USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1198 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 117 ASN : amide:sc= -1.67 K(o=-4,f=-5.7!) USER MOD Set 1.2: A 134 GLN : amide:sc= -2.31 K(o=-4,f=-6.3!) USER MOD Set 2.1: A 47 HIS : no HD1:sc= -6.56 K(o=-8,f=-8.6!) USER MOD Set 2.2: A 78 ASN : amide:sc= -1.42! C(o=-8!,f=-12!) USER MOD Set 3.1: A 73 ASN :FLIP amide:sc= -4.26 F(o=-14!,f=-9.8) USER MOD Set 3.2: A 140 GLN :FLIP amide:sc= -5.52! F(o=-11,f=-9.8!) USER MOD Set 4.1: A 24 HIS :FLIP no HD1:sc= -3.54! C(o=-13!,f=-12!) USER MOD Set 4.2: A 71 SER OG : rot 70:sc= -1.57 USER MOD Set 4.3: A 136 MET CE :methyl -168:sc= -6.49! (180deg=-6.85!) USER MOD Set 5.1: A 12 HIS :FLIP no HD1:sc= -0.485 X(o=-0.97,f=-0.53) USER MOD Set 5.2: A 13 ASN :FLIP amide:sc= -0.0422 F(o=-1.9,f=-0.53) USER MOD Set 6.1: A 3 HIS :FLIP no HD1:sc= -0.233 F(o=-4.9,f=-4) USER MOD Set 6.2: A 6 HIS : no HD1:sc= -3.81 K(o=-4,f=-5.1) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 HIS : no HD1:sc= -0.445 K(o=-0.45,f=-1.7) USER MOD Single : A 4 HIS : no HD1:sc= -0.0983 X(o=-0.098,f=-0.24) USER MOD Single : A 5 HIS : no HD1:sc= -2.86! C(o=-2.9!,f=-2.9!) USER MOD Single : A 7 HIS : no HD1:sc= -1.53 X(o=-1.5,f=-1.5) USER MOD Single : A 8 MET CE :methyl -145:sc= -0.467 (180deg=-1.81!) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 HIS :FLIP no HE2:sc= -0.338 F(o=-1.7,f=-0.34) USER MOD Single : A 27 THR OG1 : rot 71:sc= 0.664 USER MOD Single : A 32 LYS NZ :NH3+ -157:sc= 0 (180deg=-0.26) USER MOD Single : A 33 LYS NZ :NH3+ 153:sc= -0.489 (180deg=-1.52!) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 43 MET CE :methyl -128:sc= -6.65! (180deg=-15.8!) USER MOD Single : A 48 LYS NZ :NH3+ 178:sc= -1.3 (180deg=-1.44) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ -165:sc=-0.000685 (180deg=-0.0955) USER MOD Single : A 60 LYS NZ :NH3+ 139:sc= -2.08 (180deg=-4.52!) USER MOD Single : A 64 SER OG : rot 170:sc= 0.809 USER MOD Single : A 65 THR OG1 : rot 51:sc= 0.373 USER MOD Single : A 68 SER OG : rot -68:sc= 1.2 USER MOD Single : A 72 HIS : no HD1:sc= -2.27! C(o=-2.3!,f=-1.9!) USER MOD Single : A 76 MET CE :methyl -161:sc= -0.0887 (180deg=-0.313) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot -56:sc= -0.154 USER MOD Single : A 96 TYR OH : rot -33:sc= -1.47! USER MOD Single : A 106 SER OG : rot -97:sc= -0.255 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 HIS : no HD1:sc= -0.114 X(o=-0.11,f=-0.39) USER MOD Single : A 115 ASN : amide:sc= -4.84! C(o=-4.8!,f=-5.4!) USER MOD Single : A 119 ASN : amide:sc= -1.99 K(o=-2,f=-3.8!) USER MOD Single : A 121 SER OG : rot 63:sc= 1.21 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ -137:sc= -0.923 (180deg=-3.55!) USER MOD Single : A 124 TYR OH : rot 15:sc= -2.07 USER MOD Single : A 126 TYR OH : rot 68:sc= 0.0466 USER MOD Single : A 128 SER OG : rot 180:sc= 0.146 USER MOD Single : A 131 GLN : amide:sc= -4.18 X(o=-4.2,f=-4.4!) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 THR OG1 : rot -160:sc= 1.07 USER MOD Single : A 150 LYS NZ :NH3+ 175:sc= -1.03 (180deg=-1.24) USER MOD Single : A 151 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000401) USER MOD Single : A 152 HIS :FLIP no HE2:sc= -0.781 F(o=-2.2,f=-0.78) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -44.582 3.776 7.721 1.00 0.00 N ATOM 2 CA MET A 1 -44.625 5.258 7.826 1.00 0.00 C ATOM 3 C MET A 1 -43.225 5.857 7.736 1.00 0.00 C ATOM 4 O MET A 1 -42.398 5.664 8.627 1.00 0.00 O ATOM 5 CB MET A 1 -45.276 5.633 9.159 1.00 0.00 C ATOM 6 CG MET A 1 -46.198 6.836 9.067 1.00 0.00 C ATOM 7 SD MET A 1 -46.969 7.242 10.646 1.00 0.00 S ATOM 8 CE MET A 1 -47.027 9.029 10.546 1.00 0.00 C ATOM 0 H1 MET A 1 -45.548 3.395 7.785 1.00 0.00 H new ATOM 0 H2 MET A 1 -44.163 3.505 6.809 1.00 0.00 H new ATOM 0 H3 MET A 1 -44.005 3.390 8.495 1.00 0.00 H new ATOM 0 HA MET A 1 -45.208 5.660 6.997 1.00 0.00 H new ATOM 0 HB2 MET A 1 -45.842 4.779 9.530 1.00 0.00 H new ATOM 0 HB3 MET A 1 -44.495 5.840 9.890 1.00 0.00 H new ATOM 0 HG2 MET A 1 -45.632 7.697 8.712 1.00 0.00 H new ATOM 0 HG3 MET A 1 -46.974 6.638 8.328 1.00 0.00 H new ATOM 0 HE1 MET A 1 -47.480 9.430 11.453 1.00 0.00 H new ATOM 0 HE2 MET A 1 -46.015 9.421 10.442 1.00 0.00 H new ATOM 0 HE3 MET A 1 -47.622 9.326 9.682 1.00 0.00 H new ATOM 20 N HIS A 2 -42.967 6.584 6.654 1.00 0.00 N ATOM 21 CA HIS A 2 -41.667 7.213 6.446 1.00 0.00 C ATOM 22 C HIS A 2 -41.798 8.732 6.399 1.00 0.00 C ATOM 23 O HIS A 2 -42.904 9.267 6.328 1.00 0.00 O ATOM 24 CB HIS A 2 -41.030 6.703 5.152 1.00 0.00 C ATOM 25 CG HIS A 2 -41.933 6.806 3.961 1.00 0.00 C ATOM 26 ND1 HIS A 2 -42.478 7.997 3.530 1.00 0.00 N ATOM 27 CD2 HIS A 2 -42.385 5.857 3.106 1.00 0.00 C ATOM 28 CE1 HIS A 2 -43.227 7.776 2.464 1.00 0.00 C ATOM 29 NE2 HIS A 2 -43.187 6.486 2.186 1.00 0.00 N ATOM 0 H HIS A 2 -43.641 6.752 5.907 1.00 0.00 H new ATOM 0 HA HIS A 2 -41.025 6.948 7.286 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -40.119 7.269 4.957 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -40.736 5.662 5.287 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -42.157 4.802 3.142 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -43.778 8.524 1.914 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -43.673 6.031 1.413 1.00 0.00 H new ATOM 38 N HIS A 3 -40.661 9.420 6.436 1.00 0.00 N ATOM 39 CA HIS A 3 -40.649 10.877 6.397 1.00 0.00 C ATOM 40 C HIS A 3 -40.024 11.381 5.100 1.00 0.00 C ATOM 41 O HIS A 3 -38.823 11.231 4.879 1.00 0.00 O ATOM 42 CB HIS A 3 -39.882 11.433 7.597 1.00 0.00 C ATOM 43 CG HIS A 3 -38.539 10.801 7.796 1.00 0.00 C ATOM 44 ND1 HIS A 3 -38.196 9.584 8.279 1.00 0.00 N flip ATOM 45 CD2 HIS A 3 -37.354 11.434 7.482 1.00 0.00 C flip ATOM 46 CE1 HIS A 3 -36.825 9.506 8.250 1.00 0.00 C flip ATOM 47 NE2 HIS A 3 -36.342 10.633 7.764 1.00 0.00 N flip ATOM 0 H HIS A 3 -39.737 8.992 6.493 1.00 0.00 H new ATOM 0 HA HIS A 3 -41.681 11.226 6.441 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -39.753 12.508 7.469 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -40.479 11.289 8.498 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -37.267 12.429 7.070 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -36.238 8.659 8.573 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -35.354 10.849 7.629 1.00 0.00 H new ATOM 56 N HIS A 4 -40.848 11.981 4.247 1.00 0.00 N ATOM 57 CA HIS A 4 -40.377 12.510 2.971 1.00 0.00 C ATOM 58 C HIS A 4 -39.816 11.397 2.090 1.00 0.00 C ATOM 59 O HIS A 4 -38.965 11.642 1.235 1.00 0.00 O ATOM 60 CB HIS A 4 -39.309 13.580 3.201 1.00 0.00 C ATOM 61 CG HIS A 4 -39.870 14.957 3.379 1.00 0.00 C ATOM 62 ND1 HIS A 4 -40.805 15.504 2.525 1.00 0.00 N ATOM 63 CD2 HIS A 4 -39.624 15.900 4.319 1.00 0.00 C ATOM 64 CE1 HIS A 4 -41.108 16.723 2.933 1.00 0.00 C ATOM 65 NE2 HIS A 4 -40.406 16.987 4.019 1.00 0.00 N ATOM 0 H HIS A 4 -41.845 12.113 4.416 1.00 0.00 H new ATOM 0 HA HIS A 4 -41.228 12.959 2.459 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -38.727 13.317 4.084 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -38.621 13.583 2.355 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -38.940 15.813 5.150 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -41.811 17.391 2.458 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -40.439 17.858 4.549 1.00 0.00 H new ATOM 74 N HIS A 5 -40.300 10.172 2.307 1.00 0.00 N ATOM 75 CA HIS A 5 -39.857 9.006 1.536 1.00 0.00 C ATOM 76 C HIS A 5 -38.338 9.003 1.338 1.00 0.00 C ATOM 77 O HIS A 5 -37.602 8.467 2.165 1.00 0.00 O ATOM 78 CB HIS A 5 -40.576 8.937 0.181 1.00 0.00 C ATOM 79 CG HIS A 5 -40.998 10.268 -0.361 1.00 0.00 C ATOM 80 ND1 HIS A 5 -40.399 10.864 -1.451 1.00 0.00 N ATOM 81 CD2 HIS A 5 -41.974 11.120 0.040 1.00 0.00 C ATOM 82 CE1 HIS A 5 -40.983 12.024 -1.695 1.00 0.00 C ATOM 83 NE2 HIS A 5 -41.941 12.201 -0.805 1.00 0.00 N ATOM 0 H HIS A 5 -41.003 9.960 3.015 1.00 0.00 H new ATOM 0 HA HIS A 5 -40.119 8.119 2.112 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -39.918 8.455 -0.542 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -41.457 8.303 0.282 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -42.651 10.975 0.869 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -40.721 12.710 -2.487 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -42.558 13.011 -0.753 1.00 0.00 H new ATOM 92 N HIS A 6 -37.874 9.601 0.239 1.00 0.00 N ATOM 93 CA HIS A 6 -36.445 9.666 -0.067 1.00 0.00 C ATOM 94 C HIS A 6 -35.773 8.308 0.127 1.00 0.00 C ATOM 95 O HIS A 6 -36.443 7.294 0.325 1.00 0.00 O ATOM 96 CB HIS A 6 -35.762 10.724 0.805 1.00 0.00 C ATOM 97 CG HIS A 6 -35.698 10.367 2.257 1.00 0.00 C ATOM 98 ND1 HIS A 6 -34.771 9.488 2.778 1.00 0.00 N ATOM 99 CD2 HIS A 6 -36.455 10.774 3.305 1.00 0.00 C ATOM 100 CE1 HIS A 6 -34.959 9.371 4.080 1.00 0.00 C ATOM 101 NE2 HIS A 6 -35.975 10.141 4.425 1.00 0.00 N ATOM 0 H HIS A 6 -38.471 10.049 -0.456 1.00 0.00 H new ATOM 0 HA HIS A 6 -36.340 9.947 -1.115 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -34.749 10.885 0.436 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -36.295 11.669 0.697 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -37.282 11.467 3.266 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -34.380 8.751 4.749 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -36.343 10.248 5.370 1.00 0.00 H new ATOM 110 N HIS A 7 -34.445 8.296 0.067 1.00 0.00 N ATOM 111 CA HIS A 7 -33.683 7.064 0.236 1.00 0.00 C ATOM 112 C HIS A 7 -32.235 7.366 0.606 1.00 0.00 C ATOM 113 O HIS A 7 -31.797 8.516 0.555 1.00 0.00 O ATOM 114 CB HIS A 7 -33.730 6.231 -1.047 1.00 0.00 C ATOM 115 CG HIS A 7 -35.039 5.537 -1.261 1.00 0.00 C ATOM 116 ND1 HIS A 7 -35.496 4.523 -0.446 1.00 0.00 N ATOM 117 CD2 HIS A 7 -35.992 5.716 -2.207 1.00 0.00 C ATOM 118 CE1 HIS A 7 -36.673 4.107 -0.881 1.00 0.00 C ATOM 119 NE2 HIS A 7 -36.996 4.816 -1.946 1.00 0.00 N ATOM 0 H HIS A 7 -33.875 9.125 -0.097 1.00 0.00 H new ATOM 0 HA HIS A 7 -34.136 6.495 1.048 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -33.528 6.880 -1.899 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -32.934 5.487 -1.017 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -35.967 6.432 -3.015 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -37.268 3.321 -0.440 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -37.854 4.712 -2.488 1.00 0.00 H new ATOM 128 N MET A 8 -31.496 6.327 0.981 1.00 0.00 N ATOM 129 CA MET A 8 -30.097 6.482 1.361 1.00 0.00 C ATOM 130 C MET A 8 -29.318 5.194 1.103 1.00 0.00 C ATOM 131 O MET A 8 -29.861 4.096 1.215 1.00 0.00 O ATOM 132 CB MET A 8 -29.988 6.870 2.836 1.00 0.00 C ATOM 133 CG MET A 8 -28.674 7.550 3.189 1.00 0.00 C ATOM 134 SD MET A 8 -28.868 9.312 3.526 1.00 0.00 S ATOM 135 CE MET A 8 -29.252 9.929 1.889 1.00 0.00 C ATOM 0 H MET A 8 -31.843 5.369 1.030 1.00 0.00 H new ATOM 0 HA MET A 8 -29.666 7.276 0.751 1.00 0.00 H new ATOM 0 HB2 MET A 8 -30.812 7.536 3.090 1.00 0.00 H new ATOM 0 HB3 MET A 8 -30.101 5.975 3.448 1.00 0.00 H new ATOM 0 HG2 MET A 8 -28.241 7.063 4.063 1.00 0.00 H new ATOM 0 HG3 MET A 8 -27.969 7.417 2.368 1.00 0.00 H new ATOM 0 HE1 MET A 8 -28.813 10.919 1.761 1.00 0.00 H new ATOM 0 HE2 MET A 8 -28.843 9.251 1.140 1.00 0.00 H new ATOM 0 HE3 MET A 8 -30.333 9.993 1.769 1.00 0.00 H new ATOM 145 N SER A 9 -28.043 5.341 0.758 1.00 0.00 N ATOM 146 CA SER A 9 -27.188 4.191 0.484 1.00 0.00 C ATOM 147 C SER A 9 -26.052 4.105 1.497 1.00 0.00 C ATOM 148 O SER A 9 -25.779 5.063 2.222 1.00 0.00 O ATOM 149 CB SER A 9 -26.618 4.278 -0.933 1.00 0.00 C ATOM 150 OG SER A 9 -27.447 3.596 -1.858 1.00 0.00 O ATOM 0 H SER A 9 -27.579 6.244 0.661 1.00 0.00 H new ATOM 0 HA SER A 9 -27.795 3.290 0.569 1.00 0.00 H new ATOM 0 HB2 SER A 9 -26.523 5.323 -1.227 1.00 0.00 H new ATOM 0 HB3 SER A 9 -25.616 3.849 -0.953 1.00 0.00 H new ATOM 0 HG SER A 9 -27.062 3.667 -2.757 1.00 0.00 H new ATOM 156 N ASP A 10 -25.391 2.953 1.542 1.00 0.00 N ATOM 157 CA ASP A 10 -24.283 2.742 2.465 1.00 0.00 C ATOM 158 C ASP A 10 -22.943 2.895 1.753 1.00 0.00 C ATOM 159 O ASP A 10 -21.966 2.228 2.096 1.00 0.00 O ATOM 160 CB ASP A 10 -24.381 1.353 3.102 1.00 0.00 C ATOM 161 CG ASP A 10 -24.032 1.369 4.577 1.00 0.00 C ATOM 162 OD1 ASP A 10 -24.885 1.794 5.385 1.00 0.00 O ATOM 163 OD2 ASP A 10 -22.906 0.954 4.925 1.00 0.00 O ATOM 0 H ASP A 10 -25.604 2.151 0.949 1.00 0.00 H new ATOM 0 HA ASP A 10 -24.345 3.499 3.247 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -25.393 0.968 2.975 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -23.712 0.669 2.580 1.00 0.00 H new ATOM 168 N GLY A 11 -22.904 3.778 0.760 1.00 0.00 N ATOM 169 CA GLY A 11 -21.678 4.003 0.016 1.00 0.00 C ATOM 170 C GLY A 11 -21.677 3.296 -1.325 1.00 0.00 C ATOM 171 O GLY A 11 -22.407 2.325 -1.523 1.00 0.00 O ATOM 0 H GLY A 11 -23.699 4.341 0.457 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -21.543 5.073 -0.141 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -20.829 3.657 0.606 1.00 0.00 H new ATOM 175 N HIS A 12 -20.855 3.783 -2.249 1.00 0.00 N ATOM 176 CA HIS A 12 -20.762 3.192 -3.578 1.00 0.00 C ATOM 177 C HIS A 12 -19.565 3.749 -4.342 1.00 0.00 C ATOM 178 O HIS A 12 -18.775 2.997 -4.914 1.00 0.00 O ATOM 179 CB HIS A 12 -22.049 3.448 -4.365 1.00 0.00 C ATOM 180 CG HIS A 12 -22.448 4.891 -4.409 1.00 0.00 C ATOM 181 ND1 HIS A 12 -22.847 5.729 -3.422 1.00 0.00 N flip ATOM 182 CD2 HIS A 12 -22.466 5.633 -5.571 1.00 0.00 C flip ATOM 183 CE1 HIS A 12 -23.097 6.949 -4.003 1.00 0.00 C flip ATOM 184 NE2 HIS A 12 -22.859 6.865 -5.299 1.00 0.00 N flip ATOM 0 H HIS A 12 -20.244 4.586 -2.101 1.00 0.00 H new ATOM 0 HA HIS A 12 -20.624 2.117 -3.460 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -21.920 3.084 -5.384 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -22.858 2.869 -3.920 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -22.200 5.265 -6.551 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -23.434 7.834 -3.483 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -22.961 7.622 -5.975 1.00 0.00 H new ATOM 193 N ASN A 13 -19.437 5.072 -4.350 1.00 0.00 N ATOM 194 CA ASN A 13 -18.337 5.731 -5.045 1.00 0.00 C ATOM 195 C ASN A 13 -17.059 5.676 -4.214 1.00 0.00 C ATOM 196 O ASN A 13 -17.098 5.404 -3.014 1.00 0.00 O ATOM 197 CB ASN A 13 -18.697 7.185 -5.353 1.00 0.00 C ATOM 198 CG ASN A 13 -18.900 8.013 -4.097 1.00 0.00 C ATOM 199 OD1 ASN A 13 -20.119 8.003 -3.572 1.00 0.00 O flip ATOM 200 ND2 ASN A 13 -17.970 8.652 -3.606 1.00 0.00 N flip ATOM 0 H ASN A 13 -20.082 5.709 -3.883 1.00 0.00 H new ATOM 0 HA ASN A 13 -18.164 5.202 -5.982 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -17.906 7.632 -5.955 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -19.607 7.211 -5.952 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -17.049 8.630 -4.044 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -18.120 9.203 -2.761 1.00 0.00 H new ATOM 207 N GLY A 14 -15.927 5.939 -4.860 1.00 0.00 N ATOM 208 CA GLY A 14 -14.654 5.916 -4.162 1.00 0.00 C ATOM 209 C GLY A 14 -13.552 5.267 -4.978 1.00 0.00 C ATOM 210 O GLY A 14 -13.110 5.820 -5.984 1.00 0.00 O ATOM 0 H GLY A 14 -15.868 6.167 -5.852 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -14.363 6.936 -3.912 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -14.769 5.378 -3.221 1.00 0.00 H new ATOM 214 N LEU A 15 -13.107 4.095 -4.537 1.00 0.00 N ATOM 215 CA LEU A 15 -12.051 3.370 -5.220 1.00 0.00 C ATOM 216 C LEU A 15 -10.760 4.195 -5.210 1.00 0.00 C ATOM 217 O LEU A 15 -10.318 4.641 -4.151 1.00 0.00 O ATOM 218 CB LEU A 15 -12.488 3.016 -6.649 1.00 0.00 C ATOM 219 CG LEU A 15 -13.604 