.00 C ATOM 551 NH1 ARG A 40 -12.059 -16.159 -6.543 1.00 0.00 N ATOM 552 NH2 ARG A 40 -13.407 -16.535 -8.394 1.00 0.00 N ATOM 0 H ARG A 40 -10.906 -9.615 -8.441 1.00 0.00 H new ATOM 0 HA ARG A 40 -13.146 -10.568 -10.109 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -13.086 -11.019 -7.154 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -13.661 -12.069 -8.433 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -11.218 -12.404 -9.131 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -10.752 -11.534 -7.683 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -10.677 -13.864 -7.093 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -12.127 -13.233 -6.336 1.00 0.00 H new ATOM 0 HE ARG A 40 -12.944 -14.129 -8.895 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -11.482 -15.531 -5.983 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -12.187 -17.129 -6.253 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -13.857 -16.193 -9.243 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -13.535 -17.504 -8.104 1.00 0.00 H new ATOM 566 N THR A 41 -14.813 -9.468 -8.082 1.00 0.00 N ATOM 567 CA THR A 41 -15.752 -8.491 -7.557 1.00 0.00 C ATOM 568 C THR A 41 -15.182 -7.823 -6.304 1.00 0.00 C ATOM 569 O THR A 41 -14.438 -6.847 -6.400 1.00 0.00 O ATOM 570 CB THR A 41 -17.086 -9.200 -7.313 1.00 0.00 C ATOM 571 OG1 THR A 41 -16.712 -10.520 -6.930 1.00 0.00 O ATOM 572 CG2 THR A 41 -17.887 -9.398 -8.601 1.00 0.00 C ATOM 0 H THR A 41 -15.111 -10.439 -7.989 1.00 0.00 H new ATOM 0 HA THR A 41 -15.922 -7.684 -8.270 1.00 0.00 H new ATOM 0 HB THR A 41 -17.679 -8.625 -6.602 1.00 0.00 H new ATOM 0 HG1 THR A 41 -16.924 -11.144 -7.656 1.00 0.00 H new ATOM 0 HG21 THR A 41 -18.824 -9.905 -8.372 1.00 0.00 H new ATOM 0 HG22 THR A 41 -18.100 -8.428 -9.050 1.00 0.00 H new ATOM 0 HG23 THR A 41 -17.309 -10.002 -9.300 1.00 0.00 H new ATOM 580 N THR A 42 -15.551 -8.374 -5.157 1.00 0.00 N ATOM 581 CA THR A 42 -15.086 -7.844 -3.887 1.00 0.00 C ATOM 582 C THR A 42 -13.643 -8.278 -3.625 1.00 0.00 C ATOM 583 O THR A 42 -13.096 -8.014 -2.555 1.00 0.00 O ATOM 584 CB THR A 42 -16.063 -8.295 -2.800 1.00 0.00 C ATOM 585 OG1 THR A 42 -15.897 -9.709 -2.749 1.00 0.00 O ATOM 586 CG2 THR A 42 -17.525 -8.106 -3.211 1.00 0.00 C ATOM 0 H THR A 42 -16.167 -9.183 -5.081 1.00 0.00 H new ATOM 0 HA THR A 42 -15.068 -6.754 -3.896 1.00 0.00 H new ATOM 0 HB THR A 42 -15.869 -7.737 -1.884 1.00 0.00 H new ATOM 0 HG1 THR A 42 -16.493 -10.084 -2.067 1.00 0.00 H new ATOM 0 HG21 THR A 42 -18.176 -8.442 -2.404 1.00 0.00 H new ATOM 0 HG22 THR A 42 -17.713 -7.052 -3.414 1.00 0.00 H new ATOM 0 HG23 THR A 42 -17.729 -8.690 -4.108 1.00 0.00 H new ATOM 594 N SER A 43 -13.066 -8.936 -4.620 1.00 0.00 N ATOM 595 CA SER A 43 -11.697 -9.409 -4.511 1.00 0.00 C ATOM 596 C SER A 43 -10.966 -9.210 -5.840 1.00 0.00 C ATOM 597 O SER A 43 -11.465 -9.608 -6.892 1.00 0.00 O ATOM 598 CB SER A 43 -11.654 -10.882 -4.097 1.00 0.00 C ATOM 599 OG SER A 43 -12.866 -11.561 -4.415 1.00 0.00 O ATOM 0 H SER A 43 -13.522 -9.153 -5.506 1.00 0.00 H new ATOM 0 HA SER A 43 -11.196 -8.827 -3.738 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.820 -11.375 -4.597 1.00 0.00 H new ATOM 0 HB3 SER A 43 -11.470 -10.952 -3.025 1.00 0.00 H new ATOM 0 HG SER A 43 -12.799 -12.498 -4.137 1.00 0.00 H new ATOM 605 N VAL A 44 -9.796 -8.594 -5.749 1.00 0.00 N ATOM 606 CA VAL A 44 -8.992 -8.338 -6.932 1.00 0.00 C ATOM 607 C VAL A 44 -7.519 -8.591 -6.607 1.00 0.00 C ATOM 608 O VAL A 44 -7.140 -8.654 -5.438 1.00 0.00 O ATOM 609 CB VAL A 44 -9.256 -6.921 -7.447 1.00 0.00 C ATOM 610 CG1 VAL A 44 -10.749 -6.591 -7.403 1.00 0.00 C ATOM 611 CG2 VAL A 44 -8.444 -5.892 -6.659 1.00 0.00 C ATOM 0 H VAL A 44 -9.386 -8.265 -4.875 1.00 0.00 H new ATOM 0 HA VAL A 44 -9.269 -9.019 -7.737 1.00 0.00 H new ATOM 0 HB VAL A 44 -8.934 -6.877 -8.487 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -10.909 -5.579 -7.774 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -11.296 -7.297 -8.027 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -11.107 -6.662 -6.376 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.650 -4.894 -7.045 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -8.722 -5.939 -5.606 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -7.381 -6.110 -6.764 1.00 0.00 H new ATOM 621 N ARG A 45 -6.729 -8.729 -7.661 1.00 0.00 N ATOM 622 CA ARG A 45 -5.305 -8.974 -7.502 1.00 0.00 C ATOM 623 C ARG A 45 -4.524 -8.327 -8.647 1.00 0.00 C ATOM 624 O ARG A 45 -4.671 -8.718 -9.804 1.00 0.00 O ATOM 625 CB ARG A 45 -5.004 -10.474 -7.473 1.00 0.00 C ATOM 626 CG ARG A 45 -3.533 -10.732 -7.141 1.00 0.00 C ATOM 627 CD ARG A 45 -3.016 -11.973 -7.872 1.00 0.00 C ATOM 628 NE ARG A 45 -3.402 -13.194 -7.132 1.00 0.00 N ATOM 629 CZ ARG A 45 -3.099 -14.439 -7.525 1.00 0.00 C ATOM 630 NH1 ARG A 45 -2.404 -14.634 -8.654 1.00 0.00 N ATOM 631 NH2 ARG A 45 -3.491 -15.488 -6.790 1.00 0.00 N ATOM 0 H ARG A 45 -7.047 -8.676 -8.629 1.00 0.00 H new ATOM 0 HA ARG A 45 -4.997 -8.534 -6.553 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -5.638 -10.962 -6.733 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -5.245 -10.916 -8.440 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -2.935 -9.865 -7.422 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -3.417 -10.864 -6.065 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -3.424 -12.006 -8.882 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -1.931 -11.923 -7.967 1.00 0.00 H new ATOM 0 HE ARG A 45 -3.932 -13.081 -6.268 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -2.106 -13.835 -9.214 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -2.173 -15.581 -8.954 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -4.020 -15.339 -5.931 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -3.260 -16.435 -7.089 1.00 0.00 H new ATOM 645 N LEU A 46 -3.710 -7.346 -8.285 1.00 0.00 N ATOM 646 CA LEU A 46 -2.905 -6.640 -9.268 1.00 0.00 C ATOM 647 C LEU A 46 -1.423 -6.886 -8.978 1.00 0.00 C ATOM 648 O LEU A 46 -1.073 -7.430 -7.932 1.00 0.00 O ATOM 649 CB LEU A 46 -3.286 -5.159 -9.308 1.00 0.00 C ATOM 650 CG LEU A 46 -2.441 -4.225 -8.439 1.00 0.00 C ATOM 651 CD1 LEU A 46 -2.528 -2.782 -8.939 1.00 0.00 C ATOM 652 CD2 LEU A 46 -2.831 -4.345 -6.964 1.00 0.00 C ATOM 0 H LEU A 46 -3.591 -7.023 -7.325 1.00 0.00 H new ATOM 0 HA LEU A 46 -3.103 -7.023 -10.269 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -3.225 -4.816 -10.341 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -4.328 -5.064 -9.002 1.00 0.00 H new ATOM 0 HG LEU A 46 -1.399 -4.532 -8.522 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -1.918 -2.139 -8.304 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -2.163 -2.730 -9.965 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -3.565 -2.447 -8.905 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -2.215 -3.671 -6.369 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -3.881 -4.080 -6.843 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -2.675 -5.370 -6.629 1.00 0.00 H new ATOM 664 N ILE A 47 -0.592 -6.474 -9.925 1.00 0.00 N ATOM 665 CA ILE A 47 0.844 -6.643 -9.785 1.00 0.00 C ATOM 666 C ILE A 47 1.547 -5.339 -10.168 1.00 0.00 C ATOM 667 O ILE A 47 0.922 -4.431 -10.714 1.00 0.00 O ATOM 668 CB ILE A 47 1.321 -7.857 -10.585 1.00 0.00 C ATOM 669 CG1 ILE A 47 1.463 -7.514 -12.069 1.00 0.00 C ATOM 670 CG2 ILE A 47 0.402 -9.059 -10.359 1.00 0.00 C ATOM 671 CD1 ILE A 47 0.093 -7.287 -12.712 1.00 0.00 C ATOM 0 H ILE A 47 -0.886 -6.024 -10.792 1.00 0.00 H new ATOM 0 HA ILE A 47 1.103 -6.852 -8.747 1.00 0.00 H new ATOM 0 HB ILE A 47 2.310 -8.137 -10.223 1.00 0.00 H new ATOM 0 HG12 ILE A 47 2.075 -6.619 -12.182 1.00 0.00 H new ATOM 0 HG13 ILE A 47 1.982 -8.322 -12.585 1.00 0.00 H new ATOM 0 HG21 ILE A 47 0.764 -9.908 -10.939 1.00 0.00 H new ATOM 0 HG22 ILE A 47 0.397 -9.319 -9.300 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -0.610 -8.808 -10.676 1.00 0.00 H new ATOM 0 HD11 ILE A 47 0.222 -7.045 -13.767 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -0.507 -8.192 -12.618 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -0.413 -6.462 -12.209 1.00 0.00 H new ATOM 683 N TRP A 48 2.836 -5.289 -9.868 1.00 0.00 N ATOM 684 CA TRP A 48 3.630 -4.111 -10.175 1.00 0.00 C ATOM 685 C TRP A 48 5.105 -4.519 -10.166 1.00 0.00 C ATOM 686 O TRP A 48 5.426 -5.694 -9.991 1.00 0.00 O ATOM 687 CB TRP A 48 3.320 -2.972 -9.202 1.00 0.00 C ATOM 688 CG TRP A 48 3.784 -3.235 -7.767 1.00 0.00 C ATOM 689 CD1 TRP A 48 4.928 -2.849 -7.186 1.00 0.00 C ATOM 690 CD2 TRP A 48 3.062 -3.961 -6.750 1.00 0.00 C ATOM 691 NE1 TRP A 48 4.997 -3.272 -5.875 1.00 0.00 N ATOM 692 CE2 TRP A 48 3.826 -3.970 -5.601 1.00 0.00 C ATOM 693 CE3 TRP A 48 1.806 -4.591 -6.799 1.00 0.00 C ATOM 694 CZ2 TRP A 48 3.420 -4.594 -4.415 1.00 0.00 C ATOM 695 CZ3 TRP A 48 1.414 -5.209 -5.606 1.00 0.00 C ATOM 696 CH2 TRP A 48 2.172 -5.227 -4.441 1.00 0.00 C ATOM 0 H TRP A 48 3.351 -6.045 -9.416 1.00 0.00 H new ATOM 0 HA TRP A 48 3.381 -3.726 -11.164 1.00 0.00 H new ATOM 0 HB2 TRP A 48 3.793 -2.059 -9.564 1.00 0.00 H new ATOM 0 HB3 TRP A 48 2.245 -2.794 -9.198 1.00 0.00 H new ATOM 0 HD1 TRP A 48 5.699 -2.278 -7.682 1.00 0.00 H new ATOM 0 HE1 TRP A 48 5.766 -3.104 -5.226 1.00 0.00 H new ATOM 0 HE3 TRP A 48 1.192 -4.598 -7.687 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 4.036 -4.587 -3.528 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 0.456 -5.707 -5.589 1.00 0.00 H new ATOM 0 HH2 TRP A 48 1.799 -5.727 -3.559 1.00 0.00 H new ATOM 707 N GLN A 49 5.962 -3.527 -10.357 1.00 0.00 N ATOM 708 CA GLN A 49 7.394 -3.769 -10.374 1.00 0.00 C ATOM 709 C GLN A 49 8.134 -2.620 -9.684 1.00 0.00 C ATOM 710 O GLN A 49 7.575 -1.541 -9.498 1.00 0.00 O ATOM 711 CB GLN A 49 7.901 -3.967 -11.804 1.00 0.00 C ATOM 712 CG GLN A 49 7.923 -5.451 -12.176 1.00 0.00 C ATOM 713 CD GLN A 49 8.249 -5.639 -13.659 1.00 0.00 C ATOM 714 OE1 GLN A 49 9.138 -5.010 -14.211 1.00 0.00 O ATOM 715 NE2 GLN A 49 7.484 -6.537 -14.272 1.00 0.00 N ATOM 0 H GLN A 49 5.692 -2.554 -10.501 1.00 0.00 H new ATOM 0 HA GLN A 49 7.594 -4.688 -9.823 1.00 0.00 H new ATOM 0 HB2 GLN A 49 7.261 -3.423 -12.499 1.00 0.00 H new ATOM 0 HB3 GLN A 49 8.903 -3.549 -11.900 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.663 -5.971 -11.568 1.00 0.00 H new ATOM 0 HG3 GLN A 49 6.955 -5.900 -11.953 1.00 0.00 H new ATOM 0 HE21 GLN A 49 6.757 -7.028 -13.751 1.00 0.00 H new ATOM 0 HE22 GLN A 49 7.624 -6.735 -15.263 1.00 0.00 H new ATOM 724 N PRO A 50 9.413 -2.900 -9.316 1.00 0.00 N ATOM 725 CA PRO A 50 10.235 -1.903 -8.651 1.00 0.00 C ATOM 726 C PRO A 50 10.716 -0.840 -9.642 1.00 0.00 C ATOM 727 O PRO A 50 10.828 -1.106 -10.837 1.00 0.00 O ATOM 728 CB PRO A 50 11.375 -2.688 -8.022 1.00 0.00 C ATOM 729 CG PRO A 50 11.406 -4.026 -8.743 1.00 0.00 C ATOM 730 CD PRO A 50 10.108 -4.167 -9.520 1.00 0.00 C ATOM 0 HA PRO A 50 9.687 -1.345 -7.892 1.00 0.00 H new ATOM 0 HB2 PRO A 50 12.322 -2.161 -8.136 1.00 0.00 H new ATOM 0 HB3 PRO A 50 11.213 -2.824 -6.953 1.00 0.00 H new ATOM 0 HG2 PRO A 50 12.261 -4.077 -9.417 1.00 0.00 H new ATOM 0 HG3 PRO A 50 11.514 -4.842 -8.029 1.00 0.00 H new ATOM 0 HD2 PRO A 50 10.298 -4.348 -10.578 1.00 0.00 H new ATOM 0 HD3 PRO A 50 9.517 -5.006 -9.154 1.00 0.00 H new ATOM 738 N PRO A 51 10.996 0.372 -9.093 1.00 0.00 N ATOM 739 CA PRO A 51 11.463 1.476 -9.915 1.00 0.00 C ATOM 740 C PRO A 51 12.926 1.280 -10.315 1.00 0.00 C ATOM 741 O PRO A 51 13.800 1.171 -9.456 1.00 0.00 O ATOM 742 CB PRO A 51 11.239 2.718 -9.069 1.00 0.00 C ATOM 743 CG PRO A 51 11.091 2.227 -7.638 1.00 0.00 C ATOM 744 CD PRO A 51 10.876 0.723 -7.681 1.00 0.00 C ATOM 0 HA PRO A 51 10.927 1.553 -10.861 1.00 0.00 H new ATOM 0 HB2 PRO A 51 12.077 3.409 -9.160 1.00 0.00 H new ATOM 0 HB3 PRO A 51 10.347 3.255 -9.392 1.00 0.00 H new ATOM 0 HG2 PRO A 51 11.981 2.469 -7.057 1.00 0.00 H new ATOM 0 HG3 PRO A 51 10.249 2.719 -7.151 1.00 0.00 H new ATOM 0 HD2 PRO A 51 11.618 0.199 -7.078 1.00 0.00 H new ATOM 0 HD3 PRO A 51 9.897 0.452 -7.287 1.00 0.00 H new ATOM 752 N ALA A 52 13.150 1.243 -11.621 1.00 0.00 N ATOM 753 CA ALA A 52 14.493 1.063 -12.145 1.00 0.00 C ATOM 754 C ALA A 52 15.468 1.932 -11.349 1.00 0.00 C ATOM 755 O ALA A 52 16.642 1.590 -11.214 1.00 0.00 O ATOM 756 CB ALA A 52 14.505 1.391 -13.640 1.00 0.00 C ATOM 0 H ALA A 52 12.424 1.335 -12.331 1.00 0.00 H new ATOM 0 HA ALA A 52 14.812 0.027 -12.036 1.00 0.00 H new ATOM 0 HB1 ALA A 52 15.512 1.256 -14.034 1.00 0.00 H new ATOM 0 HB2 ALA A 52 13.818 0.726 -14.164 1.00 0.00 H new ATOM 0 HB3 ALA A 52 14.193 2.425 -13.788 1.00 0.00 H new ATOM 762 N ALA A 53 14.945 3.039 -10.841 1.00 0.00 N ATOM 763 CA ALA A 53 15.755 3.959 -10.062 1.00 0.00 C ATOM 764 C ALA A 53 15.211 4.025 -8.633 1.00 0.00 C ATOM 765 O ALA A 53 14.420 4.909 -8.306 1.00 0.00 O ATOM 766 CB ALA A 53 15.770 5.329 -10.743 1.00 0.00 C ATOM 0 H ALA A 53 13.971 3.319 -10.954 1.00 0.00 H new ATOM 0 HA ALA A 53 16.786 3.611 -10.007 1.00 0.00 H new ATOM 0 HB1 ALA A 53 16.378 6.019 -10.158 1.00 0.00 H new ATOM 0 HB2 ALA A 53 16.191 5.233 -11.744 1.00 0.00 H new ATOM 0 HB3 ALA A 53 14.752 5.712 -10.813 1.00 0.00 H new ATOM 772 N PRO A 54 15.669 3.054 -7.798 1.00 0.00 N ATOM 773 CA PRO A 54 15.238 2.994 -6.412 1.00 0.00 C ATOM 774 C PRO A 54 15.919 4.081 -5.578 1.00 0.00 C ATOM 775 O PRO A 54 15.306 4.654 -4.679 1.00 0.00 O ATOM 776 CB PRO A 54 15.585 1.587 -5.953 1.00 0.00 C ATOM 777 CG PRO A 54 16.613 1.067 -6.945 1.00 0.00 C ATOM 778 CD PRO A 54 16.607 1.992 -8.151 1.00 0.00 C ATOM 0 HA PRO A 54 14.171 3.185 -6.294 1.00 0.00 H new ATOM 0 HB2 PRO A 54 15.988 1.595 -4.940 1.00 0.00 H new ATOM 0 HB3 PRO A 54 14.700 0.951 -5.939 1.00 0.00 H new ATOM 0 HG2 PRO A 54 17.603 1.040 -6.490 1.00 0.00 H new ATOM 0 HG3 PRO A 54 16.372 0.047 -7.245 1.00 0.00 H new ATOM 0 HD2 PRO A 54 17.602 2.392 -8.349 1.00 0.00 H new ATOM 0 HD3 PRO A 54 16.290 1.467 -9.052 1.00 0.00 H new ATOM 786 N ASN A 55 17.178 4.331 -5.905 1.00 0.00 N ATOM 787 CA ASN A 55 17.949 5.338 -5.197 1.00 0.00 C ATOM 788 C ASN A 55 17.667 5.230 -3.698 1.00 0.00 C ATOM 789 O ASN A 55 17.502 6.243 -3.019 1.00 0.00 O ATOM 790 CB ASN A 55 17.562 6.747 -5.651 1.00 0.00 C ATOM 791 CG ASN A 55 17.041 6.737 -7.089 1.00 0.00 C ATOM 792 OD1 ASN A 55 17.786 6.607 -8.046 1.00 0.00 O ATOM 793 ND2 ASN A 55 15.722 6.879 -7.187 1.00 0.00 N ATOM 0 H ASN A 55 17.684 3.853 -6.651 1.00 0.00 H new ATOM 0 HA ASN A 55 19.004 5.167 -5.411 1.00 0.00 H new ATOM 0 HB2 ASN A 55 16.798 7.150 -4.986 1.00 0.00 H new ATOM 0 HB3 ASN A 55 18.427 7.406 -5.579 1.00 0.00 H new ATOM 0 HD21 ASN A 55 15.276 6.883 -8.104 1.00 0.00 H new ATOM 0 HD22 ASN A 55 15.156 6.983 -6.345 1.00 0.00 H new ATOM 800 N GLY A 56 17.619 3.993 -3.225 1.00 0.00 N ATOM 801 CA GLY A 56 17.360 3.740 -1.818 1.00 0.00 C ATOM 802 C GLY A 56 16.753 2.350 -1.614 1.00 0.00 C ATOM 803 O GLY A 56 15.776 1.993 -2.270 1.00 0.00 O ATOM 0 H GLY A 56 17.755 3.156 -3.791 1.00 0.00 H new ATOM 0 HA2 GLY A 56 18.289 3.822 -1.253 1.00 0.00 H new ATOM 0 HA3 GLY A 56 16.681 4.498 -1.427 1.00 0.00 H new ATOM 807 N ILE A 57 17.357 1.604 -0.701 1.00 0.00 N ATOM 808 CA ILE A 57 16.888 0.261 -0.403 1.00 0.00 C ATOM 809 C ILE A 57 15.427 0.323 0.045 1.00 0.00 C ATOM 810 O ILE A 57 15.077 1.104 0.928 1.00 0.00 O ATOM 811 CB ILE A 57 17.813 -0.416 0.610 1.00 0.00 C ATOM 812 CG1 ILE A 57 19.037 -1.021 -0.082 1.00 0.00 C ATOM 813 CG2 ILE A 57 17.053 -1.454 1.438 1.00 0.00 C ATOM 814 CD1 ILE A 57 19.547 -0.102 -1.194 1.00 0.00 C ATOM 0 H ILE A 57 18.167 1.904 -0.158 1.00 0.00 H new ATOM 0 HA ILE A 57 16.921 -0.361 -1.297 1.00 0.00 H new ATOM 0 HB ILE A 57 18.177 0.345 1.301 1.00 0.00 H new ATOM 0 HG12 ILE A 57 19.828 -1.187 0.649 1.00 0.00 H new ATOM 0 HG13 ILE A 57 18.779 -1.995 -0.499 1.00 0.00 H new ATOM 0 HG21 ILE A 57 17.734 -1.920 2.150 1.00 0.00 H new ATOM 0 HG22 ILE A 57 16.242 -0.966 1.978 1.00 0.00 H new ATOM 0 HG23 ILE A 57 16.642 -2.217 0.777 1.00 0.00 H new ATOM 0 HD11 ILE A 57 20.417 -0.555 -1.670 1.00 0.00 H new ATOM 0 HD12 ILE A 57 18.762 0.042 -1.936 1.00 0.00 H new ATOM 0 HD13 ILE A 57 19.826 0.862 -0.770 1.00 0.00 H new ATOM 826 N ILE A 58 14.612 -0.509 -0.586 1.00 0.00 N ATOM 827 CA ILE A 58 13.196 -0.559 -0.264 1.00 0.00 C ATOM 828 C ILE A 58 13.003 -1.312 1.053 1.00 0.00 C ATOM 829 O ILE A 58 13.596 -2.370 1.260 1.00 0.00 O ATOM 830 CB ILE A 58 12.401 -1.147 -1.431 1.00 0.00 C ATOM 831 CG1 ILE A 58 12.817 -0.506 -2.757 1.00 0.00 C ATOM 832 CG2 ILE A 58 10.896 -1.029 -1.185 1.00 0.00 C ATOM 833 CD1 ILE A 58 12.561 1.003 -2.740 1.00 0.00 C ATOM 0 H ILE A 58 14.905 -1.154 -1.319 1.00 0.00 H new ATOM 0 HA ILE A 58 12.804 0.447 -0.117 1.00 0.00 H new ATOM 0 HB ILE A 58 12.633 -2.210 -1.500 1.00 0.00 H new ATOM 0 HG12 ILE A 58 13.874 -0.697 -2.942 1.00 0.00 H new ATOM 0 HG13 ILE A 58 12.262 -0.964 -3.576 1.00 0.00 H new ATOM 0 HG21 ILE A 58 10.355 -1.455 -2.030 1.00 0.00 H new ATOM 0 HG22 ILE A 58 10.632 -1.569 -0.276 1.00 0.00 H new ATOM 0 HG23 ILE A 58 10.627 0.021 -1.074 1.00 0.00 H new ATOM 0 HD11 ILE A 58 12.865 1.434 -3.694 1.00 0.00 H new ATOM 0 HD12 ILE A 58 11.499 1.190 -2.579 1.00 0.00 H new ATOM 0 HD13 ILE A 58 13.136 1.461 -1.935 1.00 0.00 H new ATOM 845 N LEU A 59 12.171 -0.738 1.910 1.00 0.00 N ATOM 846 CA LEU A 59 11.893 -1.342 3.202 1.00 0.00 C ATOM 847 C LEU A 59 10.527 -2.031 3.154 1.00 0.00 C ATOM 848 O LEU A 59 10.262 -2.947 3.931 1.00 0.00 O ATOM 849 CB LEU A 59 12.019 -0.303 4.318 1.00 0.00 C ATOM 850 CG LEU A 59 13.434 0.206 4.602 1.00 0.00 C ATOM 851 CD1 LEU A 59 14.235 0.351 3.307 1.00 0.00 C ATOM 852 CD2 LEU A 59 13.396 1.510 5.402 1.00 0.00 C ATOM 0 H LEU A 59 11.680 0.139 1.735 1.00 0.00 H new ATOM 0 HA LEU A 59 12.631 -2.111 3.430 1.00 0.00 H new ATOM 0 HB2 LEU A 59 11.391 0.551 4.065 1.00 0.00 H new ATOM 0 HB3 LEU A 59 11.618 -0.733 5.236 1.00 0.00 H new ATOM 0 HG LEU A 59 13.947 -0.534 5.216 1.00 0.00 H new ATOM 0 HD11 LEU A 59 15.237 0.714 3.537 1.00 0.00 H new ATOM 0 HD12 LEU A 59 14.305 -0.618 2.812 1.00 0.00 H new ATOM 0 HD13 LEU A 59 13.735 1.060 2.647 1.00 0.00 H new ATOM 0 HD21 LEU A 59 14.414 1.851 5.591 1.00 0.00 H new ATOM 0 HD22 LEU A 59 12.858 2.270 4.834 1.00 0.00 H new ATOM 0 HD23 LEU A 59 12.888 1.340 6.351 1.00 0.00 H new ATOM 864 N ALA A 60 9.696 -1.563 2.235 1.00 0.00 N ATOM 865 CA ALA A 60 8.364 -2.121 2.076 1.00 0.00 C ATOM 866 C ALA A 60 7.596 -1.309 1.031 1.00 0.00 C ATOM 867 O ALA A 60 8.169 -0.446 0.367 1.00 0.00 O ATOM 868 CB ALA A 60 7.656 -2.146 3.432 1.00 0.00 C ATOM 0 H ALA A 60 9.919 -0.803 1.592 1.00 0.00 H new ATOM 0 HA ALA A 60 8.419 -3.149 1.718 1.00 0.00 H new ATOM 0 HB1 ALA A 60 6.657 -2.565 3.313 1.00 0.00 H new ATOM 0 HB2 ALA A 60 8.226 -2.760 4.129 1.00 0.00 H new ATOM 0 HB3 ALA A 60 7.580 -1.131 3.822 1.00 0.00 H new ATOM 874 N TYR A 61 6.311 -1.613 0.919 1.00 0.00 N ATOM 875 CA TYR A 61 5.459 -0.921 -0.033 1.00 0.00 C ATOM 876 C TYR A 61 4.100 -0.592 0.587 1.00 0.00 C ATOM 877 O TYR A 61 3.800 -1.022 1.700 1.00 0.00 O ATOM 878 CB TYR A 61 5.254 -1.892 -1.197 1.00 0.00 C ATOM 879 CG TYR A 61 6.416 -1.926 -2.192 1.00 0.00 C ATOM 880 CD1 TYR A 61 7.588 -2.576 -1.863 1.00 0.00 C ATOM 881 CD2 TYR A 61 6.292 -1.305 -3.419 1.00 0.00 C ATOM 882 CE1 TYR A 61 8.681 -2.607 -2.799 1.00 0.00 C ATOM 883 CE2 TYR A 61 7.386 -1.337 -4.355 1.00 0.00 C ATOM 884 CZ TYR A 61 8.526 -1.986 -3.999 1.00 0.00 C ATOM 885 OH TYR A 61 9.559 -2.016 -4.883 1.00 0.00 O ATOM 0 H TYR A 61 5.840 -2.329 1.472 1.00 0.00 H new ATOM 0 HA TYR A 61 5.916 0.018 -0.347 1.00 0.00 H new ATOM 0 HB2 TYR A 61 5.102 -2.895 -0.798 1.00 0.00 H new ATOM 0 HB3 TYR A 61 4.342 -1.619 -1.728 1.00 0.00 H new ATOM 0 HD1 TYR A 61 7.685 -3.061 -0.903 1.00 0.00 H new ATOM 0 HD2 TYR A 61 5.375 -0.796 -3.677 1.00 0.00 H new ATOM 0 HE1 TYR A 61 9.604 -3.112 -2.554 1.00 0.00 H new ATOM 0 HE2 TYR A 61 7.302 -0.856 -5.318 1.00 0.00 H new ATOM 0 HH TYR A 61 9.307 -1.533 -5.698 1.00 0.00 H new ATOM 895 N GLN A 62 3.313 0.168 -0.161 1.00 0.00 N ATOM 896 CA GLN A 62 1.992 0.560 0.301 1.00 0.00 C ATOM 897 C GLN A 62 0.984 0.483 -0.847 1.00 0.00 C ATOM 898 O GLN A 62 1.243 0.985 -1.940 1.00 0.00 O ATOM 899 CB GLN A 62 2.019 1.961 0.914 1.00 0.00 C ATOM 900 CG GLN A 62 0.617 2.402 1.338 1.00 0.00 C ATOM 901 CD GLN A 62 0.289 3.792 0.788 1.00 0.00 C ATOM 902 OE1 GLN A 62 -0.445 4.539 1.608 1.00 0.00 O flip ATOM 903 NE2 GLN A 62 0.678 4.162 -0.307 1.00 0.00 N flip ATOM 0 H GLN A 62 3.565 0.523 -1.084 1.00 0.00 H new ATOM 0 HA GLN A 62 1.680 -0.135 1.080 1.00 0.00 H new ATOM 0 HB2 GLN A 62 2.684 1.971 1.778 1.00 0.00 H new ATOM 0 HB3 GLN