USER MOD reduce.3.24.130724 H: found=0, std=0, add=750, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 738 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 160 SER OG : rot -172:sc= 0.945 USER MOD Set 1.2: A 163 SER OG : rot 75:sc= 0.766 USER MOD Set 2.1: A 107 CYS SG : rot -140:sc= 0.673 USER MOD Set 2.2: A 138 SER OG : rot 161:sc= 0.794 USER MOD Set 3.1: A 128 HIS : no HD1:sc= -0.0729 X(o=-0.13,f=-0.11) USER MOD Set 3.2: A 157 ASN : amide:sc= -0.0603 K(o=-0.13,f=-2.2!) USER MOD Set 4.1: A 104 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 118 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 91 HIS : no HD1:sc= -0.0937 X(o=-0.07,f=-0.026) USER MOD Set 5.2: A 93 SER OG : rot -67:sc= 0.0233 USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 HIS :FLIP no HE2:sc= 0.146 F(o=-1,f=0.15) USER MOD Single : A 83 HIS : no HD1:sc= -0.0547 X(o=-0.055,f=-0.055) USER MOD Single : A 84 HIS : no HE2:sc= 0.891 K(o=0.89,f=-2.7!) USER MOD Single : A 85 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 86 HIS : no HE2:sc= -0.0222 X(o=-0.022,f=-0.064) USER MOD Single : A 87 HIS : no HD1:sc= 0 X(o=0,f=-0.06) USER MOD Single : A 88 HIS : no HE2:sc= -0.145 K(o=-0.15,f=-0.8) USER MOD Single : A 89 HIS : no HD1:sc= -0.303 X(o=-0.3,f=-0.017) USER MOD Single : A 90 HIS : no HE2:sc= 0.573 K(o=0.57,f=-1.8!) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 95 HIS : no HE2:sc= 0.124 K(o=0.12,f=-0.64) USER MOD Single : A 100 HIS : no HD1:sc= -0.35 K(o=-0.35,f=-1) USER MOD Single : A 101 MET CE :methyl -168:sc= -0.188 (180deg=-0.366) USER MOD Single : A 106 TYR OH : rot 180:sc= -0.0914 USER MOD Single : A 113 SER OG : rot 160:sc= 0 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 129 ASN : amide:sc=-0.00959 K(o=-0.0096,f=-0.55) USER MOD Single : A 134 CYS SG : rot 71:sc= 0.644 USER MOD Single : A 145 SER OG : rot -88:sc= 0.363 USER MOD Single : A 146 GLN : amide:sc= -0.132 X(o=-0.13,f=0) USER MOD Single : A 149 TYR OH : rot 125:sc= 0.186 USER MOD Single : A 155 THR OG1 : rot 79:sc= 0.0169 USER MOD Single : A 158 HIS : no HD1:sc= -0.0266 X(o=-0.027,f=0) USER MOD Single : A 164 TYR OH : rot 161:sc= 1.06 USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 GLN : amide:sc= -0.196 K(o=-0.2,f=-2.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 80 52.779 -20.902 -46.594 1.00 25.00 N ATOM 2 CA MET A 80 53.296 -19.516 -46.809 1.00 25.00 C ATOM 3 C MET A 80 52.990 -18.548 -45.664 1.00 25.00 C ATOM 4 O MET A 80 52.735 -17.376 -45.820 1.00 25.00 O ATOM 5 CB MET A 80 52.720 -18.967 -48.131 1.00 25.00 C ATOM 6 CG MET A 80 53.145 -19.839 -49.324 1.00 25.00 C ATOM 7 SD MET A 80 52.561 -19.149 -50.907 1.00 25.00 S ATOM 8 CE MET A 80 53.106 -20.458 -52.053 1.00 25.00 C ATOM 0 HA MET A 80 54.383 -19.588 -46.851 1.00 25.00 H new ATOM 0 HB2 MET A 80 51.632 -18.933 -48.071 1.00 25.00 H new ATOM 0 HB3 MET A 80 53.063 -17.944 -48.284 1.00 25.00 H new ATOM 0 HG2 MET A 80 54.231 -19.924 -49.343 1.00 25.00 H new ATOM 0 HG3 MET A 80 52.748 -20.846 -49.198 1.00 25.00 H new ATOM 0 HE1 MET A 80 52.825 -20.190 -53.071 1.00 25.00 H new ATOM 0 HE2 MET A 80 54.189 -20.567 -51.992 1.00 25.00 H new ATOM 0 HE3 MET A 80 52.631 -21.401 -51.781 1.00 25.00 H new ATOM 18 N GLY A 81 53.012 -19.101 -44.444 1.00 25.00 N ATOM 19 CA GLY A 81 52.699 -18.361 -43.230 1.00 25.00 C ATOM 20 C GLY A 81 51.429 -18.901 -42.607 1.00 25.00 C ATOM 21 O GLY A 81 50.964 -19.976 -42.988 1.00 25.00 O ATOM 0 H GLY A 81 53.249 -20.079 -44.278 1.00 25.00 H new ATOM 0 HA2 GLY A 81 53.524 -18.442 -42.522 1.00 25.00 H new ATOM 0 HA3 GLY A 81 52.579 -17.302 -43.460 1.00 25.00 H new ATOM 25 N HIS A 82 50.872 -18.182 -41.645 1.00 25.00 N ATOM 26 CA HIS A 82 49.636 -18.610 -40.996 1.00 25.00 C ATOM 27 C HIS A 82 48.456 -17.947 -41.703 1.00 25.00 C ATOM 28 O HIS A 82 48.541 -16.797 -42.109 1.00 25.00 O ATOM 29 CB HIS A 82 49.649 -18.243 -39.511 1.00 25.00 C ATOM 30 CG HIS A 82 48.539 -18.876 -38.732 1.00 25.00 C ATOM 31 ND1 HIS A 82 47.488 -18.318 -38.070 1.00 25.00 N flip ATOM 32 CD2 HIS A 82 48.395 -20.230 -38.550 1.00 25.00 C flip ATOM 33 CE1 HIS A 82 46.705 -19.306 -37.511 1.00 25.00 C flip ATOM 34 NE2 HIS A 82 47.301 -20.437 -37.825 1.00 25.00 N flip ATOM 0 H HIS A 82 51.252 -17.302 -41.295 1.00 25.00 H new ATOM 0 HA HIS A 82 49.544 -19.694 -41.067 1.00 25.00 H new ATOM 0 HB2 HIS A 82 50.603 -18.543 -39.079 1.00 25.00 H new ATOM 0 HB3 HIS A 82 49.581 -17.160 -39.412 1.00 25.00 H new ATOM 0 HD1 HIS A 82 47.307 -17.317 -37.998 1.00 25.00 H new ATOM 0 HD2 HIS A 82 49.057 -20.994 -38.930 1.00 25.00 H new ATOM 0 HE1 HIS A 82 45.798 -19.179 -36.939 1.00 25.00 H new ATOM 42 N HIS A 83 47.370 -18.690 -41.867 1.00 25.00 N ATOM 43 CA HIS A 83 46.203 -18.216 -42.615 1.00 25.00 C ATOM 44 C HIS A 83 45.399 -17.128 -41.884 1.00 25.00 C ATOM 45 O HIS A 83 44.561 -16.464 -42.483 1.00 25.00 O ATOM 46 CB HIS A 83 45.296 -19.421 -42.907 1.00 25.00 C ATOM 47 CG HIS A 83 44.162 -19.119 -43.837 1.00 25.00 C ATOM 48 ND1 HIS A 83 44.311 -18.773 -45.158 1.00 25.00 N ATOM 49 CD2 HIS A 83 42.817 -19.114 -43.622 1.00 25.00 C ATOM 50 CE1 HIS A 83 43.100 -18.582 -45.676 1.00 25.00 C ATOM 51 NE2 HIS A 83 42.152 -18.785 -44.786 1.00 25.00 N ATOM 0 H HIS A 83 47.268 -19.632 -41.490 1.00 25.00 H new ATOM 0 HA HIS A 83 46.568 -17.754 -43.532 1.00 25.00 H new ATOM 0 HB2 HIS A 83 45.899 -20.222 -43.335 1.00 25.00 H new ATOM 0 HB3 HIS A 83 44.891 -19.794 -41.966 1.00 25.00 H new ATOM 0 HD2 HIS A 83 42.340 -19.335 -42.678 1.00 25.00 H new ATOM 0 HE1 HIS A 83 42.918 -18.295 -46.701 1.00 25.00 H new ATOM 0 HE2 HIS A 83 41.144 -18.714 -44.926 1.00 25.00 H new ATOM 59 N HIS A 84 45.641 -16.955 -40.593 1.00 25.00 N ATOM 60 CA HIS A 84 44.886 -15.989 -39.797 1.00 25.00 C ATOM 61 C HIS A 84 45.810 -14.944 -39.177 1.00 25.00 C ATOM 62 O HIS A 84 46.904 -15.262 -38.719 1.00 25.00 O ATOM 63 CB HIS A 84 44.109 -16.727 -38.704 1.00 25.00 C ATOM 64 CG HIS A 84 42.842 -16.039 -38.300 1.00 25.00 C ATOM 65 ND1 HIS A 84 42.777 -14.936 -37.487 1.00 25.00 N ATOM 66 CD2 HIS A 84 41.548 -16.313 -38.624 1.00 25.00 C ATOM 67 CE1 HIS A 84 41.501 -14.592 -37.351 1.00 25.00 C ATOM 68 NE2 HIS A 84 40.706 -15.398 -38.022 1.00 25.00 N ATOM 0 H HIS A 84 46.352 -17.468 -40.072 1.00 25.00 H new ATOM 0 HA HIS A 84 44.188 -15.468 -40.452 1.00 25.00 H new ATOM 0 HB2 HIS A 84 43.871 -17.731 -39.054 1.00 25.00 H new ATOM 0 HB3 HIS A 84 44.748 -16.838 -37.828 1.00 25.00 H new ATOM 0 HD1 HIS A 84 43.572 -14.461 -37.060 1.00 25.00 H new ATOM 0 HD2 HIS A 84 41.227 -17.126 -39.258 1.00 25.00 H new ATOM 0 HE1 HIS A 84 41.158 -13.754 -36.762 1.00 25.00 H new ATOM 76 N HIS A 85 45.357 -13.700 -39.150 1.00 25.00 N ATOM 77 CA HIS A 85 46.120 -12.608 -38.546 1.00 25.00 C ATOM 78 C HIS A 85 45.716 -12.476 -37.078 1.00 25.00 C ATOM 79 O HIS A 85 44.668 -12.979 -36.677 1.00 25.00 O ATOM 80 CB HIS A 85 45.833 -11.302 -39.291 1.00 25.00 C ATOM 81 CG HIS A 85 46.129 -11.372 -40.758 1.00 25.00 C ATOM 82 ND1 HIS A 85 45.475 -10.637 -41.715 1.00 25.00 N ATOM 83 CD2 HIS A 85 47.036 -12.122 -41.447 1.00 25.00 C ATOM 84 CE1 HIS A 85 45.983 -10.956 -42.903 1.00 25.00 C ATOM 85 NE2 HIS A 85 46.940 -11.854 -42.798 1.00 25.00 N ATOM 0 H HIS A 85 44.459 -13.416 -39.541 1.00 25.00 H new ATOM 0 HA HIS A 85 47.187 -12.820 -38.613 1.00 25.00 H new ATOM 0 HB2 HIS A 85 44.785 -11.037 -39.152 1.00 25.00 H new ATOM 0 HB3 HIS A 85 46.425 -10.502 -38.847 1.00 25.00 H new ATOM 0 HD2 HIS A 85 47.727 -12.822 -41.002 1.00 25.00 H new ATOM 0 HE1 HIS A 85 45.651 -10.530 -43.838 1.00 25.00 H new ATOM 0 HE2 HIS A 85 47.492 -12.263 -43.552 1.00 25.00 H new ATOM 93 N HIS A 86 46.523 -11.792 -36.279 1.00 25.00 N ATOM 94 CA HIS A 86 46.222 -11.616 -34.859 1.00 25.00 C ATOM 95 C HIS A 86 46.764 -10.293 -34.335 1.00 25.00 C ATOM 96 O HIS A 86 47.863 -9.882 -34.689 1.00 25.00 O ATOM 97 CB HIS A 86 46.847 -12.758 -34.047 1.00 25.00 C ATOM 98 CG HIS A 86 46.630 -12.627 -32.570 1.00 25.00 C ATOM 99 ND1 HIS A 86 45.479 -12.999 -31.919 1.00 25.00 N ATOM 100 CD2 HIS A 86 47.443 -12.133 -31.595 1.00 25.00 C ATOM 101 CE1 HIS A 86 45.625 -12.718 -30.626 1.00 25.00 C ATOM 102 NE2 HIS A 86 46.804 -12.189 -30.373 1.00 25.00 N ATOM 0 H HIS A 86 47.390 -11.350 -36.586 1.00 25.00 H new ATOM 0 HA HIS A 86 45.138 -11.621 -34.750 1.00 25.00 H new ATOM 0 HB2 HIS A 86 46.428 -13.706 -34.385 1.00 25.00 H new ATOM 0 HB3 HIS A 86 47.918 -12.793 -34.248 1.00 25.00 H new ATOM 0 HD1 HIS A 86 44.655 -13.418 -32.351 1.00 25.00 H new ATOM 0 HD2 HIS A 86 48.441 -11.753 -31.755 1.00 25.00 H new ATOM 0 HE1 HIS A 86 44.869 -12.901 -29.877 1.00 25.00 H new ATOM 110 N HIS A 87 46.005 -9.675 -33.443 1.00 25.00 N ATOM 111 CA HIS A 87 46.440 -8.496 -32.708 1.00 25.00 C ATOM 112 C HIS A 87 45.720 -8.604 -31.370 1.00 25.00 C ATOM 113 O HIS A 87 44.566 -9.027 -31.330 1.00 25.00 O ATOM 114 CB HIS A 87 46.046 -7.209 -33.439 1.00 25.00 C ATOM 115 CG HIS A 87 46.741 -5.988 -32.920 1.00 25.00 C ATOM 116 ND1 HIS A 87 46.443 -5.364 -31.732 1.00 25.00 N ATOM 117 CD2 HIS A 87 47.765 -5.263 -33.449 1.00 25.00 C ATOM 118 CE1 HIS A 87 47.263 -4.328 -31.588 1.00 25.00 C ATOM 119 NE2 HIS A 87 48.091 -4.218 -32.607 1.00 25.00 N ATOM 0 H HIS A 87 45.061 -9.980 -33.206 1.00 25.00 H new ATOM 0 HA HIS A 87 47.524 -8.453 -32.599 1.00 25.00 H new ATOM 0 HB2 HIS A 87 46.269 -7.321 -34.500 1.00 25.00 H new ATOM 0 HB3 HIS A 87 44.969 -7.068 -33.353 1.00 25.00 H new ATOM 0 HD2 HIS A 87 48.251 -5.474 -34.390 1.00 25.00 H new ATOM 0 HE1 HIS A 87 47.252 -3.659 -30.740 1.00 25.00 H new ATOM 0 HE2 HIS A 87 48.816 -3.514 -32.744 1.00 25.00 H new ATOM 127 N HIS A 88 46.394 -8.258 -30.285 1.00 25.00 N ATOM 128 CA HIS A 88 45.821 -8.374 -28.945 1.00 25.00 C ATOM 129 C HIS A 88 45.562 -6.996 -28.344 1.00 25.00 C ATOM 130 O HIS A 88 46.193 -6.014 -28.732 1.00 25.00 O ATOM 131 CB HIS A 88 46.784 -9.155 -28.046 1.00 25.00 C ATOM 132 CG HIS A 88 48.223 -8.790 -28.249 1.00 25.00 C ATOM 133 ND1 HIS A 88 48.730 -7.517 -28.138 1.00 25.00 N ATOM 134 CD2 HIS A 88 49.290 -9.565 -28.587 1.00 25.00 C ATOM 135 CE1 HIS A 88 50.033 -7.565 -28.394 1.00 25.00 C ATOM 136 NE2 HIS A 88 50.429 -8.789 -28.675 1.00 25.00 N ATOM 0 H HIS A 88 47.346 -7.891 -30.302 1.00 25.00 H new ATOM 0 HA HIS A 88 44.870 -8.902 -29.017 1.00 25.00 H new ATOM 0 HB2 HIS A 88 46.517 -8.981 -27.004 1.00 25.00 H new ATOM 0 HB3 HIS A 88 46.658 -10.221 -28.233 1.00 25.00 H new ATOM 0 HD1 HIS A 88 48.198 -6.680 -27.900 1.00 25.00 H new ATOM 0 HD2 HIS A 88 49.251 -10.630 -28.761 1.00 25.00 H new ATOM 0 HE1 HIS A 88 50.687 -6.706 -28.374 1.00 25.00 H new ATOM 144 N HIS A 89 44.660 -6.935 -27.377 1.00 25.00 N ATOM 145 CA HIS A 89 44.345 -5.691 -26.677 1.00 25.00 C ATOM 146 C HIS A 89 44.726 -5.876 -25.208 1.00 25.00 C ATOM 147 O HIS A 89 44.006 -6.511 -24.446 1.00 25.00 O ATOM 148 CB HIS A 89 42.853 -5.366 -26.832 1.00 25.00 C ATOM 149 CG HIS A 89 42.475 -3.992 -26.368 1.00 25.00 C ATOM 150 ND1 HIS A 89 41.322 -3.346 -26.741 1.00 25.00 N ATOM 151 CD2 HIS A 89 43.115 -3.117 -25.539 1.00 25.00 C ATOM 152 CE1 HIS A 89 41.306 -2.152 -26.159 1.00 25.00 C ATOM 153 NE2 HIS A 89 42.377 -1.957 -25.418 1.00 25.00 N ATOM 0 H HIS A 89 44.125 -7.741 -27.053 1.00 25.00 H new ATOM 0 HA HIS A 89 44.903 -4.854 -27.096 1.00 25.00 H new ATOM 0 HB2 HIS A 89 42.576 -5.473 -27.881 1.00 25.00 H new ATOM 0 HB3 HIS A 89 42.272 -6.099 -26.273 1.00 25.00 H new ATOM 0 HD2 HIS A 89 44.059 -3.305 -25.050 1.00 25.00 H new ATOM 0 HE1 HIS A 89 40.512 -1.430 -26.279 1.00 25.00 H new ATOM 0 HE2 HIS A 89 42.611 -1.128 -24.872 1.00 25.00 H new ATOM 161 N HIS A 90 45.896 -5.379 -24.837 1.00 25.00 N ATOM 162 CA HIS A 90 46.376 -5.505 -23.463 1.00 25.00 C ATOM 163 C HIS A 90 45.823 -4.334 -22.660 1.00 25.00 C ATOM 164 O HIS A 90 45.538 -3.284 -23.222 1.00 25.00 O ATOM 165 CB HIS A 90 47.907 -5.492 -23.430 1.00 0.00 C ATOM 166 CG HIS A 90 48.489 -6.284 -22.298 1.00 25.00 C ATOM 167 ND1 HIS A 90 48.587 -5.842 -20.999 1.00 25.00 N ATOM 168 CD2 HIS A 90 49.018 -7.538 -22.281 1.00 25.00 C ATOM 169 CE1 HIS A 90 49.141 -6.806 -20.273 1.00 25.00 C ATOM 170 NE2 HIS A 90 49.421 -7.866 -21.004 1.00 25.00 N ATOM 0 H HIS A 90 46.532 -4.885 -25.464 1.00 25.00 H new ATOM 0 HA HIS A 90 46.039 -6.449 -23.034 1.00 25.00 H new ATOM 0 HB2 HIS A 90 48.286 -5.888 -24.372 1.00 0.00 H new ATOM 0 HB3 HIS A 90 48.252 -4.461 -23.356 1.00 0.00 H new ATOM 0 HD1 HIS A 90 48.286 -4.931 -20.653 1.00 25.00 H new ATOM 0 HD2 HIS A 90 49.109 -8.183 -23.143 1.00 25.00 H new ATOM 0 HE1 HIS A 90 49.338 -6.731 -19.214 1.00 25.00 H new ATOM 178 N HIS A 91 45.697 -4.509 -21.354 1.00 25.00 N ATOM 179 CA HIS A 91 45.216 -3.452 -20.469 1.00 25.00 C ATOM 180 C HIS A 91 46.341 -3.085 -19.507 1.00 25.00 C ATOM 181 O HIS A 91 47.277 -3.863 -19.324 1.00 25.00 O ATOM 182 CB HIS A 91 43.989 -3.935 -19.686 1.00 25.00 C ATOM 183 CG HIS A 91 44.285 -5.057 -18.737 1.00 25.00 C ATOM 184 ND1 HIS A 91 44.277 -6.388 -19.077 1.00 25.00 N ATOM 185 CD2 HIS A 91 44.606 -5.033 -17.412 1.00 25.00 C ATOM 186 CE1 HIS A 91 44.595 -7.095 -17.995 1.00 25.00 C ATOM 187 NE2 HIS A 91 44.805 -6.320 -16.950 1.00 25.00 N ATOM 0 H HIS A 91 45.923 -5.382 -20.877 1.00 25.00 H new ATOM 0 HA HIS A 91 44.924 -2.580 -21.054 1.00 25.00 H new ATOM 0 HB2 HIS A 91 43.573 -3.097 -19.126 1.00 25.00 H new ATOM 0 HB3 HIS A 91 43.223 -4.259 -20.391 1.00 25.00 H new ATOM 0 HD2 HIS A 91 44.692 -4.139 -16.812 1.00 25.00 H new ATOM 0 HE1 HIS A 91 44.672 -8.172 -17.976 1.00 25.00 H new ATOM 0 HE2 HIS A 91 45.059 -6.608 -16.005 1.00 25.00 H new ATOM 195 N SER A 92 46.248 -1.917 -18.889 1.00 25.00 N ATOM 196 CA SER A 92 47.224 -1.506 -17.883 1.00 25.00 C ATOM 197 C SER A 92 46.805 -2.087 -16.540 1.00 25.00 C ATOM 198 O SER A 92 45.616 -2.134 -16.235 1.00 25.00 O ATOM 199 CB SER A 92 47.272 0.017 -17.785 1.00 25.00 C ATOM 200 OG SER A 92 47.583 0.582 -19.047 1.00 25.00 O ATOM 0 H SER A 92 45.509 -1.236 -19.064 1.00 25.00 H new ATOM 0 HA SER A 92 48.213 -1.869 -18.163 1.00 25.00 H new ATOM 0 HB2 SER A 92 46.311 0.396 -17.436 1.00 25.00 H new ATOM 0 HB3 SER A 92 48.019 0.317 -17.050 1.00 25.00 H new ATOM 0 HG SER A 92 47.609 1.559 -18.971 1.00 25.00 H new ATOM 206 N SER A 93 47.770 -2.522 -15.743 1.00 25.00 N ATOM 207 CA SER A 93 47.484 -3.123 -14.436 1.00 25.00 C ATOM 208 C SER A 93 48.123 -2.340 -13.288 1.00 25.00 C ATOM 209 O SER A 93 48.081 -2.763 -12.139 1.00 25.00 O ATOM 210 CB SER A 93 47.998 -4.562 -14.415 1.00 25.00 C ATOM 211 OG SER A 93 47.601 -5.252 -15.590 1.00 25.00 O ATOM 0 H SER A 93 48.762 -2.472 -15.974 1.00 25.00 H new ATOM 0 HA SER A 93 46.404 -3.100 -14.292 1.00 25.00 H new ATOM 0 HB2 SER A 93 49.085 -4.564 -14.335 1.00 25.00 H new ATOM 0 HB3 SER A 93 47.613 -5.079 -13.536 1.00 25.00 H new ATOM 0 HG SER A 93 46.628 -5.365 -15.590 1.00 25.00 H new ATOM 217 N GLY A 94 48.741 -1.212 -13.611 1.00 25.00 N ATOM 218 CA GLY A 94 49.426 -0.409 -12.613 1.00 25.00 C ATOM 219 C GLY A 94 49.989 0.831 -13.269 1.00 25.00 C ATOM 220 O GLY A 94 49.784 1.030 -14.469 1.00 25.00 O ATOM 0 H GLY A 94 48.781 -0.834 -14.558 1.00 25.00 H new ATOM 0 HA2 GLY A 94 48.735 -0.131 -11.817 1.00 25.00 H new ATOM 0 HA3 GLY A 94 50.228 -0.987 -12.153 1.00 25.00 H new ATOM 224 N HIS A 95 50.681 1.660 -12.498 1.00 25.00 N ATOM 225 CA HIS A 95 51.295 2.883 -13.018 1.00 25.00 C ATOM 226 C HIS A 95 52.538 2.540 -13.840 1.00 25.00 C ATOM 227 O HIS A 95 53.144 1.485 -13.651 1.00 25.00 O ATOM 228 CB HIS A 95 51.676 3.815 -11.854 1.00 25.00 C ATOM 229 CG HIS A 95 52.756 3.271 -10.967 1.00 25.00 C ATOM 230 ND1 HIS A 95 54.100 3.516 -11.131 1.00 25.00 N ATOM 231 CD2 HIS A 95 52.676 2.486 -9.857 1.00 25.00 C ATOM 232 CE1 HIS A 95 54.756 2.889 -10.162 1.00 25.00 C ATOM 233 NE2 HIS A 95 53.938 2.243 -9.355 1.00 25.00 N ATOM 0 H HIS A 95 50.834 1.509 -11.501 1.00 25.00 H new ATOM 0 HA HIS A 95 50.577 3.392 -13.661 1.00 25.00 H new ATOM 0 HB2 HIS A 95 52.001 4.773 -12.260 1.00 25.00 H new ATOM 0 HB3 HIS A 95 50.788 4.009 -11.252 1.00 25.00 H new ATOM 0 HD1 HIS A 95 54.520 4.081 -11.869 1.00 25.00 H new ATOM 0 HD2 HIS A 95 51.758 2.108 -9.431 1.00 25.00 H new ATOM 0 HE1 HIS A 95 55.830 2.906 -10.049 1.00 25.00 H new ATOM 241 N ILE A 96 52.918 3.442 -14.737 1.00 25.00 N ATOM 242 CA ILE A 96 54.132 3.278 -15.555 1.00 25.00 C ATOM 243 C ILE A 96 55.061 4.466 -15.294 1.00 25.00 C ATOM 244 O ILE A 96 56.150 4.592 -15.865 1.00 25.00 O ATOM 245 CB ILE A 96 53.787 3.166 -17.070 1.00 25.00 C ATOM 246 CG1 ILE A 96 53.075 4.444 -17.565 1.00 25.00 C ATOM 247 CG2 ILE A 96 52.899 1.911 -17.315 1.00 25.00 C ATOM 248 CD1 ILE A 96 52.892 4.517 -19.089 1.00 25.00 C ATOM 0 H ILE A 96 52.404 4.303 -14.923 1.00 25.00 H new ATOM 0 HA ILE A 96 54.631 2.350 -15.274 1.00 25.00 H new ATOM 0 HB ILE A 96 54.713 3.059 -17.635 1.00 25.00 H new ATOM 0 HG12 ILE A 96 52.096 4.507 -17.090 1.00 25.00 H new ATOM 0 HG13 ILE A 96 53.645 5.313 -17.237 1.00 25.00 H new ATOM 0 HG21 ILE A 96 52.660 1.836 -18.376 1.00 25.00 H new ATOM 0 HG22 ILE A 96 53.438 1.017 -17.000 1.00 25.00 H new ATOM 0 HG23 ILE A 96 51.977 2.000 -16.741 1.00 25.00 H new ATOM 0 HD11 ILE A 96 52.384 5.445 -19.350 1.00 25.00 H new ATOM 0 HD12 ILE A 96 53.868 4.488 -19.574 1.00 25.00 H new ATOM 0 HD13 ILE A 96 52.294 3.670 -19.425 1.00 25.00 H new ATOM 260 N GLU A 97 54.595 5.344 -14.424 1.00 25.00 N ATOM 261 CA GLU A 97 55.313 6.545 -14.031 1.00 25.00 C ATOM 262 C GLU A 97 56.425 6.162 -13.054 1.00 25.00 C ATOM 263 O GLU A 97 56.374 5.098 -12.437 1.00 25.00 O ATOM 264 CB GLU A 97 54.328 7.516 -13.364 1.00 25.00 C ATOM 265 CG GLU A 97 53.308 8.153 -14.337 1.00 25.00 C ATOM 266 CD GLU A 97 52.324 7.147 -14.957 1.00 25.00 C ATOM 267 OE1 GLU A 97 51.905 6.182 -14.269 1.00 25.00 O ATOM 268 OE2 GLU A 97 52.028 7.288 -16.157 1.00 25.00 O1- ATOM 0 H GLU A 97 53.691 5.241 -13.962 1.00 25.00 H new ATOM 0 HA GLU A 97 55.756 7.027 -14.902 1.00 25.00 H new ATOM 0 HB2 GLU A 97 53.785 6.985 -12.582 1.00 25.00 H new ATOM 0 HB3 GLU A 97 54.893 8.310 -12.876 1.00 25.00 H new ATOM 0 HG2 GLU A 97 52.743 8.918 -13.805 1.00 25.00 H new ATOM 0 HG3 GLU A 97 53.850 8.656 -15.138 1.00 25.00 H new ATOM 275 N GLY A 98 57.434 7.015 -12.933 1.00 25.00 N ATOM 276 CA GLY A 98 58.583 6.721 -12.093 1.00 25.00 C ATOM 277 C GLY A 98 59.807 7.366 -12.707 1.00 25.00 C ATOM 278 O GLY A 98 59.673 8.401 -13.353 1.00 25.00 O ATOM 0 H GLY A 98 57.478 7.917 -13.408 1.00 25.00 H new ATOM 0 HA2 GLY A 98 58.421 7.101 -11.084 1.00 25.00 H new ATOM 0 HA3 GLY A 98 58.725 5.644 -12.009 1.00 25.00 H new ATOM 282 N ARG A 99 60.967 6.725 -12.550 1.00 25.00 N ATOM 283 CA ARG A 99 62.261 7.174 -13.133 1.00 25.00 C ATOM 284 C ARG A 99 62.727 8.530 -12.599 1.00 25.00 C ATOM 285 O ARG A 99 63.481 9.236 -13.253 1.00 25.00 O ATOM 286 CB ARG A 99 62.194 7.248 -14.669 1.00 25.00 C ATOM 287 CG ARG A 99 61.630 6.001 -15.357 1.00 25.00 C ATOM 288 CD ARG A 99 61.459 6.244 -16.858 1.00 25.00 C ATOM 289 NE ARG A 99 60.562 7.386 -17.120 1.00 25.00 N ATOM 290 CZ ARG A 99 59.233 7.341 -17.135 1.00 25.00 C ATOM 291 NH1 ARG A 99 58.562 6.233 -16.929 1.00 25.00 N1+ ATOM 292 NH2 ARG A 99 58.569 8.440 -17.360 1.00 25.00 N ATOM 0 H ARG A 99 61.049 5.865 -12.008 1.00 25.00 H new ATOM 0 HA ARG A 99 62.986 6.420 -12.826 1.00 25.00 H new ATOM 0 HB2 ARG A 99 61.583 8.106 -14.949 1.00 25.00 H new ATOM 0 HB3 ARG A 99 63.198 7.433 -15.052 1.00 25.00 H new ATOM 0 HG2 ARG A 99 62.298 5.156 -15.194 1.00 25.00 H new ATOM 0 HG3 ARG A 99 60.669 5.738 -14.914 1.00 25.00 H new ATOM 0 HD2 ARG A 99 62.432 6.433 -17.311 1.00 25.00 H new ATOM 0 HD3 ARG A 99 61.056 5.348 -17.330 1.00 25.00 H new ATOM 0 HE ARG A 99 60.999 8.289 -17.306 1.00 25.00 H new ATOM 0 HH11 ARG A 99 59.060 5.361 -16.748 1.00 25.00 H new ATOM 0 HH12 ARG A 99 57.542 6.243 -16.949 1.00 25.00 H new ATOM 0 HH21 ARG A 99 59.069 9.314 -17.521 1.00 25.00 H new ATOM 0 HH22 ARG A 99 57.549 8.426 -17.375 1.00 25.00 H new ATOM 306 N HIS A 100 62.294 8.863 -11.397 1.00 25.00 N ATOM 307 CA HIS A 100 62.691 10.096 -10.743 1.00 25.00 C ATOM 308 C HIS A 100 63.694 9.702 -9.675 1.00 25.00 C ATOM 309 O HIS A 100 63.768 8.534 -9.288 1.00 25.00 O ATOM 310 CB HIS A 100 61.469 10.771 -10.114 1.00 25.00 C ATOM 311 CG HIS A 100 60.564 9.818 -9.394 1.00 25.00 C ATOM 312 ND1 HIS A 100 60.952 9.011 -8.355 1.00 25.00 N ATOM 313 CD2 HIS A 100 59.248 9.534 -9.589 1.00 25.00 C ATOM 314 CE1 HIS A 100 59.904 8.291 -7.972 1.00 25.00 C ATOM 315 NE2 HIS A 100 58.837 8.564 -8.695 1.00 25.00 N ATOM 0 H HIS A 100 61.657 8.286 -10.847 1.00 25.00 H new ATOM 0 HA HIS A 100 63.126 10.805 -11.447 1.00 25.00 H new ATOM 0 HB2 HIS A 100 61.806 11.537 -9.416 1.00 25.00 H new ATOM 0 HB3 HIS A 100 60.902 11.278 -10.895 1.00 25.00 H new ATOM 0 HD2 HIS A 100 58.617 9.998 -10.333 1.00 25.00 H new ATOM 0 HE1 HIS A 100 59.924 7.571 -7.167 1.00 25.00 H new ATOM 0 HE2 HIS A 100 57.909 8.149 -8.613 1.00 25.00 H new ATOM 323 N MET A 101 64.441 10.671 -9.185 1.00 25.00 N ATOM 324 CA MET A 101 65.449 10.441 -8.167 1.00 25.00 C ATOM 325 C MET A 101 65.235 11.449 -7.046 1.00 25.00 C ATOM 326 O MET A 101 64.410 12.352 -7.175 1.00 25.00 O ATOM 327 CB MET A 101 66.843 10.607 -8.779 1.00 25.00 C ATOM 328 CG MET A 101 67.113 12.003 -9.305 1.00 25.00 C ATOM 329 SD MET A 101 68.719 12.108 -10.069 1.00 25.00 S ATOM 330 CE MET A 101 68.783 13.846 -10.406 1.00 25.00 C ATOM 0 H MET A 101 64.366 11.644 -9.482 1.00 25.00 H new ATOM 0 HA MET A 101 65.367 9.429 -7.769 1.00 25.00 H new ATOM 0 HB2 MET A 101 67.592 10.360 -8.027 1.00 25.00 H new ATOM 0 HB3 MET A 101 66.961 9.892 -9.593 1.00 25.00 H new ATOM 0 HG2 MET A 101 66.345 12.276 -10.029 1.00 25.00 H new ATOM 0 HG3 MET A 101 67.049 12.721 -8.487 1.00 25.00 H new ATOM 0 HE1 MET A 101 69.621 14.057 -11.071 1.00 25.00 H new ATOM 0 HE2 MET A 101 67.854 14.159 -10.882 1.00 25.00 H new ATOM 0 HE3 MET A 101 68.914 14.393 -9.472 1.00 25.00 H new ATOM 340 N LEU A 102 65.962 11.290 -5.949 1.00 25.00 N ATOM 341 CA LEU A 102 65.847 12.190 -4.805 1.00 25.00 C ATOM 342 C LEU A 102 67.211 12.808 -4.523 1.00 25.00 C ATOM 343 O LEU A 102 68.209 12.097 -4.480 1.00 25.00 O ATOM 344 CB LEU A 102 65.374 11.402 -3.575 1.00 25.00 C ATOM 345 CG LEU A 102 64.999 12.237 -2.339 1.00 25.00 C ATOM 346 CD1 LEU A 102 63.594 12.825 -2.486 1.00 25.00 C ATOM 347 CD2 LEU A 102 65.061 11.370 -1.085 1.00 25.00 C ATOM 0 H LEU A 102 66.643 10.541 -5.825 1.00 25.00 H new ATOM 0 HA LEU A 102 65.124 12.976 -5.025 1.00 25.00 H new ATOM 0 HB2 LEU A 102 64.508 10.806 -3.862 1.00 25.00 H new ATOM 0 HB3 LEU A 102 66.162 10.704 -3.291 1.00 25.00 H new ATOM 0 HG LEU A 102 65.713 13.056 -2.251 1.00 25.00 H new ATOM 0 HD11 LEU A 102 63.350 13.411 -1.600 1.00 25.00 H new ATOM 0 HD12 LEU A 102 63.558 13.466 -3.367 1.00 25.00 H new