1.971 -6.754 1.00 0.00 C ATOM 220 CD1 LEU A 15 -13.086 0.596 -6.360 1.00 0.00 C ATOM 221 CD2 LEU A 15 -14.793 2.361 -5.888 1.00 0.00 C ATOM 0 H LEU A 15 -13.466 3.628 -3.704 1.00 0.00 H new ATOM 0 HA LEU A 15 -11.855 2.435 -4.695 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -12.819 3.928 -7.146 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -11.619 2.652 -7.197 1.00 0.00 H new ATOM 0 HG LEU A 15 -13.937 1.931 -7.791 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -13.892 -0.133 -6.441 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -12.270 0.310 -7.024 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -12.724 0.624 -5.332 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -15.573 1.605 -5.978 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -14.477 2.434 -4.847 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -15.182 3.324 -6.217 1.00 0.00 H new ATOM 233 N GLY A 16 -10.159 4.403 -6.376 1.00 0.00 N ATOM 234 CA GLY A 16 -8.933 5.179 -6.449 1.00 0.00 C ATOM 235 C GLY A 16 -9.138 6.500 -7.163 1.00 0.00 C ATOM 236 O GLY A 16 -8.877 6.608 -8.360 1.00 0.00 O ATOM 0 H GLY A 16 -10.497 4.049 -7.271 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -8.562 5.366 -5.441 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -8.169 4.601 -6.968 1.00 0.00 H new ATOM 240 N LYS A 17 -9.613 7.505 -6.428 1.00 0.00 N ATOM 241 CA LYS A 17 -9.863 8.829 -6.998 1.00 0.00 C ATOM 242 C LYS A 17 -8.710 9.267 -7.899 1.00 0.00 C ATOM 243 O LYS A 17 -7.698 9.779 -7.421 1.00 0.00 O ATOM 244 CB LYS A 17 -10.069 9.856 -5.883 1.00 0.00 C ATOM 245 CG LYS A 17 -11.114 10.908 -6.210 1.00 0.00 C ATOM 246 CD LYS A 17 -10.751 11.683 -7.467 1.00 0.00 C ATOM 247 CE LYS A 17 -11.051 13.166 -7.312 1.00 0.00 C ATOM 248 NZ LYS A 17 -10.113 14.007 -8.105 1.00 0.00 N ATOM 0 H LYS A 17 -9.833 7.427 -5.435 1.00 0.00 H new ATOM 0 HA LYS A 17 -10.768 8.768 -7.603 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -10.362 9.336 -4.971 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -9.120 10.351 -5.676 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -12.084 10.429 -6.344 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -11.212 11.598 -5.372 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -9.692 11.546 -7.688 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -11.308 11.285 -8.315 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -12.074 13.365 -7.630 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -10.985 13.442 -6.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -10.350 15.011 -7.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -9.138 13.837 -7.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -10.194 13.762 -9.112 1.00 0.00 H new ATOM 262 N GLY A 18 -8.869 9.050 -9.199 1.00 0.00 N ATOM 263 CA GLY A 18 -7.834 9.414 -10.138 1.00 0.00 C ATOM 264 C GLY A 18 -6.706 8.411 -10.140 1.00 0.00 C ATOM 265 O GLY A 18 -6.877 7.275 -9.703 1.00 0.00 O ATOM 0 H GLY A 18 -9.698 8.628 -9.617 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.259 9.486 -11.139 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -7.444 10.400 -9.886 1.00 0.00 H new ATOM 269 N PHE A 19 -5.553 8.837 -10.633 1.00 0.00 N ATOM 270 CA PHE A 19 -4.365 7.986 -10.696 1.00 0.00 C ATOM 271 C PHE A 19 -4.692 6.565 -11.163 1.00 0.00 C ATOM 272 O PHE A 19 -3.965 5.622 -10.848 1.00 0.00 O ATOM 273 CB PHE A 19 -3.679 7.935 -9.329 1.00 0.00 C ATOM 274 CG PHE A 19 -4.594 7.550 -8.209 1.00 0.00 C ATOM 275 CD1 PHE A 19 -5.064 6.253 -8.100 1.00 0.00 C ATOM 276 CD2 PHE A 19 -4.979 8.482 -7.259 1.00 0.00 C ATOM 277 CE1 PHE A 19 -5.902 5.893 -7.063 1.00 0.00 C ATOM 278 CE2 PHE A 19 -5.819 8.129 -6.221 1.00 0.00 C ATOM 279 CZ PHE A 19 -6.281 6.831 -6.122 1.00 0.00 C ATOM 0 H PHE A 19 -5.410 9.778 -11.000 1.00 0.00 H new ATOM 0 HA PHE A 19 -3.693 8.428 -11.431 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.854 7.224 -9.373 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -3.246 8.912 -9.113 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -4.773 5.515 -8.833 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -4.618 9.497 -7.331 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -6.261 4.877 -6.988 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -6.114 8.866 -5.489 1.00 0.00 H new ATOM 0 HZ PHE A 19 -6.937 6.550 -5.311 1.00 0.00 H new ATOM 289 N GLY A 20 -5.776 6.414 -11.918 1.00 0.00 N ATOM 290 CA GLY A 20 -6.156 5.100 -12.407 1.00 0.00 C ATOM 291 C GLY A 20 -7.661 4.894 -12.420 1.00 0.00 C ATOM 292 O GLY A 20 -8.373 5.532 -13.193 1.00 0.00 O ATOM 0 H GLY A 20 -6.396 7.174 -12.199 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -5.766 4.965 -13.416 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -5.694 4.336 -11.782 1.00 0.00 H new ATOM 296 N ASP A 21 -8.145 3.996 -11.563 1.00 0.00 N ATOM 297 CA ASP A 21 -9.577 3.707 -11.482 1.00 0.00 C ATOM 298 C ASP A 21 -9.895 2.818 -10.278 1.00 0.00 C ATOM 299 O ASP A 21 -10.301 3.309 -9.224 1.00 0.00 O ATOM 300 CB ASP A 21 -10.068 3.040 -12.774 1.00 0.00 C ATOM 301 CG ASP A 21 -8.982 2.246 -13.477 1.00 0.00 C ATOM 302 OD1 ASP A 21 -8.739 1.089 -13.074 1.00 0.00 O ATOM 303 OD2 ASP A 21 -8.376 2.782 -14.429 1.00 0.00 O ATOM 0 H ASP A 21 -7.569 3.457 -10.916 1.00 0.00 H new ATOM 0 HA ASP A 21 -10.100 4.655 -11.354 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -10.902 2.378 -12.541 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -10.448 3.805 -13.451 1.00 0.00 H new ATOM 308 N HIS A 22 -9.710 1.508 -10.438 1.00 0.00 N ATOM 309 CA HIS A 22 -9.979 0.554 -9.365 1.00 0.00 C ATOM 310 C HIS A 22 -8.900 -0.522 -9.321 1.00 0.00 C ATOM 311 O HIS A 22 -8.526 -1.065 -10.359 1.00 0.00 O ATOM 312 CB HIS A 22 -11.348 -0.098 -9.565 1.00 0.00 C ATOM 313 CG HIS A 22 -11.526 -0.716 -10.920 1.00 0.00 C ATOM 314 ND1 HIS A 22 -10.903 -1.769 -11.506 1.00 0.00 N flip ATOM 315 CD2 HIS A 22 -12.437 -0.251 -11.844 1.00 0.00 C flip ATOM 316 CE1 HIS A 22 -11.447 -1.916 -12.758 1.00 0.00 C flip ATOM 317 NE2 HIS A 22 -12.370 -0.989 -12.939 1.00 0.00 N flip ATOM 0 H HIS A 22 -9.374 1.083 -11.303 1.00 0.00 H new ATOM 0 HA HIS A 22 -9.975 1.096 -8.419 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -11.491 -0.865 -8.804 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -12.124 0.652 -9.412 1.00 0.00 H new ATOM 0 HD1 HIS A 22 -10.168 -2.344 -11.094 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -13.103 0.587 -11.696 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -11.165 -2.669 -13.479 1.00 0.00 H new ATOM 326 N ILE A 23 -8.400 -0.829 -8.120 1.00 0.00 N ATOM 327 CA ILE A 23 -7.357 -1.845 -7.960 1.00 0.00 C ATOM 328 C ILE A 23 -6.721 -1.777 -6.560 1.00 0.00 C ATOM 329 O ILE A 23 -7.143 -2.490 -5.631 1.00 0.00 O ATOM 330 CB ILE A 23 -6.276 -1.698 -9.072 1.00 0.00 C ATOM 331 CG1 ILE A 23 -5.032 -2.541 -8.782 1.00 0.00 C ATOM 332 CG2 ILE A 23 -5.900 -0.240 -9.280 1.00 0.00 C ATOM 333 CD1 ILE A 23 -3.961 -2.406 -9.849 1.00 0.00 C ATOM 0 H ILE A 23 -8.699 -0.391 -7.249 1.00 0.00 H new ATOM 0 HA ILE A 23 -7.822 -2.825 -8.062 1.00 0.00 H new ATOM 0 HB ILE A 23 -6.717 -2.076 -9.994 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -4.616 -2.246 -7.819 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -5.322 -3.588 -8.696 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -5.144 -0.167 -10.062 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -6.784 0.325 -9.576 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -5.502 0.169 -8.351 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -3.105 -3.027 -9.586 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -4.362 -2.728 -10.810 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -3.646 -1.365 -9.918 1.00 0.00 H new ATOM 345 N HIS A 24 -5.718 -0.916 -6.400 1.00 0.00 N ATOM 346 CA HIS A 24 -5.043 -0.755 -5.123 1.00 0.00 C ATOM 347 C HIS A 24 -5.784 0.253 -4.243 1.00 0.00 C ATOM 348 O HIS A 24 -5.166 1.027 -3.512 1.00 0.00 O ATOM 349 CB HIS A 24 -3.599 -0.305 -5.344 1.00 0.00 C ATOM 350 CG HIS A 24 -2.791 -1.273 -6.149 1.00 0.00 C ATOM 351 ND1 HIS A 24 -2.805 -2.626 -6.183 1.00 0.00 N flip ATOM 352 CD2 HIS A 24 -1.825 -0.879 -7.051 1.00 0.00 C flip ATOM 353 CE1 HIS A 24 -1.857 -3.020 -7.095 1.00 0.00 C flip ATOM 354 NE2 HIS A 24 -1.281 -1.947 -7.605 1.00 0.00 N flip ATOM 0 H HIS A 24 -5.357 -0.319 -7.144 1.00 0.00 H new ATOM 0 HA HIS A 24 -5.038 -1.717 -4.611 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -3.601 0.662 -5.847 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -3.119 -0.160 -4.376 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -1.555 0.144 -7.270 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -1.621 -4.042 -7.353 1.00 0.00 H new ATOM 0 HE2 HIS A 24 -0.542 -1.944 -8.308 1.00 0.00 H new ATOM 363 N TRP A 25 -7.113 0.231 -4.325 1.00 0.00 N ATOM 364 CA TRP A 25 -7.948 1.143 -3.544 1.00 0.00 C ATOM 365 C TRP A 25 -9.353 0.597 -3.336 1.00 0.00 C ATOM 366 O TRP A 25 -10.093 1.114 -2.499 1.00 0.00 O ATOM 367 CB TRP A 25 -8.049 2.497 -4.231 1.00 0.00 C ATOM 368 CG TRP A 25 -7.656 2.450 -5.663 1.00 0.00 C ATOM 369 CD1 TRP A 25 -8.478 2.238 -6.723 1.00 0.00 C ATOM 370 CD2 TRP A 25 -6.337 2.596 -6.189 1.00 0.00 C ATOM 371 NE1 TRP A 25 -7.757 2.269 -7.884 1.00 0.00 N ATOM 372 CE2 TRP A 25 -6.436 2.486 -7.585 1.00 0.00 C ATOM 373 CE3 TRP A 25 -5.084 2.819 -5.616 1.00 0.00 C ATOM 374 CZ2 TRP A 25 -5.329 2.594 -8.422 1.00 0.00 C ATOM 375 CZ3 TRP A 25 -3.983 2.925 -6.444 1.00 0.00 C ATOM 376 CH2 TRP A 25 -4.111 2.814 -7.835 1.00 0.00 C ATOM 0 H TRP A 25 -7.635 -0.408 -4.924 1.00 0.00 H new ATOM 0 HA TRP A 25 -7.468 1.249 -2.571 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -9.073 2.863 -4.152 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -7.414 3.212 -3.708 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -9.543 2.070 -6.658 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -8.140 2.150 -8.822 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -4.977 2.907 -4.545 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -5.427 2.508 -9.494 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -3.008 3.096 -6.012 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -3.232 2.904 -8.456 1.00 0.00 H new ATOM 387 N ARG A 26 -9.723 -0.441 -4.091 1.00 0.00 N ATOM 388 CA ARG A 26 -11.051 -1.048 -3.965 1.00 0.00 C ATOM 389 C ARG A 26 -11.628 -0.836 -2.561 1.00 0.00 C ATOM 390 O ARG A 26 -12.757 -0.372 -2.415 1.00 0.00 O ATOM 391 CB ARG A 26 -10.957 -2.539 -4.250 1.00 0.00 C ATOM 392 CG ARG A 26 -12.048 -3.127 -5.112 1.00 0.00 C ATOM 393 CD ARG A 26 -13.418 -2.976 -4.472 1.00 0.00 C ATOM 394 NE ARG A 26 -14.405 -2.446 -5.408 1.00 0.00 N ATOM 395 CZ ARG A 26 -15.584 -1.949 -5.041 1.00 0.00 C ATOM 396 NH1 ARG A 26 -15.925 -1.910 -3.759 1.00 0.00 N ATOM 397 NH2 ARG A 26 -16.425 -1.492 -5.958 1.00 0.00 N ATOM 0 H ARG A 26 -9.125 -0.877 -4.793 1.00 0.00 H new ATOM 0 HA ARG A 26 -11.714 -0.569 -4.685 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -9.999 -2.735 -4.731 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -10.951 -3.069 -3.298 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -12.046 -2.637 -6.085 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -11.843 -4.183 -5.287 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -13.754 -3.945 -4.102 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -13.344 -2.313 -3.610 1.00 0.00 H new ATOM 0 HE ARG A 26 -14.178 -2.457 -6.402 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -15.282 -2.262 -3.049 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -16.830 -1.528 -3.483 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -16.169 -1.521 -6.945 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -17.328 -1.111 -5.677 1.00 0.00 H new ATOM 411 N THR A 27 -10.825 -1.169 -1.534 1.00 0.00 N ATOM 412 CA THR A 27 -11.224 -1.011 -0.131 1.00 0.00 C ATOM 413 C THR A 27 -10.373 -1.909 0.767 1.00 0.00 C ATOM 414 O THR A 27 -10.066 -3.048 0.416 1.00 0.00 O ATOM 415 CB THR A 27 -12.720 -1.322 0.068 1.00 0.00 C ATOM 416 OG1 THR A 27 -13.511 -0.189 -0.241 1.00 0.00 O ATOM 417 CG2 THR A 27 -13.082 -1.740 1.480 1.00 0.00 C ATOM 0 H THR A 27 -9.888 -1.553 -1.656 1.00 0.00 H new ATOM 0 HA THR A 27 -11.059 0.030 0.147 1.00 0.00 H new ATOM 0 HB THR A 27 -12.920 -2.157 -0.603 1.00 0.00 H new ATOM 0 HG1 THR A 27 -13.500 -0.037 -1.209 1.00 0.00 H new ATOM 0 HG21 THR A 27 -14.152 -1.941 1.537 1.00 0.00 H new ATOM 0 HG22 THR A 27 -12.529 -2.641 1.746 1.00 0.00 H new ATOM 0 HG23 THR A 27 -12.826 -0.939 2.174 1.00 0.00 H new ATOM 425 N LEU A 28 -9.999 -1.382 1.929 1.00 0.00 N ATOM 426 CA LEU A 28 -9.184 -2.129 2.883 1.00 0.00 C ATOM 427 C LEU A 28 -9.954 -3.318 3.451 1.00 0.00 C ATOM 428 O LEU A 28 -9.391 -4.393 3.652 1.00 0.00 O ATOM 429 CB LEU A 28 -8.732 -1.212 4.022 1.00 0.00 C ATOM 430 CG LEU A 28 -7.647 -1.798 4.929 1.00 0.00 C ATOM 431 CD1 LEU A 28 -6.741 -0.695 5.454 1.00 0.00 C ATOM 432 CD2 LEU A 28 -8.275 -2.568 6.080 1.00 0.00 C ATOM 0 H LEU A 28 -10.247 -0.441 2.233 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.309 -2.507 2.355 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -8.363 -0.280 3.594 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -9.599 -0.961 4.633 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.042 -2.490 4.343 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.975 -1.129 6.097 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -6.265 -0.185 4.616 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -7.332 0.020 6.026 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.490 -2.978 6.715 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -8.903 -1.897 6.667 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -8.883 -3.381 5.685 1.00 0.00 H new ATOM 444 N GLU A 29 -11.243 -3.117 3.707 1.00 0.00 N ATOM 445 CA GLU A 29 -12.089 -4.174 4.254 1.00 0.00 C ATOM 446 C GLU A 29 -12.007 -5.438 3.405 1.00 0.00 C ATOM 447 O GLU A 29 -11.522 -6.473 3.861 1.00 0.00 O ATOM 448 CB GLU A 29 -13.541 -3.697 4.345 1.00 0.00 C ATOM 449 CG GLU A 29 -14.212 -4.043 5.664 1.00 0.00 C ATOM 450 CD GLU A 29 -15.641 -4.517 5.485 1.00 0.00 C ATOM 451 OE1 GLU A 29 -16.494 -3.694 5.094 1.00 0.00 O ATOM 452 OE2 GLU A 29 -15.905 -5.711 5.737 1.00 0.00 O ATOM 0 H GLU A 29 -11.725 -2.233 3.545 1.00 0.00 H new ATOM 0 HA GLU A 29 -11.727 -4.411 5.255 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -13.569 -2.616 4.205 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -14.112 -4.140 3.529 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -13.636 -4.819 6.168 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -14.202 -3.167 6.313 1.00 0.00 H new ATOM 459 N ASP A 30 -12.478 -5.349 2.167 1.00 0.00 N ATOM 460 CA ASP A 30 -12.453 -6.486 1.255 1.00 0.00 C ATOM 461 C ASP A 30 -11.022 -6.943 0.979 1.00 0.00 C ATOM 462 O ASP A 30 -10.803 -8.048 0.483 1.00 0.00 O ATOM 463 CB ASP A 30 -13.145 -6.122 -0.061 1.00 0.00 C ATOM 464 CG ASP A 30 -13.971 -7.267 -0.614 1.00 0.00 C ATOM 465 OD1 ASP A 30 -13.379 -8.193 -1.208 1.00 0.00 O ATOM 466 OD2 ASP A 30 -15.209 -7.237 -0.453 1.00 0.00 O ATOM 0 H ASP A 30 -12.882 -4.500 1.771 1.00 0.00 H new ATOM 0 HA ASP A 30 -12.988 -7.308 1.730 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -13.788 -5.256 0.097 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -12.394 -5.831 -0.795 1.00 0.00 H new ATOM 471 N GLY A 31 -10.050 -6.089 1.289 1.00 0.00 N ATOM 472 CA GLY A 31 -8.661 -6.430 1.052 1.00 0.00 C ATOM 473 C GLY A 31 -8.078 -7.360 2.103 1.00 0.00 C ATOM 474 O GLY A 31 -7.232 -8.197 1.789 1.00 0.00 O ATOM 0 H GLY A 31 -10.201 -5.168 1.700 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.572 -6.900 0.073 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -8.070 -5.514 1.021 1.00 0.00 H new ATOM 478 N LYS A 32 -8.511 -7.212 3.351 1.00 0.00 N ATOM 479 CA LYS A 32 -7.997 -8.051 4.431 1.00 0.00 C ATOM 480 C LYS A 32 -8.607 -9.451 4.397 1.00 0.00 C ATOM 481 O LYS A 32 -7.896 -10.446 4.548 1.00 0.00 O ATOM 482 CB LYS A 32 -8.241 -7.392 5.795 1.00 0.00 C ATOM 483 CG LYS A 32 -9.697 -7.384 6.233 1.00 0.00 C ATOM 484 CD LYS A 32 -10.018 -8.570 7.127 1.00 0.00 C ATOM 485 CE LYS A 32 -11.368 -8.406 7.804 1.00 0.00 C ATOM 486 NZ LYS A 32 -11.950 -9.716 8.207 1.00 0.00 N ATOM 0 H LYS A 32 -9.209 -6.527 3.639 1.00 0.00 H new ATOM 0 HA LYS A 32 -6.922 -8.154 4.280 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -7.650 -7.913 6.548 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -7.879 -6.365 5.759 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -9.912 -6.457 6.765 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -10.342 -7.404 5.355 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -10.015 -9.485 6.535 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -9.241 -8.678 7.884 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -11.258 -7.772 8.684 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -12.054 -7.897 7.