A 62 2.424 2.670 0.192 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -0.119 1.682 0.979 1.00 0.00 H new ATOM 0 HG3 GLN A 62 0.549 2.412 2.426 1.00 0.00 H new ATOM 0 HE21 GLN A 62 1.239 3.538 -0.887 1.00 0.00 H new ATOM 0 HE22 GLN A 62 0.443 5.096 -0.643 1.00 0.00 H new ATOM 912 N ILE A 63 -0.145 -0.149 -0.560 1.00 0.00 N ATOM 913 CA ILE A 63 -1.193 -0.297 -1.555 1.00 0.00 C ATOM 914 C ILE A 63 -2.506 0.250 -0.992 1.00 0.00 C ATOM 915 O ILE A 63 -3.147 -0.395 -0.163 1.00 0.00 O ATOM 916 CB ILE A 63 -1.284 -1.751 -2.025 1.00 0.00 C ATOM 917 CG1 ILE A 63 -0.709 -1.908 -3.434 1.00 0.00 C ATOM 918 CG2 ILE A 63 -2.720 -2.269 -1.930 1.00 0.00 C ATOM 919 CD1 ILE A 63 0.195 -3.139 -3.523 1.00 0.00 C ATOM 0 H ILE A 63 -0.356 -0.564 0.347 1.00 0.00 H new ATOM 0 HA ILE A 63 -0.959 0.288 -2.445 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.677 -2.364 -1.359 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.522 -1.997 -4.155 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -0.142 -1.016 -3.701 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -2.757 -3.304 -2.270 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -3.059 -2.215 -0.895 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -3.369 -1.658 -2.557 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.591 -3.227 -4.535 1.00 0.00 H new ATOM 0 HD12 ILE A 63 1.020 -3.036 -2.818 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -0.381 -4.032 -3.279 1.00 0.00 H new ATOM 931 N THR A 64 -2.868 1.433 -1.464 1.00 0.00 N ATOM 932 CA THR A 64 -4.093 2.074 -1.018 1.00 0.00 C ATOM 933 C THR A 64 -5.249 1.729 -1.959 1.00 0.00 C ATOM 934 O THR A 64 -5.152 1.932 -3.169 1.00 0.00 O ATOM 935 CB THR A 64 -3.828 3.577 -0.908 1.00 0.00 C ATOM 936 OG1 THR A 64 -3.784 4.022 -2.261 1.00 0.00 O ATOM 937 CG2 THR A 64 -2.430 3.887 -0.369 1.00 0.00 C ATOM 0 H THR A 64 -2.334 1.965 -2.151 1.00 0.00 H new ATOM 0 HA THR A 64 -4.394 1.710 -0.036 1.00 0.00 H new ATOM 0 HB THR A 64 -4.577 4.031 -0.259 1.00 0.00 H new ATOM 0 HG1 THR A 64 -4.492 3.580 -2.774 1.00 0.00 H new ATOM 0 HG21 THR A 64 -2.294 4.967 -0.311 1.00 0.00 H new ATOM 0 HG22 THR A 64 -2.319 3.453 0.625 1.00 0.00 H new ATOM 0 HG23 THR A 64 -1.680 3.462 -1.036 1.00 0.00 H new ATOM 945 N HIS A 65 -6.317 1.214 -1.369 1.00 0.00 N ATOM 946 CA HIS A 65 -7.491 0.838 -2.139 1.00 0.00 C ATOM 947 C HIS A 65 -8.683 1.696 -1.710 1.00 0.00 C ATOM 948 O HIS A 65 -9.030 1.735 -0.530 1.00 0.00 O ATOM 949 CB HIS A 65 -7.764 -0.662 -2.016 1.00 0.00 C ATOM 950 CG HIS A 65 -7.430 -1.238 -0.661 1.00 0.00 C ATOM 951 ND1 HIS A 65 -8.397 -1.574 0.270 1.00 0.00 N ATOM 952 CD2 HIS A 65 -6.227 -1.535 -0.091 1.00 0.00 C ATOM 953 CE1 HIS A 65 -7.792 -2.049 1.349 1.00 0.00 C ATOM 954 NE2 HIS A 65 -6.447 -2.024 1.123 1.00 0.00 N ATOM 0 H HIS A 65 -6.394 1.048 -0.366 1.00 0.00 H new ATOM 0 HA HIS A 65 -7.313 1.030 -3.197 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -8.817 -0.848 -2.229 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -7.187 -1.189 -2.776 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -5.259 -1.396 -0.550 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -8.278 -2.395 2.249 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -5.729 -2.331 1.779 1.00 0.00 H new ATOM 962 N ARG A 66 -9.276 2.361 -2.690 1.00 0.00 N ATOM 963 CA ARG A 66 -10.422 3.215 -2.428 1.00 0.00 C ATOM 964 C ARG A 66 -11.326 3.283 -3.660 1.00 0.00 C ATOM 965 O ARG A 66 -10.860 3.114 -4.786 1.00 0.00 O ATOM 966 CB ARG A 66 -9.980 4.629 -2.049 1.00 0.00 C ATOM 967 CG ARG A 66 -9.500 5.402 -3.279 1.00 0.00 C ATOM 968 CD ARG A 66 -9.154 6.848 -2.919 1.00 0.00 C ATOM 969 NE ARG A 66 -8.294 7.440 -3.967 1.00 0.00 N ATOM 970 CZ ARG A 66 -7.773 8.672 -3.905 1.00 0.00 C ATOM 971 NH1 ARG A 66 -8.022 9.452 -2.843 1.00 0.00 N ATOM 972 NH2 ARG A 66 -7.003 9.126 -4.903 1.00 0.00 N ATOM 0 H ARG A 66 -8.985 2.326 -3.667 1.00 0.00 H new ATOM 0 HA ARG A 66 -10.973 2.783 -1.593 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -10.809 5.160 -1.582 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -9.179 4.578 -1.312 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -8.625 4.910 -3.703 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -10.275 5.390 -4.045 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -10.067 7.433 -2.813 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -8.642 6.879 -1.957 1.00 0.00 H new ATOM 0 HE ARG A 66 -8.085 6.874 -4.789 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -8.608 9.107 -2.083 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -7.625 10.391 -2.795 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -6.813 8.533 -5.711 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -6.607 10.065 -4.855 1.00 0.00 H new ATOM 986 N LEU A 67 -12.602 3.532 -3.406 1.00 0.00 N ATOM 987 CA LEU A 67 -13.575 3.625 -4.481 1.00 0.00 C ATOM 988 C LEU A 67 -13.450 4.991 -5.160 1.00 0.00 C ATOM 989 O LEU A 67 -13.514 6.025 -4.497 1.00 0.00 O ATOM 990 CB LEU A 67 -14.982 3.326 -3.958 1.00 0.00 C ATOM 991 CG LEU A 67 -15.466 1.884 -4.125 1.00 0.00 C ATOM 992 CD1 LEU A 67 -16.947 1.758 -3.763 1.00 0.00 C ATOM 993 CD2 LEU A 67 -15.176 1.368 -5.536 1.00 0.00 C ATOM 0 H LEU A 67 -12.985 3.672 -2.471 1.00 0.00 H new ATOM 0 HA LEU A 67 -13.375 2.870 -5.242 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -15.016 3.580 -2.898 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -15.685 3.986 -4.466 1.00 0.00 H new ATOM 0 HG LEU A 67 -14.909 1.254 -3.431 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -17.266 0.723 -3.890 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -17.095 2.058 -2.726 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -17.537 2.402 -4.415 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -15.530 0.341 -5.628 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -15.689 1.995 -6.265 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -14.102 1.400 -5.721 1.00 0.00 H new ATOM 1005 N ASN A 68 -13.273 4.950 -6.472 1.00 0.00 N ATOM 1006 CA ASN A 68 -13.138 6.171 -7.248 1.00 0.00 C ATOM 1007 C ASN A 68 -14.480 6.905 -7.273 1.00 0.00 C ATOM 1008 O ASN A 68 -14.556 8.053 -7.708 1.00 0.00 O ATOM 1009 CB ASN A 68 -12.739 5.864 -8.693 1.00 0.00 C ATOM 1010 CG ASN A 68 -11.662 6.833 -9.182 1.00 0.00 C ATOM 1011 OD1 ASN A 68 -11.051 7.561 -8.416 1.00 0.00 O ATOM 1012 ND2 ASN A 68 -11.463 6.803 -10.496 1.00 0.00 N ATOM 0 H ASN A 68 -13.220 4.090 -7.018 1.00 0.00 H new ATOM 0 HA ASN A 68 -12.365 6.783 -6.783 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -12.371 4.840 -8.763 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -13.615 5.932 -9.338 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -10.764 7.413 -10.920 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -12.009 6.170 -11.080 1.00 0.00 H new ATOM 1019 N THR A 69 -15.506 6.212 -6.802 1.00 0.00 N ATOM 1020 CA THR A 69 -16.842 6.784 -6.765 1.00 0.00 C ATOM 1021 C THR A 69 -17.620 6.244 -5.563 1.00 0.00 C ATOM 1022 O THR A 69 -18.367 5.275 -5.687 1.00 0.00 O ATOM 1023 CB THR A 69 -17.517 6.494 -8.106 1.00 0.00 C ATOM 1024 OG1 THR A 69 -17.869 5.115 -8.027 1.00 0.00 O ATOM 1025 CG2 THR A 69 -16.540 6.562 -9.281 1.00 0.00 C ATOM 0 H THR A 69 -15.440 5.260 -6.443 1.00 0.00 H new ATOM 0 HA THR A 69 -16.806 7.865 -6.630 1.00 0.00 H new ATOM 0 HB THR A 69 -18.326 7.206 -8.266 1.00 0.00 H new ATOM 0 HG1 THR A 69 -18.612 5.002 -7.398 1.00 0.00 H new ATOM 0 HG21 THR A 69 -17.071 6.348 -10.209 1.00 0.00 H new ATOM 0 HG22 THR A 69 -16.104 7.559 -9.334 1.00 0.00 H new ATOM 0 HG23 THR A 69 -15.748 5.827 -9.139 1.00 0.00 H new ATOM 1033 N THR A 70 -17.418 6.896 -4.427 1.00 0.00 N ATOM 1034 CA THR A 70 -18.092 6.494 -3.204 1.00 0.00 C ATOM 1035 C THR A 70 -17.669 7.394 -2.041 1.00 0.00 C ATOM 1036 O THR A 70 -18.487 7.740 -1.190 1.00 0.00 O ATOM 1037 CB THR A 70 -17.793 5.012 -2.965 1.00 0.00 C ATOM 1038 OG1 THR A 70 -19.005 4.497 -2.420 1.00 0.00 O ATOM 1039 CG2 THR A 70 -16.763 4.794 -1.855 1.00 0.00 C ATOM 0 H THR A 70 -16.797 7.699 -4.328 1.00 0.00 H new ATOM 0 HA THR A 70 -19.172 6.613 -3.290 1.00 0.00 H new ATOM 0 HB THR A 70 -17.431 4.561 -3.889 1.00 0.00 H new ATOM 0 HG1 THR A 70 -18.901 3.540 -2.236 1.00 0.00 H new ATOM 0 HG21 THR A 70 -16.587 3.726 -1.726 1.00 0.00 H new ATOM 0 HG22 THR A 70 -15.828 5.286 -2.124 1.00 0.00 H new ATOM 0 HG23 THR A 70 -17.139 5.215 -0.922 1.00 0.00 H new ATOM 1047 N THR A 71 -16.392 7.747 -2.043 1.00 0.00 N ATOM 1048 CA THR A 71 -15.850 8.601 -0.999 1.00 0.00 C ATOM 1049 C THR A 71 -16.318 8.122 0.377 1.00 0.00 C ATOM 1050 O THR A 71 -17.385 8.515 0.846 1.00 0.00 O ATOM 1051 CB THR A 71 -16.255 10.043 -1.310 1.00 0.00 C ATOM 1052 OG1 THR A 71 -17.668 9.978 -1.483 1.00 0.00 O ATOM 1053 CG2 THR A 71 -15.735 10.517 -2.669 1.00 0.00 C ATOM 0 H THR A 71 -15.717 7.457 -2.751 1.00 0.00 H new ATOM 0 HA THR A 71 -14.761 8.552 -0.973 1.00 0.00 H new ATOM 0 HB THR A 71 -15.879 10.702 -0.527 1.00 0.00 H new ATOM 0 HG1 THR A 71 -18.056 9.405 -0.789 1.00 0.00 H new ATOM 0 HG21 THR A 71 -16.050 11.546 -2.840 1.00 0.00 H new ATOM 0 HG22 THR A 71 -14.646 10.464 -2.681 1.00 0.00 H new ATOM 0 HG23 THR A 71 -16.137 9.878 -3.455 1.00 0.00 H new ATOM 1061 N ALA A 72 -15.496 7.280 0.986 1.00 0.00 N ATOM 1062 CA ALA A 72 -15.812 6.744 2.299 1.00 0.00 C ATOM 1063 C ALA A 72 -14.985 7.477 3.357 1.00 0.00 C ATOM 1064 O ALA A 72 -14.206 8.372 3.031 1.00 0.00 O ATOM 1065 CB ALA A 72 -15.562 5.234 2.307 1.00 0.00 C ATOM 0 H ALA A 72 -14.612 6.956 0.594 1.00 0.00 H new ATOM 0 HA ALA A 72 -16.864 6.902 2.535 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -15.799 4.831 3.292 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -16.194 4.757 1.558 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -14.515 5.037 2.077 1.00 0.00 H new ATOM 1071 N ASN A 73 -15.183 7.071 4.603 1.00 0.00 N ATOM 1072 CA ASN A 73 -14.465 7.678 5.711 1.00 0.00 C ATOM 1073 C ASN A 73 -13.005 7.896 5.309 1.00 0.00 C ATOM 1074 O ASN A 73 -12.484 9.004 5.426 1.00 0.00 O ATOM 1075 CB ASN A 73 -14.487 6.772 6.943 1.00 0.00 C ATOM 1076 CG ASN A 73 -14.539 7.599 8.230 1.00 0.00 C ATOM 1077 OD1 ASN A 73 -15.546 8.195 8.575 1.00 0.00 O ATOM 1078 ND2 ASN A 73 -13.401 7.600 8.918 1.00 0.00 N ATOM 0 H ASN A 73 -15.830 6.329 4.870 