ATOM 0 HD13 LEU A 102 62.871 12.017 -2.596 1.00 25.00 H new ATOM 0 HD21 LEU A 102 64.794 11.969 -0.215 1.00 25.00 H new ATOM 0 HD22 LEU A 102 64.362 10.539 -1.182 1.00 25.00 H new ATOM 0 HD23 LEU A 102 66.072 10.981 -0.961 1.00 25.00 H new ATOM 359 N LEU A 103 67.246 14.114 -4.308 1.00 25.00 N ATOM 360 CA LEU A 103 68.480 14.818 -3.950 1.00 25.00 C ATOM 361 C LEU A 103 68.246 15.517 -2.631 1.00 25.00 C ATOM 362 O LEU A 103 67.121 15.905 -2.332 1.00 25.00 O ATOM 363 CB LEU A 103 68.845 15.870 -5.005 1.00 25.00 C ATOM 364 CG LEU A 103 69.248 15.360 -6.395 1.00 25.00 C ATOM 365 CD1 LEU A 103 69.507 16.554 -7.306 1.00 25.00 C ATOM 366 CD2 LEU A 103 70.495 14.500 -6.323 1.00 25.00 C ATOM 0 H LEU A 103 66.427 14.718 -4.375 1.00 25.00 H new ATOM 0 HA LEU A 103 69.297 14.099 -3.886 1.00 25.00 H new ATOM 0 HB2 LEU A 103 67.992 16.538 -5.125 1.00 25.00 H new ATOM 0 HB3 LEU A 103 69.667 16.469 -4.614 1.00 25.00 H new ATOM 0 HG LEU A 103 68.436 14.750 -6.791 1.00 25.00 H new ATOM 0 HD11 LEU A 103 69.794 16.201 -8.296 1.00 25.00 H new ATOM 0 HD12 LEU A 103 68.601 17.155 -7.384 1.00 25.00 H new ATOM 0 HD13 LEU A 103 70.311 17.161 -6.890 1.00 25.00 H new ATOM 0 HD21 LEU A 103 70.756 14.153 -7.323 1.00 25.00 H new ATOM 0 HD22 LEU A 103 71.319 15.087 -5.916 1.00 25.00 H new ATOM 0 HD23 LEU A 103 70.308 13.641 -5.678 1.00 25.00 H new ATOM 378 N THR A 104 69.301 15.716 -1.863 1.00 25.00 N ATOM 379 CA THR A 104 69.202 16.447 -0.602 1.00 25.00 C ATOM 380 C THR A 104 69.766 17.836 -0.839 1.00 25.00 C ATOM 381 O THR A 104 70.797 17.980 -1.482 1.00 25.00 O ATOM 382 CB THR A 104 69.996 15.739 0.510 1.00 25.00 C ATOM 383 OG1 THR A 104 69.589 14.371 0.578 1.00 25.00 O ATOM 384 CG2 THR A 104 69.740 16.374 1.873 1.00 25.00 C ATOM 0 H THR A 104 70.239 15.384 -2.086 1.00 25.00 H new ATOM 0 HA THR A 104 68.162 16.496 -0.279 1.00 25.00 H new ATOM 0 HB THR A 104 71.056 15.828 0.271 1.00 25.00 H new ATOM 0 HG1 THR A 104 70.093 13.914 1.284 1.00 25.00 H new ATOM 0 HG21 THR A 104 70.317 15.848 2.634 1.00 25.00 H new ATOM 0 HG22 THR A 104 70.041 17.421 1.849 1.00 25.00 H new ATOM 0 HG23 THR A 104 68.679 16.307 2.112 1.00 25.00 H new ATOM 392 N VAL A 105 69.092 18.859 -0.345 1.00 25.00 N ATOM 393 CA VAL A 105 69.539 20.234 -0.516 1.00 25.00 C ATOM 394 C VAL A 105 69.686 20.860 0.863 1.00 25.00 C ATOM 395 O VAL A 105 68.748 20.884 1.660 1.00 25.00 O ATOM 396 CB VAL A 105 68.543 21.047 -1.371 1.00 25.00 C ATOM 397 CG1 VAL A 105 69.048 22.491 -1.579 1.00 25.00 C ATOM 398 CG2 VAL A 105 68.325 20.368 -2.734 1.00 25.00 C ATOM 0 H VAL A 105 68.225 18.764 0.183 1.00 25.00 H new ATOM 0 HA VAL A 105 70.494 20.241 -1.041 1.00 25.00 H new ATOM 0 HB VAL A 105 67.593 21.084 -0.837 1.00 25.00 H new ATOM 0 HG11 VAL A 105 68.330 23.044 -2.184 1.00 25.00 H new ATOM 0 HG12 VAL A 105 69.160 22.980 -0.611 1.00 25.00 H new ATOM 0 HG13 VAL A 105 70.011 22.470 -2.089 1.00 25.00 H new ATOM 0 HG21 VAL A 105 67.620 20.954 -3.324 1.00 25.00 H new ATOM 0 HG22 VAL A 105 69.275 20.302 -3.264 1.00 25.00 H new ATOM 0 HG23 VAL A 105 67.925 19.366 -2.581 1.00 25.00 H new ATOM 408 N TYR A 106 70.883 21.339 1.145 1.00 25.00 N ATOM 409 CA TYR A 106 71.202 21.952 2.422 1.00 25.00 C ATOM 410 C TYR A 106 71.350 23.453 2.230 1.00 25.00 C ATOM 411 O TYR A 106 72.266 23.908 1.554 1.00 25.00 O ATOM 412 CB TYR A 106 72.504 21.352 2.957 1.00 25.00 C ATOM 413 CG TYR A 106 72.951 21.917 4.290 1.00 25.00 C ATOM 414 CD1 TYR A 106 72.012 22.291 5.277 1.00 25.00 C ATOM 415 CD2 TYR A 106 74.322 22.070 4.579 1.00 25.00 C ATOM 416 CE1 TYR A 106 72.432 22.793 6.524 1.00 25.00 C ATOM 417 CE2 TYR A 106 74.747 22.576 5.837 1.00 25.00 C ATOM 418 CZ TYR A 106 73.791 22.936 6.792 1.00 25.00 C ATOM 419 OH TYR A 106 74.171 23.435 8.003 1.00 25.00 O ATOM 0 H TYR A 106 71.666 21.314 0.492 1.00 25.00 H new ATOM 0 HA TYR A 106 70.404 21.763 3.140 1.00 25.00 H new ATOM 0 HB2 TYR A 106 72.379 20.274 3.056 1.00 25.00 H new ATOM 0 HB3 TYR A 106 73.294 21.515 2.224 1.00 25.00 H new ATOM 0 HD1 TYR A 106 70.956 22.190 5.072 1.00 25.00 H new ATOM 0 HD2 TYR A 106 75.058 21.800 3.836 1.00 25.00 H new ATOM 0 HE1 TYR A 106 71.702 23.067 7.271 1.00 25.00 H new ATOM 0 HE2 TYR A 106 75.800 22.682 6.054 1.00 25.00 H new ATOM 0 HH TYR A 106 75.149 23.477 8.047 1.00 25.00 H new ATOM 429 N CYS A 107 70.439 24.219 2.807 1.00 25.00 N ATOM 430 CA CYS A 107 70.462 25.667 2.683 1.00 25.00 C ATOM 431 C CYS A 107 71.124 26.273 3.910 1.00 25.00 C ATOM 432 O CYS A 107 70.725 26.003 5.036 1.00 25.00 O ATOM 433 CB CYS A 107 69.042 26.213 2.552 1.00 25.00 C ATOM 434 SG CYS A 107 69.002 28.011 2.357 1.00 25.00 S ATOM 0 H CYS A 107 69.669 23.859 3.370 1.00 25.00 H new ATOM 0 HA CYS A 107 71.027 25.933 1.790 1.00 25.00 H new ATOM 0 HB2 CYS A 107 68.556 25.748 1.695 1.00 25.00 H new ATOM 0 HB3 CYS A 107 68.467 25.934 3.435 1.00 25.00 H new ATOM 0 HG CYS A 107 68.014 28.500 3.046 1.00 25.00 H new ATOM 440 N VAL A 108 72.144 27.083 3.681 1.00 25.00 N ATOM 441 CA VAL A 108 72.924 27.686 4.755 1.00 25.00 C ATOM 442 C VAL A 108 72.797 29.201 4.731 1.00 25.00 C ATOM 443 O VAL A 108 73.059 29.853 3.707 1.00 25.00 O ATOM 444 CB VAL A 108 74.429 27.307 4.616 1.00 25.00 C ATOM 445 CG1 VAL A 108 75.240 27.816 5.826 1.00 25.00 C ATOM 446 CG2 VAL A 108 74.587 25.791 4.492 1.00 25.00 C ATOM 0 H VAL A 108 72.457 27.343 2.746 1.00 25.00 H new ATOM 0 HA VAL A 108 72.534 27.305 5.699 1.00 25.00 H new ATOM 0 HB VAL A 108 74.813 27.783 3.714 1.00 25.00 H new ATOM 0 HG11 VAL A 108 76.287 27.539 5.705 1.00 25.00 H new ATOM 0 HG12 VAL A 108 75.157 28.901 5.889 1.00 25.00 H new ATOM 0 HG13 VAL A 108 74.850 27.368 6.740 1.00 25.00 H new ATOM 0 HG21 VAL A 108 75.644 25.542 4.396 1.00 25.00 H new ATOM 0 HG22 VAL A 108 74.180 25.309 5.381 1.00 25.00 H new ATOM 0 HG23 VAL A 108 74.050 25.440 3.611 1.00 25.00 H new ATOM 456 N ARG A 109 72.457 29.774 5.875 1.00 25.00 N ATOM 457 CA ARG A 109 72.458 31.219 6.049 1.00 25.00 C ATOM 458 C ARG A 109 73.530 31.505 7.069 1.00 25.00 C ATOM 459 O ARG A 109 73.767 30.692 7.951 1.00 25.00 O ATOM 460 CB ARG A 109 71.108 31.722 6.541 1.00 25.00 C ATOM 461 CG ARG A 109 69.982 31.517 5.515 1.00 25.00 C ATOM 462 CD ARG A 109 69.055 32.737 5.378 1.00 25.00 C ATOM 463 NE ARG A 109 68.080 32.870 6.479 1.00 25.00 N ATOM 464 CZ ARG A 109 68.152 33.743 7.480 1.00 25.00 C ATOM 465 NH1 ARG A 109 69.149 34.579 7.619 1.00 25.00 N1+ ATOM 466 NH2 ARG A 109 67.192 33.773 8.361 1.00 25.00 N ATOM 0 H ARG A 109 72.174 29.254 6.706 1.00 25.00 H new ATOM 0 HA ARG A 109 72.647 31.727 5.103 1.00 25.00 H new ATOM 0 HB2 ARG A 109 70.849 31.206 7.465 1.00 25.00 H new ATOM 0 HB3 ARG A 109 71.186 32.783 6.780 1.00 25.00 H new ATOM 0 HG2 ARG A 109 70.422 31.292 4.543 1.00 25.00 H new ATOM 0 HG3 ARG A 109 69.389 30.649 5.805 1.00 25.00 H new ATOM 0 HD2 ARG A 109 69.663 33.641 5.332 1.00 25.00 H new ATOM 0 HD3 ARG A 109 68.515 32.668 4.433 1.00 25.00 H new ATOM 0 HE ARG A 109 67.281 32.236 6.471 1.00 25.00 H new ATOM 0 HH11 ARG A 109 69.913 34.578 6.943 1.00 25.00 H new ATOM 0 HH12 ARG A 109 69.162 35.231 8.403 1.00 25.00 H new ATOM 0 HH21 ARG A 109 66.402 33.133 8.276 1.00 25.00 H new ATOM 0 HH22 ARG A 109 67.231 34.436 9.135 1.00 25.00 H new ATOM 480 N ARG A 110 74.193 32.644 6.942 1.00 25.00 N ATOM 481 CA ARG A 110 75.319 32.975 7.815 1.00 25.00 C ATOM 482 C ARG A 110 74.942 33.011 9.289 1.00 25.00 C ATOM 483 O ARG A 110 75.759 32.747 10.156 1.00 25.00 O ATOM 484 CB ARG A 110 75.890 34.331 7.401 1.00 25.00 C ATOM 485 CG ARG A 110 77.247 34.643 8.020 1.00 25.00 C ATOM 486 CD ARG A 110 77.755 35.980 7.538 1.00 25.00 C ATOM 487 NE ARG A 110 76.942 37.087 8.068 1.00 25.00 N ATOM 488 CZ ARG A 110 77.159 38.376 7.838 1.00 25.00 C ATOM 489 NH1 ARG A 110 78.158 38.800 7.099 1.00 25.00 N1+ ATOM 490 NH2 ARG A 110 76.352 39.254 8.362 1.00 25.00 N ATOM 0 H ARG A 110 73.975 33.357 6.245 1.00 25.00 H new ATOM 0 HA ARG A 110 76.062 32.186 7.699 1.00 25.00 H new ATOM 0 HB2 ARG A 110 75.981 34.360 6.315 1.00 25.00 H new ATOM 0 HB3 ARG A 110 75.185 35.113 7.682 1.00 25.00 H new ATOM 0 HG2 ARG A 110 77.164 34.649 9.107 1.00 25.00 H new ATOM 0 HG3 ARG A 110 77.960 33.861 7.759 1.00 25.00 H new ATOM 0 HD2 ARG A 110 78.793 36.109 7.846 1.00 25.00 H new ATOM 0 HD3 ARG A 110 77.740 36.005 6.448 1.00 25.00 H new ATOM 0 HE ARG A 110 76.148 36.844 8.660 1.00 25.00 H new ATOM 0 HH11 ARG A 110 78.801 38.130 6.678 1.00 25.00 H new ATOM 0 HH12 ARG A 110 78.291 39.800 6.946 1.00 25.00 H new ATOM 0 HH21 ARG A 110 75.569 38.947 8.938 1.00 25.00 H new ATOM 0 HH22 ARG A 110 76.503 40.249 8.196 1.00 25.00 H new ATOM 504 N ASP A 111 73.694 33.343 9.551 1.00 25.00 N ATOM 505 CA ASP A 111 73.184 33.502 10.908 1.00 25.00 C ATOM 506 C ASP A 111 72.709 32.177 11.522 1.00 25.00 C ATOM 507 O ASP A 111 71.885 32.168 12.430 1.00 25.00 O ATOM 508 CB ASP A 111 72.043 34.513 10.855 1.00 25.00 C ATOM 509 CG ASP A 111 72.306 35.614 9.836 1.00 25.00 C ATOM 510 OD1 ASP A 111 73.116 36.530 10.108 1.00 25.00 O ATOM 511 OD2 ASP A 111 71.797 35.479 8.695 1.00 25.00 O1- ATOM 0 H ASP A 111 72.996 33.512 8.827 1.00 25.00 H new ATOM 0 HA ASP A 111 73.990 33.854 11.552 1.00 25.00 H new ATOM 0 HB2 ASP A 111 71.115 34.000 10.603 1.00 25.00 H new ATOM 0 HB3 ASP A 111 71.905 34.957 11.841 1.00 25.00 H new ATOM 516 N LEU A 112 73.225 31.072 10.983 1.00 25.00 N ATOM 517 CA LEU A 112 72.912 29.697 11.431 1.00 25.00 C ATOM 518 C LEU A 112 71.412 29.414 11.412 1.00 25.00 C ATOM 519 O LEU A 112 70.880 28.651 12.204 1.00 25.00 O ATOM 520 CB LEU A 112 73.515 29.412 12.815 1.00 25.00 C ATOM 521 CG LEU A 112 75.040 29.592 12.926 1.00 25.00 C ATOM 522 CD1 LEU A 112 75.476 29.328 14.367 1.00 25.00 C ATOM 523 CD2 LEU A 112 75.805 28.653 11.980 1.00 25.00 C ATOM 0 H LEU A 112 73.886 31.098 10.207 1.00 25.00 H new ATOM 0 HA LEU A 112 73.374 29.016 10.716 1.00 25.00 H new ATOM 0 HB2 LEU A 112 73.036 30.068 13.542 1.00 25.00 H new ATOM 0 HB3 LEU A 112 73.267 28.389 13.096 1.00 25.00 H new ATOM 0 HG LEU A 112 75.276 30.616 12.636 1.00 25.00 H new ATOM 0 HD11 LEU A 112 76.555 29.455 14.449 1.00 25.00 H new ATOM 0 HD12 LEU A 112 74.976 30.031 15.033 1.00 25.00 H new ATOM 0 HD13 LEU A 112 75.208 28.309 14.648 1.00 25.00 H new ATOM 0 HD21 LEU A 112 76.877 28.816 12.094 1.00 25.00 H new ATOM 0 HD22 LEU A 112 75.568 27.618 12.225 1.00 25.00 H new ATOM 0 HD23 LEU A 112 75.514 28.858 10.950 1.00 25.00 H new ATOM 535 N SER A 113 70.755 30.019 10.438 1.00 25.00 N ATOM 536 CA SER A 113 69.325 29.840 10.185 1.00 25.00 C ATOM 537 C SER A 113 69.140 28.723 9.163 1.00 25.00 C ATOM 538 O SER A 113 68.255 28.776 8.313 1.00 25.00 O ATOM 539 CB SER A 113 68.723 31.130 9.668 1.00 25.00 C ATOM 540 OG SER A 113 69.167 32.230 10.447 1.00 25.00 O ATOM 0 H SER A 113 71.204 30.662 9.785 1.00 25.00 H new ATOM 0 HA SER A 113 68.818 29.573 11.112 1.00 25.00 H new ATOM 0 HB2 SER A 113 69.004 31.278 8.625 1.00 25.00 H new ATOM 0 HB3 SER A 113 67.635 31.069 9.699 1.00 25.00 H new ATOM 0 HG SER A 113 69.049 33.060 9.939 1.00 25.00 H new ATOM 546 N GLU A 114 70.119 27.838 9.138 1.00 25.00 N ATOM 547 CA GLU A 114 70.259 26.810 8.120 1.00 25.00 C ATOM 548 C GLU A 114 69.222 25.688 8.260 1.00 25.00 C ATOM 549 O GLU A 114 68.702 25.426 9.345 1.00 25.00 O ATOM 550 CB GLU A 114 71.685 26.243 8.224 1.00 25.00 C ATOM 551 CG GLU A 114 72.038 25.636 9.610 1.00 25.00 C ATOM 552 CD GLU A 