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -12.982 -9.625 8.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -11.727 -10.432 7.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -11.548 -10.008 9.121 1.00 0.00 H new ATOM 500 N LYS A 33 -9.919 -9.533 4.195 1.00 0.00 N ATOM 501 CA LYS A 33 -10.595 -10.826 4.144 1.00 0.00 C ATOM 502 C LYS A 33 -10.305 -11.547 2.830 1.00 0.00 C ATOM 503 O LYS A 33 -10.405 -12.771 2.751 1.00 0.00 O ATOM 504 CB LYS A 33 -12.105 -10.670 4.339 1.00 0.00 C ATOM 505 CG LYS A 33 -12.732 -9.543 3.530 1.00 0.00 C ATOM 506 CD LYS A 33 -13.591 -8.646 4.410 1.00 0.00 C ATOM 507 CE LYS A 33 -14.735 -8.012 3.634 1.00 0.00 C ATOM 508 NZ LYS A 33 -15.393 -8.981 2.715 1.00 0.00 N ATOM 0 H LYS A 33 -10.531 -8.727 4.065 1.00 0.00 H new ATOM 0 HA LYS A 33 -10.204 -11.430 4.963 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -12.592 -11.607 4.071 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -12.306 -10.497 5.396 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -11.948 -8.951 3.058 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -13.341 -9.962 2.729 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -13.994 -9.229 5.238 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -12.970 -7.863 4.845 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -15.472 -7.618 4.333 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -14.358 -7.166 3.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -16.382 -8.698 2.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -14.891 -8.991 1.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -15.366 -9.932 3.136 1.00 0.00 H new ATOM 522 N GLU A 34 -9.936 -10.786 1.804 1.00 0.00 N ATOM 523 CA GLU A 34 -9.624 -11.364 0.503 1.00 0.00 C ATOM 524 C GLU A 34 -8.153 -11.755 0.427 1.00 0.00 C ATOM 525 O GLU A 34 -7.812 -12.842 -0.038 1.00 0.00 O ATOM 526 CB GLU A 34 -9.960 -10.379 -0.616 1.00 0.00 C ATOM 527 CG GLU A 34 -9.696 -10.935 -2.005 1.00 0.00 C ATOM 528 CD GLU A 34 -10.738 -10.495 -3.015 1.00 0.00 C ATOM 529 OE1 GLU A 34 -11.880 -10.997 -2.948 1.00 0.00 O ATOM 530 OE2 GLU A 34 -10.412 -9.648 -3.873 1.00 0.00 O ATOM 0 H GLU A 34 -9.846 -9.771 1.849 1.00 0.00 H new ATOM 0 HA GLU A 34 -10.231 -12.260 0.377 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -11.010 -10.096 -0.539 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -9.374 -9.470 -0.479 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -8.710 -10.612 -2.341 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -9.676 -12.024 -1.959 1.00 0.00 H new ATOM 537 N ALA A 35 -7.285 -10.862 0.895 1.00 0.00 N ATOM 538 CA ALA A 35 -5.850 -11.113 0.885 1.00 0.00 C ATOM 539 C ALA A 35 -5.520 -12.400 1.634 1.00 0.00 C ATOM 540 O ALA A 35 -4.555 -13.093 1.308 1.00 0.00 O ATOM 541 CB ALA A 35 -5.105 -9.938 1.498 1.00 0.00 C ATOM 0 H ALA A 35 -7.552 -9.958 1.286 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.530 -11.229 -0.150 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.034 -10.139 1.484 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.312 -9.036 0.923 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.434 -9.796 2.527 1.00 0.00 H new ATOM 547 N ALA A 36 -6.334 -12.713 2.639 1.00 0.00 N ATOM 548 CA ALA A 36 -6.139 -13.914 3.439 1.00 0.00 C ATOM 549 C ALA A 36 -6.214 -15.169 2.575 1.00 0.00 C ATOM 550 O ALA A 36 -5.535 -16.160 2.842 1.00 0.00 O ATOM 551 CB ALA A 36 -7.174 -13.977 4.552 1.00 0.00 C ATOM 0 H ALA A 36 -7.136 -12.148 2.917 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.144 -13.869 3.882 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -7.018 -14.879 5.143 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -7.073 -13.101 5.193 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -8.174 -13.996 4.118 1.00 0.00 H new ATOM 557 N ALA A 37 -7.048 -15.121 1.539 1.00 0.00 N ATOM 558 CA ALA A 37 -7.214 -16.255 0.635 1.00 0.00 C ATOM 559 C ALA A 37 -5.865 -16.754 0.124 1.00 0.00 C ATOM 560 O ALA A 37 -5.424 -17.849 0.474 1.00 0.00 O ATOM 561 CB ALA A 37 -8.114 -15.872 -0.529 1.00 0.00 C ATOM 0 H ALA A 37 -7.619 -14.309 1.305 1.00 0.00 H new ATOM 0 HA ALA A 37 -7.683 -17.067 1.191 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -8.230 -16.726 -1.196 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -9.091 -15.572 -0.150 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -7.667 -15.042 -1.077 1.00 0.00 H new ATOM 567 N SER A 38 -5.214 -15.942 -0.701 1.00 0.00 N ATOM 568 CA SER A 38 -3.913 -16.298 -1.255 1.00 0.00 C ATOM 569 C SER A 38 -2.812 -16.096 -0.219 1.00 0.00 C ATOM 570 O SER A 38 -1.780 -16.765 -0.254 1.00 0.00 O ATOM 571 CB SER A 38 -3.619 -15.464 -2.501 1.00 0.00 C ATOM 572 OG SER A 38 -4.342 -15.946 -3.620 1.00 0.00 O ATOM 0 H SER A 38 -5.566 -15.033 -1.001 1.00 0.00 H new ATOM 0 HA SER A 38 -3.938 -17.352 -1.533 1.00 0.00 H new ATOM 0 HB2 SER A 38 -3.882 -14.423 -2.316 1.00 0.00 H new ATOM 0 HB3 SER A 38 -2.551 -15.490 -2.716 1.00 0.00 H new ATOM 0 HG SER A 38 -4.138 -15.394 -4.404 1.00 0.00 H new ATOM 578 N GLY A 39 -3.043 -15.169 0.707 1.00 0.00 N ATOM 579 CA GLY A 39 -2.066 -14.894 1.744 1.00 0.00 C ATOM 580 C GLY A 39 -1.123 -13.767 1.373 1.00 0.00 C ATOM 581 O GLY A 39 -0.042 -13.641 1.950 1.00 0.00 O ATOM 0 H GLY A 39 -3.890 -14.603 0.757 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -2.585 -14.639 2.668 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -1.488 -15.797 1.941 1.00 0.00 H new ATOM 585 N LEU A 40 -1.531 -12.941 0.414 1.00 0.00 N ATOM 586 CA LEU A 40 -0.708 -11.817 -0.018 1.00 0.00 C ATOM 587 C LEU A 40 -0.961 -10.604 0.879 1.00 0.00 C ATOM 588 O LEU A 40 -1.927 -10.583 1.636 1.00 0.00 O ATOM 589 CB LEU A 40 -0.997 -11.474 -1.484 1.00 0.00 C ATOM 590 CG LEU A 40 -2.197 -10.558 -1.712 1.00 0.00 C ATOM 591 CD1 LEU A 40 -1.716 -9.175 -2.084 1.00 0.00 C ATOM 592 CD2 LEU A 40 -3.115 -11.120 -2.786 1.00 0.00 C ATOM 0 H LEU A 40 -2.421 -13.028 -0.076 1.00 0.00 H new ATOM 0 HA LEU A 40 0.342 -12.098 0.066 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.113 -11.001 -1.911 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.159 -12.402 -2.033 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.773 -10.496 -0.788 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -2.574 -8.523 -2.246 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.103 -8.774 -1.277 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -1.124 -9.229 -2.997 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.962 -10.449 -2.929 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.565 -11.214 -3.722 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.478 -12.101 -2.478 1.00 0.00 H new ATOM 604 N PRO A 41 -0.090 -9.582 0.821 1.00 0.00 N ATOM 605 CA PRO A 41 -0.222 -8.383 1.646 1.00 0.00 C ATOM 606 C PRO A 41 -1.186 -7.347 1.069 1.00 0.00 C ATOM 607 O PRO A 41 -1.859 -7.577 0.062 1.00 0.00 O ATOM 608 CB PRO A 41 1.203 -7.812 1.694 1.00 0.00 C ATOM 609 CG PRO A 41 2.039 -8.660 0.780 1.00 0.00 C ATOM 610 CD PRO A 41 1.097 -9.512 -0.030 1.00 0.00 C ATOM 0 HA PRO A 41 -0.638 -8.629 2.623 1.00 0.00 H new ATOM 0 HB2 PRO A 41 1.213 -6.770 1.373 1.00 0.00 H new ATOM 0 HB3 PRO A 41 1.595 -7.836 2.711 1.00 0.00 H new ATOM 0 HG2 PRO A 41 2.649 -8.035 0.128 1.00 0.00 H new ATOM 0 HG3 PRO A 41 2.723 -9.284 1.355 1.00 0.00 H new ATOM 0 HD2 PRO A 41 0.875 -9.062 -0.998 1.00 0.00 H new ATOM 0 HD3 PRO A 41 1.513 -10.500 -0.226 1.00 0.00 H new ATOM 618 N LEU A 42 -1.247 -6.197 1.728 1.00 0.00 N ATOM 619 CA LEU A 42 -2.125 -5.121 1.296 1.00 0.00 C ATOM 620 C LEU A 42 -1.337 -4.018 0.593 1.00 0.00 C ATOM 621 O LEU A 42 -0.172 -3.756 0.914 1.00 0.00 O ATOM 622 CB LEU A 42 -2.892 -4.551 2.491 1.00 0.00 C ATOM 623 CG LEU A 42 -4.275 -5.164 2.722 1.00 0.00 C ATOM 624 CD1 LEU A 42 -4.147 -6.573 3.280 1.00 0.00 C ATOM 625 CD2 LEU A 42 -5.093 -4.290 3.659 1.00 0.00 C ATOM 0 H LEU A 42 -0.699 -5.987 2.562 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.840 -5.531 0.582 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -2.293 -4.694 3.390 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -3.006 -3.476 2.351 1.00 0.00 H new ATOM 0 HG LEU A 42 -4.793 -5.220 1.764 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -5.140 -6.993 3.438 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.598 -7.196 2.574 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -3.611 -6.541 4.229 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -6.074 -4.740 3.813 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -4.579 -4.203 4.616 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -5.213 -3.299 3.220 1.00 0.00 H new ATOM 637 N MET A 43 -1.985 -3.382 -0.375 1.00 0.00 N ATOM 638 CA MET A 43 -1.374 -2.307 -1.148 1.00 0.00 C ATOM 639 C MET A 43 -1.885 -0.949 -0.682 1.00 0.00 C ATOM 640 O MET A 43 -2.883 -0.444 -1.200 1.00 0.00 O ATOM 641 CB MET A 43 -1.688 -2.491 -2.633 1.00 0.00 C ATOM 642 CG MET A 43 -0.820 -1.640 -3.547 1.00 0.00 C ATOM 643 SD MET A 43 0.943 -1.919 -3.293 1.00 0.00 S ATOM 644 CE MET A 43 1.297 -0.715 -2.015 1.00 0.00 C ATOM 0 H MET A 43 -2.945 -3.595 -0.646 1.00 0.00 H new ATOM 0 HA MET A 43 -0.295 -2.345 -0.996 1.00 0.00 H new ATOM 0 HB2 MET A 43 -1.558 -3.541 -2.896 1.00 0.00 H new ATOM 0 HB3 MET A 43 -2.735 -2.245 -2.808 1.00 0.00 H new ATOM 0 HG2 MET A 43 -1.072 -1.857 -4.585 1.00 0.00 H new ATOM 0 HG3 MET A 43 -1.045 -0.587 -3.378 1.00 0.00 H new ATOM 0 HE1 MET A 43 2.144 -0.100 -2.319 1.00 0.00 H new ATOM 0 HE2 MET A 43 0.424 -0.080 -1.861 1.00 0.00 H new ATOM 0 HE3 MET A 43 1.539 -1.231 -1.086 1.00 0.00 H new ATOM 654 N VAL A 44 -1.206 -0.359 0.296 1.00 0.00 N ATOM 655 CA VAL A 44 -1.621 0.933 0.812 1.00 0.00 C ATOM 656 C VAL A 44 -0.978 2.076 0.037 1.00 0.00 C ATOM 657 O VAL A 44 0.218 2.334 0.155 1.00 0.00 O ATOM 658 CB VAL A 44 -1.315 1.071 2.319 1.00 0.00 C ATOM 659 CG1 VAL A 44 -1.522 2.506 2.792 1.00 0.00 C ATOM 660 CG2 VAL A 44 -2.185 0.113 3.121 1.00 0.00 C ATOM 0 H VAL A 44 -0.376 -0.752 0.741 1.00 0.00 H new ATOM 0 HA VAL A 44 -2.701 0.993 0.679 1.00 0.00 H new ATOM 0 HB VAL A 44 -0.268 0.814 2.480 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -1.299 2.574 3.857 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -0.858 3.171 2.239 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -2.557 2.801 2.618 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -1.960 0.219 4.182 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -3.236 0.344 2.948 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.982 -0.911 2.808 1.00 0.00 H new ATOM 670 N ILE A 45 -1.796 2.760 -0.752 1.00 0.00 N ATOM 671 CA ILE A 45 -1.342 3.887 -1.554 1.00 0.00 C ATOM 672 C ILE A 45 -2.099 5.150 -1.156 1.00 0.00 C ATOM 673 O ILE A 45 -3.291 5.278 -1.434 1.00 0.00 O ATOM 674 CB ILE A 45 -1.554 3.618 -3.058 1.00 0.00 C ATOM 675 CG1 ILE A 45 -0.801 2.353 -3.481 1.00 0.00 C ATOM 676 CG2 ILE A 45 -1.111 4.816 -3.891 1.00 0.00 C ATOM 677 CD1 ILE A 45 -1.332 1.739 -4.756 1.00 0.00 C ATOM 0 H ILE A 45 -2.789 2.550 -0.854 1.00 0.00 H new ATOM 0 HA ILE A 45 -0.276 4.023 -1.370 1.00 0.00 H new ATOM 0 HB ILE A 45 -2.618 3.463 -3.235 1.00 0.00 H new ATOM 0 HG12 ILE A 45 0.254 2.594 -3.614 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -0.862 1.617 -2.679 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -1.270 4.603 -4.948 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.693 5.692 -3.606 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -0.053 5.010 -3.715 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -0.754 0.847 -4.998 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -2.379 1.468 -4.621 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -1.246 2.459 -5.570 1.00 0.00 H new ATOM 689 N ILE A 46 -1.417 6.070 -0.483 1.00 0.00 N ATOM 690 CA ILE A 46 -2.052 7.297 -0.037 1.00 0.00 C ATOM 691 C ILE A 46 -1.501 8.507 -0.777 1.00 0.00 C ATOM 692 O ILE A 46 -0.333 8.534 -1.163 1.00 0.00 O ATOM 693 CB ILE A 46 -1.864 7.496 1.476 1.00 0.00 C ATOM 694 CG1 ILE A 46 -1.995 6.159 2.205 1.00 0.00 C ATOM 695 CG2 ILE A 46 -2.879 8.489 2.009 1.00 0.00 C ATOM 696 CD1 ILE A 46 -0.924 5.938 3.246 1.00 0.00 C ATOM 0 H ILE A 46 -0.431 5.987 -0.237 1.00 0.00 H new ATOM 0 HA ILE A 46 -3.116 7.205 -0.257 1.00 0.00 H new ATOM 0 HB ILE A 46 -0.865 7.894 1.653 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -2.973 6.109 2.684 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.955 5.350 1.476 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -2.733 8.619 3.081 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.749 9.447 1.506 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -3.886 8.115 1.823 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -1.076 4.971 3.725 1.00 0.00 H new ATOM 0 HD12 ILE A 46 0.056 5.957 2.769 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -0.978 6.727 3.996 1.00 0.00 H new ATOM 708 N HIS A 47 -2.354 9.504 -0.972 1.00 0.00 N ATOM 709 CA HIS A 47 -1.951 10.720 -1.674 1.00 0.00 C ATOM 710 C HIS A 47 -2.430 11.965 -0.938 1.00 0.00 C ATOM 711 O HIS A 47 -3.583 12.374 -1.078 1.00 0.00 O ATOM 712 CB HIS A 47 -2.503 10.712 -3.101 1.00 0.00 C ATOM 713 CG HIS A 47 -3.966 10.402 -3.179 1.00 0.00 C ATOM 714 ND1 HIS A 47 -4.871 11.205 -3.841 1.00 0.00 N ATOM 715 CD2 HIS A 47 -4.682 9.367 -2.680 1.00 0.00 C ATOM 716 CE1 HIS A 47 -6.078 10.679 -3.744 1.00 0.00 C ATOM 717 NE2 HIS A 47 -5.991 9.563 -3.045 1.00 0.00 N ATOM 0 H HIS A 47 -3.324 9.497 -0.657 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.862 10.743 -1.710 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.322 11.686 -3.556 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -1.953 9.978 -3.690 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -4.295 8.541 -2.102 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -6.983 11.092 -4.165 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -6.770 8.946 -2.814 1.00 0.00 H new ATOM 726 N LYS A 48 -1.541 12.567 -0.151 1.00 0.00 N ATOM 727 CA LYS A 48 -1.895 13.771 0.602 1.00 0.00 C ATOM 728 C LYS A 48 -0.879 14.890 0.388 1.00 0.00 C ATOM 729 O LYS A 48 0.323 14.648 0.317 1.00 0.00 O ATOM 730 CB LYS A 48 -1.996 13.457 2.095 1.00 0.00 C ATOM 731 CG LYS A 48 -3.353 12.922 2.520 1.00 0.00 C ATOM 732 CD LYS A 48 -3.570 13.083 4.017 1.00 0.00 C ATOM 733 CE LYS A 48 -4.206 11.844 4.624 1.00 0.00 C ATOM 734 NZ LYS A 48 -3.786 11.639 6.038 1.00 0.00 N ATOM 0 H LYS A 48 -0.582 12.247 -0.018 1.00 0.00 H new ATOM 0 HA LYS A 48 -2.863 14.110 0.232 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -1.230 12.726 2.355 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -1.779 14.362 2.662 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.139 13.448 1.978 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -3.431 11.869 2.251 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -2.615 13.279 4.505 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -4.207 13.948 4.202 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -5.291 11.933 4.577 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -3.932 10.969 4.