1.00 0.00 H new ATOM 0 HA ASN A 73 -14.951 8.624 5.951 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -15.352 6.110 6.897 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -13.600 6.138 6.949 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -13.334 8.122 9.792 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -12.595 7.079 8.572 1.00 0.00 H new ATOM 1085 N THR A 74 -12.386 6.820 4.844 1.00 0.00 N ATOM 1086 CA THR A 74 -10.996 6.879 4.425 1.00 0.00 C ATOM 1087 C THR A 74 -10.625 5.626 3.629 1.00 0.00 C ATOM 1088 O THR A 74 -11.384 4.659 3.598 1.00 0.00 O ATOM 1089 CB THR A 74 -10.134 7.084 5.672 1.00 0.00 C ATOM 1090 OG1 THR A 74 -9.542 8.366 5.479 1.00 0.00 O ATOM 1091 CG2 THR A 74 -8.942 6.126 5.724 1.00 0.00 C ATOM 0 H THR A 74 -12.822 5.903 4.748 1.00 0.00 H new ATOM 0 HA THR A 74 -10.822 7.718 3.751 1.00 0.00 H new ATOM 0 HB THR A 74 -10.747 6.948 6.563 1.00 0.00 H new ATOM 0 HG1 THR A 74 -10.246 9.041 5.389 1.00 0.00 H new ATOM 0 HG21 THR A 74 -8.363 6.314 6.629 1.00 0.00 H new ATOM 0 HG22 THR A 74 -9.302 5.097 5.731 1.00 0.00 H new ATOM 0 HG23 THR A 74 -8.310 6.284 4.850 1.00 0.00 H new ATOM 1099 N ALA A 75 -9.458 5.685 3.004 1.00 0.00 N ATOM 1100 CA ALA A 75 -8.978 4.567 2.211 1.00 0.00 C ATOM 1101 C ALA A 75 -8.009 3.730 3.049 1.00 0.00 C ATOM 1102 O ALA A 75 -6.924 4.193 3.397 1.00 0.00 O ATOM 1103 CB ALA A 75 -8.332 5.092 0.927 1.00 0.00 C ATOM 0 H ALA A 75 -8.831 6.489 3.031 1.00 0.00 H new ATOM 0 HA ALA A 75 -9.806 3.921 1.920 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -7.972 4.253 0.332 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -9.068 5.655 0.353 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -7.495 5.743 1.181 1.00 0.00 H new ATOM 1109 N THR A 76 -8.438 2.513 3.351 1.00 0.00 N ATOM 1110 CA THR A 76 -7.622 1.607 4.142 1.00 0.00 C ATOM 1111 C THR A 76 -6.426 1.115 3.325 1.00 0.00 C ATOM 1112 O THR A 76 -6.554 0.190 2.525 1.00 0.00 O ATOM 1113 CB THR A 76 -8.522 0.476 4.644 1.00 0.00 C ATOM 1114 OG1 THR A 76 -9.398 1.114 5.570 1.00 0.00 O ATOM 1115 CG2 THR A 76 -7.762 -0.545 5.492 1.00 0.00 C ATOM 0 H THR A 76 -9.340 2.133 3.062 1.00 0.00 H new ATOM 0 HA THR A 76 -7.197 2.113 5.009 1.00 0.00 H new ATOM 0 HB THR A 76 -8.979 -0.028 3.793 1.00 0.00 H new ATOM 0 HG1 THR A 76 -10.018 0.453 5.943 1.00 0.00 H new ATOM 0 HG21 THR A 76 -8.447 -1.326 5.822 1.00 0.00 H new ATOM 0 HG22 THR A 76 -6.964 -0.990 4.897 1.00 0.00 H new ATOM 0 HG23 THR A 76 -7.332 -0.048 6.361 1.00 0.00 H new ATOM 1123 N VAL A 77 -5.289 1.756 3.555 1.00 0.00 N ATOM 1124 CA VAL A 77 -4.071 1.395 2.851 1.00 0.00 C ATOM 1125 C VAL A 77 -3.382 0.245 3.589 1.00 0.00 C ATOM 1126 O VAL A 77 -3.515 0.114 4.805 1.00 0.00 O ATOM 1127 CB VAL A 77 -3.174 2.625 2.691 1.00 0.00 C ATOM 1128 CG1 VAL A 77 -4.006 3.908 2.656 1.00 0.00 C ATOM 1129 CG2 VAL A 77 -2.121 2.683 3.799 1.00 0.00 C ATOM 0 H VAL A 77 -5.186 2.523 4.219 1.00 0.00 H new ATOM 0 HA VAL A 77 -4.302 1.044 1.845 1.00 0.00 H new ATOM 0 HB VAL A 77 -2.652 2.538 1.738 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.345 4.767 2.542 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.699 3.869 1.816 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -4.567 4.003 3.586 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -1.497 3.566 3.662 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -2.616 2.735 4.769 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -1.499 1.789 3.757 1.00 0.00 H new ATOM 1139 N GLU A 78 -2.660 -0.559 2.822 1.00 0.00 N ATOM 1140 CA GLU A 78 -1.949 -1.694 3.388 1.00 0.00 C ATOM 1141 C GLU A 78 -0.463 -1.621 3.031 1.00 0.00 C ATOM 1142 O GLU A 78 -0.109 -1.332 1.889 1.00 0.00 O ATOM 1143 CB GLU A 78 -2.563 -3.014 2.918 1.00 0.00 C ATOM 1144 CG GLU A 78 -1.646 -4.193 3.249 1.00 0.00 C ATOM 1145 CD GLU A 78 -2.414 -5.297 3.979 1.00 0.00 C ATOM 1146 OE1 GLU A 78 -2.573 -5.159 5.211 1.00 0.00 O ATOM 1147 OE2 GLU A 78 -2.823 -6.255 3.288 1.00 0.00 O ATOM 0 H GLU A 78 -2.552 -0.447 1.814 1.00 0.00 H new ATOM 0 HA GLU A 78 -2.043 -1.654 4.473 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -3.533 -3.158 3.394 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -2.738 -2.975 1.843 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.214 -4.591 2.331 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.817 -3.851 3.869 1.00 0.00 H new ATOM 1154 N VAL A 79 0.366 -1.889 4.029 1.00 0.00 N ATOM 1155 CA VAL A 79 1.805 -1.858 3.835 1.00 0.00 C ATOM 1156 C VAL A 79 2.297 -3.260 3.471 1.00 0.00 C ATOM 1157 O VAL A 79 1.983 -4.230 4.160 1.00 0.00 O ATOM 1158 CB VAL A 79 2.489 -1.289 5.080 1.00 0.00 C ATOM 1159 CG1 VAL A 79 3.879 -1.900 5.270 1.00 0.00 C ATOM 1160 CG2 VAL A 79 2.567 0.238 5.013 1.00 0.00 C ATOM 0 H VAL A 79 0.068 -2.129 4.975 1.00 0.00 H new ATOM 0 HA VAL A 79 2.064 -1.198 3.007 1.00 0.00 H new ATOM 0 HB VAL A 79 1.884 -1.557 5.946 1.00 0.00 H new ATOM 0 HG11 VAL A 79 4.343 -1.478 6.162 1.00 0.00 H new ATOM 0 HG12 VAL A 79 3.789 -2.980 5.384 1.00 0.00 H new ATOM 0 HG13 VAL A 79 4.496 -1.677 4.400 1.00 0.00 H new ATOM 0 HG21 VAL A 79 3.057 0.617 5.910 1.00 0.00 H new ATOM 0 HG22 VAL A 79 3.139 0.535 4.134 1.00 0.00 H new ATOM 0 HG23 VAL A 79 1.560 0.651 4.948 1.00 0.00 H new ATOM 1170 N LEU A 80 3.060 -3.323 2.390 1.00 0.00 N ATOM 1171 CA LEU A 80 3.598 -4.591 1.927 1.00 0.00 C ATOM 1172 C LEU A 80 5.101 -4.635 2.207 1.00 0.00 C ATOM 1173 O LEU A 80 5.690 -3.635 2.614 1.00 0.00 O ATOM 1174 CB LEU A 80 3.240 -4.820 0.457 1.00 0.00 C ATOM 1175 CG LEU A 80 1.773 -5.145 0.167 1.00 0.00 C ATOM 1176 CD1 LEU A 80 1.277 -4.390 -1.067 1.00 0.00 C ATOM 1177 CD2 LEU A 80 1.561 -6.655 0.038 1.00 0.00 C ATOM 0 H LEU A 80 3.319 -2.517 1.821 1.00 0.00 H new ATOM 0 HA LEU A 80 3.147 -5.419 2.474 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.512 -3.927 -0.106 1.00 0.00 H new ATOM 0 HB3 LEU A 80 3.854 -5.636 0.077 1.00 0.00 H new ATOM 0 HG LEU A 80 1.175 -4.806 1.013 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.232 -4.639 -1.250 1.00 0.00 H new ATOM 0 HD12 LEU A 80 1.370 -3.317 -0.899 1.00 0.00 H new ATOM 0 HD13 LEU A 80 1.875 -4.675 -1.933 1.00 0.00 H new ATOM 0 HD21 LEU A 80 0.510 -6.859 -0.168 1.00 0.00 H new ATOM 0 HD22 LEU A 80 2.172 -7.040 -0.779 1.00 0.00 H new ATOM 0 HD23 LEU A 80 1.850 -7.144 0.969 1.00 0.00 H new ATOM 1189 N ALA A 81 5.680 -5.805 1.978 1.00 0.00 N ATOM 1190 CA ALA A 81 7.103 -5.993 2.201 1.00 0.00 C ATOM 1191 C ALA A 81 7.882 -5.385 1.033 1.00 0.00 C ATOM 1192 O ALA A 81 7.302 -5.052 0.001 1.00 0.00 O ATOM 1193 CB ALA A 81 7.399 -7.482 2.387 1.00 0.00 C ATOM 0 H ALA A 81 5.189 -6.632 1.640 1.00 0.00 H new ATOM 0 HA ALA A 81 7.420 -5.482 3.110 1.00 0.00 H new ATOM 0 HB1 ALA A 81 8.467 -7.623 2.554 1.00 0.00 H new ATOM 0 HB2 ALA A 81 6.844 -7.859 3.246 1.00 0.00 H new ATOM 0 HB3 ALA A 81 7.097 -8.027 1.493 1.00 0.00 H new ATOM 1199 N PRO A 82 9.220 -5.255 1.240 1.00 0.00 N ATOM 1200 CA PRO A 82 10.085 -4.693 0.217 1.00 0.00 C ATOM 1201 C PRO A 82 10.322 -5.698 -0.913 1.00 0.00 C ATOM 1202 O PRO A 82 10.975 -5.379 -1.905 1.00 0.00 O ATOM 1203 CB PRO A 82 11.361 -4.308 0.947 1.00 0.00 C ATOM 1204 CG PRO A 82 11.346 -5.088 2.252 1.00 0.00 C ATOM 1205 CD PRO A 82 9.942 -5.638 2.450 1.00 0.00 C ATOM 0 HA PRO A 82 9.646 -3.824 -0.274 1.00 0.00 H new ATOM 0 HB2 PRO A 82 12.241 -4.557 0.353 1.00 0.00 H new ATOM 0 HB3 PRO A 82 11.395 -3.235 1.134 1.00 0.00 H new ATOM 0 HG2 PRO A 82 12.073 -5.900 2.220 1.00 0.00 H new ATOM 0 HG3 PRO A 82 11.625 -4.443 3.085 1.00 0.00 H new ATOM 0 HD2 PRO A 82 9.955 -6.720 2.577 1.00 0.00 H new ATOM 0 HD3 PRO A 82 9.474 -5.218 3.340 1.00 0.00 H new ATOM 1213 N SER A 83 9.779 -6.891 -0.724 1.00 0.00 N ATOM 1214 CA SER A 83 9.924 -7.945 -1.714 1.00 0.00 C ATOM 1215 C SER A 83 8.549 -8.359 -2.242 1.00 0.00 C ATOM 1216 O SER A 83 8.324 -9.528 -2.549 1.00 0.00 O ATOM 1217 CB SER A 83 10.654 -9.155 -1.128 1.00 0.00 C ATOM 1218 OG SER A 83 9.980 -9.685 0.010 1.00 0.00 O ATOM 0 H SER A 83 9.238 -7.152 0.100 1.00 0.00 H new ATOM 0 HA SER A 83 10.522 -7.559 -2.539 1.00 0.00 H new ATOM 0 HB2 SER A 83 10.742 -9.929 -1.890 1.00 0.00 H new ATOM 0 HB3 SER A 83 11.667 -8.867 -0.848 1.00 0.00 H new ATOM 0 HG SER A 83 10.476 -10.457 0.354 1.00 0.00 H new ATOM 1224 N ALA A 84 7.664 -7.376 -2.331 1.00 0.00 N ATOM 1225 CA ALA A 84 6.318 -7.624 -2.817 1.00 0.00 C ATOM 1226 C ALA A 84 6.226 -7.208 -4.287 1.00 0.00 C ATOM 1227 O ALA A 84 6.670 -6.123 -4.658 1.00 0.00 O ATOM 1228 CB ALA A 84 5.312 -6.879 -1.937 1.00 0.00 C ATOM 0 H ALA A 84 7.853 -6.407 -2.075 1.00 0.00 H new ATOM 0 HA ALA A 84 6.079 -8.686 -2.759 1.00 0.00 H new ATOM 0 HB1 ALA A 84 4.302 -7.065 -2.302 1.00 0.00 H new ATOM 0 HB2 ALA A 84 5.397 -7.231 -0.909 1.00 0.00 H new ATOM 0 HB3 ALA A 84 5.519 -5.810 -1.973 1.00 0.00 H new ATOM 1234 N ARG A 85 5.646 -8.094 -5.084 1.00 0.00 N ATOM 1235 CA ARG A 85 5.490 -7.833 -6.505 1.00 0.00 C ATOM 1236 C ARG A 85 4.009 -7.669 -6.855 1.00 0.00 C ATOM 1237 O ARG A 85 3.670 -7.025 -7.847 1.00 0.00 O ATOM 1238 CB ARG A 85 6.082 -8.968 -7.342 1.00 0.00 C ATOM 1239 CG ARG A 85 6.497 -8.469 -8.727 1.00 0.00 C ATOM 1240 CD ARG A 85 7.939 -7.958 -8.716 1.00 0.00 C ATOM 1241 NE ARG A 85 8.710 -8.593 -9.808 1.00 0.00 N ATOM 1242 CZ ARG A 85 9.172 -9.850 -9.768 1.00 0.00 C ATOM 1243 NH1 ARG A 85 8.945 -10.614 -8.691 1.00 0.00 N ATOM 1244 NH2 ARG A 85 9.862 -10.344 -10.806 1.00 0.00 N ATOM 0 H ARG A 85 5.279 -8.993 -4.773 1.00 0.00 H new ATOM 0 HA ARG A 85 6.025 -6.911 -6.733 1.00 0.00 H new ATOM 0 HB2 ARG A 85 6.947 -9.390 -6.829 1.00 0.00 H new ATOM 0 HB3 ARG A 85 5.350 -9.769 -7.444 1.00 0.00 H new ATOM 0 HG2 ARG A 85 6.399 -9.276 -9.453 1.00 0.00 H new ATOM 0 HG3 ARG A 85 5.827 -7.671 -9.046 1.00 0.00 H new ATOM 0 HD2 ARG A 85 7.950 -6.874 -8.834 1.00 0.00 H new ATOM 0 HD3 ARG A 85 8.404 -8.179 -7.755 1.00 0.00 H new ATOM 0 HE ARG A 85 8.902 -8.039 -10.643 1.00 0.00 H new ATOM 0 HH11 ARG A 85 8.420 -10.239 -7.901 1.00 0.00 H new ATOM 0 HH12 ARG A 85 9.297 -11.571 -8.661 1.00 0.00 H new ATOM 0 HH21 ARG A 85 10.035 -9.763 -11.626 1.00 0.00 H new ATOM 0 HH22 ARG A 85 10.214 -11.301 -10.776 1.00 0.00 H new ATOM 1258 N GLN A 86 3.168 -8.262 -6.021 1.00 0.00 N ATOM 1259 CA GLN A 86 1.732 -8.189 -6.230 1.00 0.00 C ATOM 1260 C GLN A 86 1.001 -8.151 -4.887 1.00 