114 73.539 25.673 9.917 1.00 25.00 C ATOM 553 OE1 GLU A 114 74.230 26.605 9.437 1.00 25.00 O1- ATOM 554 OE2 GLU A 114 74.016 24.810 10.687 1.00 25.00 O1- ATOM 0 H GLU A 114 70.857 27.812 9.841 1.00 25.00 H new ATOM 0 HA GLU A 114 70.083 27.257 7.142 1.00 25.00 H new ATOM 0 HB2 GLU A 114 71.813 25.475 7.462 1.00 25.00 H new ATOM 0 HB3 GLU A 114 72.396 27.038 7.998 1.00 25.00 H new ATOM 0 HG2 GLU A 114 71.501 26.181 10.386 1.00 25.00 H new ATOM 0 HG3 GLU A 114 71.691 24.603 9.647 1.00 25.00 H new ATOM 561 N VAL A 115 68.893 25.066 7.135 1.00 25.00 N ATOM 562 CA VAL A 115 67.862 24.029 7.070 1.00 25.00 C ATOM 563 C VAL A 115 68.247 23.062 5.955 1.00 25.00 C ATOM 564 O VAL A 115 68.893 23.456 4.990 1.00 25.00 O ATOM 565 CB VAL A 115 66.439 24.667 6.798 1.00 25.00 C ATOM 566 CG1 VAL A 115 66.375 25.356 5.419 1.00 25.00 C ATOM 567 CG2 VAL A 115 65.317 23.623 6.925 1.00 25.00 C ATOM 0 H VAL A 115 69.333 25.265 6.237 1.00 25.00 H new ATOM 0 HA VAL A 115 67.798 23.500 8.021 1.00 25.00 H new ATOM 0 HB VAL A 115 66.286 25.428 7.564 1.00 25.00 H new ATOM 0 HG11 VAL A 115 65.382 25.781 5.270 1.00 25.00 H new ATOM 0 HG12 VAL A 115 67.120 26.150 5.374 1.00 25.00 H new ATOM 0 HG13 VAL A 115 66.577 24.624 4.637 1.00 25.00 H new ATOM 0 HG21 VAL A 115 64.355 24.097 6.732 1.00 25.00 H new ATOM 0 HG22 VAL A 115 65.480 22.824 6.201 1.00 25.00 H new ATOM 0 HG23 VAL A 115 65.320 23.206 7.932 1.00 25.00 H new ATOM 577 N THR A 116 67.864 21.803 6.076 1.00 25.00 N ATOM 578 CA THR A 116 68.128 20.815 5.035 1.00 25.00 C ATOM 579 C THR A 116 66.807 20.135 4.720 1.00 25.00 C ATOM 580 O THR A 116 65.957 19.976 5.601 1.00 25.00 O ATOM 581 CB THR A 116 69.221 19.791 5.467 1.00 25.00 C ATOM 582 OG1 THR A 116 69.317 18.746 4.498 1.00 25.00 O ATOM 583 CG2 THR A 116 68.926 19.175 6.829 1.00 25.00 C ATOM 0 H THR A 116 67.367 21.436 6.887 1.00 25.00 H new ATOM 0 HA THR A 116 68.526 21.301 4.144 1.00 25.00 H new ATOM 0 HB THR A 116 70.162 20.336 5.537 1.00 25.00 H new ATOM 0 HG1 THR A 116 70.006 18.106 4.774 1.00 25.00 H new ATOM 0 HG21 THR A 116 69.715 18.468 7.087 1.00 25.00 H new ATOM 0 HG22 THR A 116 68.883 19.962 7.582 1.00 25.00 H new ATOM 0 HG23 THR A 116 67.969 18.654 6.793 1.00 25.00 H new ATOM 591 N PHE A 117 66.612 19.804 3.455 1.00 25.00 N ATOM 592 CA PHE A 117 65.373 19.205 2.972 1.00 25.00 C ATOM 593 C PHE A 117 65.745 18.385 1.745 1.00 25.00 C ATOM 594 O PHE A 117 66.893 18.419 1.316 1.00 25.00 O ATOM 595 CB PHE A 117 64.339 20.294 2.637 1.00 25.00 C ATOM 596 CG PHE A 117 64.842 21.350 1.686 1.00 25.00 C ATOM 597 CD1 PHE A 117 65.462 22.519 2.177 1.00 25.00 C ATOM 598 CD2 PHE A 117 64.675 21.197 0.296 1.00 25.00 C ATOM 599 CE1 PHE A 117 65.914 23.529 1.287 1.00 25.00 C ATOM 600 CE2 PHE A 117 65.121 22.200 -0.603 1.00 25.00 C ATOM 601 CZ PHE A 117 65.741 23.368 -0.105 1.00 25.00 C ATOM 0 H PHE A 117 67.312 19.943 2.726 1.00 25.00 H new ATOM 0 HA PHE A 117 64.912 18.571 3.729 1.00 25.00 H new ATOM 0 HB2 PHE A 117 63.457 19.822 2.205 1.00 25.00 H new ATOM 0 HB3 PHE A 117 64.022 20.775 3.562 1.00 25.00 H new ATOM 0 HD1 PHE A 117 65.594 22.647 3.241 1.00 25.00 H new ATOM 0 HD2 PHE A 117 64.202 20.306 -0.090 1.00 25.00 H new ATOM 0 HE1 PHE A 117 66.389 24.418 1.674 1.00 25.00 H new ATOM 0 HE2 PHE A 117 64.987 22.071 -1.667 1.00 25.00 H new ATOM 0 HZ PHE A 117 66.081 24.134 -0.786 1.00 25.00 H new ATOM 611 N SER A 118 64.803 17.644 1.187 1.00 25.00 N ATOM 612 CA SER A 118 65.081 16.818 0.015 1.00 25.00 C ATOM 613 C SER A 118 64.055 17.097 -1.066 1.00 25.00 C ATOM 614 O SER A 118 62.924 17.465 -0.768 1.00 25.00 O ATOM 615 CB SER A 118 65.059 15.336 0.389 1.00 25.00 C ATOM 616 OG SER A 118 66.020 15.053 1.393 1.00 25.00 O ATOM 0 H SER A 118 63.841 17.594 1.522 1.00 25.00 H new ATOM 0 HA SER A 118 66.074 17.066 -0.361 1.00 25.00 H new ATOM 0 HB2 SER A 118 64.065 15.061 0.743 1.00 25.00 H new ATOM 0 HB3 SER A 118 65.261 14.731 -0.495 1.00 25.00 H new ATOM 0 HG SER A 118 65.987 14.100 1.618 1.00 25.00 H new ATOM 622 N LEU A 119 64.463 16.930 -2.314 1.00 25.00 N ATOM 623 CA LEU A 119 63.605 17.196 -3.463 1.00 25.00 C ATOM 624 C LEU A 119 63.609 16.017 -4.408 1.00 25.00 C ATOM 625 O LEU A 119 64.637 15.370 -4.603 1.00 25.00 O ATOM 626 CB LEU A 119 64.110 18.428 -4.216 1.00 25.00 C ATOM 627 CG LEU A 119 63.593 19.777 -3.702 1.00 25.00 C ATOM 628 CD1 LEU A 119 64.323 20.889 -4.432 1.00 25.00 C ATOM 629 CD2 LEU A 119 62.081 19.893 -3.933 1.00 25.00 C ATOM 0 H LEU A 119 65.398 16.606 -2.561 1.00 25.00 H new ATOM 0 HA LEU A 119 62.592 17.369 -3.100 1.00 25.00 H new ATOM 0 HB2 LEU A 119 65.199 18.437 -4.173 1.00 25.00 H new ATOM 0 HB3 LEU A 119 63.833 18.329 -5.266 1.00 25.00 H new ATOM 0 HG LEU A 119 63.778 19.856 -2.631 1.00 25.00 H new ATOM 0 HD11 LEU A 119 63.965 21.855 -4.076 1.00 25.00 H new ATOM 0 HD12 LEU A 119 65.393 20.807 -4.243 1.00 25.00 H new ATOM 0 HD13 LEU A 119 64.136 20.805 -5.503 1.00 25.00 H new ATOM 0 HD21 LEU A 119 61.729 20.856 -3.563 1.00 25.00 H new ATOM 0 HD22 LEU A 119 61.869 19.815 -4.999 1.00 25.00 H new ATOM 0 HD23 LEU A 119 61.569 19.091 -3.401 1.00 25.00 H new ATOM 641 N GLN A 120 62.456 15.756 -5.006 1.00 25.00 N ATOM 642 CA GLN A 120 62.312 14.671 -5.971 1.00 25.00 C ATOM 643 C GLN A 120 62.271 15.299 -7.355 1.00 25.00 C ATOM 644 O GLN A 120 61.502 16.225 -7.599 1.00 25.00 O ATOM 645 CB GLN A 120 61.040 13.865 -5.695 1.00 25.00 C ATOM 646 CG GLN A 120 60.949 12.580 -6.507 1.00 25.00 C ATOM 647 CD GLN A 120 59.714 11.777 -6.171 1.00 25.00 C ATOM 648 OE1 GLN A 120 58.622 12.092 -6.600 1.00 25.00 O ATOM 649 NE2 GLN A 120 59.883 10.742 -5.388 1.00 25.00 N ATOM 0 H GLN A 120 61.599 16.284 -4.840 1.00 25.00 H new ATOM 0 HA GLN A 120 63.149 13.976 -5.895 1.00 25.00 H new ATOM 0 HB2 GLN A 120 60.998 13.619 -4.634 1.00 25.00 H new ATOM 0 HB3 GLN A 120 60.171 14.486 -5.913 1.00 25.00 H new ATOM 0 HG2 GLN A 120 60.944 12.824 -7.569 1.00 25.00 H new ATOM 0 HG3 GLN A 120 61.836 11.973 -6.324 1.00 25.00 H new ATOM 0 HE21 GLN A 120 60.815 10.507 -5.047 1.00 25.00 H new ATOM 0 HE22 GLN A 120 59.083 10.170 -5.119 1.00 25.00 H new ATOM 658 N VAL A 121 63.159 14.846 -8.225 1.00 25.00 N ATOM 659 CA VAL A 121 63.359 15.451 -9.541 1.00 25.00 C ATOM 660 C VAL A 121 63.667 14.362 -10.558 1.00 25.00 C ATOM 661 O VAL A 121 64.002 13.243 -10.189 1.00 25.00 O ATOM 662 CB VAL A 121 64.563 16.447 -9.504 1.00 25.00 C ATOM 663 CG1 VAL A 121 64.214 17.681 -8.685 1.00 25.00 C ATOM 664 CG2 VAL A 121 65.815 15.770 -8.900 1.00 25.00 C ATOM 0 H VAL A 121 63.765 14.046 -8.042 1.00 25.00 H new ATOM 0 HA VAL A 121 62.451 15.986 -9.818 1.00 25.00 H new ATOM 0 HB VAL A 121 64.778 16.746 -10.530 1.00 25.00 H new ATOM 0 HG11 VAL A 121 65.065 18.362 -8.672 1.00 25.00 H new ATOM 0 HG12 VAL A 121 63.355 18.183 -9.131 1.00 25.00 H new ATOM 0 HG13 VAL A 121 63.971 17.384 -7.665 1.00 25.00 H new ATOM 0 HG21 VAL A 121 66.641 16.481 -8.884 1.00 25.00 H new ATOM 0 HG22 VAL A 121 65.597 15.444 -7.883 1.00 25.00 H new ATOM 0 HG23 VAL A 121 66.091 14.907 -9.507 1.00 25.00 H new ATOM 674 N ASP A 122 63.570 14.691 -11.834 1.00 25.00 N ATOM 675 CA ASP A 122 63.953 13.761 -12.896 1.00 25.00 C ATOM 676 C ASP A 122 65.477 13.820 -13.027 1.00 25.00 C ATOM 677 O ASP A 122 66.099 14.802 -12.625 1.00 25.00 O ATOM 678 CB ASP A 122 63.275 14.167 -14.214 1.00 25.00 C ATOM 679 CG ASP A 122 63.296 13.051 -15.257 1.00 25.00 C ATOM 680 OD1 ASP A 122 64.380 12.760 -15.810 1.00 25.00 O1- ATOM 681 OD2 ASP A 122 62.228 12.462 -15.515 1.00 25.00 O1- ATOM 0 H ASP A 122 63.230 15.594 -12.166 1.00 25.00 H new ATOM 0 HA ASP A 122 63.636 12.745 -12.661 1.00 25.00 H new ATOM 0 HB2 ASP A 122 62.242 14.452 -14.014 1.00 25.00 H new ATOM 0 HB3 ASP A 122 63.775 15.047 -14.619 1.00 25.00 H new ATOM 686 N ALA A 123 66.083 12.794 -13.600 1.00 25.00 N ATOM 687 CA ALA A 123 67.519 12.802 -13.835 1.00 25.00 C ATOM 688 C ALA A 123 67.864 13.911 -14.841 1.00 25.00 C ATOM 689 O ALA A 123 68.888 14.588 -14.716 1.00 25.00 O ATOM 690 CB ALA A 123 67.966 11.435 -14.362 1.00 25.00 C ATOM 0 H ALA A 123 65.606 11.947 -13.910 1.00 25.00 H new ATOM 0 HA ALA A 123 68.044 12.999 -12.900 1.00 25.00 H new ATOM 0 HB1 ALA A 123 69.042 11.446 -14.536 1.00 25.00 H new ATOM 0 HB2 ALA A 123 67.725 10.666 -13.628 1.00 25.00 H new ATOM 0 HB3 ALA A 123 67.449 11.219 -15.297 1.00 25.00 H new ATOM 696 N ASP A 124 67.001 14.099 -15.829 1.00 25.00 N ATOM 697 CA ASP A 124 67.251 15.081 -16.888 1.00 25.00 C ATOM 698 C ASP A 124 66.623 16.445 -16.577 1.00 25.00 C ATOM 699 O ASP A 124 66.488 17.303 -17.443 1.00 25.00 O ATOM 700 CB ASP A 124 66.738 14.552 -18.230 1.00 25.00 C ATOM 701 CG ASP A 124 67.564 15.056 -19.413 1.00 25.00 C ATOM 702 OD1 ASP A 124 68.788 15.302 -19.235 1.00 25.00 O ATOM 703 OD2 ASP A 124 67.018 15.122 -20.534 1.00 25.00 O1- ATOM 0 H ASP A 124 66.123 13.589 -15.924 1.00 25.00 H new ATOM 0 HA ASP A 124 68.329 15.230 -16.945 1.00 25.00 H new ATOM 0 HB2 ASP A 124 66.755 13.462 -18.218 1.00 25.00 H new ATOM 0 HB3 ASP A 124 65.699 14.853 -18.362 1.00 25.00 H new ATOM 708 N PHE A 125 66.247 16.644 -15.322 1.00 25.00 N ATOM 709 CA PHE A 125 65.669 17.913 -14.875 1.00 25.00 C ATOM 710 C PHE A 125 66.722 19.014 -15.039 1.00 25.00 C ATOM 711 O PHE A 125 67.891 18.804 -14.726 1.00 25.00 O ATOM 712 CB PHE A 125 65.264 17.767 -13.406 1.00 25.00 C ATOM 713 CG PHE A 125 64.245 18.764 -12.934 1.00 25.00 C ATOM 714 CD1 PHE A 125 62.900 18.640 -13.325 1.00 25.00 C ATOM 715 CD2 PHE A 125 64.605 19.795 -12.046 1.00 25.00 C ATOM 716 CE1 PHE A 125 61.920 19.541 -12.843 1.00 25.00 C ATOM 717 CE2 PHE A 125 63.630 20.692 -11.550 1.00 25.00 C ATOM 718 CZ PHE A 125 62.288 20.568 -11.953 1.00 25.00 C ATOM 0 H PHE A 125 66.331 15.941 -14.588 1.00 25.00 H new ATOM 0 HA PHE A 125 64.790 18.175 -15.464 1.00 25.00 H new ATOM 0 HB2 PHE A 125 64.869 16.763 -13.250 1.00 25.00 H new ATOM 0 HB3 PHE A 125 66.156 17.859 -12.786 1.00 25.00 H new ATOM 0 HD1 PHE A 125 62.611 17.848 -14.001 1.00 25.00 H new ATOM 0 HD2 PHE A 125 65.635 19.902 -11.740 1.00 25.00 H new ATOM 0 HE1 PHE A 125 60.892 19.441 -13.158 1.00 25.00 H new ATOM 0 HE2 PHE A 125 63.916 21.473 -10.861 1.00 25.00 H new ATOM 0 HZ PHE A 125 61.544 21.257 -11.582 1.00 25.00 H new ATOM 728 N GLU A 126 66.325 20.172 -15.546 1.00 25.00 N ATOM 729 CA GLU A 126 67.273 21.271 -15.763 1.00 25.00 C ATOM 730 C GLU A 126 67.785 21.806 -14.434 1.00 25.00 C ATOM 731 O GLU A 126 67.007 21.993 -13.500 1.00 25.00 O ATOM 732 CB GLU A 126 66.603 22.455 -16.465 1.00 25.00 C ATOM 733 CG GLU A 126 66.127 22.214 -17.883 1.00 25.00 C ATOM 734 CD GLU A 126 65.572 23.497 -18.513 1.00 25.00 C ATOM 735 OE1 GLU A 126 65.321 24.475 -17.763 1.00 25.00 O ATOM 736 OE2 GLU A 126 65.376 23.529 -19.741 1.00 25.00 O1- ATOM 0 H GLU A 126 65.363 20.381 -15.815 1.00 25.00 H new ATOM 0 HA GLU A 126 68.081 20.864 -16.372 1.00 25.00 H new ATOM 0 HB2 GLU A 126 65.748 22.768 -15.866 1.00 25.00 H new ATOM 0 HB3 GLU A 126 67.306 23.288 -16.477 1.00 25.00 H new ATOM 0 HG2 GLU A 126 66.953 21.838 -18.487 1.00 25.00 H new ATOM 0 HG3 GLU A 126 65.356 21.444 -17.883 1.00 25.00 H new ATOM 743 N LEU A 127 69.058 22.179 -14.381 1.00 25.00 N ATOM 744 CA LEU A 127 69.600 22.863 -13.205 1.00 25.00 C ATOM 745 C LEU A 127 68.901 24.221 -13.080 1.00 25.00 C ATOM 746 O LEU A 127 68.681 24.736 -11.981 1.00 25.00 O ATOM 747 CB LEU A 127 71.122 23.031 -13.349 1.00 25.00 C ATOM 748 CG LEU A 127 71.947 23.553 -12.152 1.00 25.00 C ATOM 749 CD1 LEU A 127 72.045 25.075 -12.158 1.00 25.00 C ATOM 750 CD2 LEU A 127 71.418 23.079 -10.794 1.00 25.00 C ATOM 0 H LEU A 127 69.732 22.023 -15.130 1.00 25.00 H new ATOM 0 HA LEU A 127 69.419 22.278 -12.303 1.00 25.00 H new ATOM 0 HB2 LEU A 127 71.532 22.061 -13.630 1.00 25.00 H new ATOM 0 HB3 LEU A 127 71.298 23.706 -14.186 1.00 25.00 H new ATOM 0 HG LEU A 127 72.941 23.125 -12.283 1.00 25.00 H new ATOM 0 HD11 LEU A 127 72.633 25.405 -11.301 1.00 25.00 H new ATOM 0 HD12 LEU A 127 72.528 25.405 -13.078 1.00 25.00 H new ATOM 0 HD13 LEU A 127 71.045 25.504 -12.099 1.00 25.00 H new ATOM 0 HD21 LEU A 127 72.044 23.483 -9.998 1.00 25.00 H new ATOM 0 HD22 LEU A 127 70.394 23.427 -10.661 1.00 25.00 H new ATOM 0 HD23 LEU A 127 71.439 21.990 -10.755 1.00 25.00 H new ATOM 762 N HIS A 128 68.502 24.767 -14.219 1.00 25.00 N ATOM 763 CA HIS A 128 67.741 26.011 -14.270 1.00 25.00 C ATOM 764 C HIS A 128 66.448 25.910 -13.461 1.00 25.00 C ATOM 765 O HIS A 128 66.161 26.764 -12.628 1.00 25.00 O ATOM 766 CB HIS A 128 67.397 26.305 -15.728 1.00 25.00 C ATOM 767 CG HIS A 128 66.651 27.583 -15.929 1.00 25.00 C ATOM 768 ND1 HIS A 128 65.526 27.695 -16.699 1.00 25.00 N ATOM 769 CD2 HIS A 128 66.884 28.837 -15.454 1.00 25.00 C ATOM 770 CE1 HIS A 128 65.129 28.963 -16.672 1.00 25.00 C ATOM 771 NE2 HIS A 128 65.927 29.707 -15.932 1.00 25.00 N ATOM 0 H HIS A 128 68.695 24.362 -15.135 1.00 25.00 H new ATOM 0 HA HIS A 128 68.346 26.810 -13.840 1.00 25.00 H new ATOM 0 HB2 HIS A 128 68.319 26.339 -16.309 1.00 25.00 H new ATOM 0 HB3 HIS A 128 66.801 25.482 -16.123 1.00 25.00 H new ATOM 0 HD2 HIS A 128 67.698 29.110 -14.799 1.00 25.00 H new ATOM 0 HE1 HIS A 128 64.260 29.338 -17.192 1.00 25.00 H new ATOM 0 HE2 HIS A 128 65.853 30.708 -15.752 1.00 25.00 H new ATOM 779 N ASN A 129 65.695 24.840 -13.668 1.00 25.00 N ATOM 780 CA ASN A 129 64.455 24.643 -12.927 1.00 25.00 C ATOM 781 C ASN A 129 64.754 24.182 -11.506 1.00 25.00 C ATOM 782 O ASN A 129 64.025 24.499 -10.581 1.00 25.00 O ATOM 783 CB ASN A 129 63.565 23.616 -13.633 1.00 25.00 C ATOM 784 CG ASN A 129 62.978 24.150 -14.916 1.00 25.00 C ATOM 785 OD1 ASN A 129 62.533 25.282 -14.977 1.00 25.00 O ATOM 786 ND2 ASN A 129 62.979 23.345 -15.940 1.00 25.00 N ATOM 0 H ASN A 129 65.916 24.101 -14.335 1.00 25.00 H new ATOM 0 HA ASN A 129 63.926 25.595 -12.885 1.00 25.00 H new ATOM 0 HB2 ASN A 129 64.148 22.721 -13.848 1.00 25.00 H new ATOM 0 HB3 ASN A 129 62.758 23.317 -12.964 1.00 25.00 H new ATOM 0 HD21 ASN A 129 62.598 23.656 -16.833 1.00 25.00 H new ATOM 0 HD22 ASN A 129 63.361 22.404 -15.848 1.00 25.00 H new ATOM 793 N PHE A 130 65.840 23.446 -11.326 1.00 25.00 N ATOM 794 CA PHE A 130 66.211 22.939 -10.007 1.00 25.00 C ATOM 795 C PHE A 130 66.506 24.051 -9.012 1.00 25.00 C ATOM 796 O PHE A 130 66.069 23.986 -7.870 1.00 25.00 O ATOM 797 CB PHE A 130 67.431 22.032 -10.118 1.00 25.00 C ATOM 798 CG PHE A 130 67.799 21.360 -8.827 1.00 25.00 C ATOM 799 CD1 PHE A 130 66.961 20.376 -8.281 1.00 25.00 C ATOM 800 CD2 PHE A 130 68.984 21.703 -8.148 1.00 25.00 C ATOM 801 CE1 PHE A 130 67.297 19.723 -7.071 1.00 25.00 C ATOM 802 CE2 PHE A 130 69.334 21.058 -6.937 1.00 25.00 C ATOM 803 CZ PHE A 130 68.491 20.061 -6.401 1.00 25.00 C ATOM 0 H PHE A 130 66.482 23.185 -12.074 1.00 25.00 H new ATOM 0 HA PHE A 130 65.353 22.379 -9.634 1.00 25.00 H new ATOM 0 HB2 PHE A 130 67.239 21.270 -10.873 1.00 25.00 H new ATOM 0 HB3 PHE A 130 68.280 22.620 -10.467 1.00 25.00 H new ATOM 0 HD1 PHE A 130 66.046 20.113 -8.791 1.00 25.00 H new ATOM 0 HD2 PHE A 130 69.632 22.465 -8.555 1.00 25.00 H new ATOM 0 HE1 PHE A 130 66.641 18.968 -6.662 1.00 25.00 H new ATOM 0 HE2 PHE A 130 70.245 21.329 -6.424 1.00 25.00 H new ATOM 0 HZ PHE A 130 68.759 19.560 -5.483 1.00 25.00 H new ATOM 813 N ARG A 131 67.227 25.086 -9.427 1.00 25.00 N ATOM 814 CA ARG A 131 67.529 26.184 -8.501 1.00 25.00 C ATOM 815 C ARG A 131 66.249 26.923 -8.104 1.00 25.00 C ATOM 816 O ARG A 131 66.136 27.372 -6.975 1.00 25.00 O ATOM 817 CB ARG A 131 68.586 27.149 -9.070 1.00 25.00 C ATOM 818 CG ARG A 131 68.172 27.902 -10.333 1.00 25.00 C ATOM 819 CD ARG A 131 69.194 28.959 -10.732 1.00 25.00 C ATOM 820 NE ARG A 131 70.471 28.375 -11.188 1.00 25.00 N ATOM 821 CZ ARG A 131 71.503 29.072 -11.655 1.00 25.00 C ATOM 822 NH1 ARG A 131 71.474 30.380 -11.749 1.00 25.00 N1+ ATOM 823 NH2 ARG A 131 72.582 28.450 -12.035 1.00 25.00 N ATOM 0 H ARG A 131 67.606 25.193 -10.368 1.00 25.00 H new ATOM 0 HA ARG A 131 67.961 25.745 -7.602 1.00 25.00 H new ATOM 0 HB2 ARG A 131 68.841 27.877 -8.300 1.00 25.00 H new ATOM 0 HB3 ARG A 131 69.492 26.583 -9.285 1.00 25.00 H new ATOM 0 HG2 ARG A 131 68.046 27.194 -11.152 1.00 25.00 H new ATOM 0 HG3 ARG A 131 67.205 28.377 -10.170 1.00 25.00 H new ATOM 0 HD2 ARG A 131 68.778 29.578 -11.527 1.00 25.00 H new ATOM 0 HD3 ARG A 131 69.382 29.615 -9.882 1.00 25.00 H new ATOM 0 HE ARG A 131 70.569 27.361 -11.141 1.00 25.00 H new ATOM 0 HH11 ARG A 131 70.642 30.894 -11.459 1.00 25.00 H new ATOM 0 HH12 ARG A 131 72.284 30.883 -12.112 1.00 25.00 H new ATOM 0 HH21 ARG A 131 72.633 27.433 -11.974 1.00 25.00 H new ATOM 0 HH22 ARG A 131 73.376 28.980 -12.394 1.00 25.00 H new ATOM 837 N ALA A 132 65.274 26.987 -9.003 1.00 25.00 N ATOM 838 CA ALA A 132 63.991 27.623 -8.700 1.00 25.00 C ATOM 839 C ALA A 132 63.176 26.731 -7.754 1.00 25.00 C ATOM 840 O ALA A 132 62.502 27.207 -6.851 1.00 25.00 O ATOM 841 CB ALA A 132 63.215 27.881 -9.997 1.00 25.00 C ATOM 0 H ALA A 132 65.344 26.608 -9.947 1.00 25.00 H new ATOM 0 HA ALA A 132 64.172 28.579 -8.208 1.00 25.00 H new ATOM 0 HB1 ALA A 132 62.262 28.354 -9.763 1.00 25.00 H new ATOM 0 HB2 ALA A 132 63.796 28.537 -10.644 1.00 25.00 H new ATOM 0 HB3 ALA A 132 63.035 26.935 -10.507 1.00 25.00 H new ATOM 847 N LEU A 133 63.271 25.426 -7.954 1.00 25.00 N ATOM 848 CA LEU A 133 62.576 24.460 -7.108 1.00 25.00 C ATOM 849 C LEU A 133 63.123 24.523 -5.676 1.00 25.00 C ATOM 850 O LEU A 133 62.378 24.438 -4.710 1.00 25.00 O ATOM 851 CB LEU A 133 62.753 23.055 -7.700 1.00 25.00 C ATOM 852 CG LEU A 133 61.804 21.955 -7.207 1.00 25.00 C ATOM 853 CD1 LEU A 133 60.360 22.232 -7.611 1.00 25.00 C ATOM 854 CD2 LEU A 133 62.245 20.619 -7.804 1.00 25.00 C ATOM 0 H LEU A 133 63.826 25.006 -8.700 1.00 25.00 H new ATOM 0 HA LEU A 133 61.513 24.699 -7.072 1.00 25.00 H new ATOM 0 HB2 LEU A 133 62.648 23.130 -8.782 1.00 25.00 H new ATOM 0 HB3 LEU A 133 63.775 22.732 -7.501 1.00 25.00 H new ATOM 0 HG LEU A 133 61.848 21.928 -6.118 1.00 25.00 H new ATOM 0 HD11 LEU A 133 59.719 21.431 -7.243 1.00 25.00 H new ATOM 0 HD12 LEU A 133 60.038 23.180 -7.181 1.00 25.00 H new ATOM 0 HD13 LEU A 133 60.290 22.283 -8.698 1.00 25.00 H new ATOM 0 HD21 LEU A 133 61.577 19.829 -7.460 1.00 25.00 H new ATOM 0 HD22 LEU A 133 62.209 20.677 -8.892 1.00 25.00 H new ATOM 0 HD23 LEU A 133 63.264 20.397 -7.486 1.00 25.00 H new ATOM 866 N CYS A 134 64.426 24.731 -5.550 1.00 25.00 N ATOM 867 CA CYS A 134 65.051 24.890 -4.237 1.00 25.00 C ATOM 868 C CYS A 134 64.625 26.210 -3.594 1.00 25.00 C ATOM 869 O CYS A 134 64.468 26.296 -2.382 1.00 25.00 O ATOM 870 CB CYS A 134 66.574 24.881 -4.371 1.00 25.00 C ATOM 871 SG CYS A 134 67.252 23.342 -5.031 1.00 25.00 S ATOM 0 H CYS A 134 65.073 24.794 -6.336 1.00 25.00 H new ATOM 0 HA CYS A 134 64.729 24.059 -3.610 1.00 25.00 H new ATOM 0 HB2 CYS A 134 66.875 25.704 -5.019 1.00 25.00 H new ATOM 0 HB3 CYS A 134 67.015 25.068 -3.392 1.00 25.00 H new ATOM 0 HG CYS A 134 66.945 23.237 -6.290 1.00 25.00 H new ATOM 877 N GLU A 135 64.451 27.233 -4.417 1.00 25.00 N ATOM 878 CA GLU A 135 64.032 28.556 -3.951 1.00 25.00 C ATOM 879 C GLU A 135 62.612 28.485 -3.386 1.00 25.00 C ATOM 880 O GLU A 135 62.313 29.102 -2.362 1.00 25.00 O ATOM 881 CB GLU A 135 64.155 29.551 -5.124 1.00 25.00 C ATOM 882 CG GLU A 135 62.974 30.493 -5.393 1.00 25.00 C ATOM 883 CD GLU A 135 63.246 31.389 -6.601 1.00 25.00 C ATOM 884 OE1 GLU A 135 63.302 30.870 -7.734 1.00 25.00 O1- ATOM 885 OE2 GLU A 135 63.500 32.603 -6.410 1.00 25.00 O1- ATOM 0 H GLU A 135 64.595 27.175 -5.425 1.00 25.00 H new ATOM 0 HA GLU A 135 64.674 28.904 -3.142 1.00 25.00 H new ATOM 0 HB2 GLU A 135 65.039 30.164 -4.951 1.00 25.00 H new ATOM 0 HB3 GLU A 135 64.338 28.977 -6.032 1.00 25.00 H new ATOM 0 HG2 GLU A 135 62.071 29.908 -5.567 1.00 25.00 H new ATOM 0 HG3 GLU A 135 62.790 31.110 -4.513 1.00 25.00 H new ATOM 892 N LEU A 136 61.768 27.677 -4.015 1.00 25.00 N ATOM 893 CA LEU A 136 60.387 27.495 -3.571 1.00 25.00 C ATOM 894 C LEU A 136 60.349 26.880 -2.172 1.00 25.00 C ATOM 895 O LEU A 136 59.674 27.391 -1.284 1.00 25.00 O ATOM 896 CB LEU A 136 59.641 26.608 -4.590 1.00 25.00 C ATOM 897 CG LEU A 136 58.110 26.409 -4.501 1.00 25.00 C ATOM 898 CD1 LEU A 136 57.690 25.466 -3.373 1.00 25.00 C ATOM 899 CD2 LEU A 136 57.377 27.746 -4.356 1.00 25.00 C ATOM 0 H LEU A 136 62.016 27.132 -4.841 1.00 25.00 H new ATOM 0 HA LEU A 136 59.891 28.464 -3.516 1.00 25.00 H new ATOM 0 HB2 LEU A 136 59.854 27.011 -5.580 1.00 25.00 H new ATOM 0 HB3 LEU A 136 60.095 25.618 -4.544 1.00 25.00 H new ATOM 0 HG LEU A 136 57.822 25.941 -5.443 1.00 25.00 H new ATOM 0 HD11 LEU A 136 56.604 25.369 -3.365 1.00 25.00 H new ATOM 0 HD12 LEU A 136 58.140 24.486 -3.531 1.00 25.00 H new ATOM 0 HD13 LEU A 136 58.025 25.870 -2.418 1.00 25.00 H new ATOM 0 HD21 LEU A 136 56.303 27.568 -4.296 1.00 25.00 H new ATOM 0 HD22 LEU A 136 57.712 28.248 -3.449 1.00 25.00 H new ATOM 0 HD23 LEU A 136 57.593 28.375 -5.220 1.00 25.00 H new ATOM 911 N GLU A 137 61.090 25.798 -1.975 1.00 25.00 N ATOM 912 CA GLU A 137 61.109 25.108 -0.682 1.00 25.00 C ATOM 913 C GLU A 137 61.779 25.943 0.406 1.00 25.00 C ATOM 914 O GLU A 137 61.353 25.943 1.558 1.00 25.00 O ATOM 915 CB GLU A 137 61.876 23.789 -0.800 1.00 25.00 C ATOM 916 CG GLU A 137 61.229 22.756 -1.708 1.00 25.00 C ATOM 917 CD GLU A 137 59.846 22.326 -1.236 1.00 25.00 C ATOM 918 OE1 GLU A 137 59.706 21.934 -0.056 1.00 25.00 O1- ATOM 919 OE2 GLU A 137 58.904 22.344 -2.059 1.00 25.00 O1- ATOM 0 H GLU A 137 61.685 25.376 -2.688 1.00 25.00 H new ATOM 0 HA GLU A 137 60.069 24.933 -0.406 1.00 25.00 H new ATOM 0 HB2 GLU A 137 62.879 24.000 -1.170 1.00 25.00 H new ATOM 0 HB3 GLU A 137 61.987 23.359 0.195 1.00 25.00 H new ATOM 0 HG2 GLU A 137 61.151 23.165 -2.715 1.00 25.00 H new ATOM 0 HG3 GLU A 137 61.874 21.880 -1.768 1.00 25.00 H new ATOM 926 N SER A 138 62.863 26.619 0.055 1.00 25.00 N ATOM 927 CA SER A 138 63.642 27.359 1.046 1.00 25.00 C ATOM 928 C SER A 138 63.102 28.765 1.314 1.00 25.00 C ATOM 929 O SER A 138 63.476 29.389 2.312 1.00 25.00 O ATOM 930 CB SER A 138 65.103 27.437 0.613 1.00 25.00 C ATOM 931 OG SER A 138 65.895 27.982 1.655 1.00 25.00 O ATOM 0 H SER A 138 63.223 26.673 -0.898 1.00 25.00 H new ATOM 0 HA SER A 138 63.557 26.807 1.982 1.00 25.00 H new ATOM 0 HB2 SER A 138 65.466 26.443 0.353 1.00 25.00 H new ATOM 0 HB3 SER A 138 65.192 28.053 -0.282 1.00 25.00 H new ATOM 0 HG SER A 138 66.837 27.760 1.500 1.00 25.00 H new ATOM 937 N GLY A 139 62.238 29.270 0.441 1.00 25.00 N ATOM 938 CA GLY A 139 61.615 30.569 0.662 1.00 25.00 C ATOM 939 C GLY A 139 62.557 31.749 0.501 1.00 25.00 C ATOM 940 O GLY A 139 62.394 32.776 1.162 1.00 25.00 O ATOM 0 H GLY A 139 61.955 28.803 -0.421 1.00 25.00 H new ATOM 0 HA2 GLY