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -4.268 10.803 6.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -2.757 11.494 6.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -4.039 12.476 6.600 1.00 0.00 H new ATOM 748 N SER A 49 -1.385 16.120 0.310 1.00 0.00 N ATOM 749 CA SER A 49 -0.548 17.310 0.126 1.00 0.00 C ATOM 750 C SER A 49 0.541 17.102 -0.926 1.00 0.00 C ATOM 751 O SER A 49 1.536 16.421 -0.679 1.00 0.00 O ATOM 752 CB SER A 49 0.094 17.705 1.458 1.00 0.00 C ATOM 753 OG SER A 49 -0.860 17.701 2.505 1.00 0.00 O ATOM 0 H SER A 49 -2.383 16.322 0.372 1.00 0.00 H new ATOM 0 HA SER A 49 -1.198 18.109 -0.230 1.00 0.00 H new ATOM 0 HB2 SER A 49 0.902 17.013 1.695 1.00 0.00 H new ATOM 0 HB3 SER A 49 0.539 18.696 1.371 1.00 0.00 H new ATOM 0 HG SER A 49 -0.424 17.955 3.345 1.00 0.00 H new ATOM 759 N TRP A 50 0.354 17.712 -2.095 1.00 0.00 N ATOM 760 CA TRP A 50 1.326 17.607 -3.185 1.00 0.00 C ATOM 761 C TRP A 50 1.779 16.164 -3.375 1.00 0.00 C ATOM 762 O TRP A 50 2.794 15.747 -2.822 1.00 0.00 O ATOM 763 CB TRP A 50 2.543 18.497 -2.912 1.00 0.00 C ATOM 764 CG TRP A 50 2.233 19.710 -2.084 1.00 0.00 C ATOM 765 CD1 TRP A 50 1.596 20.845 -2.498 1.00 0.00 C ATOM 766 CD2 TRP A 50 2.552 19.908 -0.702 1.00 0.00 C ATOM 767 NE1 TRP A 50 1.497 21.735 -1.455 1.00 0.00 N ATOM 768 CE2 TRP A 50 2.076 21.183 -0.344 1.00 0.00 C ATOM 769 CE3 TRP A 50 3.190 19.130 0.267 1.00 0.00 C ATOM 770 CZ2 TRP A 50 2.220 21.697 0.943 1.00 0.00 C ATOM 771 CZ3 TRP A 50 3.332 19.641 1.544 1.00 0.00 C ATOM 772 CH2 TRP A 50 2.849 20.914 1.871 1.00 0.00 C ATOM 0 H TRP A 50 -0.461 18.285 -2.313 1.00 0.00 H new ATOM 0 HA TRP A 50 0.836 17.944 -4.099 1.00 0.00 H new ATOM 0 HB2 TRP A 50 3.306 17.907 -2.404 1.00 0.00 H new ATOM 0 HB3 TRP A 50 2.968 18.817 -3.863 1.00 0.00 H new ATOM 0 HD1 TRP A 50 1.225 21.018 -3.497 1.00 0.00 H new ATOM 0 HE1 TRP A 50 1.063 22.657 -1.501 1.00 0.00 H new ATOM 0 HE3 TRP A 50 3.566 18.147 0.023 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 1.848 22.678 1.198 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 3.823 19.049 2.302 1.00 0.00 H new ATOM 0 HH2 TRP A 50 2.976 21.285 2.877 1.00 0.00 H new ATOM 783 N CYS A 51 1.015 15.406 -4.150 1.00 0.00 N ATOM 784 CA CYS A 51 1.332 14.006 -4.400 1.00 0.00 C ATOM 785 C CYS A 51 1.646 13.769 -5.878 1.00 0.00 C ATOM 786 O CYS A 51 0.765 13.868 -6.733 1.00 0.00 O ATOM 787 CB CYS A 51 0.160 13.123 -3.947 1.00 0.00 C ATOM 788 SG CYS A 51 0.070 11.486 -4.747 1.00 0.00 S ATOM 0 H CYS A 51 0.171 15.737 -4.617 1.00 0.00 H new ATOM 0 HA CYS A 51 2.221 13.741 -3.827 1.00 0.00 H new ATOM 0 HB2 CYS A 51 0.229 12.980 -2.869 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -0.771 13.656 -4.139 1.00 0.00 H new ATOM 793 N GLY A 52 2.903 13.436 -6.170 1.00 0.00 N ATOM 794 CA GLY A 52 3.301 13.173 -7.542 1.00 0.00 C ATOM 795 C GLY A 52 3.174 11.704 -7.892 1.00 0.00 C ATOM 796 O GLY A 52 2.942 11.350 -9.047 1.00 0.00 O ATOM 0 H GLY A 52 3.650 13.344 -5.482 1.00 0.00 H new ATOM 0 HA2 GLY A 52 2.683 13.763 -8.219 1.00 0.00 H new ATOM 0 HA3 GLY A 52 4.332 13.494 -7.689 1.00 0.00 H new ATOM 800 N ALA A 53 3.306 10.847 -6.884 1.00 0.00 N ATOM 801 CA ALA A 53 3.184 9.409 -7.088 1.00 0.00 C ATOM 802 C ALA A 53 1.820 9.074 -7.670 1.00 0.00 C ATOM 803 O ALA A 53 1.623 8.003 -8.243 1.00 0.00 O ATOM 804 CB ALA A 53 3.407 8.664 -5.780 1.00 0.00 C ATOM 0 H ALA A 53 3.497 11.123 -5.921 1.00 0.00 H new ATOM 0 HA ALA A 53 3.950 9.091 -7.796 1.00 0.00 H new ATOM 0 HB1 ALA A 53 3.312 7.592 -5.951 1.00 0.00 H new ATOM 0 HB2 ALA A 53 4.405 8.884 -5.402 1.00 0.00 H new ATOM 0 HB3 ALA A 53 2.664 8.982 -5.049 1.00 0.00 H new ATOM 810 N CYS A 54 0.883 10.006 -7.526 1.00 0.00 N ATOM 811 CA CYS A 54 -0.458 9.827 -8.044 1.00 0.00 C ATOM 812 C CYS A 54 -0.700 10.752 -9.237 1.00 0.00 C ATOM 813 O CYS A 54 -1.552 10.477 -10.080 1.00 0.00 O ATOM 814 CB CYS A 54 -1.492 10.093 -6.950 1.00 0.00 C ATOM 815 SG CYS A 54 -1.348 11.738 -6.179 1.00 0.00 S ATOM 0 H CYS A 54 1.035 10.896 -7.051 1.00 0.00 H new ATOM 0 HA CYS A 54 -0.562 8.795 -8.379 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -2.490 9.988 -7.375 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -1.393 9.331 -6.177 1.00 0.00 H new ATOM 820 N LYS A 55 0.053 11.851 -9.296 1.00 0.00 N ATOM 821 CA LYS A 55 -0.087 12.816 -10.383 1.00 0.00 C ATOM 822 C LYS A 55 0.259 12.181 -11.729 1.00 0.00 C ATOM 823 O LYS A 55 -0.500 12.302 -12.689 1.00 0.00 O ATOM 824 CB LYS A 55 0.784 14.055 -10.118 1.00 0.00 C ATOM 825 CG LYS A 55 2.190 13.974 -10.698 1.00 0.00 C ATOM 826 CD LYS A 55 2.995 15.223 -10.378 1.00 0.00 C ATOM 827 CE LYS A 55 3.845 15.654 -11.562 1.00 0.00 C ATOM 828 NZ LYS A 55 4.870 16.662 -11.172 1.00 0.00 N ATOM 0 H LYS A 55 0.763 12.093 -8.605 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.129 13.133 -10.425 1.00 0.00 H new ATOM 0 HB2 LYS A 55 0.284 14.931 -10.532 1.00 0.00 H new ATOM 0 HB3 LYS A 55 0.857 14.209 -9.041 1.00 0.00 H new ATOM 0 HG2 LYS A 55 2.700 13.098 -10.298 1.00 0.00 H new ATOM 0 HG3 LYS A 55 2.132 13.843 -11.779 1.00 0.00 H new ATOM 0 HD2 LYS A 55 2.319 16.032 -10.100 1.00 0.00 H new ATOM 0 HD3 LYS A 55 3.637 15.034 -9.517 1.00 0.00 H new ATOM 0 HE2 LYS A 55 4.338 14.782 -11.991 1.00 0.00 H new ATOM 0 HE3 LYS A 55 3.203 16.071 -12.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 5.429 16.930 -12.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 4.399 17.505 -10.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 5.499 16.256 -10.450 1.00 0.00 H new ATOM 842 N ALA A 56 1.395 11.494 -11.792 1.00 0.00 N ATOM 843 CA ALA A 56 1.809 10.828 -13.026 1.00 0.00 C ATOM 844 C ALA A 56 1.135 9.463 -13.143 1.00 0.00 C ATOM 845 O ALA A 56 1.025 8.895 -14.230 1.00 0.00 O ATOM 846 CB ALA A 56 3.324 10.682 -13.067 1.00 0.00 C ATOM 0 H ALA A 56 2.042 11.383 -11.011 1.00 0.00 H new ATOM 0 HA ALA A 56 1.499 11.440 -13.873 1.00 0.00 H new ATOM 0 HB1 ALA A 56 3.617 10.184 -13.992 1.00 0.00 H new ATOM 0 HB2 ALA A 56 3.786 11.668 -13.024 1.00 0.00 H new ATOM 0 HB3 ALA A 56 3.656 10.089 -12.215 1.00 0.00 H new ATOM 852 N LEU A 57 0.687 8.955 -12.003 1.00 0.00 N ATOM 853 CA LEU A 57 0.014 7.665 -11.913 1.00 0.00 C ATOM 854 C LEU A 57 -1.186 7.575 -12.861 1.00 0.00 C ATOM 855 O LEU A 57 -1.401 6.556 -13.512 1.00 0.00 O ATOM 856 CB LEU A 57 -0.450 7.470 -10.469 1.00 0.00 C ATOM 857 CG LEU A 57 -0.331 6.056 -9.892 1.00 0.00 C ATOM 858 CD1 LEU A 57 1.117 5.582 -9.911 1.00 0.00 C ATOM 859 CD2 LEU A 57 -0.889 6.021 -8.474 1.00 0.00 C ATOM 0 H LEU A 57 0.781 9.431 -11.106 1.00 0.00 H new ATOM 0 HA LEU A 57 0.714 6.883 -12.208 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.123 8.146 -9.834 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.494 7.778 -10.403 1.00 0.00 H new ATOM 0 HG LEU A 57 -0.914 5.378 -10.515 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.176 4.576 -9.496 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.484 5.574 -10.937 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.729 6.257 -9.313 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -0.800 5.011 -8.073 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.328 6.712 -7.845 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.939 6.314 -8.489 1.00 0.00 H new ATOM 871 N LYS A 58 -1.985 8.631 -12.904 1.00 0.00 N ATOM 872 CA LYS A 58 -3.189 8.646 -13.747 1.00 0.00 C ATOM 873 C LYS A 58 -2.929 8.155 -15.174 1.00 0.00 C ATOM 874 O LYS A 58 -3.480 7.144 -15.583 1.00 0.00 O ATOM 875 CB LYS A 58 -3.852 10.039 -13.799 1.00 0.00 C ATOM 876 CG LYS A 58 -3.069 11.158 -13.130 1.00 0.00 C ATOM 877 CD LYS A 58 -3.529 11.378 -11.698 1.00 0.00 C ATOM 878 CE LYS A 58 -4.873 12.085 -11.649 1.00 0.00 C ATOM 879 NZ LYS A 58 -5.384 12.214 -10.256 1.00 0.00 N ATOM 0 H LYS A 58 -1.830 9.487 -12.372 1.00 0.00 H new ATOM 0 HA LYS A 58 -3.874 7.947 -13.267 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -4.016 10.306 -14.843 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -4.833 9.974 -13.329 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -2.006 10.916 -13.139 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.191 12.080 -13.699 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -3.602 10.418 -11.186 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -2.786 11.969 -11.162 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -4.778 13.076 -12.094 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -5.595 11.533 -12.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -6.394 12.463 -10.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -5.261 11.310 -9.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -4.855 12.959 -9.760 1.00 0.00 H new ATOM 893 N PRO A 59 -2.126 8.883 -15.964 1.00 0.00 N ATOM 894 CA PRO A 59 -1.856 8.522 -17.366 1.00 0.00 C ATOM 895 C PRO A 59 -0.837 7.400 -17.563 1.00 0.00 C ATOM 896 O PRO A 59 -0.793 6.790 -18.632 1.00 0.00 O ATOM 897 CB PRO A 59 -1.314 9.821 -17.949 1.00 0.00 C ATOM 898 CG PRO A 59 -0.652 10.494 -16.798 1.00 0.00 C ATOM 899 CD PRO A 59 -1.457 10.136 -15.580 1.00 0.00 C ATOM 0 HA PRO A 59 -2.757 8.131 -17.839 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -0.608 9.630 -18.757 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -2.114 10.435 -18.363 1.00 0.00 H new ATOM 0 HG2 PRO A 59 0.380 10.160 -16.694 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -0.625 11.574 -16.942 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -0.821 9.999 -14.705 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -2.177 10.916 -15.332 1.00 0.00 H new ATOM 907 N LYS A 60 -0.012 7.128 -16.560 1.00 0.00 N ATOM 908 CA LYS A 60 0.993 6.076 -16.692 1.00 0.00 C ATOM 909 C LYS A 60 0.578 4.811 -15.952 1.00 0.00 C ATOM 910 O LYS A 60 0.631 3.716 -16.505 1.00 0.00 O ATOM 911 CB LYS A 60 2.355 6.562 -16.192 1.00 0.00 C ATOM 912 CG LYS A 60 2.505 6.524 -14.682 1.00 0.00 C ATOM 913 CD LYS A 60 3.562 7.507 -14.197 1.00 0.00 C ATOM 914 CE LYS A 60 4.852 7.390 -14.999 1.00 0.00 C ATOM 915 NZ LYS A 60 4.768 8.113 -16.298 1.00 0.00 N ATOM 0 H LYS A 60 -0.015 7.610 -15.661 1.00 0.00 H new ATOM 0 HA LYS A 60 1.075 5.833 -17.751 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.136 5.948 -16.640 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.515 7.583 -16.538 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.548 6.758 -14.215 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.774 5.516 -14.368 1.00 0.00 H new ATOM 0 HD2 LYS A 60 3.176 8.524 -14.275 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.771 7.325 -13.143 1.00 0.00 H new ATOM 0 HE2 LYS A 60 5.680 7.790 -14.414 1.00 0.00 H new ATOM 0 HE3 LYS A 60 5.071 6.338 -15.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 5.665 8.608 -16.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.589 7.432 -17.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 3.992 8.804 -16.261 1.00 0.00 H new ATOM 929 N PHE A 61 0.156 4.966 -14.705 1.00 0.00 N ATOM 930 CA PHE A 61 -0.275 3.828 -13.913 1.00 0.00 C ATOM 931 C PHE A 61 -1.602 3.317 -14.425 1.00 0.00 C ATOM 932 O PHE A 61 -1.919 2.145 -14.258 1.00 0.00 O ATOM 933 CB PHE A 61 -0.364 4.190 -12.438 1.00 0.00 C ATOM 934 CG PHE A 61 -0.523 3.000 -11.537 1.00 0.00 C ATOM 935 CD1 PHE A 61 0.561 2.196 -11.230 1.00 0.00 C ATOM 936 CD2 PHE A 61 -1.761 2.684 -11.000 1.00 0.00 C ATOM 937 CE1 PHE A 61 0.416 1.098 -10.401 1.00 0.00 C ATOM 938 CE2 PHE A 61 -1.913 1.589 -10.172 1.00 0.00 C ATOM 939 CZ PHE A 61 -0.823 0.795 -9.872 1.00 0.00 C ATOM 0 H PHE A 61 0.104 5.864 -14.224 1.00 0.00 H new ATOM 0 HA PHE A 61 0.467 3.035 -14.012 1.00 0.00 H new ATOM 0 HB2 PHE A 61 0.535 4.735 -12.151 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -1.207 4.864 -12.288 1.00 0.00 H new ATOM 0 HD1 PHE A 61 1.532 2.429 -11.643 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -2.617 3.301 -11.232 1.00 0.00 H new ATOM 0 HE1 PHE A 61 1.270 0.479 -10.168 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -2.883 1.354 -9.760 1.00 0.00 H new ATOM 0 HZ PHE A 61 -0.940 -0.062 -9.225 1.00 0.00 H new ATOM 949 N ALA A 62 -2.358 4.173 -15.110 1.00 0.00 N ATOM 950 CA ALA A 62 -3.607 3.725 -15.697 1.00 0.00 C ATOM 951 C ALA A 62 -3.275 2.603 -16.679 1.00 0.00 C ATOM 952 O ALA A 62 -4.096 1.732 -16.968 1.00 0.00 O ATOM 953 CB ALA A 62 -4.331 4.874 -16.381 1.00 0.00 C ATOM 0 H ALA A 62 -2.131 5.155 -15.267 1.00 0.00 H new ATOM 0 HA ALA A 62 -4.282 3.355 -14.925 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -5.264 4.511 -16.812 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -4.548 5.653 -15.651 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -3.701 5.282 -17.171 1.00 0.00 H new ATOM 959 N GLU A 63 -2.013 2.620 -17.126 1.00 0.00 N ATOM 960 CA GLU A 63 -1.465 1.605 -18.012 1.00 0.00 C ATOM 961 C GLU A 63 -1.418 0.275 -17.287 1.00 0.00 C ATOM 962 O GLU A 63 -1.233 -0.780 -17.900 1.00 0.00 O ATOM 963 CB GLU A 63 -0.063 2.014 -18.471 1.00 0.00 C ATOM 964 CG GLU A 63 0.433 1.235 -19.677 1.00 0.00 C ATOM 965 CD GLU A 63 1.926 1.395 -19.898 1.00 0.00 C ATOM 966 OE1 GLU A 63 2.324 2.357 -20.587 1.00 0.00 O ATOM 967 OE2 GLU A 63 2.694 0.556 -19.384 1.00 0.00 O ATOM 0 H GLU A 63 -1.344 3.348 -16.876 1.00 0.00 H new ATOM 0 HA GLU A 63 -2.101 1.507 -18.891 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -0.064 3.077 -18.711 1.00 0.00 H new ATOM 0 HB3 GLU A 63 0.636 1.874 -17.646 1.00 0.00 H new ATOM 0 HG2 GLU A 63 0.200 0.179 -19.544 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -0.101 1.570 -20.566 1.00 0.00 H new ATOM 974 N SER A 64 -1.602 0.329 -15.967 1.00 0.00 N ATOM 975 CA SER A 64 -1.602 -0.858 -15.141 1.00 0.00 C ATOM 976 C SER A 64 -2.645 -1.866 -15.611 1.00 0.00 C ATOM 977 O SER A 64 -2.893 -2.856 -14.932 1.00 0.00 O ATOM 978 CB SER A 64 -1.865 -0.497 -13.681 1.00 0.00 C ATOM 979 OG SER A 64 -0.671 -0.116 -13.022 1.00 0.00 O ATOM 0 H SER A 64 -1.754 1.196 -15.452 1.00 0.00 H new ATOM 0 HA SER A 64 -0.616 -1.314 -15.229 1.00 0.00 H new ATOM 0 HB2 SER A 64 -2.587 0.318 -13.630 1.00 0.00 H new ATOM 0 HB3 SER A 64 -2.310 -1.350 -13.168 1.00 0.00 H new ATOM 0 HG SER A 64 -0.888 0.262 -12.144 1.00 0.00 H new ATOM 985 N THR A 65 -3.238 -1.636 -16.783 1.00 0.00 N ATOM 986 CA THR A 65 -4.213 -2.575 -17.325 1.00 0.00 C ATOM 987 C THR A 65 -3.632 -3.977 -17.216 1.00 0.00 C ATOM 988 O THR A 65 -4.331 -4.937 -16.892 1.00 0.00 O ATOM 989 CB THR A 65 -4.537 -2.246 -18.783 1.00 0.00 C ATOM 990 OG1 THR A 65 -3.500 -1.474 -19.365 1.00 0.00 O ATOM 991 CG2 THR A 65 -5.831 -1.478 -18.950 1.00 0.00 C ATOM 0 H THR A 65 -3.062 -0.818 -17.367 1.00 0.00 H new ATOM 0 HA THR A 65 -5.142 -2.506 -16.760 1.00 0.00 H new ATOM 0 HB THR A 65 -4.639 -3.210 -19.281 1.00 0.00 H new ATOM 0 HG1 THR A 65 -2.638 -1.913 -19.209 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.001 -1.277 -20.008 