0.00 C ATOM 1261 O GLN A 86 1.592 -8.434 -3.846 1.00 0.00 O ATOM 1262 CB GLN A 86 1.243 -9.359 -7.087 1.00 0.00 C ATOM 1263 CG GLN A 86 1.087 -10.627 -6.247 1.00 0.00 C ATOM 1264 CD GLN A 86 1.195 -11.880 -7.119 1.00 0.00 C ATOM 1265 OE1 GLN A 86 0.524 -12.025 -8.127 1.00 0.00 O ATOM 1266 NE2 GLN A 86 2.075 -12.773 -6.675 1.00 0.00 N ATOM 0 H GLN A 86 3.453 -8.795 -5.199 1.00 0.00 H new ATOM 0 HA GLN A 86 1.509 -7.268 -6.769 1.00 0.00 H new ATOM 0 HB2 GLN A 86 0.288 -9.103 -7.547 1.00 0.00 H new ATOM 0 HB3 GLN A 86 1.949 -9.540 -7.898 1.00 0.00 H new ATOM 0 HG2 GLN A 86 1.854 -10.651 -5.473 1.00 0.00 H new ATOM 0 HG3 GLN A 86 0.122 -10.615 -5.740 1.00 0.00 H new ATOM 0 HE21 GLN A 86 2.604 -12.588 -5.823 1.00 0.00 H new ATOM 0 HE22 GLN A 86 2.221 -13.643 -7.187 1.00 0.00 H new ATOM 1275 N TYR A 87 -0.275 -7.800 -4.953 1.00 0.00 N ATOM 1276 CA TYR A 87 -1.093 -7.721 -3.754 1.00 0.00 C ATOM 1277 C TYR A 87 -2.544 -8.103 -4.055 1.00 0.00 C ATOM 1278 O TYR A 87 -3.098 -7.697 -5.075 1.00 0.00 O ATOM 1279 CB TYR A 87 -1.045 -6.259 -3.306 1.00 0.00 C ATOM 1280 CG TYR A 87 -2.110 -5.890 -2.272 1.00 0.00 C ATOM 1281 CD1 TYR A 87 -3.369 -5.503 -2.685 1.00 0.00 C ATOM 1282 CD2 TYR A 87 -1.812 -5.945 -0.925 1.00 0.00 C ATOM 1283 CE1 TYR A 87 -4.371 -5.155 -1.711 1.00 0.00 C ATOM 1284 CE2 TYR A 87 -2.815 -5.597 0.048 1.00 0.00 C ATOM 1285 CZ TYR A 87 -4.045 -5.220 -0.393 1.00 0.00 C ATOM 1286 OH TYR A 87 -4.991 -4.892 0.527 1.00 0.00 O ATOM 0 H TYR A 87 -0.763 -7.567 -5.818 1.00 0.00 H new ATOM 0 HA TYR A 87 -0.722 -8.404 -2.990 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -0.060 -6.050 -2.889 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -1.164 -5.618 -4.179 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -3.603 -5.461 -3.739 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -0.827 -6.249 -0.601 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -5.359 -4.849 -2.021 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -2.595 -5.635 1.105 1.00 0.00 H new ATOM 0 HH TYR A 87 -5.168 -3.929 0.485 1.00 0.00 H new ATOM 1296 N THR A 88 -3.118 -8.879 -3.147 1.00 0.00 N ATOM 1297 CA THR A 88 -4.493 -9.320 -3.302 1.00 0.00 C ATOM 1298 C THR A 88 -5.428 -8.462 -2.446 1.00 0.00 C ATOM 1299 O THR A 88 -5.171 -8.249 -1.263 1.00 0.00 O ATOM 1300 CB THR A 88 -4.554 -10.810 -2.960 1.00 0.00 C ATOM 1301 OG1 THR A 88 -3.677 -11.419 -3.904 1.00 0.00 O ATOM 1302 CG2 THR A 88 -5.919 -11.427 -3.268 1.00 0.00 C ATOM 0 H THR A 88 -2.655 -9.213 -2.302 1.00 0.00 H new ATOM 0 HA THR A 88 -4.835 -9.193 -4.329 1.00 0.00 H new ATOM 0 HB THR A 88 -4.323 -10.949 -1.904 1.00 0.00 H new ATOM 0 HG1 THR A 88 -3.655 -12.387 -3.753 1.00 0.00 H new ATOM 0 HG21 THR A 88 -5.907 -12.485 -3.007 1.00 0.00 H new ATOM 0 HG22 THR A 88 -6.688 -10.918 -2.687 1.00 0.00 H new ATOM 0 HG23 THR A 88 -6.136 -11.318 -4.331 1.00 0.00 H new ATOM 1310 N ALA A 89 -6.493 -7.993 -3.079 1.00 0.00 N ATOM 1311 CA ALA A 89 -7.468 -7.164 -2.391 1.00 0.00 C ATOM 1312 C ALA A 89 -8.726 -7.988 -2.111 1.00 0.00 C ATOM 1313 O ALA A 89 -9.104 -8.841 -2.911 1.00 0.00 O ATOM 1314 CB ALA A 89 -7.761 -5.918 -3.230 1.00 0.00 C ATOM 0 H ALA A 89 -6.702 -8.171 -4.061 1.00 0.00 H new ATOM 0 HA ALA A 89 -7.076 -6.826 -1.432 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -8.492 -5.296 -2.714 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -6.841 -5.352 -3.375 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -8.159 -6.218 -4.200 1.00 0.00 H new ATOM 1320 N THR A 90 -9.339 -7.704 -0.971 1.00 0.00 N ATOM 1321 CA THR A 90 -10.547 -8.408 -0.575 1.00 0.00 C ATOM 1322 C THR A 90 -11.460 -7.487 0.237 1.00 0.00 C ATOM 1323 O THR A 90 -10.981 -6.633 0.982 1.00 0.00 O ATOM 1324 CB THR A 90 -10.131 -9.671 0.181 1.00 0.00 C ATOM 1325 OG1 THR A 90 -9.171 -9.209 1.128 1.00 0.00 O ATOM 1326 CG2 THR A 90 -9.347 -10.648 -0.698 1.00 0.00 C ATOM 0 H THR A 90 -9.022 -6.996 -0.309 1.00 0.00 H new ATOM 0 HA THR A 90 -11.132 -8.709 -1.444 1.00 0.00 H new ATOM 0 HB THR A 90 -11.018 -10.168 0.574 1.00 0.00 H new ATOM 0 HG1 THR A 90 -8.849 -9.965 1.663 1.00 0.00 H new ATOM 0 HG21 THR A 90 -9.076 -11.527 -0.113 1.00 0.00 H new ATOM 0 HG22 THR A 90 -9.963 -10.951 -1.544 1.00 0.00 H new ATOM 0 HG23 THR A 90 -8.442 -10.163 -1.064 1.00 0.00 H new ATOM 1334 N GLY A 91 -12.757 -7.691 0.065 1.00 0.00 N ATOM 1335 CA GLY A 91 -13.741 -6.890 0.772 1.00 0.00 C ATOM 1336 C GLY A 91 -14.019 -5.581 0.030 1.00 0.00 C ATOM 1337 O GLY A 91 -13.979 -4.505 0.625 1.00 0.00 O ATOM 0 H GLY A 91 -13.150 -8.400 -0.554 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -14.667 -7.455 0.878 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -13.383 -6.673 1.778 1.00 0.00 H new ATOM 1341 N LEU A 92 -14.293 -5.716 -1.259 1.00 0.00 N ATOM 1342 CA LEU A 92 -14.577 -4.557 -2.089 1.00 0.00 C ATOM 1343 C LEU A 92 -15.997 -4.670 -2.647 1.00 0.00 C ATOM 1344 O LEU A 92 -16.581 -5.753 -2.655 1.00 0.00 O ATOM 1345 CB LEU A 92 -13.504 -4.395 -3.168 1.00 0.00 C ATOM 1346 CG LEU A 92 -12.076 -4.756 -2.753 1.00 0.00 C ATOM 1347 CD1 LEU A 92 -11.250 -5.199 -3.962 1.00 0.00 C ATOM 1348 CD2 LEU A 92 -11.416 -3.601 -1.999 1.00 0.00 C ATOM 0 H LEU A 92 -14.324 -6.610 -1.749 1.00 0.00 H new ATOM 0 HA LEU A 92 -14.539 -3.644 -1.494 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -13.780 -5.013 -4.023 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -13.512 -3.359 -3.508 1.00 0.00 H new ATOM 0 HG LEU A 92 -12.122 -5.602 -2.068 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -10.239 -5.450 -3.640 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -11.713 -6.074 -4.418 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -11.208 -4.389 -4.690 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -10.402 -3.884 -1.716 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -11.381 -2.720 -2.640 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -11.993 -3.374 -1.103 1.00 0.00 H new ATOM 1360 N LYS A 93 -16.513 -3.537 -3.099 1.00 0.00 N ATOM 1361 CA LYS A 93 -17.854 -3.495 -3.657 1.00 0.00 C ATOM 1362 C LYS A 93 -17.778 -3.694 -5.173 1.00 0.00 C ATOM 1363 O LYS A 93 -17.011 -3.014 -5.853 1.00 0.00 O ATOM 1364 CB LYS A 93 -18.568 -2.208 -3.241 1.00 0.00 C ATOM 1365 CG LYS A 93 -19.915 -2.072 -3.954 1.00 0.00 C ATOM 1366 CD LYS A 93 -20.149 -0.632 -4.414 1.00 0.00 C ATOM 1367 CE LYS A 93 -20.080 0.339 -3.233 1.00 0.00 C ATOM 1368 NZ LYS A 93 -20.654 1.651 -3.606 1.00 0.00 N ATOM 0 H LYS A 93 -16.027 -2.641 -3.090 1.00 0.00 H new ATOM 0 HA LYS A 93 -18.458 -4.310 -3.258 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -18.722 -2.206 -2.162 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -17.940 -1.348 -3.475 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -19.945 -2.741 -4.814 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -20.718 -2.378 -3.284 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -19.401 -0.358 -5.159 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -21.123 -0.554 -4.897 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -20.623 -0.074 -2.383 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -19.044 0.465 -2.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -20.599 2.298 -2.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -20.118 2.050 -4.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -21.649 1.528 -3.884 1.00 0.00 H new ATOM 1382 N PRO A 94 -18.605 -4.652 -5.669 1.00 0.00 N ATOM 1383 CA PRO A 94 -18.638 -4.949 -7.091 1.00 0.00 C ATOM 1384 C PRO A 94 -19.384 -3.857 -7.861 1.00 0.00 C ATOM 1385 O PRO A 94 -20.132 -3.078 -7.273 1.00 0.00 O ATOM 1386 CB PRO A 94 -19.306 -6.310 -7.194 1.00 0.00 C ATOM 1387 CG PRO A 94 -20.037 -6.516 -5.877 1.00 0.00 C ATOM 1388 CD PRO A 94 -19.526 -5.477 -4.893 1.00 0.00 C ATOM 0 HA PRO A 94 -17.645 -4.974 -7.539 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -19.999 -6.342 -8.035 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -18.569 -7.096 -7.358 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -21.113 -6.412 -6.017 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -19.861 -7.522 -5.496 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -20.343 -4.882 -4.486 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -19.022 -5.946 -4.048 1.00 0.00 H new ATOM 1396 N GLU A 95 -19.154 -3.836 -9.166 1.00 0.00 N ATOM 1397 CA GLU A 95 -19.796 -2.853 -10.023 1.00 0.00 C ATOM 1398 C GLU A 95 -19.335 -1.443 -9.649 1.00 0.00 C ATOM 1399 O GLU A 95 -20.152 -0.529 -9.535 1.00 0.00 O ATOM 1400 CB GLU A 95 -21.319 -2.971 -9.948 1.00 0.00 C ATOM 1401 CG GLU A 95 -21.812 -4.203 -10.708 1.00 0.00 C ATOM 1402 CD GLU A 95 -22.311 -5.280 -9.743 1.00 0.00 C ATOM 1403 OE1 GLU A 95 -23.321 -5.007 -9.060 1.00 0.00 O ATOM 1404 OE2 GLU A 95 -21.670 -6.353 -9.709 1.00 0.00 O ATOM 0 H GLU A 95 -18.532 -4.483 -9.651 1.00 0.00 H new ATOM 0 HA GLU A 95 -19.501 -3.049 -11.054 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -21.631 -3.033 -8.906 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -21.778 -2.074 -10.365 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -22.615 -3.918 -11.387 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -21.004 -4.604 -11.320 1.00 0.00 H new ATOM 1411 N SER A 96 -18.030 -1.309 -9.469 1.00 0.00 N ATOM 1412 CA SER A 96 -17.451 -0.025 -9.111 1.00 0.00 C ATOM 1413 C SER A 96 -16.006 0.054 -9.606 1.00 0.00 C ATOM 1414 O SER A 96 -15.527 -0.854 -10.284 1.00 0.00 O ATOM 1415 CB SER A 96 -17.508 0.202 -7.599 1.00 0.00 C ATOM 1416 OG SER A 96 -18.841 0.407 -7.139 1.00 0.00 O ATOM 0 H SER A 96 -17.356 -2.069 -9.564 1.00 0.00 H new ATOM 0 HA SER A 96 -18.036 0.760 -9.591 1.00 0.00 H new ATOM 0 HB2 SER A 96 -17.076 -0.658 -7.087 1.00 0.00 H new ATOM 0 HB3 SER A 96 -16.898 1.067 -7.339 1.00 0.00 H new ATOM 0 HG SER A 96 -19.467 0.278 -7.882 1.00 0.00 H new ATOM 1422 N VAL A 97 -15.350 1.149 -9.248 1.00 0.00 N ATOM 1423 CA VAL A 97 -13.969 1.358 -9.647 1.00 0.00 C ATOM 1424 C VAL A 97 -13.130 1.691 -8.412 1.00 0.00 C ATOM 1425 O VAL A 97 -13.518 2.531 -7.601 1.00 0.00 O ATOM 1426 CB VAL A 97 -13.895 2.438 -10.729 1.00 0.00 C ATOM 1427 CG1 VAL A 97 -12.502 2.488 -11.360 1.00 0.00 C ATOM 1428 CG2 VAL A 97 -14.972 2.223 -11.794 1.00 0.00 C ATOM 0 H VAL A 97 -15.750 1.900 -8.686 1.00 0.00 H new