A 139 60.785 30.684 -0.035 1.00 25.00 H new ATOM 0 HA3 GLY A 139 61.193 30.590 1.667 1.00 25.00 H new ATOM 944 N ILE A 140 63.551 31.605 -0.364 1.00 25.00 N ATOM 945 CA ILE A 140 64.548 32.657 -0.599 1.00 25.00 C ATOM 946 C ILE A 140 64.780 32.807 -2.102 1.00 25.00 C ATOM 947 O ILE A 140 64.682 31.832 -2.837 1.00 25.00 O ATOM 948 CB ILE A 140 65.905 32.327 0.092 1.00 25.00 C ATOM 949 CG1 ILE A 140 66.321 30.878 -0.226 1.00 25.00 C ATOM 950 CG2 ILE A 140 65.789 32.533 1.626 1.00 25.00 C ATOM 951 CD1 ILE A 140 67.748 30.543 0.098 1.00 25.00 C ATOM 0 H ILE A 140 63.695 30.764 -0.923 1.00 25.00 H new ATOM 0 HA ILE A 140 64.164 33.585 -0.174 1.00 25.00 H new ATOM 0 HB ILE A 140 66.670 33.002 -0.291 1.00 25.00 H new ATOM 0 HG12 ILE A 140 65.670 30.200 0.325 1.00 25.00 H new ATOM 0 HG13 ILE A 140 66.151 30.691 -1.286 1.00 25.00 H new ATOM 0 HG21 ILE A 140 66.743 32.299 2.098 1.00 25.00 H new ATOM 0 HG22 ILE A 140 65.525 33.570 1.835 1.00 25.00 H new ATOM 0 HG23 ILE A 140 65.017 31.875 2.024 1.00 25.00 H new ATOM 0 HD11 ILE A 140 67.945 29.503 -0.161 1.00 25.00 H new ATOM 0 HD12 ILE A 140 68.413 31.191 -0.473 1.00 25.00 H new ATOM 0 HD13 ILE A 140 67.924 30.692 1.163 1.00 25.00 H new ATOM 963 N PRO A 141 65.069 34.032 -2.582 1.00 25.00 N ATOM 964 CA PRO A 141 65.240 34.148 -4.035 1.00 25.00 C ATOM 965 C PRO A 141 66.437 33.381 -4.596 1.00 25.00 C ATOM 966 O PRO A 141 67.555 33.466 -4.067 1.00 25.00 O ATOM 967 CB PRO A 141 65.441 35.658 -4.241 1.00 25.00 C ATOM 968 CG PRO A 141 64.852 36.286 -3.028 1.00 25.00 C ATOM 969 CD PRO A 141 65.208 35.345 -1.925 1.00 25.00 C ATOM 0 HA PRO A 141 64.386 33.718 -4.559 1.00 25.00 H new ATOM 0 HB2 PRO A 141 66.497 35.907 -4.342 1.00 25.00 H new ATOM 0 HB3 PRO A 141 64.944 36.004 -5.147 1.00 25.00 H new ATOM 0 HG2 PRO A 141 65.264 37.280 -2.853 1.00 25.00 H new ATOM 0 HG3 PRO A 141 63.772 36.400 -3.122 1.00 25.00 H new ATOM 0 HD2 PRO A 141 66.221 35.512 -1.558 1.00 25.00 H new ATOM 0 HD3 PRO A 141 64.538 35.446 -1.071 1.00 25.00 H new ATOM 977 N ALA A 142 66.226 32.689 -5.707 1.00 25.00 N ATOM 978 CA ALA A 142 67.304 31.980 -6.400 1.00 25.00 C ATOM 979 C ALA A 142 68.331 32.988 -6.924 1.00 25.00 C ATOM 980 O ALA A 142 69.512 32.688 -7.050 1.00 25.00 O ATOM 981 CB ALA A 142 66.731 31.150 -7.561 1.00 25.00 C ATOM 0 H ALA A 142 65.313 32.601 -6.154 1.00 25.00 H new ATOM 0 HA ALA A 142 67.795 31.304 -5.700 1.00 25.00 H new ATOM 0 HB1 ALA A 142 67.541 30.627 -8.069 1.00 25.00 H new ATOM 0 HB2 ALA A 142 66.018 30.423 -7.172 1.00 25.00 H new ATOM 0 HB3 ALA A 142 66.227 31.811 -8.266 1.00 25.00 H new ATOM 987 N ALA A 143 67.859 34.189 -7.227 1.00 25.00 N ATOM 988 CA ALA A 143 68.713 35.251 -7.751 1.00 25.00 C ATOM 989 C ALA A 143 69.706 35.772 -6.700 1.00 25.00 C ATOM 990 O ALA A 143 70.767 36.285 -7.043 1.00 25.00 O ATOM 991 CB ALA A 143 67.836 36.404 -8.258 1.00 25.00 C ATOM 0 H ALA A 143 66.881 34.456 -7.118 1.00 25.00 H new ATOM 0 HA ALA A 143 69.299 34.834 -8.570 1.00 25.00 H new ATOM 0 HB1 ALA A 143 68.471 37.199 -8.650 1.00 25.00 H new ATOM 0 HB2 ALA A 143 67.179 36.041 -9.048 1.00 25.00 H new ATOM 0 HB3 ALA A 143 67.234 36.792 -7.436 1.00 25.00 H new ATOM 997 N GLU A 144 69.343 35.663 -5.430 1.00 25.00 N ATOM 998 CA GLU A 144 70.164 36.197 -4.338 1.00 25.00 C ATOM 999 C GLU A 144 70.941 35.099 -3.622 1.00 25.00 C ATOM 1000 O GLU A 144 71.502 35.322 -2.548 1.00 25.00 O ATOM 1001 CB GLU A 144 69.276 36.919 -3.320 1.00 25.00 C ATOM 1002 CG GLU A 144 68.614 38.174 -3.868 1.00 25.00 C ATOM 1003 CD GLU A 144 67.823 38.915 -2.800 1.00 25.00 C ATOM 1004 OE1 GLU A 144 68.293 38.983 -1.639 1.00 25.00 O1- ATOM 1005 OE2 GLU A 144 66.726 39.418 -3.115 1.00 25.00 O1- ATOM 0 H GLU A 144 68.483 35.209 -5.123 1.00 25.00 H new ATOM 0 HA GLU A 144 70.878 36.892 -4.780 1.00 25.00 H new ATOM 0 HB2 GLU A 144 68.503 36.233 -2.974 1.00 25.00 H new ATOM 0 HB3 GLU A 144 69.878 37.186 -2.451 1.00 25.00 H new ATOM 0 HG2 GLU A 144 69.376 38.836 -4.279 1.00 25.00 H new ATOM 0 HG3 GLU A 144 67.950 37.904 -4.689 1.00 25.00 H new ATOM 1012 N SER A 145 70.965 33.906 -4.195 1.00 25.00 N ATOM 1013 CA SER A 145 71.627 32.776 -3.557 1.00 25.00 C ATOM 1014 C SER A 145 72.574 32.059 -4.508 1.00 25.00 C ATOM 1015 O SER A 145 72.466 32.167 -5.729 1.00 25.00 O ATOM 1016 CB SER A 145 70.578 31.808 -3.018 1.00 25.00 C ATOM 1017 OG SER A 145 69.711 31.364 -4.042 1.00 25.00 O ATOM 0 H SER A 145 70.536 33.694 -5.096 1.00 25.00 H new ATOM 0 HA SER A 145 72.230 33.159 -2.734 1.00 25.00 H new ATOM 0 HB2 SER A 145 71.073 30.951 -2.561 1.00 25.00 H new ATOM 0 HB3 SER A 145 69.998 32.297 -2.235 1.00 25.00 H new ATOM 0 HG SER A 145 68.962 31.990 -4.131 1.00 25.00 H new ATOM 1023 N GLN A 146 73.533 31.344 -3.938 1.00 25.00 N ATOM 1024 CA GLN A 146 74.515 30.602 -4.722 1.00 25.00 C ATOM 1025 C GLN A 146 74.359 29.134 -4.421 1.00 25.00 C ATOM 1026 O GLN A 146 74.293 28.734 -3.267 1.00 25.00 O ATOM 1027 CB GLN A 146 75.943 31.042 -4.392 1.00 25.00 C ATOM 1028 CG GLN A 146 76.480 32.139 -5.306 1.00 25.00 C ATOM 1029 CD GLN A 146 75.957 33.513 -4.954 1.00 25.00 C ATOM 1030 OE1 GLN A 146 76.543 34.217 -4.150 1.00 25.00 O ATOM 1031 NE2 GLN A 146 74.873 33.901 -5.563 1.00 25.00 N ATOM 0 H GLN A 146 73.654 31.261 -2.929 1.00 25.00 H new ATOM 0 HA GLN A 146 74.341 30.800 -5.780 1.00 25.00 H new ATOM 0 HB2 GLN A 146 75.975 31.394 -3.361 1.00 25.00 H new ATOM 0 HB3 GLN A 146 76.603 30.176 -4.454 1.00 25.00 H new ATOM 0 HG2 GLN A 146 77.569 32.147 -5.253 1.00 25.00 H new ATOM 0 HG3 GLN A 146 76.212 31.908 -6.337 1.00 25.00 H new ATOM 0 HE21 GLN A 146 74.413 33.281 -6.229 1.00 25.00 H new ATOM 0 HE22 GLN A 146 74.484 34.825 -5.374 1.00 25.00 H new ATOM 1040 N ILE A 147 74.291 28.340 -5.473 1.00 25.00 N ATOM 1041 CA ILE A 147 74.073 26.901 -5.345 1.00 25.00 C ATOM 1042 C ILE A 147 75.343 26.145 -5.794 1.00 25.00 C ATOM 1043 O ILE A 147 75.957 26.468 -6.823 1.00 25.00 O ATOM 1044 CB ILE A 147 72.760 26.505 -6.105 1.00 25.00 C ATOM 1045 CG1 ILE A 147 72.305 25.102 -5.680 1.00 25.00 C ATOM 1046 CG2 ILE A 147 72.922 26.655 -7.642 1.00 25.00 C ATOM 1047 CD1 ILE A 147 70.904 24.707 -6.191 1.00 25.00 C ATOM 0 H ILE A 147 74.384 28.665 -6.435 1.00 25.00 H new ATOM 0 HA ILE A 147 73.912 26.609 -4.307 1.00 25.00 H new ATOM 0 HB ILE A 147 71.967 27.199 -5.825 1.00 25.00 H new ATOM 0 HG12 ILE A 147 73.030 24.373 -6.042 1.00 25.00 H new ATOM 0 HG13 ILE A 147 72.311 25.045 -4.592 1.00 25.00 H new ATOM 0 HG21 ILE A 147 71.992 26.372 -8.135 1.00 25.00 H new ATOM 0 HG22 ILE A 147 73.160 27.691 -7.883 1.00 25.00 H new ATOM 0 HG23 ILE A 147 73.728 26.008 -7.988 1.00 25.00 H new ATOM 0 HD11 ILE A 147 70.661 23.702 -5.846 1.00 25.00 H new ATOM 0 HD12 ILE A 147 70.165 25.411 -5.808 1.00 25.00 H new ATOM 0 HD13 ILE A 147 70.895 24.728 -7.281 1.00 25.00 H new ATOM 1059 N VAL A 148 75.797 25.228 -4.946 1.00 25.00 N ATOM 1060 CA VAL A 148 77.097 24.557 -5.086 1.00 25.00 C ATOM 1061 C VAL A 148 76.945 23.041 -4.903 1.00 25.00 C ATOM 1062 O VAL A 148 76.245 22.587 -4.008 1.00 25.00 O ATOM 1063 CB VAL A 148 78.086 25.098 -3.987 1.00 25.00 C ATOM 1064 CG1 VAL A 148 79.470 24.427 -4.073 1.00 25.00 C ATOM 1065 CG2 VAL A 148 78.256 26.624 -4.120 1.00 25.00 C ATOM 0 H VAL A 148 75.269 24.921 -4.129 1.00 25.00 H new ATOM 0 HA VAL A 148 77.486 24.762 -6.084 1.00 25.00 H new ATOM 0 HB VAL A 148 77.648 24.855 -3.019 1.00 25.00 H new ATOM 0 HG11 VAL A 148 80.119 24.831 -3.296 1.00 25.00 H new ATOM 0 HG12 VAL A 148 79.362 23.351 -3.933 1.00 25.00 H new ATOM 0 HG13 VAL A 148 79.909 24.623 -5.051 1.00 25.00 H new ATOM 0 HG21 VAL A 148 78.943 26.982 -3.353 1.00 25.00 H new ATOM 0 HG22 VAL A 148 78.657 26.861 -5.105 1.00 25.00 H new ATOM 0 HG23 VAL A 148 77.288 27.110 -3.996 1.00 25.00 H new ATOM 1075 N TYR A 149 77.632 22.264 -5.725 1.00 25.00 N ATOM 1076 CA TYR A 149 77.625 20.805 -5.613 1.00 25.00 C ATOM 1077 C TYR A 149 79.040 20.305 -5.857 1.00 25.00 C ATOM 1078 O TYR A 149 79.741 20.852 -6.702 1.00 25.00 O ATOM 1079 CB TYR A 149 76.676 20.210 -6.648 1.00 25.00 C ATOM 1080 CG TYR A 149 76.884 18.736 -6.888 1.00 25.00 C ATOM 1081 CD1 TYR A 149 76.727 17.798 -5.846 1.00 25.00 C ATOM 1082 CD2 TYR A 149 77.251 18.267 -8.163 1.00 25.00 C ATOM 1083 CE1 TYR A 149 76.936 16.415 -6.082 1.00 25.00 C ATOM 1084 CE2 TYR A 149 77.447 16.886 -8.400 1.00 25.00 C ATOM 1085 CZ TYR A 149 77.287 15.973 -7.357 1.00 25.00 C ATOM 1086 OH TYR A 149 77.466 14.635 -7.595 1.00 25.00 O ATOM 0 H TYR A 149 78.209 22.620 -6.487 1.00 25.00 H new ATOM 0 HA TYR A 149 77.286 20.504 -4.622 1.00 25.00 H new ATOM 0 HB2 TYR A 149 75.649 20.374 -6.322 1.00 25.00 H new ATOM 0 HB3 TYR A 149 76.801 20.743 -7.590 1.00 25.00 H new ATOM 0 HD1 TYR A 149 76.445 18.136 -4.860 1.00 25.00 H new ATOM 0 HD2 TYR A 149 77.385 18.971 -8.971 1.00 25.00 H new ATOM 0 HE1 TYR A 149 76.823 15.706 -5.275 1.00 25.00 H new ATOM 0 HE2 TYR A 149 77.720 16.539 -9.386 1.00 25.00 H new ATOM 0 HH TYR A 149 76.890 14.355 -8.337 1.00 25.00 H new ATOM 1096 N ALA A 150 79.463 19.306 -5.086 1.00 25.00 N ATOM 1097 CA ALA A 150 80.806 18.722 -5.191 1.00 25.00 C ATOM 1098 C ALA A 150 81.896 19.809 -5.185 1.00 25.00 C ATOM 1099 O ALA A 150 82.824 19.766 -5.981 1.00 25.00 O ATOM 1100 CB ALA A 150 80.902 17.847 -6.460 1.00 25.00 C ATOM 0 H ALA A 150 78.884 18.874 -4.366 1.00 25.00 H new ATOM 0 HA ALA A 150 80.975 18.093 -4.317 1.00 25.00 H new ATOM 0 HB1 ALA A 150 81.901 17.417 -6.531 1.00 25.00 H new ATOM 0 HB2 ALA A 150 80.165 17.045 -6.406 1.00 25.00 H new ATOM 0 HB3 ALA A 150 80.707 18.460 -7.340 1.00 25.00 H new ATOM 1106 N GLU A 151 81.730 20.788 -4.300 1.00 25.00 N ATOM 1107 CA GLU A 151 82.641 21.942 -4.150 1.00 25.00 C ATOM 1108 C GLU A 151 82.790 22.846 -5.394 1.00 25.00 C ATOM 1109 O GLU A 151 83.736 23.630 -5.476 1.00 25.00 O ATOM 1110 CB GLU A 151 84.042 21.495 -3.701 1.00 25.00 C ATOM 1111 CG GLU A 151 84.104 20.746 -2.391 1.00 25.00 C ATOM 1112 CD GLU A 151 85.550 20.480 -1.980 1.00 25.00 C ATOM 1113 OE1 GLU A 151 86.456 20.619 -2.842 1.00 25.00 O ATOM 1114 OE2 GLU A 151 85.785 20.168 -0.795 1.00 25.00 O1- ATOM 0 H GLU A 151 80.945 20.811 -3.649 1.00 25.00 H new ATOM 0 HA GLU A 151 82.154 22.547 -3.385 1.00 25.00 H new ATOM 0 HB2 GLU A 151 84.468 20.863 -4.480 1.00 25.00 H new ATOM 0 HB3 GLU A 151 84.677 22.378 -3.624 1.00 25.00 H new ATOM 0 HG2 GLU A 151 83.602 21.323 -1.614 1.00 25.00 H new ATOM 0 HG3 GLU A 151 83.569 19.801 -2.483 1.00 25.00 H new ATOM 1121 N ARG A 152 81.863 22.786 -6.344 1.00 25.00 N ATOM 1122 CA ARG A 152 81.888 23.703 -7.497 1.00 25.00 C ATOM 1123 C ARG A 152 80.509 24.336 -7.673 1.00 25.00 C ATOM 1124 O ARG A 152 79.489 23.672 -7.488 1.00 25.00 O ATOM 1125 CB ARG A 152 82.282 22.974 -8.794 1.00 25.00 C ATOM 1126 CG ARG A 152 83.790 22.685 -8.941 1.00 25.00 C ATOM 1127 CD ARG A 152 84.156 21.341 -8.335 1.00 25.00 C ATOM 1128 NE ARG A 152 85.596 21.030 -8.412 1.00 25.00 N ATOM 1129 CZ ARG A 152 86.469 21.185 -7.418 1.00 25.00 C ATOM 1130 NH1 ARG A 152 86.141 21.694 -6.261 1.00 25.00 N1+ ATOM 1131 NH2 ARG A 152 87.704 20.806 -7.594 1.00 25.00 N ATOM 0 H ARG A 152 81.089 22.122 -6.347 1.00 25.00 H new ATOM 0 HA ARG A 152 82.636 24.471 -7.299 1.00 25.00 H new ATOM 0 HB2 ARG A 152 81.739 22.030 -8.843 1.00 25.00 H new ATOM 0 HB3 ARG A 152 81.957 23.573 -9.644 1.00 25.00 H new ATOM 0 HG2 ARG A 152 84.064 22.697 -9.996 1.00 