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.658 -2.068 -18.555 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.767 -0.535 -18.407 1.00 0.00 H new ATOM 999 N GLU A 66 -2.319 -4.062 -17.429 1.00 0.00 N ATOM 1000 CA GLU A 66 -1.605 -5.321 -17.293 1.00 0.00 C ATOM 1001 C GLU A 66 -1.359 -5.567 -15.819 1.00 0.00 C ATOM 1002 O GLU A 66 -1.377 -6.704 -15.352 1.00 0.00 O ATOM 1003 CB GLU A 66 -0.276 -5.299 -18.045 1.00 0.00 C ATOM 1004 CG GLU A 66 0.531 -4.041 -17.797 1.00 0.00 C ATOM 1005 CD GLU A 66 0.434 -3.049 -18.939 1.00 0.00 C ATOM 1006 OE1 GLU A 66 -0.693 -2.814 -19.427 1.00 0.00 O ATOM 1007 OE2 GLU A 66 1.482 -2.507 -19.345 1.00 0.00 O ATOM 0 H GLU A 66 -1.733 -3.271 -17.696 1.00 0.00 H new ATOM 0 HA GLU A 66 -2.208 -6.120 -17.724 1.00 0.00 H new ATOM 0 HB2 GLU A 66 0.315 -6.166 -17.750 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -0.469 -5.394 -19.114 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.184 -3.567 -16.879 1.00 0.00 H new ATOM 0 HG3 GLU A 66 1.576 -4.309 -17.642 1.00 0.00 H new ATOM 1014 N ILE A 67 -1.161 -4.477 -15.082 1.00 0.00 N ATOM 1015 CA ILE A 67 -0.951 -4.571 -13.652 1.00 0.00 C ATOM 1016 C ILE A 67 -2.229 -5.032 -12.960 1.00 0.00 C ATOM 1017 O ILE A 67 -2.206 -5.465 -11.808 1.00 0.00 O ATOM 1018 CB ILE A 67 -0.387 -3.258 -13.065 1.00 0.00 C ATOM 1019 CG1 ILE A 67 1.119 -3.429 -12.839 1.00 0.00 C ATOM 1020 CG2 ILE A 67 -1.083 -2.843 -11.772 1.00 0.00 C ATOM 1021 CD1 ILE A 67 1.841 -2.124 -12.575 1.00 0.00 C ATOM 0 H ILE A 67 -1.143 -3.527 -15.454 1.00 0.00 H new ATOM 0 HA ILE A 67 -0.188 -5.327 -13.463 1.00 0.00 H new ATOM 0 HB ILE A 67 -0.575 -2.457 -13.780 1.00 0.00 H new ATOM 0 HG12 ILE A 67 1.278 -4.100 -11.995 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.558 -3.908 -13.714 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -0.646 -1.914 -11.405 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -2.146 -2.693 -11.963 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -0.955 -3.625 -11.023 1.00 0.00 H new ATOM 0 HD11 ILE A 67 2.903 -2.320 -12.424 1.00 0.00 H new ATOM 0 HD12 ILE A 67 1.712 -1.458 -13.428 1.00 0.00 H new ATOM 0 HD13 ILE A 67 1.428 -1.654 -11.682 1.00 0.00 H new ATOM 1033 N SER A 68 -3.339 -4.985 -13.696 1.00 0.00 N ATOM 1034 CA SER A 68 -4.617 -5.449 -13.184 1.00 0.00 C ATOM 1035 C SER A 68 -4.568 -6.962 -12.963 1.00 0.00 C ATOM 1036 O SER A 68 -5.448 -7.531 -12.322 1.00 0.00 O ATOM 1037 CB SER A 68 -5.742 -5.098 -14.159 1.00 0.00 C ATOM 1038 OG SER A 68 -5.810 -6.033 -15.220 1.00 0.00 O ATOM 0 H SER A 68 -3.373 -4.628 -14.651 1.00 0.00 H new ATOM 0 HA SER A 68 -4.815 -4.954 -12.233 1.00 0.00 H new ATOM 0 HB2 SER A 68 -6.694 -5.077 -13.628 1.00 0.00 H new ATOM 0 HB3 SER A 68 -5.579 -4.098 -14.562 1.00 0.00 H new ATOM 0 HG SER A 68 -5.012 -5.948 -15.782 1.00 0.00 H new ATOM 1044 N GLU A 69 -3.535 -7.613 -13.520 1.00 0.00 N ATOM 1045 CA GLU A 69 -3.379 -9.059 -13.391 1.00 0.00 C ATOM 1046 C GLU A 69 -2.071 -9.434 -12.679 1.00 0.00 C ATOM 1047 O GLU A 69 -2.101 -10.015 -11.595 1.00 0.00 O ATOM 1048 CB GLU A 69 -3.437 -9.735 -14.769 1.00 0.00 C ATOM 1049 CG GLU A 69 -2.958 -8.859 -15.917 1.00 0.00 C ATOM 1050 CD GLU A 69 -3.366 -9.404 -17.272 1.00 0.00 C ATOM 1051 OE1 GLU A 69 -4.505 -9.128 -17.703 1.00 0.00 O ATOM 1052 OE2 GLU A 69 -2.547 -10.106 -17.901 1.00 0.00 O ATOM 0 H GLU A 69 -2.800 -7.157 -14.061 1.00 0.00 H new ATOM 0 HA GLU A 69 -4.207 -9.417 -12.780 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -2.832 -10.641 -14.742 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -4.464 -10.043 -14.967 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -3.362 -7.854 -15.796 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -1.872 -8.773 -15.876 1.00 0.00 H new ATOM 1059 N LEU A 70 -0.926 -9.117 -13.293 1.00 0.00 N ATOM 1060 CA LEU A 70 0.374 -9.448 -12.700 1.00 0.00 C ATOM 1061 C LEU A 70 0.615 -8.697 -11.390 1.00 0.00 C ATOM 1062 O LEU A 70 1.531 -9.029 -10.639 1.00 0.00 O ATOM 1063 CB LEU A 70 1.526 -9.197 -13.698 1.00 0.00 C ATOM 1064 CG LEU A 70 2.229 -7.842 -13.639 1.00 0.00 C ATOM 1065 CD1 LEU A 70 1.220 -6.728 -13.612 1.00 0.00 C ATOM 1066 CD2 LEU A 70 3.158 -7.764 -12.432 1.00 0.00 C ATOM 0 H LEU A 70 -0.872 -8.637 -14.191 1.00 0.00 H new ATOM 0 HA LEU A 70 0.353 -10.512 -12.466 1.00 0.00 H new ATOM 0 HB2 LEU A 70 2.277 -9.972 -13.546 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.132 -9.328 -14.706 1.00 0.00 H new ATOM 0 HG LEU A 70 2.837 -7.732 -14.537 1.00 0.00 H new ATOM 0 HD11 LEU A 70 1.737 -5.769 -13.570 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.607 -6.770 -14.512 1.00 0.00 H new ATOM 0 HD13 LEU A 70 0.583 -6.835 -12.734 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.647 -6.790 -12.412 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.579 -7.899 -11.518 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.913 -8.547 -12.502 1.00 0.00 H new ATOM 1078 N SER A 71 -0.194 -7.677 -11.126 1.00 0.00 N ATOM 1079 CA SER A 71 -0.045 -6.883 -9.910 1.00 0.00 C ATOM 1080 C SER A 71 -1.303 -6.914 -9.050 1.00 0.00 C ATOM 1081 O SER A 71 -1.269 -6.523 -7.881 1.00 0.00 O ATOM 1082 CB SER A 71 0.288 -5.442 -10.254 1.00 0.00 C ATOM 1083 OG SER A 71 1.672 -5.183 -10.096 1.00 0.00 O ATOM 0 H SER A 71 -0.957 -7.381 -11.734 1.00 0.00 H new ATOM 0 HA SER A 71 0.771 -7.326 -9.339 1.00 0.00 H new ATOM 0 HB2 SER A 71 -0.008 -5.233 -11.282 1.00 0.00 H new ATOM 0 HB3 SER A 71 -0.285 -4.771 -9.614 1.00 0.00 H new ATOM 0 HG SER A 71 2.174 -5.653 -10.794 1.00 0.00 H new ATOM 1089 N HIS A 72 -2.412 -7.386 -9.616 1.00 0.00 N ATOM 1090 CA HIS A 72 -3.667 -7.463 -8.875 1.00 0.00 C ATOM 1091 C HIS A 72 -3.454 -8.189 -7.564 1.00 0.00 C ATOM 1092 O HIS A 72 -4.257 -8.080 -6.638 1.00 0.00 O ATOM 1093 CB HIS A 72 -4.747 -8.167 -9.695 1.00 0.00 C ATOM 1094 CG HIS A 72 -6.042 -7.417 -9.738 1.00 0.00 C ATOM 1095 ND1 HIS A 72 -7.266 -8.012 -9.515 1.00 0.00 N ATOM 1096 CD2 HIS A 72 -6.300 -6.109 -9.978 1.00 0.00 C ATOM 1097 CE1 HIS A 72 -8.221 -7.103 -9.618 1.00 0.00 C ATOM 1098 NE2 HIS A 72 -7.661 -5.941 -9.897 1.00 0.00 N ATOM 0 H HIS A 72 -2.466 -7.719 -10.579 1.00 0.00 H new ATOM 0 HA HIS A 72 -4.003 -6.447 -8.671 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -4.385 -8.311 -10.713 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -4.923 -9.158 -9.276 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -5.571 -5.341 -10.193 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -9.279 -7.281 -9.495 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -8.158 -5.061 -10.031 1.00 0.00 H new ATOM 1107 N ASN A 73 -2.340 -8.904 -7.492 1.00 0.00 N ATOM 1108 CA ASN A 73 -1.970 -9.628 -6.301 1.00 0.00 C ATOM 1109 C ASN A 73 -2.197 -8.736 -5.086 1.00 0.00 C ATOM 1110 O ASN A 73 -3.119 -8.956 -4.304 1.00 0.00 O ATOM 1111 CB ASN A 73 -0.505 -10.048 -6.410 1.00 0.00 C ATOM 1112 CG ASN A 73 -0.195 -10.744 -7.725 1.00 0.00 C ATOM 1113 OD1 ASN A 73 0.165 -9.966 -8.745 1.00 0.00 O flip ATOM 1114 ND2 ASN A 73 -0.279 -11.969 -7.825 1.00 0.00 N flip ATOM 0 H ASN A 73 -1.674 -8.994 -8.259 1.00 0.00 H new ATOM 0 HA ASN A 73 -2.580 -10.524 -6.191 1.00 0.00 H new ATOM 0 HB2 ASN A 73 0.130 -9.168 -6.310 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -0.259 -10.714 -5.583 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -0.558 -12.529 -7.019 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -0.069 -12.424 -8.714 1.00 0.00 H new ATOM 1121 N PHE A 74 -1.384 -7.688 -4.972 1.00 0.00 N ATOM 1122 CA PHE A 74 -1.520 -6.720 -3.895 1.00 0.00 C ATOM 1123 C PHE A 74 -2.949 -6.196 -3.895 1.00 0.00 C ATOM 1124 O PHE A 74 -3.490 -5.875 -4.953 1.00 0.00 O ATOM 1125 CB PHE A 74 -0.512 -5.591 -4.086 1.00 0.00 C ATOM 1126 CG PHE A 74 0.904 -6.021 -3.823 1.00 0.00 C ATOM 1127 CD1 PHE A 74 1.596 -6.778 -4.754 1.00 0.00 C ATOM 1128 CD2 PHE A 74 1.537 -5.677 -2.640 1.00 0.00 C ATOM 1129 CE1 PHE A 74 2.892 -7.183 -4.511 1.00 0.00 C ATOM 1130 CE2 PHE A 74 2.835 -6.080 -2.391 1.00 0.00 C ATOM 1131 CZ PHE A 74 3.513 -6.834 -3.329 1.00 0.00 C ATOM 0 H PHE A 74 -0.620 -7.490 -5.619 1.00 0.00 H new ATOM 0 HA PHE A 74 -1.315 -7.186 -2.931 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -0.588 -5.211 -5.105 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -0.766 -4.767 -3.419 1.00 0.00 H new ATOM 0 HD1 PHE A 74 1.115 -7.054 -5.681 1.00 0.00 H new ATOM 0 HD2 PHE A 74 1.010 -5.087 -1.904 1.00 0.00 H new ATOM 0 HE1 PHE A 74 3.420 -7.773 -5.245 1.00 0.00 H new ATOM 0 HE2 PHE A 74 3.318 -5.806 -1.465 1.00 0.00 H new ATOM 0 HZ PHE A 74 4.528 -7.150 -3.138 1.00 0.00 H new ATOM 1141 N VAL A 75 -3.592 -6.179 -2.734 1.00 0.00 N ATOM 1142 CA VAL A 75 -4.990 -5.770 -2.684 1.00 0.00 C ATOM 1143 C VAL A 75 -5.239 -4.309 -2.284 1.00 0.00 C ATOM 1144 O VAL A 75 -4.559 -3.733 -1.441 1.00 0.00 O ATOM 1145 CB VAL A 75 -5.805 -6.689 -1.756 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -5.404 -6.482 -0.305 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -7.298 -6.455 -1.960 1.00 0.00 C ATOM 0 H VAL A 75 -3.182 -6.436 -1.836 1.00 0.00 H new ATOM 0 HA VAL A 75 -5.324 -5.862 -3.718 1.00 0.00 H new ATOM 0 HB VAL A 75 -5.588 -7.726 -2.011 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -5.993 -7.141 0.333 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -4.345 -6.710 -0.184 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.586 -5.445 -0.021 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.863 -7.111 -1.298 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -7.538 -5.416 -1.733 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.562 -6.670 -2.995 1.00 0.00 H new ATOM 1157 N MET A 76 -6.263 -3.765 -2.929 1.00 0.00 N ATOM 1158 CA MET A 76 -6.773 -2.405 -2.770 1.00 0.00 C ATOM 1159 C MET A 76 -6.776 -1.822 -1.352 1.00 0.00 C ATOM 1160 O MET A 76 -7.605 -2.211 -0.525 1.00 0.00 O ATOM 1161 CB MET A 76 -8.223 -2.483 -3.185 1.00 0.00 C ATOM 1162 CG MET A 76 -8.919 -3.724 -2.628 1.00 0.00 C ATOM 1163 SD MET A 76 -9.281 -4.969 -3.891 1.00 0.00 S ATOM 1164 CE MET A 76 -10.652 -5.835 -3.131 1.00 0.00 C ATOM 0 H MET A 76 -6.794 -4.293 -3.621 1.00 0.00 H new ATOM 0 HA MET A 76 -6.115 -1.759 -3.351 1.00 0.00 H new ATOM 0 HB2 MET A 76 -8.746 -1.591 -2.841 1.00 0.00 H new ATOM 0 HB3 MET A 76 -8.287 -2.490 -4.273 1.00 0.00 H new ATOM 0 HG2 MET A 76 -8.290 -4.170 -1.858 1.00 0.00 H new ATOM 0 HG3 MET A 76 -9.849 -3.425 -2.146 1.00 0.00 H new ATOM 0 HE1 MET A 76 -10.770 -6.812 -3.600 1.00 0.00 H new ATOM 0 HE2 MET A 76 -10.455 -5.965 -2.067 1.00 0.00 H new ATOM 0 HE3 MET A 76 -11.566 -5.256 -3.263 1.00 0.00 H new ATOM 1174 N VAL A 77 -5.917 -0.815 -1.112 1.00 0.00 N ATOM 1175 CA VAL A 77 -5.886 -0.125 0.186 1.00 0.00 C ATOM 1176 C VAL A 77 -5.320 1.292 0.070 1.00 0.00 C ATOM 1177 O VAL A 77 -4.421 1.676 0.815 1.00 0.00 O ATOM 1178 CB VAL A 77 -5.079 -0.891 1.262 1.00 0.00 C ATOM 1179 CG1 VAL A 77 -5.982 -1.381 2.380 1.00 0.00 C ATOM 1180 CG2 VAL A 77 -4.304 -2.039 0.650 1.00 0.00 C ATOM 0 H VAL A 77 -5.243 -0.465 -1.793 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.928 -0.079 0.502 1.00 0.00 H new ATOM 0 HB VAL A 77 -4.360 -0.194 1.694 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -5.387 -1.915 3.121 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -6.470 -0.529 2.853 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.738 -2.051 1.970 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -3.747 -2.558 1.430 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -4.997 -2.734 0.175 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -3.609 -1.652 -0.096 1.00 0.00 H new ATOM 1190 N ASN A 78 -5.861 2.077 -0.846 1.00 0.00 N ATOM 1191 CA ASN A 78 -5.402 3.445 -1.026 1.00 0.00 C ATOM 1192 C ASN A 78 -6.231 4.416 -0.195 1.00 0.00 C ATOM 1193 O ASN A 78 -7.451 4.496 -0.336 1.00 0.00 O ATOM 1194 CB ASN A 78 -5.442 3.825 -2.507 1.00 0.00 C ATOM 1195 CG ASN A 78 -6.102 5.167 -2.775 1.00 0.00 C ATOM 1196 OD1 ASN A 78 -7.286 5.241 -3.099 1.00 0.00 O ATOM 1197 ND2 ASN A 78 -5.329 6.232 -2.637 1.00 0.00 N ATOM 0 H ASN A 78 -6.614 1.794 -1.473 1.00 0.00 H new ATOM 0 HA ASN A 78 -4.371 3.509 -0.678 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -4.424 3.847 -2.895 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -5.976 3.051 -3.057 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -5.710 7.164 -2.801 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -4.352 6.121 -2.366 1.00 0.00 H new ATOM 1204 N LEU A 79 -5.550 5.152 0.667 1.00 0.00 N ATOM 1205 CA LEU A 79 -6.204 6.128 1.530 1.00 0.00 C ATOM 1206 C LEU A 79 -6.040 7.546 0.965 1.00 0.00 C ATOM 1207 O LEU A 79 -5.100 7.828 0.218 1.00 0.00 O ATOM 1208 CB LEU A 79 -5.642 6.008 2.959 1.00 0.00 C ATOM 1209 CG LEU A 79 -5.401 7.315 3.722 1.00 0.00 C ATOM 1210 CD1 LEU A 79 -6.677 7.774 4.409 1.00 0.00 C ATOM 1211 CD2 LEU A 79 -4.286 7.133 4.741 1.00 0.00 C ATOM 0 H LEU A 79 -4.539 5.093 0.790 1.00 0.00 H new ATOM 0 HA LEU A 79 -7.274 5.923 1.567 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -6.329 5.396 3.543 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.698 5.466 2.908 1.00 0.00 H new ATOM 0 HG LEU A 79 -5.099 8.082 3.009 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -6.487 8.703 4.946 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -7.453 7.939 3.662 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -7.007 7.009 5.113 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -4.125 8.069 5.276 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -4.565 6.353 5.450 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -3.368 6.846 4.228 1.00 0.00 H new ATOM 1223 N GLU A 80 -6.971 8.431 1.315 1.00 0.00 N ATOM 1224 CA GLU A 80 -6.935 9.811 0.836 1.00 0.00 C ATOM 1225 C GLU A 80 -6.854 10.799 1.997 1.00 0.00 C ATOM 1226 O GLU A 80 -6.765 10.401 3.158 1.00 0.00 O ATOM 1227 CB GLU A 80 -8.176 10.105 -0.008 1.00 0.00 C ATOM 1228 CG GLU A 80 -7.922 11.069 -1.153 1.00 0.00 C ATOM 1229 CD GLU A 80 -8.744 10.740 -2.384 1.00 0.00 C ATOM 1230 OE1 GLU A 80 -8.742 9.562 -2.801 1.00 0.00 O ATOM 1231 OE2 GLU A 80 -9.390 11.659 -2.929 1.00 0.00 O ATOM 0 H GLU A 80 -7.758 8.218 1.927 1.00 0.00 H new ATOM 0 HA GLU A 80 -6.041 9.931 0.224 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -8.560 9.168 -0.412 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -8.953 10.517 0.636 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -8.152 12.083 -0.827 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.863 11.050 -1.412 1.00 0.00 H new ATOM 1238 N ASP A 81 -6.886 12.092 1.673 1.00 0.00 N ATOM 1239 CA ASP A 81 -6.817 13.146 2.683 1.00 0.00 C ATOM 1240 C ASP A 81 -7.802 12.899 3.826 1.00 0.00 C ATOM 1241 O ASP A 81 -7.606 13.385 4.939 1.00 0.00 O ATOM 1242 CB ASP A 81 -7.097 14.508 2.042 1.00 0.00 C ATOM 1243 CG ASP A 81 -5.826 15.246 1.673 1.00 0.00 C ATOM 1244 OD1 ASP A 81 -5.191 15.826 2.580 1.00 0.00 O ATOM 1245 OD2 ASP A 81 -5.464 15.244 0.478 1.00 0.00 O ATOM 0 H ASP A 81 -6.960 12.434 0.715 1.00 0.00 H new ATOM 0 HA ASP A 81 -5.810 13.138 3.100 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -7.705 14.368 1.148 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -7.681 15.118 2.732 1.00 0.00 H new ATOM 1250 N GLU A 82 -8.862 12.143 3.545 1.00 0.00 N ATOM 1251 CA GLU A 82 -9.877 11.836 4.551 1.00 0.00 C ATOM 1252 C GLU A 82 -9.245 11.346 5.855 1.00 0.00 C ATOM 1253 O GLU A 82 -9.842 11.471 6.925 1.00 0.00 O ATOM 1254 CB GLU A 82 -10.849 10.782 4.012 1.00 0.00 C ATOM 1255 CG GLU A 82 -12.302 11.225 4.045 1.00 0.00 C ATOM 1256 CD GLU A 82 -12.707 11.991 2.800 1.00 0.00 C ATOM 1257 OE1 GLU A 82 -11.976 12.927 2.416 1.00 0.00 