ATOM 0 HA VAL A 97 -13.556 0.449 -10.084 1.00 0.00 H new ATOM 0 HB VAL A 97 -14.082 3.401 -10.254 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -12.477 3.264 -12.125 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -11.762 2.712 -10.592 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -12.273 1.524 -11.813 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -14.897 3.004 -12.550 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -14.831 1.249 -12.263 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -15.957 2.262 -11.329 1.00 0.00 H new ATOM 1438 N TYR A 98 -11.996 1.015 -8.307 1.00 0.00 N ATOM 1439 CA TYR A 98 -11.099 1.228 -7.184 1.00 0.00 C ATOM 1440 C TYR A 98 -9.727 1.709 -7.661 1.00 0.00 C ATOM 1441 O TYR A 98 -9.163 1.153 -8.602 1.00 0.00 O ATOM 1442 CB TYR A 98 -10.941 -0.135 -6.506 1.00 0.00 C ATOM 1443 CG TYR A 98 -12.041 -0.458 -5.494 1.00 0.00 C ATOM 1444 CD1 TYR A 98 -13.208 -1.065 -5.913 1.00 0.00 C ATOM 1445 CD2 TYR A 98 -11.868 -0.142 -4.161 1.00 0.00 C ATOM 1446 CE1 TYR A 98 -14.244 -1.369 -4.961 1.00 0.00 C ATOM 1447 CE2 TYR A 98 -12.905 -0.447 -3.209 1.00 0.00 C ATOM 1448 CZ TYR A 98 -14.041 -1.045 -3.656 1.00 0.00 C ATOM 1449 OH TYR A 98 -15.020 -1.332 -2.756 1.00 0.00 O ATOM 0 H TYR A 98 -11.677 0.319 -8.981 1.00 0.00 H new ATOM 0 HA TYR A 98 -11.500 1.986 -6.511 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -10.927 -0.911 -7.272 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -9.976 -0.168 -6.001 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -13.344 -1.312 -6.956 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -10.956 0.334 -3.832 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -15.162 -1.844 -5.276 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -12.783 -0.206 -2.163 1.00 0.00 H new ATOM 0 HH TYR A 98 -14.737 -1.046 -1.862 1.00 0.00 H new ATOM 1459 N LEU A 99 -9.230 2.738 -6.990 1.00 0.00 N ATOM 1460 CA LEU A 99 -7.935 3.300 -7.334 1.00 0.00 C ATOM 1461 C LEU A 99 -6.858 2.667 -6.451 1.00 0.00 C ATOM 1462 O LEU A 99 -6.887 2.813 -5.230 1.00 0.00 O ATOM 1463 CB LEU A 99 -7.976 4.828 -7.254 1.00 0.00 C ATOM 1464 CG LEU A 99 -6.629 5.542 -7.379 1.00 0.00 C ATOM 1465 CD1 LEU A 99 -5.876 5.528 -6.047 1.00 0.00 C ATOM 1466 CD2 LEU A 99 -5.795 4.946 -8.515 1.00 0.00 C ATOM 0 H LEU A 99 -9.701 3.197 -6.210 1.00 0.00 H new ATOM 0 HA LEU A 99 -7.680 3.064 -8.367 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -8.634 5.196 -8.041 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -8.428 5.110 -6.303 1.00 0.00 H new ATOM 0 HG LEU A 99 -6.818 6.585 -7.632 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.922 6.042 -6.163 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -6.471 6.035 -5.287 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -5.698 4.497 -5.740 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -4.843 5.472 -8.582 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -5.613 3.890 -8.317 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -6.334 5.051 -9.456 1.00 0.00 H new ATOM 1478 N PHE A 100 -5.934 1.977 -7.103 1.00 0.00 N ATOM 1479 CA PHE A 100 -4.849 1.321 -6.393 1.00 0.00 C ATOM 1480 C PHE A 100 -3.566 2.150 -6.465 1.00 0.00 C ATOM 1481 O PHE A 100 -2.981 2.303 -7.536 1.00 0.00 O ATOM 1482 CB PHE A 100 -4.613 -0.025 -7.081 1.00 0.00 C ATOM 1483 CG PHE A 100 -5.516 -1.150 -6.574 1.00 0.00 C ATOM 1484 CD1 PHE A 100 -6.819 -1.203 -6.960 1.00 0.00 C ATOM 1485 CD2 PHE A 100 -5.016 -2.099 -5.737 1.00 0.00 C ATOM 1486 CE1 PHE A 100 -7.658 -2.248 -6.489 1.00 0.00 C ATOM 1487 CE2 PHE A 100 -5.855 -3.144 -5.267 1.00 0.00 C ATOM 1488 CZ PHE A 100 -7.158 -3.196 -5.653 1.00 0.00 C ATOM 0 H PHE A 100 -5.914 1.858 -8.116 1.00 0.00 H new ATOM 0 HA PHE A 100 -5.112 1.200 -5.342 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -4.767 0.095 -8.153 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -3.572 -0.316 -6.939 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -7.216 -0.450 -7.625 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -3.981 -2.058 -5.430 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -8.693 -2.289 -6.795 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -5.458 -3.898 -4.603 1.00 0.00 H new ATOM 0 HZ PHE A 100 -7.796 -3.991 -5.295 1.00 0.00 H new ATOM 1498 N ARG A 101 -3.165 2.664 -5.311 1.00 0.00 N ATOM 1499 CA ARG A 101 -1.961 3.473 -5.230 1.00 0.00 C ATOM 1500 C ARG A 101 -0.812 2.658 -4.634 1.00 0.00 C ATOM 1501 O ARG A 101 -0.845 2.301 -3.457 1.00 0.00 O ATOM 1502 CB ARG A 101 -2.192 4.719 -4.373 1.00 0.00 C ATOM 1503 CG ARG A 101 -1.354 5.896 -4.878 1.00 0.00 C ATOM 1504 CD ARG A 101 -2.152 7.200 -4.822 1.00 0.00 C ATOM 1505 NE ARG A 101 -2.511 7.514 -3.421 1.00 0.00 N ATOM 1506 CZ ARG A 101 -3.280 8.550 -3.057 1.00 0.00 C ATOM 1507 NH1 ARG A 101 -3.774 9.377 -3.987 1.00 0.00 N ATOM 1508 NH2 ARG A 101 -3.554 8.757 -1.762 1.00 0.00 N ATOM 0 H ARG A 101 -3.653 2.536 -4.425 1.00 0.00 H new ATOM 0 HA ARG A 101 -1.702 3.784 -6.242 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -3.249 4.986 -4.391 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -1.935 4.504 -3.336 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -0.452 5.991 -4.273 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -1.033 5.706 -5.902 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -1.565 8.014 -5.247 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -3.055 7.110 -5.426 1.00 0.00 H new ATOM 0 HE ARG A 101 -2.151 6.904 -2.687 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -3.565 9.219 -4.973 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -4.359 10.165 -3.710 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -3.178 8.127 -1.054 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -4.139 9.545 -1.484 1.00 0.00 H new ATOM 1522 N ILE A 102 0.177 2.387 -5.473 1.00 0.00 N ATOM 1523 CA ILE A 102 1.334 1.620 -5.044 1.00 0.00 C ATOM 1524 C ILE A 102 2.477 2.578 -4.703 1.00 0.00 C ATOM 1525 O ILE A 102 2.727 3.536 -5.433 1.00 0.00 O ATOM 1526 CB ILE A 102 1.703 0.572 -6.096 1.00 0.00 C ATOM 1527 CG1 ILE A 102 0.606 -0.487 -6.222 1.00 0.00 C ATOM 1528 CG2 ILE A 102 3.068 -0.049 -5.796 1.00 0.00 C ATOM 1529 CD1 ILE A 102 0.589 -1.095 -7.626 1.00 0.00 C ATOM 0 H ILE A 102 0.201 2.685 -6.448 1.00 0.00 H new ATOM 0 HA ILE A 102 1.105 1.060 -4.137 1.00 0.00 H new ATOM 0 HB ILE A 102 1.782 1.070 -7.062 1.00 0.00 H new ATOM 0 HG12 ILE A 102 0.767 -1.272 -5.484 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -0.364 -0.039 -6.004 1.00 0.00 H new ATOM 0 HG21 ILE A 102 3.306 -0.790 -6.559 1.00 0.00 H new ATOM 0 HG22 ILE A 102 3.830 0.730 -5.797 1.00 0.00 H new ATOM 0 HG23 ILE A 102 3.042 -0.530 -4.818 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -0.200 -1.845 -7.688 1.00 0.00 H new ATOM 0 HD12 ILE A 102 0.403 -0.311 -8.360 1.00 0.00 H new ATOM 0 HD13 ILE A 102 1.552 -1.563 -7.831 1.00 0.00 H new ATOM 1541 N THR A 103 3.141 2.286 -3.594 1.00 0.00 N ATOM 1542 CA THR A 103 4.252 3.109 -3.148 1.00 0.00 C ATOM 1543 C THR A 103 5.292 2.254 -2.422 1.00 0.00 C ATOM 1544 O THR A 103 4.979 1.166 -1.939 1.00 0.00 O ATOM 1545 CB THR A 103 3.686 4.240 -2.286 1.00 0.00 C ATOM 1546 OG1 THR A 103 2.512 4.652 -2.981 1.00 0.00 O ATOM 1547 CG2 THR A 103 4.578 5.483 -2.292 1.00 0.00 C ATOM 0 H THR A 103 2.931 1.491 -2.991 1.00 0.00 H new ATOM 0 HA THR A 103 4.777 3.556 -3.992 1.00 0.00 H new ATOM 0 HB THR A 103 3.561 3.888 -1.262 1.00 0.00 H new ATOM 0 HG1 THR A 103 2.081 5.382 -2.490 1.00 0.00 H new ATOM 0 HG21 THR A 103 4.131 6.255 -1.665 1.00 0.00 H new ATOM 0 HG22 THR A 103 5.563 5.226 -1.903 1.00 0.00 H new ATOM 0 HG23 THR A 103 4.676 5.855 -3.312 1.00 0.00 H new ATOM 1555 N ALA A 104 6.507 2.777 -2.366 1.00 0.00 N ATOM 1556 CA ALA A 104 7.595 2.075 -1.707 1.00 0.00 C ATOM 1557 C ALA A 104 8.035 2.868 -0.475 1.00 0.00 C ATOM 1558 O ALA A 104 7.811 4.075 -0.396 1.00 0.00 O ATOM 1559 CB ALA A 104 8.739 1.859 -2.700 1.00 0.00 C ATOM 0 H ALA A 104 6.763 3.680 -2.766 1.00 0.00 H new ATOM 0 HA ALA A 104 7.268 1.092 -1.368 1.00 0.00 H new ATOM 0 HB1 ALA A 104 9.555 1.332 -2.206 1.00 0.00 H new ATOM 0 HB2 ALA A 104 8.382 1.267 -3.543 1.00 0.00 H new ATOM 0 HB3 ALA A 104 9.095 2.824 -3.060 1.00 0.00 H new ATOM 1565 N GLN A 105 8.654 2.157 0.457 1.00 0.00 N ATOM 1566 CA GLN A 105 9.127 2.779 1.682 1.00 0.00 C ATOM 1567 C GLN A 105 10.647 2.639 1.795 1.00 0.00 C ATOM 1568 O GLN A 105 11.178 1.532 1.725 1.00 0.00 O ATOM 1569 CB GLN A 105 8.429 2.183 2.905 1.00 0.00 C ATOM 1570 CG GLN A 105 8.721 3.007 4.160 1.00 0.00 C ATOM 1571 CD GLN A 105 8.829 2.109 5.394 1.00 0.00 C ATOM 1572 OE1 GLN A 105 9.816 1.427 5.613 1.00 0.00 O ATOM 1573 NE2 GLN A 105 7.760 2.147 6.185 1.00 0.00 N ATOM 0 H GLN A 105 8.839 1.156 0.388 1.00 0.00 H new ATOM 0 HA GLN A 105 8.881 3.840 1.646 1.00 0.00 H new ATOM 0 HB2 GLN A 105 7.353 2.146 2.732 1.00 0.00 H new ATOM 0 HB3 GLN A 105 8.763 1.156 3.054 1.00 0.00 H new ATOM 0 HG2 GLN A 105 9.650 3.561 4.027 1.00 0.00 H new ATOM 0 HG3 GLN A 105 7.930 3.742 4.309 1.00 0.00 H new ATOM 0 HE21 GLN A 105 6.967 2.741 5.942 1.00 0.00 H new ATOM 0 HE22 GLN A 105 7.734 1.583 7.034 1.00 0.00 H new ATOM 1582 N THR A 106 11.303 3.777 1.968 1.00 0.00 N ATOM 1583 CA THR A 106 12.750 3.795 2.092 1.00 0.00 C ATOM 1584 C THR A 106 13.165 4.475 3.399 1.00 0.00 C ATOM 1585 O THR A 106 12.329 4.723 4.266 1.00 0.00 O ATOM 1586 CB THR A 106 13.323 4.473 0.846 1.00 0.00 C ATOM 1587 OG1 THR A 106 12.382 5.500 0.546 1.00 0.00 O ATOM 1588 CG2 THR A 106 13.287 3.563 -0.384 1.00 0.00 C ATOM 0 H THR A 106 10.859 4.693 2.025 1.00 0.00 H new ATOM 0 HA THR A 106 13.155 2.784 2.145 1.00 0.00 H new ATOM 0 HB THR A 106 14.351 4.781 1.040 1.00 0.00 H new ATOM 0 HG1 THR A 106 12.466 6.222 1.203 1.00 0.00 H new ATOM 0 HG21 THR A 106 13.705 4.092 -1.240 1.00 0.00 H new ATOM 0 HG22 THR A 106 13.874 2.666 -0.190 1.00 0.00 H new ATOM 0 HG23 THR A 106 12.256 3.282 -0.599 1.00 0.00 H new ATOM 1596 N ARG A 107 14.456 4.757 3.497 1.00 0.00 N ATOM 1597 CA ARG A 107 14.992 5.404 4.683 1.00 0.00 C ATOM 1598 C ARG A 107 14.697 6.905 4.649 1.00 0.00 C ATOM 1599 O ARG A 107 14.993 7.621 5.604 1.00 0.00 O ATOM 1600 CB ARG A 107 16.503 5.190 4.791 1.00 0.00 C ATOM 1601 CG ARG A 107 17.242 5.925 3.671 1.00 0.00 C