25.00 H new ATOM 0 HG3 ARG A 152 84.363 23.474 -8.454 1.00 25.00 H new ATOM 0 HD2 ARG A 152 83.845 21.326 -7.290 1.00 25.00 H new ATOM 0 HD3 ARG A 152 83.596 20.557 -8.845 1.00 25.00 H new ATOM 0 HE ARG A 152 85.951 20.667 -9.297 1.00 25.00 H new ATOM 0 HH11 ARG A 152 85.181 21.992 -6.089 1.00 25.00 H new ATOM 0 HH12 ARG A 152 86.845 21.793 -5.529 1.00 25.00 H new ATOM 0 HH21 ARG A 152 87.990 20.397 -8.484 1.00 25.00 H new ATOM 0 HH22 ARG A 152 88.384 20.918 -6.842 1.00 25.00 H new ATOM 1145 N PRO A 153 80.451 25.638 -8.005 1.00 25.00 N ATOM 1146 CA PRO A 153 79.111 26.192 -8.204 1.00 25.00 C ATOM 1147 C PRO A 153 78.475 25.638 -9.471 1.00 25.00 C ATOM 1148 O PRO A 153 79.155 25.374 -10.462 1.00 25.00 O ATOM 1149 CB PRO A 153 79.371 27.695 -8.315 1.00 25.00 C ATOM 1150 CG PRO A 153 80.740 27.786 -8.878 1.00 25.00 C ATOM 1151 CD PRO A 153 81.495 26.655 -8.235 1.00 25.00 C ATOM 0 HA PRO A 153 78.415 25.942 -7.403 1.00 25.00 H new ATOM 0 HB2 PRO A 153 78.641 28.179 -8.963 1.00 25.00 H new ATOM 0 HB3 PRO A 153 79.307 28.183 -7.343 1.00 25.00 H new ATOM 0 HG2 PRO A 153 80.729 27.688 -9.963 1.00 25.00 H new ATOM 0 HG3 PRO A 153 81.199 28.748 -8.650 1.00 25.00 H new ATOM 0 HD2 PRO A 153 82.286 26.280 -8.884 1.00 25.00 H new ATOM 0 HD3 PRO A 153 81.967 26.965 -7.303 1.00 25.00 H new ATOM 1159 N LEU A 154 77.166 25.464 -9.437 1.00 25.00 N ATOM 1160 CA LEU A 154 76.434 24.935 -10.588 1.00 25.00 C ATOM 1161 C LEU A 154 76.052 26.106 -11.496 1.00 0.00 C ATOM 1162 O LEU A 154 74.914 26.575 -11.491 1.00 25.00 O ATOM 1163 CB LEU A 154 75.186 24.170 -10.138 1.00 25.00 C ATOM 1164 CG LEU A 154 75.425 22.965 -9.214 1.00 25.00 C ATOM 1165 CD1 LEU A 154 74.659 23.145 -7.921 1.00 25.00 C ATOM 1166 CD2 LEU A 154 74.986 21.676 -9.875 1.00 25.00 C ATOM 0 H LEU A 154 76.583 25.679 -8.628 1.00 25.00 H new ATOM 0 HA LEU A 154 77.065 24.233 -11.133 1.00 25.00 H new ATOM 0 HB2 LEU A 154 74.522 24.867 -9.627 1.00 25.00 H new ATOM 0 HB3 LEU A 154 74.659 23.821 -11.026 1.00 25.00 H new ATOM 0 HG LEU A 154 76.494 22.907 -9.008 1.00 25.00 H new ATOM 0 HD11 LEU A 154 74.834 22.287 -7.272 1.00 25.00 H new ATOM 0 HD12 LEU A 154 74.997 24.053 -7.421 1.00 25.00 H new ATOM 0 HD13 LEU A 154 73.594 23.225 -8.137 1.00 25.00 H new ATOM 0 HD21 LEU A 154 75.167 20.840 -9.199 1.00 25.00 H new ATOM 0 HD22 LEU A 154 73.923 21.731 -10.108 1.00 25.00 H new ATOM 0 HD23 LEU A 154 75.552 21.527 -10.795 1.00 25.00 H new ATOM 1178 N THR A 155 77.035 26.636 -12.204 1.00 25.00 N ATOM 1179 CA THR A 155 76.838 27.835 -13.017 1.00 25.00 C ATOM 1180 C THR A 155 76.012 27.578 -14.266 1.00 25.00 C ATOM 1181 O THR A 155 75.248 28.440 -14.700 1.00 25.00 O ATOM 1182 CB THR A 155 78.195 28.404 -13.482 1.00 25.00 C ATOM 1183 OG1 THR A 155 78.950 27.368 -14.119 1.00 25.00 O ATOM 1184 CG2 THR A 155 79.004 28.905 -12.297 1.00 25.00 C ATOM 0 H THR A 155 77.982 26.257 -12.235 1.00 25.00 H new ATOM 0 HA THR A 155 76.306 28.537 -12.375 1.00 25.00 H new ATOM 0 HB THR A 155 78.000 29.228 -14.169 1.00 25.00 H new ATOM 0 HG1 THR A 155 78.623 27.240 -15.034 1.00 25.00 H new ATOM 0 HG21 THR A 155 79.957 29.302 -12.648 1.00 25.00 H new ATOM 0 HG22 THR A 155 78.450 29.692 -11.785 1.00 25.00 H new ATOM 0 HG23 THR A 155 79.186 28.081 -11.607 1.00 25.00 H new ATOM 1192 N ASP A 156 76.185 26.409 -14.859 1.00 25.00 N ATOM 1193 CA ASP A 156 75.553 26.105 -16.138 1.00 25.00 C ATOM 1194 C ASP A 156 74.120 25.649 -15.912 1.00 25.00 C ATOM 1195 O ASP A 156 73.861 24.497 -15.566 1.00 25.00 O ATOM 1196 CB ASP A 156 76.335 25.026 -16.893 1.00 25.00 C ATOM 1197 CG ASP A 156 77.755 25.451 -17.231 1.00 25.00 C ATOM 1198 OD1 ASP A 156 78.053 26.663 -17.219 1.00 25.00 O1- ATOM 1199 OD2 ASP A 156 78.582 24.551 -17.503 1.00 25.00 O1- ATOM 0 H ASP A 156 76.756 25.654 -14.479 1.00 25.00 H new ATOM 0 HA ASP A 156 75.551 27.011 -16.744 1.00 25.00 H new ATOM 0 HB2 ASP A 156 76.367 24.119 -16.290 1.00 25.00 H new ATOM 0 HB3 ASP A 156 75.806 24.779 -17.814 1.00 25.00 H new ATOM 1204 N ASN A 157 73.188 26.570 -16.089 1.00 25.00 N ATOM 1205 CA ASN A 157 71.769 26.294 -15.870 1.00 25.00 C ATOM 1206 C ASN A 157 71.198 25.376 -16.949 1.00 25.00 C ATOM 1207 O ASN A 157 70.205 24.695 -16.727 1.00 25.00 O ATOM 1208 CB ASN A 157 70.991 27.618 -15.857 1.00 25.00 C ATOM 1209 CG ASN A 157 70.896 28.250 -17.231 1.00 25.00 C ATOM 1210 OD1 ASN A 157 71.905 28.499 -17.872 1.00 25.00 O ATOM 1211 ND2 ASN A 157 69.701 28.497 -17.687 1.00 25.00 N ATOM 0 H ASN A 157 73.386 27.525 -16.386 1.00 25.00 H new ATOM 0 HA ASN A 157 71.667 25.785 -14.911 1.00 25.00 H new ATOM 0 HB2 ASN A 157 69.987 27.442 -15.472 1.00 25.00 H new ATOM 0 HB3 ASN A 157 71.477 28.314 -15.173 1.00 25.00 H new ATOM 0 HD21 ASN A 157 69.584 28.913 -18.611 1.00 25.00 H new ATOM 0 HD22 ASN A 157 68.883 28.274 -17.120 1.00 25.00 H new ATOM 1218 N HIS A 158 71.831 25.381 -18.113 1.00 25.00 N ATOM 1219 CA HIS A 158 71.377 24.598 -19.263 1.00 25.00 C ATOM 1220 C HIS A 158 71.644 23.101 -19.079 1.00 25.00 C ATOM 1221 O HIS A 158 71.056 22.269 -19.753 1.00 25.00 O ATOM 1222 CB HIS A 158 72.103 25.104 -20.516 1.00 25.00 C ATOM 1223 CG HIS A 158 71.477 24.666 -21.806 1.00 25.00 C ATOM 1224 ND1 HIS A 158 72.118 24.691 -23.020 1.00 25.00 N ATOM 1225 CD2 HIS A 158 70.229 24.184 -22.079 1.00 25.00 C ATOM 1226 CE1 HIS A 158 71.278 24.242 -23.947 1.00 25.00 C ATOM 1227 NE2 HIS A 158 70.109 23.927 -23.430 1.00 25.00 N ATOM 0 H HIS A 158 72.674 25.927 -18.291 1.00 25.00 H new ATOM 0 HA HIS A 158 70.299 24.725 -19.363 1.00 25.00 H new ATOM 0 HB2 HIS A 158 72.132 26.193 -20.491 1.00 25.00 H new ATOM 0 HB3 HIS A 158 73.136 24.756 -20.489 1.00 25.00 H new ATOM 0 HD2 HIS A 158 69.451 24.027 -21.347 1.00 25.00 H new ATOM 0 HE1 HIS A 158 71.524 24.147 -24.994 1.00 25.00 H new ATOM 0 HE2 HIS A 158 69.290 23.570 -23.922 1.00 25.00 H new ATOM 1235 N ARG A 159 72.545 22.754 -18.169 1.00 25.00 N ATOM 1236 CA ARG A 159 72.849 21.346 -17.922 1.00 25.00 C ATOM 1237 C ARG A 159 71.726 20.725 -17.119 1.00 25.00 C ATOM 1238 O ARG A 159 71.149 21.372 -16.245 1.00 25.00 O ATOM 1239 CB ARG A 159 74.135 21.196 -17.116 1.00 25.00 C ATOM 1240 CG ARG A 159 75.402 21.509 -17.867 1.00 25.00 C ATOM 1241 CD ARG A 159 76.592 21.052 -17.037 1.00 25.00 C ATOM 1242 NE ARG A 159 77.850 21.682 -17.460 1.00 25.00 N ATOM 1243 CZ ARG A 159 79.059 21.326 -17.046 1.00 25.00 C ATOM 1244 NH1 ARG A 159 79.252 20.328 -16.215 1.00 25.00 N1+ ATOM 1245 NH2 ARG A 159 80.091 21.994 -17.474 1.00 25.00 N ATOM 0 H ARG A 159 73.072 23.414 -17.597 1.00 25.00 H new ATOM 0 HA ARG A 159 72.965 20.853 -18.887 1.00 25.00 H new ATOM 0 HB2 ARG A 159 74.077 21.849 -16.245 1.00 25.00 H new ATOM 0 HB3 ARG A 159 74.195 20.173 -16.745 1.00 25.00 H new ATOM 0 HG2 ARG A 159 75.401 21.006 -18.834 1.00 25.00 H new ATOM 0 HG3 ARG A 159 75.469 22.579 -18.065 1.00 25.00 H new ATOM 0 HD2 ARG A 159 76.409 21.283 -15.988 1.00 25.00 H new ATOM 0 HD3 ARG A 159 76.689 19.969 -17.113 1.00 25.00 H new ATOM 0 HE ARG A 159 77.789 22.454 -18.124 1.00 25.00 H new ATOM 0 HH11 ARG A 159 78.456 19.795 -15.864 1.00 25.00 H new ATOM 0 HH12 ARG A 159 80.198 20.085 -15.920 1.00 25.00 H new ATOM 0 HH21 ARG A 159 79.962 22.776 -18.116 1.00 25.00 H new ATOM 0 HH22 ARG A 159 81.029 21.736 -17.167 1.00 25.00 H new ATOM 1259 N SER A 160 71.482 19.448 -17.347 1.00 25.00 N ATOM 1260 CA SER A 160 70.569 18.698 -16.505 1.00 25.00 C ATOM 1261 C SER A 160 71.345 18.210 -15.289 1.00 25.00 C ATOM 1262 O SER A 160 72.574 18.285 -15.255 1.00 25.00 O ATOM 1263 CB SER A 160 69.980 17.521 -17.271 1.00 25.00 C ATOM 1264 OG SER A 160 70.986 16.637 -17.741 1.00 25.00 O ATOM 0 H SER A 160 71.901 18.910 -18.105 1.00 25.00 H new ATOM 0 HA SER A 160 69.741 19.333 -16.191 1.00 25.00 H new ATOM 0 HB2 SER A 160 69.291 16.976 -16.625 1.00 25.00 H new ATOM 0 HB3 SER A 160 69.399 17.892 -18.116 1.00 25.00 H new ATOM 0 HG SER A 160 70.584 15.972 -18.338 1.00 25.00 H new ATOM 1270 N LEU A 161 70.648 17.710 -14.285 1.00 25.00 N ATOM 1271 CA LEU A 161 71.301 17.240 -13.061 1.00 25.00 C ATOM 1272 C LEU A 161 72.171 16.007 -13.346 1.00 25.00 C ATOM 1273 O LEU A 161 73.285 15.870 -12.812 1.00 25.00 O ATOM 1274 CB LEU A 161 70.233 16.944 -12.004 1.00 25.00 C ATOM 1275 CG LEU A 161 69.328 18.148 -11.669 1.00 25.00 C ATOM 1276 CD1 LEU A 161 68.189 17.705 -10.794 1.00 25.00 C ATOM 1277 CD2 LEU A 161 70.075 19.293 -10.987 1.00 25.00 C ATOM 0 H LEU A 161 69.632 17.616 -14.286 1.00 25.00 H new ATOM 0 HA LEU A 161 71.964 18.017 -12.680 1.00 25.00 H new ATOM 0 HB2 LEU A 161 69.610 16.121 -12.353 1.00 25.00 H new ATOM 0 HB3 LEU A 161 70.724 16.607 -11.091 1.00 25.00 H new ATOM 0 HG LEU A 161 68.956 18.529 -12.620 1.00 25.00 H new ATOM 0 HD11 LEU A 161 67.555 18.560 -10.562 1.00 25.00 H new ATOM 0 HD12 LEU A 161 67.602 16.949 -11.316 1.00 25.00 H new ATOM 0 HD13 LEU A 161 68.583 17.284 -9.869 1.00 25.00 H new ATOM 0 HD21 LEU A 161 69.381 20.107 -10.779 1.00 25.00 H new ATOM 0 HD22 LEU A 161 70.509 18.938 -10.052 1.00 25.00 H new ATOM 0 HD23 LEU A 161 70.869 19.651 -11.643 1.00 25.00 H new ATOM 1289 N ALA A 162 71.715 15.161 -14.260 1.00 25.00 N ATOM 1290 CA ALA A 162 72.495 14.005 -14.700 1.00 25.00 C ATOM 1291 C ALA A 162 73.817 14.450 -15.338 1.00 25.00 C ATOM 1292 O ALA A 162 74.830 13.770 -15.216 1.00 25.00 O ATOM 1293 CB ALA A 162 71.682 13.176 -15.698 1.00 25.00 C ATOM 0 H ALA A 162 70.806 15.252 -14.714 1.00 25.00 H new ATOM 0 HA ALA A 162 72.725 13.392 -13.828 1.00 25.00 H new ATOM 0 HB1 ALA A 162 72.270 12.317 -16.021 1.00 25.00 H new ATOM 0 HB2 ALA A 162 70.765 12.830 -15.221 1.00 25.00 H new ATOM 0 HB3 ALA A 162 71.432 13.790 -16.563 1.00 25.00 H new ATOM 1299 N SER A 163 73.815 15.616 -15.971 1.00 25.00 N ATOM 1300 CA SER A 163 75.026 16.157 -16.598 1.00 25.00 C ATOM 1301 C SER A 163 76.057 16.613 -15.561 1.00 25.00 C ATOM 1302 O SER A 163 77.231 16.790 -15.886 1.00 25.00 O ATOM 1303 CB SER A 163 74.681 17.331 -17.511 1.00 25.00 C ATOM 1304 OG SER A 163 73.745 16.955 -18.509 1.00 25.00 O ATOM 0 H SER A 163 72.991 16.209 -16.067 1.00 25.00 H new ATOM 0 HA SER A 163 75.464 15.349 -17.184 1.00 25.00 H new ATOM 0 HB2 SER A 163 74.272 18.148 -16.916 1.00 25.00 H new ATOM 0 HB3 SER A 163 75.589 17.705 -17.984 1.00 25.00 H new ATOM 0 HG SER A 163 72.856 16.867 -18.107 1.00 25.00 H new ATOM 1310 N TYR A 164 75.633 16.787 -14.313 1.00 25.00 N ATOM 1311 CA TYR A 164 76.564 17.104 -13.229 1.00 25.00 C ATOM 1312 C TYR A 164 76.937 15.832 -12.473 1.00 25.00 C ATOM 1313 O TYR A 164 77.812 15.848 -11.616 1.00 25.00 O ATOM 1314 CB TYR A 164 75.932 18.083 -12.242 1.00 25.00 C ATOM 1315 CG TYR A 164 75.914 19.511 -12.725 1.00 25.00 C ATOM 1316 CD1 TYR A 164 77.078 20.305 -12.645 1.00 25.00 C ATOM 1317 CD2 TYR A 164 74.738 20.093 -13.237 1.00 25.00 C ATOM 1318 CE1 TYR A 164 77.061 21.664 -13.053 1.00 25.00 C ATOM 1319 CE2 TYR A 164 74.720 21.451 -13.644 1.00 25.00 C ATOM 1320 CZ TYR A 164 75.879 22.223 -13.538 1.00 25.00 C ATOM 1321 OH TYR A 164 75.863 23.538 -13.906 1.00 25.00 O ATOM 0 H TYR A 164 74.657 16.715 -14.026 1.00 25.00 H new ATOM 0 HA TYR A 164 77.452 17.555 -13.671 1.00 25.00 H new ATOM 0 HB2 TYR A 164 74.910 17.767 -12.036 1.00 25.00 H new ATOM 0 HB3 TYR A 164 76.477 18.036 -11.299 1.00 25.00 H new ATOM 0 HD1 TYR A 164 77.993 19.873 -12.268 1.00 25.00 H new ATOM 0 HD2 TYR A 164 73.840 19.498 -13.320 1.00 25.00 