O ATOM 1258 OE2 GLU A 82 -13.756 11.654 2.210 1.00 0.00 O ATOM 0 H GLU A 82 -9.040 11.732 2.629 1.00 0.00 H new ATOM 0 HA GLU A 82 -10.422 12.755 4.767 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -10.575 10.538 2.986 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -10.743 9.868 4.597 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -12.942 10.350 4.153 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -12.467 11.851 4.922 1.00 0.00 H new ATOM 1265 N GLU A 83 -8.039 10.787 5.758 1.00 0.00 N ATOM 1266 CA GLU A 83 -7.321 10.273 6.926 1.00 0.00 C ATOM 1267 C GLU A 83 -8.240 9.463 7.839 1.00 0.00 C ATOM 1268 O GLU A 83 -8.805 9.989 8.796 1.00 0.00 O ATOM 1269 CB GLU A 83 -6.676 11.421 7.714 1.00 0.00 C ATOM 1270 CG GLU A 83 -7.627 12.562 8.038 1.00 0.00 C ATOM 1271 CD GLU A 83 -6.990 13.616 8.922 1.00 0.00 C ATOM 1272 OE1 GLU A 83 -6.870 13.375 10.142 1.00 0.00 O ATOM 1273 OE2 GLU A 83 -6.612 14.683 8.395 1.00 0.00 O ATOM 0 H GLU A 83 -7.536 10.678 4.878 1.00 0.00 H new ATOM 0 HA GLU A 83 -6.538 9.609 6.560 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -6.270 11.025 8.645 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -5.836 11.814 7.141 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -7.963 13.025 7.110 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -8.512 12.163 8.534 1.00 0.00 H new ATOM 1280 N GLU A 84 -8.382 8.179 7.530 1.00 0.00 N ATOM 1281 CA GLU A 84 -9.229 7.288 8.314 1.00 0.00 C ATOM 1282 C GLU A 84 -8.496 6.767 9.550 1.00 0.00 C ATOM 1283 O GLU A 84 -9.025 6.826 10.660 1.00 0.00 O ATOM 1284 CB GLU A 84 -9.701 6.114 7.454 1.00 0.00 C ATOM 1285 CG GLU A 84 -10.999 6.387 6.711 1.00 0.00 C ATOM 1286 CD GLU A 84 -10.976 5.865 5.288 1.00 0.00 C ATOM 1287 OE1 GLU A 84 -10.083 6.278 4.518 1.00 0.00 O ATOM 1288 OE2 GLU A 84 -11.851 5.044 4.943 1.00 0.00 O ATOM 0 H GLU A 84 -7.920 7.731 6.739 1.00 0.00 H new ATOM 0 HA GLU A 84 -10.094 7.860 8.649 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -8.923 5.868 6.731 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -9.833 5.239 8.090 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -11.826 5.925 7.250 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -11.187 7.461 6.697 1.00 0.00 H new ATOM 1295 N PRO A 85 -7.268 6.240 9.381 1.00 0.00 N ATOM 1296 CA PRO A 85 -6.483 5.708 10.494 1.00 0.00 C ATOM 1297 C PRO A 85 -5.783 6.800 11.293 1.00 0.00 C ATOM 1298 O PRO A 85 -5.812 6.800 12.524 1.00 0.00 O ATOM 1299 CB PRO A 85 -5.463 4.811 9.798 1.00 0.00 C ATOM 1300 CG PRO A 85 -5.252 5.442 8.463 1.00 0.00 C ATOM 1301 CD PRO A 85 -6.551 6.118 8.094 1.00 0.00 C ATOM 0 HA PRO A 85 -7.105 5.189 11.223 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -4.532 4.758 10.362 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -5.835 3.791 9.700 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -4.437 6.164 8.501 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -4.980 4.693 7.719 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -6.378 7.093 7.639 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -7.119 5.527 7.375 1.00 0.00 H new ATOM 1309 N LYS A 86 -5.158 7.728 10.583 1.00 0.00 N ATOM 1310 CA LYS A 86 -4.449 8.833 11.221 1.00 0.00 C ATOM 1311 C LYS A 86 -3.341 8.318 12.136 1.00 0.00 C ATOM 1312 O LYS A 86 -3.395 8.493 13.354 1.00 0.00 O ATOM 1313 CB LYS A 86 -5.427 9.696 12.019 1.00 0.00 C ATOM 1314 CG LYS A 86 -5.028 11.161 12.090 1.00 0.00 C ATOM 1315 CD LYS A 86 -6.169 12.025 12.603 1.00 0.00 C ATOM 1316 CE LYS A 86 -6.455 11.760 14.074 1.00 0.00 C ATOM 1317 NZ LYS A 86 -7.901 11.507 14.323 1.00 0.00 N ATOM 0 H LYS A 86 -5.126 7.740 9.564 1.00 0.00 H new ATOM 0 HA LYS A 86 -3.992 9.439 10.439 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -6.417 9.619 11.569 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.505 9.300 13.031 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -4.163 11.272 12.744 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -4.726 11.505 11.101 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -5.920 13.077 12.464 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -7.067 11.829 12.016 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -5.874 10.900 14.407 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -6.129 12.615 14.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -8.053 11.331 15.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -8.454 12.337 14.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -8.207 10.676 13.778 1.00 0.00 H new ATOM 1331 N ASP A 87 -2.334 7.683 11.542 1.00 0.00 N ATOM 1332 CA ASP A 87 -1.212 7.146 12.304 1.00 0.00 C ATOM 1333 C ASP A 87 -0.004 6.907 11.403 1.00 0.00 C ATOM 1334 O ASP A 87 0.009 7.313 10.244 1.00 0.00 O ATOM 1335 CB ASP A 87 -1.616 5.841 12.994 1.00 0.00 C ATOM 1336 CG ASP A 87 -1.033 5.720 14.388 1.00 0.00 C ATOM 1337 OD1 ASP A 87 0.096 5.201 14.516 1.00 0.00 O ATOM 1338 OD2 ASP A 87 -1.705 6.144 15.352 1.00 0.00 O ATOM 0 H ASP A 87 -2.273 7.528 10.536 1.00 0.00 H new ATOM 0 HA ASP A 87 -0.936 7.880 13.061 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -2.703 5.785 13.052 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -1.285 4.996 12.390 1.00 0.00 H new ATOM 1343 N GLU A 88 1.011 6.239 11.944 1.00 0.00 N ATOM 1344 CA GLU A 88 2.224 5.942 11.186 1.00 0.00 C ATOM 1345 C GLU A 88 1.907 5.162 9.909 1.00 0.00 C ATOM 1346 O GLU A 88 2.735 5.078 9.005 1.00 0.00 O ATOM 1347 CB GLU A 88 3.207 5.151 12.050 1.00 0.00 C ATOM 1348 CG GLU A 88 4.411 5.963 12.488 1.00 0.00 C ATOM 1349 CD GLU A 88 4.079 6.957 13.583 1.00 0.00 C ATOM 1350 OE1 GLU A 88 3.471 8.002 13.272 1.00 0.00 O ATOM 1351 OE2 GLU A 88 4.427 6.690 14.752 1.00 0.00 O ATOM 0 H GLU A 88 1.018 5.893 12.904 1.00 0.00 H new ATOM 0 HA GLU A 88 2.678 6.890 10.899 1.00 0.00 H new ATOM 0 HB2 GLU A 88 2.687 4.781 12.933 1.00 0.00 H new ATOM 0 HB3 GLU A 88 3.549 4.279 11.493 1.00 0.00 H new ATOM 0 HG2 GLU A 88 5.191 5.288 12.840 1.00 0.00 H new ATOM 0 HG3 GLU A 88 4.816 6.497 11.629 1.00 0.00 H new ATOM 1358 N ASP A 89 0.707 4.589 9.844 1.00 0.00 N ATOM 1359 CA ASP A 89 0.289 3.811 8.683 1.00 0.00 C ATOM 1360 C ASP A 89 0.309 4.644 7.397 1.00 0.00 C ATOM 1361 O ASP A 89 0.248 4.088 6.302 1.00 0.00 O ATOM 1362 CB ASP A 89 -1.108 3.231 8.906 1.00 0.00 C ATOM 1363 CG ASP A 89 -1.074 1.912 9.655 1.00 0.00 C ATOM 1364 OD1 ASP A 89 -0.836 0.866 9.010 1.00 0.00 O ATOM 1365 OD2 ASP A 89 -1.284 1.922 10.885 1.00 0.00 O ATOM 0 H ASP A 89 0.007 4.650 10.584 1.00 0.00 H new ATOM 0 HA ASP A 89 1.005 2.998 8.564 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -1.711 3.947 9.464 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -1.596 3.086 7.942 1.00 0.00 H new ATOM 1370 N PHE A 90 0.388 5.971 7.523 1.00 0.00 N ATOM 1371 CA PHE A 90 0.412 6.834 6.343 1.00 0.00 C ATOM 1372 C PHE A 90 1.837 7.256 5.982 1.00 0.00 C ATOM 1373 O PHE A 90 2.100 7.676 4.852 1.00 0.00 O ATOM 1374 CB PHE A 90 -0.472 8.074 6.538 1.00 0.00 C ATOM 1375 CG PHE A 90 -0.286 8.783 7.853 1.00 0.00 C ATOM 1376 CD1 PHE A 90 0.966 9.219 8.258 1.00 0.00 C ATOM 1377 CD2 PHE A 90 -1.374 9.025 8.678 1.00 0.00 C ATOM 1378 CE1 PHE A 90 1.128 9.880 9.462 1.00 0.00 C ATOM 1379 CE2 PHE A 90 -1.216 9.684 9.883 1.00 0.00 C ATOM 1380 CZ PHE A 90 0.036 10.112 10.276 1.00 0.00 C ATOM 0 H PHE A 90 0.436 6.463 8.415 1.00 0.00 H new ATOM 0 HA PHE A 90 0.010 6.249 5.516 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -0.270 8.778 5.730 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -1.516 7.776 6.447 1.00 0.00 H new ATOM 0 HD1 PHE A 90 1.824 9.041 7.627 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -2.357 8.695 8.376 1.00 0.00 H new ATOM 0 HE1 PHE A 90 2.109 10.215 9.766 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -2.072 9.864 10.517 1.00 0.00 H new ATOM 0 HZ PHE A 90 0.162 10.627 11.217 1.00 0.00 H new ATOM 1390 N SER A 91 2.756 7.139 6.942 1.00 0.00 N ATOM 1391 CA SER A 91 4.152 7.507 6.715 1.00 0.00 C ATOM 1392 C SER A 91 5.044 7.001 7.850 1.00 0.00 C ATOM 1393 O SER A 91 5.501 7.782 8.685 1.00 0.00 O ATOM 1394 CB SER A 91 4.297 9.027 6.584 1.00 0.00 C ATOM 1395 OG SER A 91 3.161 9.600 5.958 1.00 0.00 O ATOM 0 H SER A 91 2.558 6.793 7.881 1.00 0.00 H new ATOM 0 HA SER A 91 4.470 7.038 5.784 1.00 0.00 H new ATOM 0 HB2 SER A 91 4.432 9.468 7.572 1.00 0.00 H new ATOM 0 HB3 SER A 91 5.191 9.261 6.005 1.00 0.00 H new ATOM 0 HG SER A 91 3.021 9.178 5.084 1.00 0.00 H new ATOM 1401 N PRO A 92 5.305 5.682 7.896 1.00 0.00 N ATOM 1402 CA PRO A 92 6.144 5.079 8.937 1.00 0.00 C ATOM 1403 C PRO A 92 7.585 5.582 8.893 1.00 0.00 C ATOM 1404 O PRO A 92 7.997 6.379 9.735 1.00 0.00 O ATOM 1405 CB PRO A 92 6.090 3.577 8.630 1.00 0.00 C ATOM 1406 CG PRO A 92 5.658 3.479 7.207 1.00 0.00 C ATOM 1407 CD PRO A 92 4.797 4.681 6.944 1.00 0.00 C ATOM 0 HA PRO A 92 5.786 5.333 9.935 1.00 0.00 H new ATOM 0 HB2 PRO A 92 7.064 3.111 8.778 1.00 0.00 H new ATOM 0 HB3 PRO A 92 5.389 3.066 9.290 1.00 0.00 H new ATOM 0 HG2 PRO A 92 6.519 3.464 6.539 1.00 0.00 H new ATOM 0 HG3 PRO A 92 5.103 2.557 7.032 1.00 0.00 H new ATOM 0 HD2 PRO A 92 4.890 5.024 5.913 1.00 0.00 H new ATOM 0 HD3 PRO A 92 3.742 4.464 7.114 1.00 0.00 H new ATOM 1415 N ASP A 93 8.347 5.115 7.907 1.00 0.00 N ATOM 1416 CA ASP A 93 9.742 5.520 7.759 1.00 0.00 C ATOM 1417 C ASP A 93 9.875 6.658 6.753 1.00 0.00 C ATOM 1418 O ASP A 93 10.838 6.716 5.989 1.00 0.00 O ATOM 1419 CB ASP A 93 10.596 4.329 7.319 1.00 0.00 C ATOM 1420 CG ASP A 93 11.835 4.158 8.178 1.00 0.00 C ATOM 1421 OD1 ASP A 93 12.406 5.183 8.605 1.00 0.00 O ATOM 1422 OD2 ASP A 93 12.232 3.000 8.424 1.00 0.00 O ATOM 0 H ASP A 93 8.022 4.456 7.199 1.00 0.00 H new ATOM 0 HA ASP A 93 10.097 5.874 8.727 1.00 0.00 H new ATOM 0 HB2 ASP A 93 9.997 3.419 7.364 1.00 0.00 H new ATOM 0 HB3 ASP A 93 10.894 4.463 6.279 1.00 0.00 H new ATOM 1427 N GLY A 94 8.901 7.562 6.759 1.00 0.00 N ATOM 1428 CA GLY A 94 8.929 8.685 5.843 1.00 0.00 C ATOM 1429 C GLY A 94 8.265 9.918 6.423 1.00 0.00 C ATOM 1430 O GLY A 94 7.114 9.865 6.856 1.00 0.00 O ATOM 0 H GLY A 94 8.094 7.536 7.382 1.00 0.00 H new ATOM 0 HA2 GLY A 94 9.963 8.918 5.589 1.00 0.00 H new ATOM 0 HA3 GLY A 94 8.428 8.407 4.916 1.00 0.00 H new ATOM 1434 N GLY A 95 8.991 11.029 6.434 1.00 0.00 N ATOM 1435 CA GLY A 95 8.448 12.263 6.967 1.00 0.00 C ATOM 1436 C GLY A 95 7.350 12.836 6.092 1.00 0.00 C ATOM 1437 O GLY A 95 6.497 13.585 6.568 1.00 0.00 O ATOM 0 H GLY A 95 9.946 11.097 6.083 1.00 0.00 H new ATOM 0 HA2 GLY A 95 8.055 12.082 7.967 1.00 0.00 H new ATOM 0 HA3 GLY A 95 9.249 12.996 7.067 1.00 0.00 H new ATOM 1441 N TYR A 96 7.373 12.486 4.810 1.00 0.00 N ATOM 1442 CA TYR A 96 6.369 12.975 3.867 1.00 0.00 C ATOM 1443 C TYR A 96 4.962 12.647 4.350 1.00 0.00 C ATOM 1444 O TYR A 96 4.785 11.994 5.378 1.00 0.00 O ATOM 1445 CB TYR A 96 6.588 12.392 2.467 1.00 0.00 C ATOM 1446 CG TYR A 96 7.132 10.976 2.452 1.00 0.00 C ATOM 1447 CD1 TYR A 96 8.502 10.740 2.454 1.00 0.00 C ATOM 1448 CD2 TYR A 96 6.278 9.879 2.425 1.00 0.00 C ATOM 1449 CE1 TYR A 96 9.004 9.454 2.433 1.00 0.00 C ATOM 1450 CE2 TYR A 96 6.774 8.589 2.405 1.00 0.00 C ATOM 1451 CZ TYR A 96 8.137 8.383 2.409 1.00 0.00 C ATOM 1452 OH TYR A 96 8.636 7.100 2.389 1.00 0.00 O ATOM 0 H TYR A 96 8.073 11.868 4.400 1.00 0.00 H new ATOM 0 HA TYR A 96 6.478 14.058 3.810 1.00 0.00 H new ATOM 0 HB2 TYR A 96 5.641 12.409 1.928 1.00 0.00 H new ATOM 0 HB3 TYR A 96 7.277 13.038 1.922 1.00 0.00 H new ATOM 0 HD1 TYR A 96 9.185 11.576 2.472 1.00 0.00 H new ATOM 0 HD2 TYR A 96 5.210 10.037 2.420 1.00 0.00 H new ATOM 0 HE1 TYR A 96 10.071 9.288 2.435 1.00 0.00 H new ATOM 0 HE2 TYR A 96 6.098 7.747 2.386 1.00 0.00 H new ATOM 0 HH TYR A 96 9.479 7.085 1.890 1.00 0.00 H new ATOM 1462 N ILE A 97 3.963 13.112 3.604 1.00 0.00 N ATOM 1463 CA ILE A 97 2.565 12.880 3.962 1.00 0.00 C ATOM 1464 C ILE A 97 1.646 12.958 2.699 1.00 0.00 C ATOM 1465 O ILE A 97 1.162 14.073 2.537 1.00 0.00 O ATOM 1466 CB ILE A 97 2.102 13.892 5.043 1.00 0.00 C ATOM 1467 CG1 ILE A 97 2.064 15.331 4.517 1.00 0.00 C ATOM 1468 CG2 ILE A 97 3.006 13.811 6.265 1.00 0.00 C ATOM 1469 CD1 ILE A 97 3.129 15.674 3.490 1.00 0.00 C ATOM 0 H ILE A 97 4.095 13.651 2.748 1.00 0.00 H new ATOM 0 HA ILE A 97 2.483 11.875 4.377 1.00 0.00 H new ATOM 0 HB ILE A 97 1.084 13.618 5.321 1.00 0.00 H new ATOM 0 HG12 ILE A 97 1.084 15.513 4.075 1.00 0.00 H new ATOM 0 HG13 ILE A 97 2.164 16.012 5.362 1.00 0.00 H new ATOM 0 HG21 ILE A 97 2.669 14.527 7.015 1.00 0.00 H new ATOM 0 HG22 ILE A 97 2.967 12.804 6.681 1.00 0.00 H new ATOM 0 HG23 ILE A 97 4.031 14.044 5.976 1.00 0.00 H new ATOM 0 HD11 ILE A 97 3.016 16.713 3.182 1.00 0.00 H new ATOM 0 HD12 ILE A 97 4.117 15.531 3.928 1.00 0.00 H new ATOM 0 HD13 ILE A 97 3.020 15.024 2.622 1.00 0.00 H new ATOM 1481 N PRO A 98 0.769 11.923 2.602 1.00 0.00 N ATOM 1482 CA PRO A 98 0.889 10.436 2.704 1.00 0.00 C ATOM 1483 C PRO A 98 1.399 9.831 1.402 1.00 0.00 C ATOM 1484 O PRO A 98 1.157 10.375 0.320 1.00 0.00 O ATOM 1485 CB PRO A 98 -0.526 9.968 2.973 1.00 0.00 C ATOM 1486 CG PRO A 98 -0.847 10.889 4.027 1.00 0.00 C ATOM 1487 CD PRO A 98 0.425 11.676 4.076 1.00 0.00 C ATOM 0 HA PRO A 98 1.595 10.136 3.478 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -1.179 10.070 2.106 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -0.576 8.926 3.289 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -1.712 11.508 3.791 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -1.063 10.386 4.969 1.00 0.00 H new ATOM 0 HD2 PRO A 98 0.293 12.613 4.617 1.00 0.00 H new ATOM 0 HD3 PRO A 98 1.216 11.124 4.583 1.00 0.00 H new ATOM 1495 N ARG A 99 2.121 8.717 1.516 1.00 0.00 N ATOM 1496 CA ARG A 99 2.695 8.039 0.362 1.00 0.00 C ATOM 1497 C ARG A 99 2.232 6.584 0.288 1.00 0.00 C ATOM 1498 O ARG A 99 1.318 6.176 1.006 1.00 0.00 O ATOM 1499 CB ARG A 99 4.219 8.102 0.442 1.00 0.00 C ATOM 1500 CG ARG A 99 4.836 9.192 -0.415 1.00 0.00 C ATOM 1501 CD ARG A 99 4.374 10.578 0.007 1.00 0.00 C ATOM 1502 NE ARG A 99 4.187 11.470 -1.133 1.00 0.00 N ATOM 1503 CZ ARG A 99 3.937 12.773 -1.021 1.00 0.00 C ATOM 1504 NH1 ARG A 99 3.823 13.332 0.178 1.00 0.00 N ATOM 1505 NH2 ARG A 99 3.797 13.518 -2.108 1.00 0.00 N ATOM 0 H ARG A 99 2.322 8.264 2.407 1.00 0.00 H new ATOM 0 HA ARG A 99 2.354 8.544 -0.542 1.00 0.00 H new ATOM 0 HB2 ARG A 99 4.512 8.260 1.480 1.00 0.00 H new ATOM 0 HB3 ARG A 99 4.629 7.139 0.138 1.00 0.00 H new ATOM 0 HG2 ARG A 99 5.922 9.136 -0.347 1.00 0.00 H new ATOM 0 HG3 ARG A 99 4.573 9.025 -1.459 1.00 0.00 H new ATOM 0 HD2 ARG A 99 3.437 10.494 0.558 1.00 0.00 H new ATOM 0 HD3 ARG A 99 5.106 11.011 0.688 1.00 0.00 H new ATOM 0 HE ARG A 99 4.252 11.072 -2.070 1.00 0.00 H new ATOM 0 HH11 ARG A 99 3.927 12.763 1.018 1.00 0.00 H new ATOM 0 HH12 ARG A 99 3.631 14.331 0.259 1.00 0.00 H new ATOM 0 HH21 ARG A 99 3.881 13.093 -3.032 1.00 0.00 H new ATOM 0 HH22 ARG A 99 3.605 14.516 -2.021 1.00 0.00 H new ATOM 1519 N ILE A 100 2.866 5.807 -0.590 1.00 0.00 N ATOM 1520 CA ILE A 100 2.515 4.397 -0.762 1.00 0.00 C ATOM 1521 C ILE A 100 3.334 3.503 0.166 1.00 0.00 C ATOM 1522 O ILE A 100 4.557 3.425 0.050 1.00 0.00 O ATOM 1523 CB ILE A 100 2.725 3.945 -2.221 1.00 0.00 C ATOM 1524 CG1 ILE A 100 1.883 4.804 -3.170 1.00 0.00 C ATOM 1525 CG2 ILE A 100 2.374 2.472 -2.381 1.00 0.00 C ATOM 1526 CD1 ILE A 100 2.698 5.573 -4.183 1.00 0.00 C ATOM 0 H ILE A 100 3.624 6.129 -1.192 1.00 0.00 H new ATOM 0 HA ILE A 100 1.460 4.299 -0.507 1.00 0.00 H new ATOM 0 HB ILE A 100 3.777 4.075 -2.476 1.00 0.00 H new ATOM 0 HG12 ILE A 100 1.178 4.161 -3.697 1.00 0.00 H new ATOM 0 HG13 ILE A 100 1.294 5.508 -2.582 1.00 0.00 H new ATOM 