ATOM 1602 CD ARG A 107 18.755 5.892 3.898 1.00 0.00 C ATOM 1603 NE ARG A 107 19.464 6.171 2.630 1.00 0.00 N ATOM 1604 CZ ARG A 107 19.500 5.328 1.588 1.00 0.00 C ATOM 1605 NH1 ARG A 107 18.868 4.149 1.659 1.00 0.00 N ATOM 1606 NH2 ARG A 107 20.168 5.665 0.477 1.00 0.00 N ATOM 0 H ARG A 107 15.146 4.550 2.775 1.00 0.00 H new ATOM 0 HA ARG A 107 14.510 4.956 5.552 1.00 0.00 H new ATOM 0 HB2 ARG A 107 16.856 5.546 5.759 1.00 0.00 H new ATOM 0 HB3 ARG A 107 16.728 4.125 4.742 1.00 0.00 H new ATOM 0 HG2 ARG A 107 17.005 5.466 2.711 1.00 0.00 H new ATOM 0 HG3 ARG A 107 16.900 6.959 3.623 1.00 0.00 H new ATOM 0 HD2 ARG A 107 19.034 6.630 4.650 1.00 0.00 H new ATOM 0 HD3 ARG A 107 19.052 4.916 4.283 1.00 0.00 H new ATOM 0 HE ARG A 107 19.956 7.060 2.543 1.00 0.00 H new ATOM 0 HH11 ARG A 107 18.360 3.893 2.505 1.00 0.00 H new ATOM 0 HH12 ARG A 107 18.895 3.507 0.867 1.00 0.00 H new ATOM 0 HH21 ARG A 107 20.649 6.563 0.424 1.00 0.00 H new ATOM 0 HH22 ARG A 107 20.196 5.024 -0.316 1.00 0.00 H new ATOM 1620 N LYS A 108 14.118 7.336 3.538 1.00 0.00 N ATOM 1621 CA LYS A 108 13.779 8.739 3.366 1.00 0.00 C ATOM 1622 C LYS A 108 12.274 8.924 3.567 1.00 0.00 C ATOM 1623 O LYS A 108 11.829 9.982 4.010 1.00 0.00 O ATOM 1624 CB LYS A 108 14.288 9.251 2.017 1.00 0.00 C ATOM 1625 CG LYS A 108 15.698 8.731 1.729 1.00 0.00 C ATOM 1626 CD LYS A 108 16.718 9.357 2.681 1.00 0.00 C ATOM 1627 CE LYS A 108 16.752 10.879 2.526 1.00 0.00 C ATOM 1628 NZ LYS A 108 16.317 11.537 3.778 1.00 0.00 N ATOM 0 H LYS A 108 13.875 6.739 2.748 1.00 0.00 H new ATOM 0 HA LYS A 108 14.278 9.347 4.120 1.00 0.00 H new ATOM 0 HB2 LYS A 108 13.611 8.933 1.224 1.00 0.00 H new ATOM 0 HB3 LYS A 108 14.291 10.341 2.016 1.00 0.00 H new ATOM 0 HG2 LYS A 108 15.717 7.646 1.832 1.00 0.00 H new ATOM 0 HG3 LYS A 108 15.970 8.958 0.698 1.00 0.00 H new ATOM 0 HD2 LYS A 108 16.467 9.098 3.710 1.00 0.00 H new ATOM 0 HD3 LYS A 108 17.707 8.945 2.481 1.00 0.00 H new ATOM 0 HE2 LYS A 108 17.761 11.202 2.270 1.00 0.00 H new ATOM 0 HE3 LYS A 108 16.103 11.181 1.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 16.346 12.569 3.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 15.346 11.242 4.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 16.953 11.262 4.554 1.00 0.00 H new ATOM 1642 N GLY A 109 11.531 7.880 3.231 1.00 0.00 N ATOM 1643 CA GLY A 109 10.085 7.914 3.368 1.00 0.00 C ATOM 1644 C GLY A 109 9.406 7.202 2.196 1.00 0.00 C ATOM 1645 O GLY A 109 9.905 6.190 1.706 1.00 0.00 O ATOM 0 H GLY A 109 11.904 7.004 2.864 1.00 0.00 H new ATOM 0 HA2 GLY A 109 9.794 7.439 4.305 1.00 0.00 H new ATOM 0 HA3 GLY A 109 9.745 8.948 3.416 1.00 0.00 H new ATOM 1649 N TRP A 110 8.278 7.759 1.781 1.00 0.00 N ATOM 1650 CA TRP A 110 7.525 7.190 0.676 1.00 0.00 C ATOM 1651 C TRP A 110 7.670 8.126 -0.526 1.00 0.00 C ATOM 1652 O TRP A 110 7.295 9.295 -0.455 1.00 0.00 O ATOM 1653 CB TRP A 110 6.067 6.948 1.073 1.00 0.00 C ATOM 1654 CG TRP A 110 5.891 5.941 2.212 1.00 0.00 C ATOM 1655 CD1 TRP A 110 5.991 6.161 3.530 1.00 0.00 C ATOM 1656 CD2 TRP A 110 5.579 4.539 2.079 1.00 0.00 C ATOM 1657 NE1 TRP A 110 5.767 5.008 4.254 1.00 0.00 N ATOM 1658 CE2 TRP A 110 5.508 3.990 3.343 1.00 0.00 C ATOM 1659 CE3 TRP A 110 5.363 3.760 0.929 1.00 0.00 C ATOM 1660 CZ2 TRP A 110 5.221 2.639 3.577 1.00 0.00 C ATOM 1661 CZ3 TRP A 110 5.078 2.412 1.180 1.00 0.00 C ATOM 1662 CH2 TRP A 110 5.003 1.844 2.446 1.00 0.00 C ATOM 0 H TRP A 110 7.867 8.598 2.190 1.00 0.00 H new ATOM 0 HA TRP A 110 7.919 6.211 0.404 1.00 0.00 H new ATOM 0 HB2 TRP A 110 5.619 7.897 1.368 1.00 0.00 H new ATOM 0 HB3 TRP A 110 5.518 6.594 0.201 1.00 0.00 H new ATOM 0 HD1 TRP A 110 6.218 7.121 3.970 1.00 0.00 H new ATOM 0 HE1 TRP A 110 5.788 4.919 5.270 1.00 0.00 H new ATOM 0 HE3 TRP A 110 5.413 4.169 -0.069 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 5.171 2.233 4.576 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 4.904 1.769 0.330 1.00 0.00 H new ATOM 0 HH2 TRP A 110 4.777 0.794 2.557 1.00 0.00 H new ATOM 1673 N GLY A 111 8.214 7.576 -1.601 1.00 0.00 N ATOM 1674 CA GLY A 111 8.413 8.347 -2.817 1.00 0.00 C ATOM 1675 C GLY A 111 7.144 8.358 -3.672 1.00 0.00 C ATOM 1676 O GLY A 111 6.038 8.226 -3.150 1.00 0.00 O ATOM 0 H GLY A 111 8.523 6.606 -1.656 1.00 0.00 H new ATOM 0 HA2 GLY A 111 8.693 9.369 -2.562 1.00 0.00 H new ATOM 0 HA3 GLY A 111 9.238 7.924 -3.390 1.00 0.00 H new ATOM 1680 N GLU A 112 7.347 8.518 -4.972 1.00 0.00 N ATOM 1681 CA GLU A 112 6.233 8.548 -5.904 1.00 0.00 C ATOM 1682 C GLU A 112 5.320 7.341 -5.681 1.00 0.00 C ATOM 1683 O GLU A 112 5.704 6.384 -5.011 1.00 0.00 O ATOM 1684 CB GLU A 112 6.730 8.599 -7.351 1.00 0.00 C ATOM 1685 CG GLU A 112 6.327 9.913 -8.023 1.00 0.00 C ATOM 1686 CD GLU A 112 7.472 10.468 -8.873 1.00 0.00 C ATOM 1687 OE1 GLU A 112 8.489 10.866 -8.264 1.00 0.00 O ATOM 1688 OE2 GLU A 112 7.305 10.481 -10.111 1.00 0.00 O ATOM 0 H GLU A 112 8.266 8.628 -5.401 1.00 0.00 H new ATOM 0 HA GLU A 112 5.656 9.454 -5.720 1.00 0.00 H new ATOM 0 HB2 GLU A 112 7.815 8.494 -7.371 1.00 0.00 H new ATOM 0 HB3 GLU A 112 6.318 7.759 -7.911 1.00 0.00 H new ATOM 0 HG2 GLU A 112 5.450 9.751 -8.649 1.00 0.00 H new ATOM 0 HG3 GLU A 112 6.046 10.643 -7.264 1.00 0.00 H new ATOM 1695 N ALA A 113 4.128 7.427 -6.254 1.00 0.00 N ATOM 1696 CA ALA A 113 3.158 6.353 -6.125 1.00 0.00 C ATOM 1697 C ALA A 113 2.445 6.153 -7.464 1.00 0.00 C ATOM 1698 O ALA A 113 2.090 7.122 -8.134 1.00 0.00 O ATOM 1699 CB ALA A 113 2.185 6.678 -4.990 1.00 0.00 C ATOM 0 H ALA A 113 3.812 8.223 -6.808 1.00 0.00 H new ATOM 0 HA ALA A 113 3.654 5.416 -5.872 1.00 0.00 H new ATOM 0 HB1 ALA A 113 1.457 5.872 -4.893 1.00 0.00 H new ATOM 0 HB2 ALA A 113 2.737 6.783 -4.056 1.00 0.00 H new ATOM 0 HB3 ALA A 113 1.666 7.611 -5.211 1.00 0.00 H new ATOM 1705 N ALA A 114 2.258 4.889 -7.815 1.00 0.00 N ATOM 1706 CA ALA A 114 1.595 4.549 -9.062 1.00 0.00 C ATOM 1707 C ALA A 114 0.108 4.305 -8.794 1.00 0.00 C ATOM 1708 O ALA A 114 -0.248 3.441 -7.994 1.00 0.00 O ATOM 1709 CB ALA A 114 2.281 3.335 -9.692 1.00 0.00 C ATOM 0 H ALA A 114 2.554 4.088 -7.257 1.00 0.00 H new ATOM 0 HA ALA A 114 1.671 5.371 -9.773 1.00 0.00 H new ATOM 0 HB1 ALA A 114 1.783 3.080 -10.628 1.00 0.00 H new ATOM 0 HB2 ALA A 114 3.327 3.570 -9.890 1.00 0.00 H new ATOM 0 HB3 ALA A 114 2.223 2.488 -9.008 1.00 0.00 H new ATOM 1715 N GLU A 115 -0.719 5.081 -9.479 1.00 0.00 N ATOM 1716 CA GLU A 115 -2.159 4.959 -9.325 1.00 0.00 C ATOM 1717 C GLU A 115 -2.748 4.137 -10.472 1.00 0.00 C ATOM 1718 O GLU A 115 -2.566 4.476 -11.641 1.00 0.00 O ATOM 1719 CB GLU A 115 -2.819 6.337 -9.241 1.00 0.00 C ATOM 1720 CG GLU A 115 -2.991 6.775 -7.786 1.00 0.00 C ATOM 1721 CD GLU A 115 -4.000 7.920 -7.673 1.00 0.00 C ATOM 1722 OE1 GLU A 115 -4.903 7.968 -8.536 1.00 0.00 O ATOM 1723 OE2 GLU A 115 -3.846 8.722 -6.727 1.00 0.00 O ATOM 0 H GLU A 115 -0.420 5.796 -10.142 1.00 0.00 H new ATOM 0 HA GLU A 115 -2.362 4.437 -8.390 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -2.212 7.068 -9.775 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -3.791 6.309 -9.733 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -3.326 5.930 -7.185 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -2.030 7.092 -7.382 1.00 0.00 H new ATOM 1730 N ALA A 116 -3.443 3.072 -10.099 1.00 0.00 N ATOM 1731 CA ALA A 116 -4.060 2.199 -11.083 1.00 0.00 C ATOM 1732 C ALA A 116 -5.504 1.910 -10.668 1.00 0.00 C ATOM 1733 O ALA A 116 -5.756 1.481 -9.543 1.00 0.00 O ATOM 1734 CB ALA A 116 -3.229 0.923 -11.227 1.00 0.00 C ATOM 0 H ALA A 116 -3.592 2.794 -9.129 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.088 2.682 -12.060 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -3.692 0.268 -11.965 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -2.221 1.180 -11.552 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -3.181 0.410 -10.267 1.00 0.00 H new ATOM 1740 N LEU A 117 -6.415 2.157 -11.598 1.00 0.00 N ATOM 1741 CA LEU A 117 -7.827 1.929 -11.343 1.00 0.00 C ATOM 1742 C LEU A 117 -8.213 0.537 -11.845 1.00 0.00 C ATOM 1743 O LEU A 117 -7.750 0.102 -12.898 1.00 0.00 O ATOM 1744 CB LEU A 117 -8.669 3.056 -11.945 1.00 0.00 C ATOM 1745 CG LEU A 117 -8.686 4.372 -11.165 1.00 0.00 C ATOM 1746 CD1 LEU A 117 -8.557 5.570 -12.107 1.00 0.00 C ATOM 1747 CD2 LEU A 117 -9.931 4.469 -10.281 1.00 0.00 C ATOM 0 H LEU A 117 -6.202 2.513 -12.530 1.00 0.00 H new ATOM 0 HA LEU A 117 -8.029 1.949 -10.272 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -8.303 3.258 -12.952 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -9.695 2.702 -12.044 1.00 0.00 H new ATOM 0 HG LEU A 117 -7.819 4.388 -10.504 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -8.572 6.492 -11.527 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -7.618 5.502 -12.656 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -9.389 5.571 -12.811 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -9.919 5.414 -9.737 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -10.824 4.420 -10.904 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -9.938 3.642 -9.571 1.00 0.00 H new ATOM 1759 N VAL A 118 -9.057 -0.125 -11.067 1.00 0.00 N ATOM 1760 CA VAL A 118 -9.511 -1.460 -11.419 1.00 0.00 C ATOM 1761 C VAL A 118 -10.962 -1.636 -10.967 1.00 0.00 C ATOM 1762 O VAL A 118 -11.274 -1.465 -9.790 1.00 0.00 O ATOM 1763 CB VAL A 118 -8.568 -2.507 -10.824 1.00 0.00 C ATOM 1764 CG1 VAL A 118 -8.513 -2.393 -9.300 1.00 0.00 C ATOM 1765 CG2 VAL A 118 -8.974 -3.918 -11.255 1.00 0.00 C ATOM 0 H VAL A 118 -9.439 0.238 -10.194 1.00 0.00 H new ATOM 0 HA VAL A 118 -9.488 -1.599 -12.500 1.00 0.00 H new ATOM 0 HB VAL A 118 -7.567 -2.314 -11.210 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -7.835 -3.149 -8.903 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -8.154 -1.402 -9.022 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -9.510 -2.547 -8.887 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -8.288 -4.643 -10.818 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -9.988 -4.126 -10.912 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -8.936 -3.991 -12.342 1.00 0.00 H new ATOM 1775 N VAL A 119 -11.810 -1.976 -11.927 1.00 0.00 N ATOM 1776 CA VAL A 119 -13.220 -2.178 -11.642 1.00 0.00 C ATOM 1777 C VAL A 119 -13.422 -3.575 -11.052 1.00 