H new ATOM 0 HE1 TYR A 164 77.958 22.262 -12.988 1.00 25.00 H new ATOM 0 HE2 TYR A 164 73.813 21.887 -14.035 1.00 25.00 H new ATOM 0 HH TYR A 164 75.093 23.705 -14.488 1.00 25.00 H new ATOM 1331 N GLY A 165 76.248 14.739 -12.767 1.00 25.00 N ATOM 1332 CA GLY A 165 76.458 13.505 -12.029 1.00 25.00 C ATOM 1333 C GLY A 165 75.728 13.537 -10.698 1.00 25.00 C ATOM 1334 O GLY A 165 76.141 12.881 -9.735 1.00 25.00 O ATOM 0 H GLY A 165 75.545 14.682 -13.504 1.00 25.00 H new ATOM 0 HA2 GLY A 165 76.107 12.659 -12.620 1.00 25.00 H new ATOM 0 HA3 GLY A 165 77.524 13.355 -11.860 1.00 25.00 H new ATOM 1338 N LEU A 166 74.652 14.311 -10.625 1.00 25.00 N ATOM 1339 CA LEU A 166 73.884 14.415 -9.384 1.00 25.00 C ATOM 1340 C LEU A 166 73.037 13.167 -9.177 1.00 25.00 C ATOM 1341 O LEU A 166 71.868 13.120 -9.526 1.00 25.00 O ATOM 1342 CB LEU A 166 73.011 15.668 -9.400 1.00 25.00 C ATOM 1343 CG LEU A 166 73.757 16.888 -8.861 1.00 25.00 C ATOM 1344 CD1 LEU A 166 73.168 18.175 -9.376 1.00 25.00 C ATOM 1345 CD2 LEU A 166 73.708 16.871 -7.339 1.00 25.00 C ATOM 0 H LEU A 166 74.292 14.871 -11.398 1.00 25.00 H new ATOM 0 HA LEU A 166 74.580 14.496 -8.549 1.00 25.00 H new ATOM 0 HB2 LEU A 166 72.679 15.866 -10.419 1.00 25.00 H new ATOM 0 HB3 LEU A 166 72.117 15.495 -8.801 1.00 25.00 H new ATOM 0 HG LEU A 166 74.790 16.837 -9.206 1.00 25.00 H new ATOM 0 HD11 LEU A 166 73.726 19.019 -8.970 1.00 25.00 H new ATOM 0 HD12 LEU A 166 73.226 18.192 -10.464 1.00 25.00 H new ATOM 0 HD13 LEU A 166 72.125 18.247 -9.067 1.00 25.00 H new ATOM 0 HD21 LEU A 166 74.239 17.739 -6.948 1.00 25.00 H new ATOM 0 HD22 LEU A 166 72.670 16.901 -7.008 1.00 25.00 H new ATOM 0 HD23 LEU A 166 74.180 15.961 -6.970 1.00 25.00 H new ATOM 1357 N LYS A 167 73.683 12.141 -8.647 1.00 25.00 N ATOM 1358 CA LYS A 167 73.040 10.851 -8.373 1.00 25.00 C ATOM 1359 C LYS A 167 72.032 10.929 -7.235 1.00 25.00 C ATOM 1360 O LYS A 167 72.105 11.797 -6.363 1.00 25.00 O ATOM 1361 CB LYS A 167 74.091 9.825 -7.969 1.00 25.00 C ATOM 1362 CG LYS A 167 75.141 9.536 -9.043 1.00 25.00 C ATOM 1363 CD LYS A 167 76.360 8.851 -8.440 1.00 25.00 C ATOM 1364 CE LYS A 167 77.176 9.835 -7.581 1.00 25.00 C ATOM 1365 NZ LYS A 167 78.341 9.173 -6.932 1.00 25.00 N1+ ATOM 0 H LYS A 167 74.670 12.172 -8.392 1.00 25.00 H new ATOM 0 HA LYS A 167 72.523 10.566 -9.289 1.00 25.00 H new ATOM 0 HB2 LYS A 167 74.597 10.176 -7.070 1.00 25.00 H new ATOM 0 HB3 LYS A 167 73.589 8.893 -7.709 1.00 25.00 H new ATOM 0 HG2 LYS A 167 74.709 8.903 -9.818 1.00 25.00 H new ATOM 0 HG3 LYS A 167 75.442 10.467 -9.523 1.00 25.00 H new ATOM 0 HD2 LYS A 167 76.042 8.006 -7.829 1.00 25.00 H new ATOM 0 HD3 LYS A 167 76.988 8.450 -9.236 1.00 25.00 H new ATOM 0 HE2 LYS A 167 77.527 10.657 -8.205 1.00 25.00 H new ATOM 0 HE3 LYS A 167 76.532 10.269 -6.816 1.00 25.00 H new ATOM 0 HZ1 LYS A 167 78.864 9.869 -6.363 1.00 25.00 H new ATOM 0 HZ2 LYS A 167 78.005 8.405 -6.316 1.00 25.00 H new ATOM 0 HZ3 LYS A 167 78.969 8.781 -7.663 1.00 25.00 H new ATOM 1379 N ASP A 168 71.151 9.949 -7.201 1.00 25.00 N ATOM 1380 CA ASP A 168 70.195 9.814 -6.119 1.00 25.00 C ATOM 1381 C ASP A 168 70.926 9.711 -4.782 1.00 25.00 C ATOM 1382 O ASP A 168 71.865 8.937 -4.616 1.00 25.00 O ATOM 1383 CB ASP A 168 69.298 8.581 -6.332 1.00 25.00 C ATOM 1384 CG ASP A 168 70.092 7.282 -6.490 1.00 25.00 C ATOM 1385 OD1 ASP A 168 70.876 7.167 -7.468 1.00 25.00 O ATOM 1386 OD2 ASP A 168 69.839 6.339 -5.711 1.00 25.00 O1- ATOM 0 H ASP A 168 71.077 9.227 -7.918 1.00 25.00 H new ATOM 0 HA ASP A 168 69.560 10.700 -6.109 1.00 25.00 H new ATOM 0 HB2 ASP A 168 68.618 8.483 -5.486 1.00 25.00 H new ATOM 0 HB3 ASP A 168 68.684 8.735 -7.219 1.00 25.00 H new ATOM 1391 N GLY A 169 70.498 10.541 -3.844 1.00 25.00 N ATOM 1392 CA GLY A 169 71.075 10.556 -2.514 1.00 25.00 C ATOM 1393 C GLY A 169 72.185 11.570 -2.344 1.00 25.00 C ATOM 1394 O GLY A 169 72.622 11.806 -1.217 1.00 25.00 O ATOM 0 H GLY A 169 69.747 11.217 -3.983 1.00 25.00 H new ATOM 0 HA2 GLY A 169 70.289 10.766 -1.789 1.00 25.00 H new ATOM 0 HA3 GLY A 169 71.463 9.564 -2.285 1.00 25.00 H new ATOM 1398 N ASP A 170 72.652 12.180 -3.426 1.00 25.00 N ATOM 1399 CA ASP A 170 73.733 13.158 -3.304 1.00 25.00 C ATOM 1400 C ASP A 170 73.230 14.491 -2.727 1.00 25.00 C ATOM 1401 O ASP A 170 72.013 14.746 -2.672 1.00 25.00 O ATOM 1402 CB ASP A 170 74.432 13.356 -4.645 1.00 25.00 C ATOM 1403 CG ASP A 170 75.943 13.325 -4.508 1.00 25.00 C ATOM 1404 OD1 ASP A 170 76.468 14.024 -3.608 1.00 25.00 O ATOM 1405 OD2 ASP A 170 76.607 12.558 -5.251 1.00 25.00 O1- ATOM 0 H ASP A 170 72.313 12.023 -4.375 1.00 25.00 H new ATOM 0 HA ASP A 170 74.464 12.763 -2.598 1.00 25.00 H new ATOM 0 HB2 ASP A 170 74.115 12.577 -5.338 1.00 25.00 H new ATOM 0 HB3 ASP A 170 74.126 14.309 -5.076 1.00 25.00 H new ATOM 1410 N VAL A 171 74.157 15.307 -2.238 1.00 25.00 N ATOM 1411 CA VAL A 171 73.811 16.526 -1.492 1.00 25.00 C ATOM 1412 C VAL A 171 74.268 17.808 -2.192 1.00 25.00 C ATOM 1413 O VAL A 171 75.432 17.950 -2.576 1.00 25.00 O ATOM 1414 CB VAL A 171 74.435 16.492 -0.056 1.00 25.00 C ATOM 1415 CG1 VAL A 171 73.939 17.689 0.793 1.00 25.00 C ATOM 1416 CG2 VAL A 171 74.079 15.172 0.661 1.00 25.00 C ATOM 0 H VAL A 171 75.160 15.151 -2.342 1.00 25.00 H new ATOM 0 HA VAL A 171 72.723 16.541 -1.436 1.00 25.00 H new ATOM 0 HB VAL A 171 75.517 16.561 -0.165 1.00 25.00 H new ATOM 0 HG11 VAL A 171 74.387 17.642 1.785 1.00 25.00 H new ATOM 0 HG12 VAL A 171 74.227 18.622 0.309 1.00 25.00 H new ATOM 0 HG13 VAL A 171 72.854 17.646 0.883 1.00 25.00 H new ATOM 0 HG21 VAL A 171 74.522 15.168 1.657 1.00 25.00 H new ATOM 0 HG22 VAL A 171 72.996 15.084 0.745 1.00 25.00 H new ATOM 0 HG23 VAL A 171 74.468 14.330 0.088 1.00 25.00 H new ATOM 1426 N VAL A 172 73.353 18.759 -2.315 1.00 25.00 N ATOM 1427 CA VAL A 172 73.640 20.064 -2.901 1.00 25.00 C ATOM 1428 C VAL A 172 73.654 21.081 -1.765 1.00 25.00 C ATOM 1429 O VAL A 172 72.805 21.028 -0.884 1.00 25.00 O ATOM 1430 CB VAL A 172 72.546 20.446 -3.939 1.00 25.00 C ATOM 1431 CG1 VAL A 172 72.900 21.754 -4.638 1.00 25.00 C ATOM 1432 CG2 VAL A 172 72.387 19.332 -4.979 1.00 25.00 C ATOM 0 H VAL A 172 72.386 18.648 -2.010 1.00 25.00 H new ATOM 0 HA VAL A 172 74.600 20.044 -3.418 1.00 25.00 H new ATOM 0 HB VAL A 172 71.604 20.576 -3.407 1.00 25.00 H new ATOM 0 HG11 VAL A 172 72.122 22.003 -5.360 1.00 25.00 H new ATOM 0 HG12 VAL A 172 72.978 22.552 -3.899 1.00 25.00 H new ATOM 0 HG13 VAL A 172 73.853 21.644 -5.155 1.00 25.00 H new ATOM 0 HG21 VAL A 172 71.618 19.613 -5.699 1.00 25.00 H new ATOM 0 HG22 VAL A 172 73.333 19.182 -5.499 1.00 25.00 H new ATOM 0 HG23 VAL A 172 72.096 18.407 -4.480 1.00 25.00 H new ATOM 1442 N ILE A 173 74.610 21.996 -1.769 1.00 25.00 N ATOM 1443 CA ILE A 173 74.706 23.019 -0.727 1.00 25.00 C ATOM 1444 C ILE A 173 74.327 24.358 -1.348 1.00 25.00 C ATOM 1445 O ILE A 173 74.873 24.759 -2.368 1.00 25.00 O ATOM 1446 CB ILE A 173 76.139 23.092 -0.119 1.00 25.00 C ATOM 1447 CG1 ILE A 173 76.534 21.713 0.457 1.00 25.00 C ATOM 1448 CG2 ILE A 173 76.198 24.182 0.998 1.00 25.00 C ATOM 1449 CD1 ILE A 173 78.004 21.598 0.899 1.00 25.00 C ATOM 0 H ILE A 173 75.336 22.055 -2.483 1.00 25.00 H new ATOM 0 HA ILE A 173 74.029 22.766 0.089 1.00 25.00 H new ATOM 0 HB ILE A 173 76.844 23.363 -0.905 1.00 25.00 H new ATOM 0 HG12 ILE A 173 75.894 21.494 1.312 1.00 25.00 H new ATOM 0 HG13 ILE A 173 76.334 20.950 -0.295 1.00 25.00 H new ATOM 0 HG21 ILE A 173 77.205 24.222 1.414 1.00 25.00 H new ATOM 0 HG22 ILE A 173 75.942 25.153 0.573 1.00 25.00 H new ATOM 0 HG23 ILE A 173 75.489 23.933 1.787 1.00 25.00 H new ATOM 0 HD11 ILE A 173 78.189 20.597 1.289 1.00 25.00 H new ATOM 0 HD12 ILE A 173 78.656 21.781 0.045 1.00 25.00 H new ATOM 0 HD13 ILE A 173 78.209 22.334 1.676 1.00 25.00 H new ATOM 1461 N LEU A 174 73.381 25.043 -0.736 1.00 25.00 N ATOM 1462 CA LEU A 174 72.895 26.324 -1.226 1.00 25.00 C ATOM 1463 C LEU A 174 73.197 27.360 -0.151 1.00 25.00 C ATOM 1464 O LEU A 174 72.976 27.117 1.023 1.00 25.00 O ATOM 1465 CB LEU A 174 71.393 26.198 -1.518 1.00 25.00 C ATOM 1466 CG LEU A 174 70.691 27.333 -2.283 1.00 25.00 C ATOM 1467 CD1 LEU A 174 69.392 26.797 -2.876 1.00 25.00 C ATOM 1468 CD2 LEU A 174 70.375 28.522 -1.390 1.00 25.00 C ATOM 0 H LEU A 174 72.924 24.728 0.120 1.00 25.00 H new ATOM 0 HA LEU A 174 73.380 26.631 -2.153 1.00 25.00 H new ATOM 0 HB2 LEU A 174 71.242 25.277 -2.081 1.00 25.00 H new ATOM 0 HB3 LEU A 174 70.880 26.076 -0.564 1.00 25.00 H new ATOM 0 HG LEU A 174 71.368 27.678 -3.064 1.00 25.00 H new ATOM 0 HD11 LEU A 174 68.885 27.593 -3.421 1.00 25.00 H new ATOM 0 HD12 LEU A 174 69.615 25.976 -3.557 1.00 25.00 H new ATOM 0 HD13 LEU A 174 68.747 26.438 -2.074 1.00 25.00 H new ATOM 0 HD21 LEU A 174 69.880 29.296 -1.976 1.00 25.00 H new ATOM 0 HD22 LEU A 174 69.718 28.204 -0.580 1.00 25.00 H new ATOM 0 HD23 LEU A 174 71.300 28.919 -0.972 1.00 25.00 H new ATOM 1480 N ARG A 175 73.747 28.499 -0.541 1.00 25.00 N ATOM 1481 CA ARG A 175 74.105 29.553 0.410 1.00 25.00 C ATOM 1482 C ARG A 175 73.360 30.839 0.130 1.00 25.00 C ATOM 1483 O ARG A 175 73.346 31.334 -0.993 1.00 25.00 O ATOM 1484 CB ARG A 175 75.598 29.845 0.336 1.00 25.00 C ATOM 1485 CG ARG A 175 76.450 28.924 1.199 1.00 25.00 C ATOM 1486 CD ARG A 175 77.928 29.281 1.072 1.00 25.00 C ATOM 1487 NE ARG A 175 78.171 30.692 1.426 1.00 25.00 N ATOM 1488 CZ ARG A 175 79.336 31.323 1.325 1.00 25.00 C ATOM 1489 NH1 ARG A 175 80.425 30.721 0.914 1.00 25.00 N1+ ATOM 1490 NH2 ARG A 175 79.402 32.586 1.643 1.00 25.00 N ATOM 0 H ARG A 175 73.958 28.723 -1.513 1.00 25.00 H new ATOM 0 HA ARG A 175 73.832 29.191 1.401 1.00 25.00 H new ATOM 0 HB2 ARG A 175 75.924 29.760 -0.701 1.00 25.00 H new ATOM 0 HB3 ARG A 175 75.772 30.877 0.641 1.00 25.00 H new ATOM 0 HG2 ARG A 175 76.140 29.004 2.241 1.00 25.00 H new ATOM 0 HG3 ARG A 175 76.294 27.888 0.898 1.00 25.00 H new ATOM 0 HD2 ARG A 175 78.518 28.634 1.722 1.00 25.00 H new ATOM 0 HD3 ARG A 175 78.262 29.097 0.051 1.00 25.00 H new ATOM 0 HE ARG A 175 77.378 31.229 1.778 1.00 25.00 H new ATOM 0 HH11 ARG A 175 80.397 29.734 0.658 1.00 25.00 H new ATOM 0 HH12 ARG A 175 81.301 31.239 0.850 1.00 25.00 H new ATOM 0 HH21 ARG A 175 78.567 33.075 1.964 1.00 25.00 H new ATOM 0 HH22 ARG A 175 80.289 33.084 1.571 1.00 25.00 H new ATOM 1504 N GLN A 176 72.803 31.408 1.198 1.00 25.00 N ATOM 1505 CA GLN A 176 72.153 32.723 1.178 1.00 25.00 C ATOM 1506 C GLN A 176 72.554 33.494 2.462 1.00 25.00 C ATOM 1507 O GLN A 176 73.702 33.826 2.683 1.00 25.00 O ATOM 1508 CB GLN A 176 70.632 32.550 0.905 1.00 25.00 C ATOM 1509 CG GLN A 176 69.980 33.797 0.245 1.00 25.00 C ATOM 1510 CD GLN A 176 69.450 34.784 1.248 1.00 25.00 C ATOM 1511 OE1 GLN A 176 69.356 34.541 2.430 1.00 25.00 O ATOM 1512 NE2 GLN A 176 69.104 35.969 0.772 1.00 25.00 N ATOM 1513 OXT GLN A 176 71.719 33.595 3.318 1.00 25.00 O ATOM 0 H GLN A 176 72.789 30.964 2.116 1.00 25.00 H new ATOM 0 HA GLN A 176 72.494 33.353 0.356 1.00 25.00 H new ATOM 0 HB2 GLN A 176 70.482 31.685 0.259 1.00 25.00 H new ATOM 0 HB3 GLN A 176 70.123 32.337 1.845 1.00 25.00 H new ATOM 0 HG2 GLN A 176 70.716 34.292 -0.389 1.00 25.00 H new ATOM 0 HG3 GLN A 176 69.166 33.474 -0.404 1.00 25.00 H new ATOM 0 HE21 GLN A 176 69.188 36.162 -0.226 1.00 25.00 H new ATOM 0 HE22 GLN A 176 68.754 36.690 1.403 1.00 25.00 H new TER 1523 GLN A 176