0 HG21 ILE A 100 2.529 2.172 -3.417 1.00 0.00 H new ATOM 0 HG22 ILE A 100 3.012 1.873 -1.731 1.00 0.00 H new ATOM 0 HG23 ILE A 100 1.330 2.315 -2.110 1.00 0.00 H new ATOM 0 HD11 ILE A 100 2.032 6.157 -4.818 1.00 0.00 H new ATOM 0 HD12 ILE A 100 3.385 6.243 -3.665 1.00 0.00 H new ATOM 0 HD13 ILE A 100 3.266 4.875 -4.798 1.00 0.00 H new ATOM 1538 N LEU A 101 2.648 2.842 1.098 1.00 0.00 N ATOM 1539 CA LEU A 101 3.304 1.962 2.062 1.00 0.00 C ATOM 1540 C LEU A 101 2.873 0.510 1.877 1.00 0.00 C ATOM 1541 O LEU A 101 1.690 0.224 1.675 1.00 0.00 O ATOM 1542 CB LEU A 101 2.950 2.390 3.494 1.00 0.00 C ATOM 1543 CG LEU A 101 3.504 3.739 3.973 1.00 0.00 C ATOM 1544 CD1 LEU A 101 3.698 4.704 2.819 1.00 0.00 C ATOM 1545 CD2 LEU A 101 2.571 4.347 5.004 1.00 0.00 C ATOM 0 H LEU A 101 1.635 2.900 1.205 1.00 0.00 H new ATOM 0 HA LEU A 101 4.378 2.041 1.893 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.864 2.419 3.580 1.00 0.00 H new ATOM 0 HB3 LEU A 101 3.303 1.617 4.176 1.00 0.00 H new ATOM 0 HG LEU A 101 4.479 3.557 4.425 1.00 0.00 H new ATOM 0 HD11 LEU A 101 4.091 5.648 3.196 1.00 0.00 H new ATOM 0 HD12 LEU A 101 4.401 4.278 2.103 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.741 4.880 2.327 1.00 0.00 H new ATOM 0 HD21 LEU A 101 2.972 5.304 5.338 1.00 0.00 H new ATOM 0 HD22 LEU A 101 1.588 4.501 4.559 1.00 0.00 H new ATOM 0 HD23 LEU A 101 2.482 3.673 5.856 1.00 0.00 H new ATOM 1557 N PHE A 102 3.826 -0.414 1.985 1.00 0.00 N ATOM 1558 CA PHE A 102 3.511 -1.829 1.871 1.00 0.00 C ATOM 1559 C PHE A 102 3.309 -2.408 3.270 1.00 0.00 C ATOM 1560 O PHE A 102 4.069 -2.098 4.198 1.00 0.00 O ATOM 1561 CB PHE A 102 4.622 -2.570 1.128 1.00 0.00 C ATOM 1562 CG PHE A 102 4.510 -2.474 -0.368 1.00 0.00 C ATOM 1563 CD1 PHE A 102 4.350 -1.242 -0.984 1.00 0.00 C ATOM 1564 CD2 PHE A 102 4.567 -3.611 -1.157 1.00 0.00 C ATOM 1565 CE1 PHE A 102 4.247 -1.148 -2.359 1.00 0.00 C ATOM 1566 CE2 PHE A 102 4.467 -3.523 -2.533 1.00 0.00 C ATOM 1567 CZ PHE A 102 4.306 -2.291 -3.135 1.00 0.00 C ATOM 0 H PHE A 102 4.811 -0.208 2.150 1.00 0.00 H new ATOM 0 HA PHE A 102 2.593 -1.953 1.296 1.00 0.00 H new ATOM 0 HB2 PHE A 102 5.587 -2.169 1.439 1.00 0.00 H new ATOM 0 HB3 PHE A 102 4.605 -3.620 1.419 1.00 0.00 H new ATOM 0 HD1 PHE A 102 4.305 -0.346 -0.383 1.00 0.00 H new ATOM 0 HD2 PHE A 102 4.691 -4.578 -0.692 1.00 0.00 H new ATOM 0 HE1 PHE A 102 4.121 -0.183 -2.827 1.00 0.00 H new ATOM 0 HE2 PHE A 102 4.515 -4.417 -3.137 1.00 0.00 H new ATOM 0 HZ PHE A 102 4.226 -2.220 -4.210 1.00 0.00 H new ATOM 1577 N LEU A 103 2.269 -3.218 3.444 1.00 0.00 N ATOM 1578 CA LEU A 103 1.988 -3.782 4.761 1.00 0.00 C ATOM 1579 C LEU A 103 1.558 -5.241 4.696 1.00 0.00 C ATOM 1580 O LEU A 103 1.202 -5.757 3.636 1.00 0.00 O ATOM 1581 CB LEU A 103 0.923 -2.944 5.473 1.00 0.00 C ATOM 1582 CG LEU A 103 -0.507 -3.106 4.968 1.00 0.00 C ATOM 1583 CD1 LEU A 103 -1.422 -2.099 5.644 1.00 0.00 C ATOM 1584 CD2 LEU A 103 -0.561 -2.939 3.462 1.00 0.00 C ATOM 0 H LEU A 103 1.619 -3.494 2.708 1.00 0.00 H new ATOM 0 HA LEU A 103 2.918 -3.753 5.329 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.943 -3.194 6.534 1.00 0.00 H new ATOM 0 HB3 LEU A 103 1.200 -1.893 5.388 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.849 -4.111 5.216 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.439 -2.226 5.274 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.405 -2.259 6.722 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.079 -1.089 5.422 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.589 -3.058 3.119 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.201 -1.946 3.193 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.068 -3.693 2.990 1.00 0.00 H new ATOM 1596 N ASP A 104 1.604 -5.898 5.854 1.00 0.00 N ATOM 1597 CA ASP A 104 1.231 -7.304 5.962 1.00 0.00 C ATOM 1598 C ASP A 104 -0.282 -7.481 5.853 1.00 0.00 C ATOM 1599 O ASP A 104 -1.049 -6.579 6.205 1.00 0.00 O ATOM 1600 CB ASP A 104 1.733 -7.884 7.287 1.00 0.00 C ATOM 1601 CG ASP A 104 2.751 -8.989 7.088 1.00 0.00 C ATOM 1602 OD1 ASP A 104 3.323 -9.078 5.981 1.00 0.00 O ATOM 1603 OD2 ASP A 104 2.976 -9.768 8.038 1.00 0.00 O ATOM 0 H ASP A 104 1.898 -5.474 6.734 1.00 0.00 H new ATOM 0 HA ASP A 104 1.698 -7.842 5.137 1.00 0.00 H new ATOM 0 HB2 ASP A 104 2.178 -7.087 7.883 1.00 0.00 H new ATOM 0 HB3 ASP A 104 0.887 -8.272 7.854 1.00 0.00 H new ATOM 1608 N PRO A 105 -0.722 -8.658 5.361 1.00 0.00 N ATOM 1609 CA PRO A 105 -2.145 -8.975 5.193 1.00 0.00 C ATOM 1610 C PRO A 105 -2.931 -8.851 6.492 1.00 0.00 C ATOM 1611 O PRO A 105 -3.017 -9.802 7.270 1.00 0.00 O ATOM 1612 CB PRO A 105 -2.152 -10.431 4.708 1.00 0.00 C ATOM 1613 CG PRO A 105 -0.784 -10.955 4.987 1.00 0.00 C ATOM 1614 CD PRO A 105 0.138 -9.771 4.932 1.00 0.00 C ATOM 0 HA PRO A 105 -2.623 -8.282 4.500 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -2.909 -11.015 5.232 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -2.384 -10.488 3.645 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -0.743 -11.435 5.965 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -0.497 -11.706 4.251 1.00 0.00 H new ATOM 0 HD2 PRO A 105 0.995 -9.896 5.594 1.00 0.00 H new ATOM 0 HD3 PRO A 105 0.531 -9.613 3.928 1.00 0.00 H new ATOM 1622 N SER A 106 -3.503 -7.671 6.713 1.00 0.00 N ATOM 1623 CA SER A 106 -4.292 -7.388 7.912 1.00 0.00 C ATOM 1624 C SER A 106 -4.353 -5.886 8.158 1.00 0.00 C ATOM 1625 O SER A 106 -5.301 -5.380 8.757 1.00 0.00 O ATOM 1626 CB SER A 106 -3.702 -8.084 9.142 1.00 0.00 C ATOM 1627 OG SER A 106 -2.285 -8.057 9.113 1.00 0.00 O ATOM 0 H SER A 106 -3.434 -6.884 6.068 1.00 0.00 H new ATOM 0 HA SER A 106 -5.298 -7.773 7.747 1.00 0.00 H new ATOM 0 HB2 SER A 106 -4.060 -7.594 10.048 1.00 0.00 H new ATOM 0 HB3 SER A 106 -4.048 -9.117 9.180 1.00 0.00 H new ATOM 0 HG SER A 106 -1.949 -8.901 8.746 1.00 0.00 H new ATOM 1633 N GLY A 107 -3.325 -5.183 7.696 1.00 0.00 N ATOM 1634 CA GLY A 107 -3.265 -3.749 7.876 1.00 0.00 C ATOM 1635 C GLY A 107 -2.145 -3.347 8.813 1.00 0.00 C ATOM 1636 O GLY A 107 -2.334 -2.501 9.686 1.00 0.00 O ATOM 0 H GLY A 107 -2.530 -5.585 7.198 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -3.121 -3.267 6.909 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -4.216 -3.392 8.272 1.00 0.00 H new ATOM 1640 N LYS A 108 -0.978 -3.967 8.644 1.00 0.00 N ATOM 1641 CA LYS A 108 0.165 -3.669 9.507 1.00 0.00 C ATOM 1642 C LYS A 108 1.337 -3.071 8.726 1.00 0.00 C ATOM 1643 O LYS A 108 2.339 -3.745 8.485 1.00 0.00 O ATOM 1644 CB LYS A 108 0.619 -4.937 10.234 1.00 0.00 C ATOM 1645 CG LYS A 108 0.064 -5.058 11.646 1.00 0.00 C ATOM 1646 CD LYS A 108 1.177 -5.150 12.678 1.00 0.00 C ATOM 1647 CE LYS A 108 1.409 -6.586 13.121 1.00 0.00 C ATOM 1648 NZ LYS A 108 2.644 -6.721 13.942 1.00 0.00 N ATOM 0 H LYS A 108 -0.799 -4.670 7.927 1.00 0.00 H new ATOM 0 HA LYS A 108 -0.162 -2.924 10.233 1.00 0.00 H new ATOM 0 HB2 LYS A 108 0.312 -5.808 9.655 1.00 0.00 H new ATOM 0 HB3 LYS A 108 1.708 -4.951 10.278 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -0.566 -4.196 11.865 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -0.570 -5.942 11.714 1.00 0.00 H new ATOM 0 HD2 LYS A 108 2.098 -4.744 12.259 1.00 0.00 H new ATOM 0 HD3 LYS A 108 0.924 -4.538 13.543 1.00 0.00 H new ATOM 0 HE2 LYS A 108 0.551 -6.931 13.697 1.00 0.00 H new ATOM 0 HE3 LYS A 108 1.484 -7.229 12.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 2.766 -7.714 14.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 3.467 -6.415 13.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 2.562 -6.127 14.792 1.00 0.00 H new ATOM 1662 N VAL A 109 1.211 -1.800 8.346 1.00 0.00 N ATOM 1663 CA VAL A 109 2.271 -1.112 7.609 1.00 0.00 C ATOM 1664 C VAL A 109 3.578 -1.163 8.377 1.00 0.00 C ATOM 1665 O VAL A 109 3.642 -0.793 9.550 1.00 0.00 O ATOM 1666 CB VAL A 109 1.883 0.360 7.316 1.00 0.00 C ATOM 1667 CG1 VAL A 109 3.040 1.314 7.592 1.00 0.00 C ATOM 1668 CG2 VAL A 109 1.401 0.508 5.881 1.00 0.00 C ATOM 0 H VAL A 109 0.389 -1.227 8.535 1.00 0.00 H new ATOM 0 HA VAL A 109 2.402 -1.628 6.658 1.00 0.00 H new ATOM 0 HB VAL A 109 1.069 0.626 7.990 1.00 0.00 H new ATOM 0 HG11 VAL A 109 2.729 2.336 7.375 1.00 0.00 H new ATOM 0 HG12 VAL A 109 3.332 1.239 8.639 1.00 0.00 H new ATOM 0 HG13 VAL A 109 3.888 1.051 6.959 1.00 0.00 H new ATOM 0 HG21 VAL A 109 1.133 1.548 5.693 1.00 0.00 H new ATOM 0 HG22 VAL A 109 2.196 0.209 5.198 1.00 0.00 H new ATOM 0 HG23 VAL A 109 0.529 -0.126 5.723 1.00 0.00 H new ATOM 1678 N HIS A 110 4.620 -1.621 7.702 1.00 0.00 N ATOM 1679 CA HIS A 110 5.933 -1.717 8.316 1.00 0.00 C ATOM 1680 C HIS A 110 6.931 -0.852 7.562 1.00 0.00 C ATOM 1681 O HIS A 110 6.933 -0.829 6.331 1.00 0.00 O ATOM 1682 CB HIS A 110 6.405 -3.172 8.340 1.00 0.00 C ATOM 1683 CG HIS A 110 6.877 -3.627 9.687 1.00 0.00 C ATOM 1684 ND1 HIS A 110 8.210 -3.797 9.999 1.00 0.00 N ATOM 1685 CD2 HIS A 110 6.186 -3.943 10.808 1.00 0.00 C ATOM 1686 CE1 HIS A 110 8.318 -4.201 11.252 1.00 0.00 C ATOM 1687 NE2 HIS A 110 7.106 -4.297 11.765 1.00 0.00 N ATOM 0 H HIS A 110 4.582 -1.931 6.731 1.00 0.00 H new ATOM 0 HA HIS A 110 5.864 -1.357 9.343 1.00 0.00 H new ATOM 0 HB2 HIS A 110 5.588 -3.816 8.014 1.00 0.00 H new ATOM 0 HB3 HIS A 110 7.214 -3.295 7.620 1.00 0.00 H new ATOM 0 HD2 HIS A 110 5.113 -3.921 10.927 1.00 0.00 H new ATOM 0 HE1 HIS A 110 9.242 -4.416 11.769 1.00 0.00 H new ATOM 0 HE2 HIS A 110 6.887 -4.587 12.718 1.00 0.00 H new ATOM 1696 N PRO A 111 7.802 -0.132 8.283 1.00 0.00 N ATOM 1697 CA PRO A 111 8.811 0.725 7.659 1.00 0.00 C ATOM 1698 C PRO A 111 9.897 -0.094 6.975 1.00 0.00 C ATOM 1699 O PRO A 111 11.079 0.239 7.048 1.00 0.00 O ATOM 1700 CB PRO A 111 9.395 1.505 8.839 1.00 0.00 C ATOM 1701 CG PRO A 111 9.166 0.632 10.023 1.00 0.00 C ATOM 1702 CD PRO A 111 7.880 -0.103 9.754 1.00 0.00 C ATOM 0 HA PRO A 111 8.390 1.363 6.882 1.00 0.00 H new ATOM 0 HB2 PRO A 111 10.457 1.705 8.694 1.00 0.00 H new ATOM 0 HB3 PRO A 111 8.902 2.470 8.958 1.00 0.00 H new ATOM 0 HG2 PRO A 111 9.993 -0.065 10.159 1.00 0.00 H new ATOM 0 HG3 PRO A 111 9.094 1.223 10.936 1.00 0.00 H new ATOM 0 HD2 PRO A 111 7.897 -1.108 10.175 1.00 0.00 H new ATOM 0 HD3 PRO A 111 7.024 0.412 10.191 1.00 0.00 H new ATOM 1710 N GLU A 112 9.488 -1.177 6.318 1.00 0.00 N ATOM 1711 CA GLU A 112 10.432 -2.051 5.631 1.00 0.00 C ATOM 1712 C GLU A 112 10.169 -2.072 4.131 1.00 0.00 C ATOM 1713 O GLU A 112 10.982 -1.592 3.342 1.00 0.00 O ATOM 1714 CB GLU A 112 10.344 -3.471 6.195 1.00 0.00 C ATOM 1715 CG GLU A 112 11.336 -4.436 5.568 1.00 0.00 C ATOM 1716 CD GLU A 112 11.565 -5.670 6.418 1.00 0.00 C ATOM 1717 OE1 GLU A 112 10.615 -6.102 7.106 1.00 0.00 O ATOM 1718 OE2 GLU A 112 12.692 -6.206 6.395 1.00 0.00 O ATOM 0 H GLU A 112 8.513 -1.468 6.248 1.00 0.00 H new ATOM 0 HA GLU A 112 11.436 -1.659 5.797 1.00 0.00 H new ATOM 0 HB2 GLU A 112 10.513 -3.437 7.271 1.00 0.00 H new ATOM 0 HB3 GLU A 112 9.334 -3.852 6.043 1.00 0.00 H new ATOM 0 HG2 GLU A 112 10.972 -4.738 4.586 1.00 0.00 H new ATOM 0 HG3 GLU A 112 12.286 -3.925 5.413 1.00 0.00 H new ATOM 1725 N ILE A 113 9.032 -2.637 3.743 1.00 0.00 N ATOM 1726 CA ILE A 113 8.669 -2.725 2.335 1.00 0.00 C ATOM 1727 C ILE A 113 8.391 -1.344 1.748 1.00 0.00 C ATOM 1728 O ILE A 113 7.266 -0.829 1.819 1.00 0.00 O ATOM 1729 CB ILE A 113 7.446 -3.636 2.125 1.00 0.00 C ATOM 1730 CG1 ILE A 113 7.643 -4.964 2.855 1.00 0.00 C ATOM 1731 CG2 ILE A 113 7.215 -3.873 0.640 1.00 0.00 C ATOM 1732 CD1 ILE A 113 8.906 -5.692 2.451 1.00 0.00 C ATOM 0 H ILE A 113 8.347 -3.040 4.382 1.00 0.00 H new ATOM 0 HA ILE A 113 9.520 -3.162 1.814 1.00 0.00 H new ATOM 0 HB ILE A 113 6.566 -3.142 2.538 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.667 -4.779 3.929 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.784 -5.607 2.661 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.347 -4.519 0.505 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.038 -2.919 0.143 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.094 -4.351 0.207 1.00 0.00 H new ATOM 0 HD11 ILE A 113 8.982 -6.626 3.008 1.00 0.00 H new ATOM 0 HD12 ILE A 113 8.876 -5.908 1.383 1.00 0.00 H new ATOM 0 HD13 ILE A 113 9.772 -5.067 2.670 1.00 0.00 H new ATOM 1744 N ILE A 114 9.438 -0.755 1.173 1.00 0.00 N ATOM 1745 CA ILE A 114 9.356 0.566 0.565 1.00 0.00 C ATOM 1746 C ILE A 114 9.726 0.501 -0.921 1.00 0.00 C ATOM 1747 O ILE A 114 9.584 -0.545 -1.555 1.00 0.00 O ATOM 1748 CB ILE A 114 10.293 1.557 1.296 1.00 0.00 C ATOM 1749 CG1 ILE A 114 11.760 1.282 0.920 1.00 0.00 C ATOM 1750 CG2 ILE A 114 10.086 1.465 2.800 1.00 0.00 C ATOM 1751 CD1 ILE A 114 12.763 1.680 1.984 1.00 0.00 C ATOM 0 H ILE A 114 10.363 -1.181 1.117 1.00 0.00 H new ATOM 0 HA ILE A 114 8.328 0.918 0.656 1.00 0.00 H new ATOM 0 HB ILE A 114 10.049 2.572 0.982 1.00 0.00 H new ATOM 0 HG12 ILE A 114 11.875 0.219 0.709 1.00 0.00 H new ATOM 0 HG13 ILE A 114 11.993 1.817 -0.000 1.00 0.00 H new ATOM 0 HG21 ILE A 114 10.751 2.167 3.302 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.051 1.710 3.041 1.00 0.00 H new ATOM 0 HG23 ILE A 114 10.307 0.452 3.136 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.771 1.452 1.637 1.00 0.00 H new ATOM 0 HD12 ILE A 114 12.680 2.749 2.181 1.00 0.00 H new ATOM 0 HD13 ILE A 114 12.560 1.126 2.900 1.00 0.00 H new ATOM 1763 N ASN A 115 10.208 1.616 -1.472 1.00 0.00 N ATOM 1764 CA ASN A 115 10.603 1.667 -2.876 1.00 0.00 C ATOM 1765 C ASN A 115 12.106 1.886 -3.008 1.00 0.00 C ATOM 1766 O ASN A 115 12.561 3.007 -3.235 1.00 0.00 O ATOM 1767 CB ASN A 115 9.861 2.791 -3.597 1.00 0.00 C ATOM 1768 CG ASN A 115 9.872 2.616 -5.104 1.00 0.00 C ATOM 1769 OD1 ASN A 115 10.304 1.585 -5.616 1.00 0.00 O ATOM 1770 ND2 ASN A 115 9.395 3.628 -5.821 1.00 0.00 N ATOM 0 H ASN A 115 10.333 2.493 -0.967 1.00 0.00 H new ATOM 0 HA ASN A 115 10.343 0.712 -3.332 1.00 0.00 H new ATOM 0 HB2 ASN A 115 8.830 2.826 -3.245 1.00 0.00 H new ATOM 0 HB3 ASN A 115 10.318 3.747 -3.341 1.00 0.00 H new ATOM 0 HD21 ASN A 115 9.377 3.568 -6.839 1.00 0.00 H new ATOM 0 HD22 ASN A 115 9.047 4.465 -5.353 1.00 0.00 H new ATOM 1777 N GLU A 116 12.875 0.812 -2.868 1.00 0.00 N ATOM 1778 CA GLU A 116 14.327 0.898 -2.977 1.00 0.00 C ATOM 1779 C GLU A 116 14.744 1.450 -4.338 1.00 0.00 C ATOM 1780 O GLU A 116 15.852 1.962 -4.496 1.00 0.00 O ATOM 1781 CB GLU A 116 14.959 -0.477 -2.749 1.00 0.00 C ATOM 1782 CG GLU A 116 15.454 -0.685 -1.328 1.00 0.00 C ATOM 1783 CD GLU A 116 16.692 0.133 -1.018 1.00 0.00 C ATOM 1784 OE1 GLU A 116 17.763 -0.174 -1.582 1.00 0.00 O ATOM 1785 OE2 GLU A 116 16.590 1.082 -0.210 1.00 0.00 O ATOM 0 H GLU A 116 12.519 -0.125 -2.679 1.00 0.00 H new ATOM 0 HA GLU A 116 14.683 1.584 -2.208 1.00 0.00 H new ATOM 0 HB2 GLU A 116 14.228 -1.249 -2.988 1.00 0.00 H new ATOM 0 HB3 GLU A 116 15.793 -0.604 -3.439 1.00 0.00 H new ATOM 0 HG2 GLU A 116 14.662 -0.418 -0.628 1.00 0.00 H new ATOM 0 HG3 GLU A 116 15.673 -1.742 -1.174 1.00 0.00 H new ATOM 1792 N ASN A 117 13.851 1.344 -5.319 1.00 0.00 N ATOM 1793 CA ASN A 117 14.130 1.835 -6.664 1.00 0.00 C ATOM 1794 C ASN A 117 14.003 3.353 -6.727 1.00 0.00 C ATOM 1795 O ASN A 117 14.738 4.017 -7.459 1.00 0.00 O ATOM 1796 CB ASN A 117 13.178 1.189 -7.672 1.00 0.00 C ATOM 1797 CG ASN A 117 13.516 1.557 -9.104 1.00 0.00 C ATOM 1798 OD1 ASN A 117 12.779 2.292 -9.760 1.00 0.00 O ATOM 1799 ND2 ASN A 117 14.639 1.045 -9.595 1.00 0.00 N ATOM 0 H ASN A 117 12.929 0.923 -5.207 1.00 0.00 H new ATOM 0 HA ASN A 117 15.155 1.564 -6.917 1.00 0.00 H new ATOM 0 HB2 ASN A 117 13.215 0.105 -7.560 1.00 0.00 H new ATOM 0 HB3 ASN A 117 12.156 1.498 -7.452 1.00 0.00 H new ATOM 0 HD21 ASN A 117 14.920 1.257 -10.552 1.00 0.00 H