0.00 C ATOM 1778 O VAL A 119 -12.625 -4.478 -11.299 1.00 0.00 O ATOM 1779 CB VAL A 119 -14.049 -1.937 -12.906 1.00 0.00 C ATOM 1780 CG1 VAL A 119 -15.384 -2.681 -12.836 1.00 0.00 C ATOM 1781 CG2 VAL A 119 -14.267 -0.441 -13.142 1.00 0.00 C ATOM 0 H VAL A 119 -11.547 -2.117 -12.903 1.00 0.00 H new ATOM 0 HA VAL A 119 -13.566 -1.459 -10.900 1.00 0.00 H new ATOM 0 HB VAL A 119 -13.489 -2.332 -13.754 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -15.954 -2.493 -13.746 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -15.200 -3.751 -12.738 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -15.951 -2.330 -11.974 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -14.859 -0.298 -14.046 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -14.795 -0.012 -12.291 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -13.302 0.053 -13.257 1.00 0.00 H new ATOM 1791 N THR A 120 -14.494 -3.709 -10.284 1.00 0.00 N ATOM 1792 CA THR A 120 -14.811 -4.981 -9.657 1.00 0.00 C ATOM 1793 C THR A 120 -15.950 -5.675 -10.406 1.00 0.00 C ATOM 1794 O THR A 120 -17.090 -5.214 -10.375 1.00 0.00 O ATOM 1795 CB THR A 120 -15.124 -4.717 -8.183 1.00 0.00 C ATOM 1796 OG1 THR A 120 -15.922 -3.536 -8.205 1.00 0.00 O ATOM 1797 CG2 THR A 120 -13.883 -4.314 -7.384 1.00 0.00 C ATOM 0 H THR A 120 -15.154 -2.958 -10.082 1.00 0.00 H new ATOM 0 HA THR A 120 -13.966 -5.668 -9.706 1.00 0.00 H new ATOM 0 HB THR A 120 -15.566 -5.609 -7.740 1.00 0.00 H new ATOM 0 HG1 THR A 120 -16.174 -3.294 -7.289 1.00 0.00 H new ATOM 0 HG21 THR A 120 -14.161 -4.138 -6.345 1.00 0.00 H new ATOM 0 HG22 THR A 120 -13.144 -5.114 -7.432 1.00 0.00 H new ATOM 0 HG23 THR A 120 -13.459 -3.402 -7.805 1.00 0.00 H new ATOM 1805 N THR A 121 -15.602 -6.774 -11.061 1.00 0.00 N ATOM 1806 CA THR A 121 -16.582 -7.536 -11.816 1.00 0.00 C ATOM 1807 C THR A 121 -15.938 -8.790 -12.410 1.00 0.00 C ATOM 1808 O THR A 121 -14.723 -8.963 -12.337 1.00 0.00 O ATOM 1809 CB THR A 121 -17.193 -6.609 -12.869 1.00 0.00 C ATOM 1810 OG1 THR A 121 -17.988 -7.475 -13.675 1.00 0.00 O ATOM 1811 CG2 THR A 121 -16.147 -6.054 -13.838 1.00 0.00 C ATOM 0 H THR A 121 -14.656 -7.154 -11.084 1.00 0.00 H new ATOM 0 HA THR A 121 -17.386 -7.895 -11.173 1.00 0.00 H new ATOM 0 HB THR A 121 -17.703 -5.783 -12.373 1.00 0.00 H new ATOM 0 HG1 THR A 121 -18.423 -6.955 -14.383 1.00 0.00 H new ATOM 0 HG21 THR A 121 -16.633 -5.403 -14.564 1.00 0.00 H new ATOM 0 HG22 THR A 121 -15.402 -5.485 -13.282 1.00 0.00 H new ATOM 0 HG23 THR A 121 -15.660 -6.878 -14.359 1.00 0.00 H new ATOM 1819 N GLU A 122 -16.782 -9.634 -12.986 1.00 0.00 N ATOM 1820 CA GLU A 122 -16.311 -10.867 -13.593 1.00 0.00 C ATOM 1821 C GLU A 122 -16.046 -10.657 -15.085 1.00 0.00 C ATOM 1822 O GLU A 122 -15.258 -11.383 -15.688 1.00 0.00 O ATOM 1823 CB GLU A 122 -17.309 -12.005 -13.368 1.00 0.00 C ATOM 1824 CG GLU A 122 -17.566 -12.221 -11.876 1.00 0.00 C ATOM 1825 CD GLU A 122 -18.888 -12.959 -11.648 1.00 0.00 C ATOM 1826 OE1 GLU A 122 -19.937 -12.344 -11.937 1.00 0.00 O ATOM 1827 OE2 GLU A 122 -18.818 -14.120 -11.192 1.00 0.00 O ATOM 0 H GLU A 122 -17.790 -9.488 -13.045 1.00 0.00 H new ATOM 0 HA GLU A 122 -15.374 -11.150 -13.114 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -18.247 -11.776 -13.873 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -16.925 -12.924 -13.811 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -16.746 -12.793 -11.441 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -17.590 -11.259 -11.364 1.00 0.00 H new ATOM 1834 N LYS A 123 -16.721 -9.659 -15.639 1.00 0.00 N ATOM 1835 CA LYS A 123 -16.568 -9.344 -17.049 1.00 0.00 C ATOM 1836 C LYS A 123 -15.292 -8.524 -17.249 1.00 0.00 C ATOM 1837 O LYS A 123 -14.774 -7.935 -16.302 1.00 0.00 O ATOM 1838 CB LYS A 123 -17.828 -8.662 -17.585 1.00 0.00 C ATOM 1839 CG LYS A 123 -18.986 -9.656 -17.695 1.00 0.00 C ATOM 1840 CD LYS A 123 -20.144 -9.062 -18.498 1.00 0.00 C ATOM 1841 CE LYS A 123 -21.477 -9.273 -17.776 1.00 0.00 C ATOM 1842 NZ LYS A 123 -22.501 -8.339 -18.295 1.00 0.00 N ATOM 0 H LYS A 123 -17.375 -9.059 -15.136 1.00 0.00 H new ATOM 0 HA LYS A 123 -16.455 -10.257 -17.633 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -18.110 -7.841 -16.925 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -17.622 -8.228 -18.564 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -18.639 -10.572 -18.173 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -19.332 -9.928 -16.698 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -19.975 -7.996 -18.653 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -20.183 -9.525 -19.484 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -21.812 -10.301 -17.912 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -21.346 -9.119 -16.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -23.399 -8.495 -17.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -22.186 -7.359 -18.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -22.638 -8.505 -19.312 1.00 0.00 H new ATOM 1856 N ARG A 124 -14.822 -8.513 -18.488 1.00 0.00 N ATOM 1857 CA ARG A 124 -13.617 -7.775 -18.824 1.00 0.00 C ATOM 1858 C ARG A 124 -13.935 -6.669 -19.832 1.00 0.00 C ATOM 1859 O ARG A 124 -14.902 -6.770 -20.585 1.00 0.00 O ATOM 1860 CB ARG A 124 -12.550 -8.701 -19.413 1.00 0.00 C ATOM 1861 CG ARG A 124 -11.205 -8.503 -18.711 1.00 0.00 C ATOM 1862 CD ARG A 124 -10.312 -9.734 -18.881 1.00 0.00 C ATOM 1863 NE ARG A 124 -9.367 -9.523 -20.000 1.00 0.00 N ATOM 1864 CZ ARG A 124 -9.680 -9.697 -21.291 1.00 0.00 C ATOM 1865 NH1 ARG A 124 -10.915 -10.087 -21.635 1.00 0.00 N ATOM 1866 NH2 ARG A 124 -8.757 -9.482 -22.239 1.00 0.00 N ATOM 0 H ARG A 124 -15.254 -9.003 -19.271 1.00 0.00 H new ATOM 0 HA ARG A 124 -13.232 -7.334 -17.905 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -12.868 -9.739 -19.312 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -12.440 -8.504 -20.479 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -10.703 -7.626 -19.119 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -11.369 -8.312 -17.651 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -9.761 -9.924 -17.960 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -10.925 -10.615 -19.073 1.00 0.00 H new ATOM 0 HE ARG A 124 -8.418 -9.226 -19.774 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -11.617 -10.252 -20.914 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -11.153 -10.219 -22.618 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -7.817 -9.186 -21.977 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -8.995 -9.614 -23.222 1.00 0.00 H new ATOM 1880 N SER A 125 -13.103 -5.638 -19.814 1.00 0.00 N ATOM 1881 CA SER A 125 -13.284 -4.514 -20.717 1.00 0.00 C ATOM 1882 C SER A 125 -11.933 -4.080 -21.289 1.00 0.00 C ATOM 1883 O SER A 125 -10.886 -4.537 -20.833 1.00 0.00 O ATOM 1884 CB SER A 125 -13.962 -3.341 -20.007 1.00 0.00 C ATOM 1885 OG SER A 125 -15.342 -3.236 -20.347 1.00 0.00 O ATOM 0 H SER A 125 -12.302 -5.557 -19.188 1.00 0.00 H new ATOM 0 HA SER A 125 -13.932 -4.832 -21.534 1.00 0.00 H new ATOM 0 HB2 SER A 125 -13.863 -3.464 -18.928 1.00 0.00 H new ATOM 0 HB3 SER A 125 -13.452 -2.414 -20.270 1.00 0.00 H new ATOM 0 HG SER A 125 -15.739 -2.476 -19.872 1.00 0.00 H new ATOM 1891 N GLY A 126 -12.000 -3.202 -22.279 1.00 0.00 N ATOM 1892 CA GLY A 126 -10.795 -2.701 -22.918 1.00 0.00 C ATOM 1893 C GLY A 126 -11.137 -1.870 -24.157 1.00 0.00 C ATOM 1894 O GLY A 126 -11.743 -2.375 -25.100 1.00 0.00 O ATOM 0 H GLY A 126 -12.870 -2.825 -22.654 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -10.231 -2.092 -22.212 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -10.155 -3.537 -23.201 1.00 0.00 H new ATOM 1898 N PRO A 127 -10.721 -0.576 -24.113 1.00 0.00 N ATOM 1899 CA PRO A 127 -10.976 0.330 -25.220 1.00 0.00 C ATOM 1900 C PRO A 127 -10.044 0.034 -26.396 1.00 0.00 C ATOM 1901 O PRO A 127 -9.207 -0.864 -26.319 1.00 0.00 O ATOM 1902 CB PRO A 127 -10.780 1.722 -24.642 1.00 0.00 C ATOM 1903 CG PRO A 127 -9.974 1.535 -23.367 1.00 0.00 C ATOM 1904 CD PRO A 127 -10.000 0.057 -23.012 1.00 0.00 C ATOM 0 HA PRO A 127 -11.980 0.221 -25.630 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -10.253 2.366 -25.346 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -11.739 2.196 -24.432 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -8.948 1.875 -23.510 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -10.397 2.130 -22.557 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -8.991 -0.345 -22.916 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -10.503 -0.113 -22.060 1.00 0.00 H new ATOM 1912 N SER A 128 -10.220 0.807 -27.458 1.00 0.00 N ATOM 1913 CA SER A 128 -9.405 0.639 -28.649 1.00 0.00 C ATOM 1914 C SER A 128 -9.478 1.899 -29.515 1.00 0.00 C ATOM 1915 O SER A 128 -10.512 2.562 -29.566 1.00 0.00 O ATOM 1916 CB SER A 128 -9.850 -0.584 -29.454 1.00 0.00 C ATOM 1917 OG SER A 128 -9.108 -0.728 -30.661 1.00 0.00 O ATOM 0 H SER A 128 -10.915 1.551 -27.518 1.00 0.00 H new ATOM 0 HA SER A 128 -8.373 0.479 -28.337 1.00 0.00 H new ATOM 0 HB2 SER A 128 -9.731 -1.481 -28.846 1.00 0.00 H new ATOM 0 HB3 SER A 128 -10.911 -0.497 -29.689 1.00 0.00 H new ATOM 0 HG SER A 128 -9.421 -1.521 -31.145 1.00 0.00 H new ATOM 1923 N SER A 129 -8.366 2.190 -30.174 1.00 0.00 N ATOM 1924 CA SER A 129 -8.291 3.359 -31.035 1.00 0.00 C ATOM 1925 C SER A 129 -7.041 3.281 -31.914 1.00 0.00 C ATOM 1926 O SER A 129 -5.968 2.910 -31.442 1.00 0.00 O ATOM 1927 CB SER A 129 -8.281 4.649 -30.212 1.00 0.00 C ATOM 1928 OG SER A 129 -7.298 4.618 -29.181 1.00 0.00 O ATOM 0 H SER A 129 -7.510 1.637 -30.129 1.00 0.00 H new ATOM 0 HA SER A 129 -9.176 3.373 -31.672 1.00 0.00 H new ATOM 0 HB2 SER A 129 -8.090 5.497 -30.870 1.00 0.00 H new ATOM 0 HB3 SER A 129 -9.265 4.804 -29.770 1.00 0.00 H new ATOM 0 HG SER A 129 -7.323 5.460 -28.680 1.00 0.00 H new ATOM 1934 N GLY A 130 -7.223 3.637 -33.177 1.00 0.00 N ATOM 1935 CA GLY A 130 -6.124 3.612 -34.127 1.00 0.00 C ATOM 1936 C GLY A 130 -5.591 2.190 -34.312 1.00 0.00 C ATOM 1937 O GLY A 130 -6.206 1.377 -35.000 1.00 0.00 O ATOM 0 H GLY A 130 -8.115 3.944 -33.565 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -6.459 4.006 -35.086 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -5.322 4.262 -33.778 1.00 0.00 H new TER 1941 GLY A 130