new ATOM 0 HD22 ASN A 117 15.220 0.440 -9.015 1.00 0.00 H new ATOM 1806 N GLY A 118 13.068 3.899 -5.955 1.00 0.00 N ATOM 1807 CA GLY A 118 12.864 5.337 -5.939 1.00 0.00 C ATOM 1808 C GLY A 118 14.113 6.095 -5.535 1.00 0.00 C ATOM 1809 O GLY A 118 15.208 5.532 -5.514 1.00 0.00 O ATOM 0 H GLY A 118 12.448 3.372 -5.340 1.00 0.00 H new ATOM 0 HA2 GLY A 118 12.546 5.667 -6.928 1.00 0.00 H new ATOM 0 HA3 GLY A 118 12.056 5.579 -5.248 1.00 0.00 H new ATOM 1813 N ASN A 119 13.951 7.375 -5.216 1.00 0.00 N ATOM 1814 CA ASN A 119 15.078 8.208 -4.813 1.00 0.00 C ATOM 1815 C ASN A 119 15.400 8.012 -3.333 1.00 0.00 C ATOM 1816 O ASN A 119 14.528 7.644 -2.544 1.00 0.00 O ATOM 1817 CB ASN A 119 14.777 9.683 -5.093 1.00 0.00 C ATOM 1818 CG ASN A 119 13.616 10.203 -4.266 1.00 0.00 C ATOM 1819 OD1 ASN A 119 13.807 10.734 -3.171 1.00 0.00 O ATOM 1820 ND2 ASN A 119 12.403 10.054 -4.787 1.00 0.00 N ATOM 0 H ASN A 119 13.052 7.857 -5.229 1.00 0.00 H new ATOM 0 HA ASN A 119 15.947 7.906 -5.397 1.00 0.00 H new ATOM 0 HB2 ASN A 119 15.665 10.279 -4.882 1.00 0.00 H new ATOM 0 HB3 ASN A 119 14.551 9.810 -6.152 1.00 0.00 H new ATOM 0 HD21 ASN A 119 11.584 10.385 -4.277 1.00 0.00 H new ATOM 0 HD22 ASN A 119 12.290 9.608 -5.697 1.00 0.00 H new ATOM 1827 N PRO A 120 16.664 8.255 -2.935 1.00 0.00 N ATOM 1828 CA PRO A 120 17.104 8.103 -1.546 1.00 0.00 C ATOM 1829 C PRO A 120 16.644 9.259 -0.659 1.00 0.00 C ATOM 1830 O PRO A 120 17.452 9.895 0.019 1.00 0.00 O ATOM 1831 CB PRO A 120 18.641 8.083 -1.645 1.00 0.00 C ATOM 1832 CG PRO A 120 18.962 8.103 -3.108 1.00 0.00 C ATOM 1833 CD PRO A 120 17.766 8.689 -3.797 1.00 0.00 C ATOM 0 HA PRO A 120 16.685 7.207 -1.089 1.00 0.00 H new ATOM 0 HB2 PRO A 120 19.076 8.945 -1.139 1.00 0.00 H new ATOM 0 HB3 PRO A 120 19.051 7.193 -1.168 1.00 0.00 H new ATOM 0 HG2 PRO A 120 19.853 8.700 -3.302 1.00 0.00 H new ATOM 0 HG3 PRO A 120 19.167 7.097 -3.474 1.00 0.00 H new ATOM 0 HD2 PRO A 120 17.827 9.775 -3.863 1.00 0.00 H new ATOM 0 HD3 PRO A 120 17.658 8.313 -4.815 1.00 0.00 H new ATOM 1841 N SER A 121 15.341 9.527 -0.664 1.00 0.00 N ATOM 1842 CA SER A 121 14.775 10.602 0.138 1.00 0.00 C ATOM 1843 C SER A 121 13.274 10.667 -0.073 1.00 0.00 C ATOM 1844 O SER A 121 12.690 11.747 -0.163 1.00 0.00 O ATOM 1845 CB SER A 121 15.411 11.943 -0.233 1.00 0.00 C ATOM 1846 OG SER A 121 16.574 12.189 0.537 1.00 0.00 O ATOM 0 H SER A 121 14.657 9.011 -1.217 1.00 0.00 H new ATOM 0 HA SER A 121 14.983 10.398 1.188 1.00 0.00 H new ATOM 0 HB2 SER A 121 15.666 11.947 -1.293 1.00 0.00 H new ATOM 0 HB3 SER A 121 14.691 12.746 -0.076 1.00 0.00 H new ATOM 0 HG SER A 121 17.247 11.503 0.342 1.00 0.00 H new ATOM 1852 N TYR A 122 12.654 9.497 -0.169 1.00 0.00 N ATOM 1853 CA TYR A 122 11.223 9.418 -0.393 1.00 0.00 C ATOM 1854 C TYR A 122 10.736 7.975 -0.314 1.00 0.00 C ATOM 1855 O TYR A 122 9.699 7.693 0.280 1.00 0.00 O ATOM 1856 CB TYR A 122 10.894 10.016 -1.759 1.00 0.00 C ATOM 1857 CG TYR A 122 10.122 11.314 -1.682 1.00 0.00 C ATOM 1858 CD1 TYR A 122 8.918 11.391 -0.993 1.00 0.00 C ATOM 1859 CD2 TYR A 122 10.603 12.463 -2.296 1.00 0.00 C ATOM 1860 CE1 TYR A 122 8.214 12.578 -0.921 1.00 0.00 C ATOM 1861 CE2 TYR A 122 9.906 13.653 -2.227 1.00 0.00 C ATOM 1862 CZ TYR A 122 8.712 13.706 -1.538 1.00 0.00 C ATOM 1863 OH TYR A 122 8.015 14.891 -1.468 1.00 0.00 O ATOM 0 H TYR A 122 13.122 8.594 -0.095 1.00 0.00 H new ATOM 0 HA TYR A 122 10.712 9.984 0.386 1.00 0.00 H new ATOM 0 HB2 TYR A 122 11.822 10.187 -2.304 1.00 0.00 H new ATOM 0 HB3 TYR A 122 10.315 9.292 -2.333 1.00 0.00 H new ATOM 0 HD1 TYR A 122 8.526 10.510 -0.506 1.00 0.00 H new ATOM 0 HD2 TYR A 122 11.537 12.425 -2.836 1.00 0.00 H new ATOM 0 HE1 TYR A 122 7.278 12.622 -0.384 1.00 0.00 H new ATOM 0 HE2 TYR A 122 10.294 14.538 -2.710 1.00 0.00 H new ATOM 0 HH TYR A 122 8.504 15.587 -1.954 1.00 0.00 H new ATOM 1873 N LYS A 123 11.501 7.067 -0.913 1.00 0.00 N ATOM 1874 CA LYS A 123 11.160 5.644 -0.912 1.00 0.00 C ATOM 1875 C LYS A 123 9.697 5.409 -1.301 1.00 0.00 C ATOM 1876 O LYS A 123 9.379 5.239 -2.477 1.00 0.00 O ATOM 1877 CB LYS A 123 11.447 5.034 0.465 1.00 0.00 C ATOM 1878 CG LYS A 123 12.907 4.673 0.695 1.00 0.00 C ATOM 1879 CD LYS A 123 13.451 3.787 -0.415 1.00 0.00 C ATOM 1880 CE LYS A 123 14.201 4.598 -1.457 1.00 0.00 C ATOM 1881 NZ LYS A 123 15.425 3.896 -1.934 1.00 0.00 N ATOM 0 H LYS A 123 12.365 7.290 -1.408 1.00 0.00 H new ATOM 0 HA LYS A 123 11.782 5.154 -1.661 1.00 0.00 H new ATOM 0 HB2 LYS A 123 11.133 5.739 1.235 1.00 0.00 H new ATOM 0 HB3 LYS A 123 10.839 4.137 0.587 1.00 0.00 H new ATOM 0 HG2 LYS A 123 13.501 5.585 0.757 1.00 0.00 H new ATOM 0 HG3 LYS A 123 13.008 4.161 1.652 1.00 0.00 H new ATOM 0 HD2 LYS A 123 14.116 3.036 0.011 1.00 0.00 H new ATOM 0 HD3 LYS A 123 12.629 3.252 -0.891 1.00 0.00 H new ATOM 0 HE2 LYS A 123 13.544 4.797 -2.304 1.00 0.00 H new ATOM 0 HE3 LYS A 123 14.478 5.564 -1.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 16.211 4.574 -1.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 15.674 3.140 -1.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 15.245 3.484 -2.872 1.00 0.00 H new ATOM 1895 N TYR A 124 8.806 5.401 -0.308 1.00 0.00 N ATOM 1896 CA TYR A 124 7.375 5.181 -0.540 1.00 0.00 C ATOM 1897 C TYR A 124 6.843 5.977 -1.736 1.00 0.00 C ATOM 1898 O TYR A 124 5.787 5.653 -2.278 1.00 0.00 O ATOM 1899 CB TYR A 124 6.578 5.539 0.714 1.00 0.00 C ATOM 1900 CG TYR A 124 6.812 4.593 1.868 1.00 0.00 C ATOM 1901 CD1 TYR A 124 6.855 3.220 1.666 1.00 0.00 C ATOM 1902 CD2 TYR A 124 6.985 5.072 3.161 1.00 0.00 C ATOM 1903 CE1 TYR A 124 7.064 2.351 2.718 1.00 0.00 C ATOM 1904 CE2 TYR A 124 7.197 4.210 4.217 1.00 0.00 C ATOM 1905 CZ TYR A 124 7.235 2.850 3.991 1.00 0.00 C ATOM 1906 OH TYR A 124 7.444 1.987 5.041 1.00 0.00 O ATOM 0 H TYR A 124 9.051 5.545 0.671 1.00 0.00 H new ATOM 0 HA TYR A 124 7.250 4.123 -0.772 1.00 0.00 H new ATOM 0 HB2 TYR A 124 6.840 6.550 1.025 1.00 0.00 H new ATOM 0 HB3 TYR A 124 5.516 5.546 0.470 1.00 0.00 H new ATOM 0 HD1 TYR A 124 6.723 2.825 0.669 1.00 0.00 H new ATOM 0 HD2 TYR A 124 6.953 6.136 3.342 1.00 0.00 H new ATOM 0 HE1 TYR A 124 7.093 1.285 2.544 1.00 0.00 H new ATOM 0 HE2 TYR A 124 7.333 4.598 5.216 1.00 0.00 H new ATOM 0 HH TYR A 124 7.679 1.101 4.694 1.00 0.00 H new ATOM 1916 N PHE A 125 7.569 7.013 -2.142 1.00 0.00 N ATOM 1917 CA PHE A 125 7.159 7.836 -3.274 1.00 0.00 C ATOM 1918 C PHE A 125 7.308 7.069 -4.588 1.00 0.00 C ATOM 1919 O PHE A 125 8.412 6.666 -4.957 1.00 0.00 O ATOM 1920 CB PHE A 125 8.004 9.110 -3.319 1.00 0.00 C ATOM 1921 CG PHE A 125 7.351 10.240 -4.058 1.00 0.00 C ATOM 1922 CD1 PHE A 125 6.015 10.541 -3.849 1.00 0.00 C ATOM 1923 CD2 PHE A 125 8.074 11.003 -4.960 1.00 0.00 C ATOM 1924 CE1 PHE A 125 5.411 11.580 -4.529 1.00 0.00 C ATOM 1925 CE2 PHE A 125 7.475 12.043 -5.644 1.00 0.00 C ATOM 1926 CZ PHE A 125 6.142 12.332 -5.427 1.00 0.00 C ATOM 0 H PHE A 125 8.444 7.303 -1.704 1.00 0.00 H new ATOM 0 HA PHE A 125 6.109 8.099 -3.147 1.00 0.00 H new ATOM 0 HB2 PHE A 125 8.218 9.430 -2.299 1.00 0.00 H new ATOM 0 HB3 PHE A 125 8.961 8.884 -3.790 1.00 0.00 H new ATOM 0 HD1 PHE A 125 5.439 9.957 -3.146 1.00 0.00 H new ATOM 0 HD2 PHE A 125 9.117 10.782 -5.130 1.00 0.00 H new ATOM 0 HE1 PHE A 125 4.368 11.804 -4.359 1.00 0.00 H new ATOM 0 HE2 PHE A 125 8.048 12.629 -6.347 1.00 0.00 H new ATOM 0 HZ PHE A 125 5.672 13.146 -5.959 1.00 0.00 H new ATOM 1936 N TYR A 126 6.195 6.873 -5.293 1.00 0.00 N ATOM 1937 CA TYR A 126 6.213 6.157 -6.567 1.00 0.00 C ATOM 1938 C TYR A 126 5.759 7.061 -7.709 1.00 0.00 C ATOM 1939 O TYR A 126 4.604 7.007 -8.130 1.00 0.00 O ATOM 1940 CB TYR A 126 5.306 4.925 -6.517 1.00 0.00 C ATOM 1941 CG TYR A 126 5.828 3.801 -5.650 1.00 0.00 C ATOM 1942 CD1 TYR A 126 5.530 3.752 -4.297 1.00 0.00 C ATOM 1943 CD2 TYR A 126 6.606 2.783 -6.186 1.00 0.00 C ATOM 1944 CE1 TYR A 126 5.992 2.724 -3.500 1.00 0.00 C ATOM 1945 CE2 TYR A 126 7.072 1.750 -5.398 1.00 0.00 C ATOM 1946 CZ TYR A 126 6.763 1.725 -4.054 1.00 0.00 C ATOM 1947 OH TYR A 126 7.224 0.697 -3.263 1.00 0.00 O ATOM 0 H TYR A 126 5.272 7.199 -5.005 1.00 0.00 H new ATOM 0 HA TYR A 126 7.241 5.841 -6.744 1.00 0.00 H new ATOM 0 HB2 TYR A 126 4.325 5.226 -6.150 1.00 0.00 H new ATOM 0 HB3 TYR A 126 5.166 4.551 -7.531 1.00 0.00 H new ATOM 0 HD1 TYR A 126 4.925 4.532 -3.859 1.00 0.00 H new ATOM 0 HD2 TYR A 126 6.851 2.800 -7.238 1.00 0.00 H new ATOM 0 HE1 TYR A 126 5.750 2.703 -2.448 1.00 0.00 H new ATOM 0 HE2 TYR A 126 7.675 0.966 -5.831 1.00 0.00 H new ATOM 0 HH TYR A 126 6.469 0.144 -2.972 1.00 0.00 H new ATOM 1957 N VAL A 127 6.672 7.879 -8.218 1.00 0.00 N ATOM 1958 CA VAL A 127 6.349 8.775 -9.323 1.00 0.00 C ATOM 1959 C VAL A 127 6.598 8.086 -10.661 1.00 0.00 C ATOM 1960 O VAL A 127 7.317 8.604 -11.517 1.00 0.00 O ATOM 1961 CB VAL A 127 7.165 10.083 -9.264 1.00 0.00 C ATOM 1962 CG1 VAL A 127 6.540 11.057 -8.279 1.00 0.00 C ATOM 1963 CG2 VAL A 127 8.617 9.803 -8.901 1.00 0.00 C ATOM 0 H VAL A 127 7.635 7.941 -7.887 1.00 0.00 H new ATOM 0 HA VAL A 127 5.293 9.027 -9.229 1.00 0.00 H new ATOM 0 HB VAL A 127 7.149 10.539 -10.254 1.00 0.00 H new ATOM 0 HG11 VAL A 127 7.129 11.974 -8.251 1.00 0.00 H new ATOM 0 HG12 VAL A 127 5.522 11.289 -8.593 1.00 0.00 H new ATOM 0 HG13 VAL A 127 6.520 10.608 -7.286 1.00 0.00 H new ATOM 0 HG21 VAL A 127 9.171 10.741 -8.866 1.00 0.00 H new ATOM 0 HG22 VAL A 127 8.661 9.319 -7.925 1.00 0.00 H new ATOM 0 HG23 VAL A 127 9.060 9.148 -9.651 1.00 0.00 H new ATOM 1973 N SER A 128 5.996 6.909 -10.833 1.00 0.00 N ATOM 1974 CA SER A 128 6.145 6.134 -12.065 1.00 0.00 C ATOM 1975 C SER A 128 5.601 4.715 -11.899 1.00 0.00 C ATOM 1976 O SER A 128 5.814 4.069 -10.871 1.00 0.00 O ATOM 1977 CB SER A 128 7.616 6.075 -12.493 1.00 0.00 C ATOM 1978 OG SER A 128 7.837 5.027 -13.420 1.00 0.00 O ATOM 0 H SER A 128 5.399 6.470 -10.132 1.00 0.00 H new ATOM 0 HA SER A 128 5.566 6.638 -12.839 1.00 0.00 H new ATOM 0 HB2 SER A 128 7.906 7.026 -12.939 1.00 0.00 H new ATOM 0 HB3 SER A 128 8.247 5.928 -11.617 1.00 0.00 H new ATOM 0 HG SER A 128 8.782 5.012 -13.678 1.00 0.00 H new ATOM 1984 N ALA A 129 4.908 4.234 -12.929 1.00 0.00 N ATOM 1985 CA ALA A 129 4.338 2.891 -12.915 1.00 0.00 C ATOM 1986 C ALA A 129 5.421 1.832 -13.117 1.00 0.00 C ATOM 1987 O ALA A 129 5.230 0.663 -12.781 1.00 0.00 O ATOM 1988 CB ALA A 129 3.273 2.763 -13.994 1.00 0.00 C ATOM 0 H ALA A 129 4.728 4.757 -13.786 1.00 0.00 H new ATOM 0 HA ALA A 129 3.880 2.727 -11.940 1.00 0.00 H new ATOM 0 HB1 ALA A 129 2.854 1.757 -13.975 1.00 0.00 H new ATOM 0 HB2 ALA A 129 2.481 3.489 -13.811 1.00 0.00 H new ATOM 0 HB3 ALA A 129 3.720 2.951 -14.970 1.00 0.00 H new ATOM 1994 N GLU A 130 6.557 2.250 -13.674 1.00 0.00 N ATOM 1995 CA GLU A 130 7.668 1.340 -13.933 1.00 0.00 C ATOM 1996 C GLU A 130 8.306 0.849 -12.635 1.00 0.00 C ATOM 1997 O GLU A 130 8.644 -0.328 -12.500 1.00 0.00 O ATOM 1998 CB GLU A 130 8.723 2.029 -14.800 1.00 0.00 C ATOM 1999 CG GLU A 130 9.411 1.092 -15.779 1.00 0.00 C ATOM 2000 CD GLU A 130 10.898 1.360 -15.893 1.00 0.00 C ATOM 2001 OE1 GLU A 130 11.615 1.167 -14.888 1.00 0.00 O ATOM 2002 OE2 GLU A 130 11.346 1.761 -16.988 1.00 0.00 O ATOM 0 H GLU A 130 6.731 3.215 -13.954 1.00 0.00 H new ATOM 0 HA GLU A 130 7.270 0.474 -14.463 1.00 0.00 H new ATOM 0 HB2 GLU A 130 8.252 2.840 -15.356 1.00 0.00 H new ATOM 0 HB3 GLU A 130 9.475 2.481 -14.153 1.00 0.00 H new ATOM 0 HG2 GLU A 130 9.254 0.061 -15.461 1.00 0.00 H new ATOM 0 HG3 GLU A 130 8.950 1.196 -16.761 1.00 0.00 H new ATOM 2009 N GLN A 131 8.485 1.748 -11.677 1.00 0.00 N ATOM 2010 CA GLN A 131 9.095 1.358 -10.418 1.00 0.00 C ATOM 2011 C GLN A 131 8.118 0.591 -9.538 1.00 0.00 C ATOM 2012 O GLN A 131 8.405 -0.520 -9.104 1.00 0.00 O ATOM 2013 CB GLN A 131 9.627 2.547 -9.641 1.00 0.00 C ATOM 2014 CG GLN A 131 8.632 3.681 -9.469 1.00 0.00 C ATOM 2015 CD GLN A 131 9.289 5.045 -9.543 1.00 0.00 C ATOM 2016 OE1 GLN A 131 10.414 5.181 -10.023 1.00 0.00 O ATOM 2017 NE2 GLN A 131 8.586 6.064 -9.064 1.00 0.00 N ATOM 0 H GLN A 131 8.222 2.731 -11.746 1.00 0.00 H new ATOM 0 HA GLN A 131 9.932 0.712 -10.681 1.00 0.00 H new ATOM 0 HB2 GLN A 131 9.947 2.208 -8.656 1.00 0.00 H new ATOM 0 HB3 GLN A 131 10.512 2.931 -10.149 1.00 0.00 H new ATOM 0 HG2 GLN A 131 7.866 3.608 -10.241 1.00 0.00 H new ATOM 0 HG3 GLN A 131 8.128 3.576 -8.508 1.00 0.00 H new ATOM 0 HE21 GLN A 131 7.657 5.904 -8.675 1.00 0.00 H new ATOM 0 HE22 GLN A 131 8.975 7.007 -9.085 1.00 0.00 H new ATOM 2026 N VAL A 132 6.961 1.188 -9.269 1.00 0.00 N ATOM 2027 CA VAL A 132 5.963 0.540 -8.427 1.00 0.00 C ATOM 2028 C VAL A 132 5.692 -0.883 -8.907 1.00 0.00 C ATOM 2029 O VAL A 132 5.287 -1.741 -8.124 1.00 0.00 O ATOM 2030 CB VAL A 132 4.642 1.340 -8.370 1.00 0.00 C ATOM 2031 CG1 VAL A 132 4.250 1.851 -9.746 1.00 0.00 C ATOM 2032 CG2 VAL A 132 3.521 0.507 -7.759 1.00 0.00 C ATOM 0 H VAL A 132 6.694 2.109 -9.617 1.00 0.00 H new ATOM 0 HA VAL A 132 6.373 0.505 -7.418 1.00 0.00 H new ATOM 0 HB VAL A 132 4.807 2.204 -7.727 1.00 0.00 H new ATOM 0 HG11 VAL A 132 3.317 2.410 -9.674 1.00 0.00 H new ATOM 0 HG12 VAL A 132 5.035 2.503 -10.129 1.00 0.00 H new ATOM 0 HG13 VAL A 132 4.116 1.007 -10.423 1.00 0.00 H new ATOM 0 HG21 VAL A 132 2.604 1.095 -7.732 1.00 0.00 H new ATOM 0 HG22 VAL A 132 3.361 -0.386 -8.363 1.00 0.00 H new ATOM 0 HG23 VAL A 132 3.795 0.216 -6.745 1.00 0.00 H new ATOM 2042 N VAL A 133 5.931 -1.136 -10.192 1.00 0.00 N ATOM 2043 CA VAL A 133 5.718 -2.465 -10.739 1.00 0.00 C ATOM 2044 C VAL A 133 6.896 -3.379 -10.415 1.00 0.00 C ATOM 2045 O VAL A 133 6.711 -4.582 -10.231 1.00 0.00 O ATOM 2046 CB VAL A 133 5.477 -2.450 -12.262 1.00 0.00 C ATOM 2047 CG1 VAL A 133 6.722 -2.011 -13.007 1.00 0.00 C ATOM 2048 CG2 VAL A 133 5.023 -3.822 -12.740 1.00 0.00 C ATOM 0 H VAL A 133 6.268 -0.445 -10.863 1.00 0.00 H new ATOM 0 HA VAL A 133 4.815 -2.851 -10.266 1.00 0.00 H new ATOM 0 HB VAL A 133 4.688 -1.728 -12.474 1.00 0.00 H new ATOM 0 HG11 VAL A 133 6.523 -2.010 -14.079 1.00 0.00 H new ATOM 0 HG12 VAL A 133 7.001 -1.007 -12.689 1.00 0.00 H new ATOM 0 HG13 VAL A 133 7.538 -2.701 -12.790 1.00 0.00 H new ATOM 0 HG21 VAL A 133 4.857 -3.796 -13.817 1.00 0.00 H new ATOM 0 HG22 VAL A 133 5.791 -4.560 -12.509 1.00 0.00 H new ATOM 0 HG23 VAL A 133 4.095 -4.094 -12.236 1.00 0.00 H new ATOM 2058 N GLN A 134 8.111 -2.818 -10.317 1.00 0.00 N ATOM 2059 CA GLN A 134 9.265 -3.649 -9.979 1.00 0.00 C ATOM 2060 C GLN A 134 9.248 -3.932 -8.489 1.00 0.00 C ATOM 2061 O GLN A 134 9.618 -5.017 -8.043 1.00 0.00 O ATOM 2062 CB GLN A 134 10.590 -3.002 -10.393 1.00 0.00 C ATOM 2063 CG GLN A 134 10.648 -1.511 -10.147 1.00 0.00 C ATOM 2064 CD GLN A 134 11.985 -0.907 -10.533 1.00 0.00 C ATOM 2065 OE1 GLN A 134 12.995 -1.127 -9.864 1.00 0.00 O ATOM 2066 NE2 GLN A 134 11.998 -0.142 -11.618 1.00 0.00 N ATOM 0 H GLN A 134 8.312 -1.829 -10.462 1.00 0.00 H new ATOM 0 HA GLN A 134 9.190 -4.582 -10.537 1.00 0.00 H new ATOM 0 HB2 GLN A 134 11.403 -3.482 -9.848 1.00 0.00 H new ATOM 0 HB3 GLN A 134 10.760 -3.192 -11.453 1.00 0.00 H new ATOM 0 HG2 GLN A 134 9.856 -1.022 -10.714 1.00 0.00 H new ATOM 0 HG3 GLN A 134 10.455 -1.313 -9.093 1.00 0.00 H new ATOM 0 HE21 GLN A 134 11.137 0.014 -12.143 1.00 0.00 H new ATOM 0 HE22 GLN A 134 12.869 0.290 -11.927 1.00 0.00 H new ATOM 2075 N GLY A 135 8.763 -2.959 -7.727 1.00 0.00 N ATOM 2076 CA GLY A 135 8.642 -3.129 -6.299 1.00 0.00 C ATOM 2077 C GLY A 135 7.446 -3.999 -5.973 1.00 0.00 C ATOM 2078 O GLY A 135 7.383 -4.614 -4.909 1.00 0.00 O ATOM 0 H GLY A 135 8.451 -2.053 -8.078 1.00 0.00 H new ATOM 0 HA2 GLY A 135 9.550 -3.583 -5.902 1.00 0.00 H new ATOM 0 HA3 GLY A 135 8.535 -2.157 -5.818 1.00 0.00 H new ATOM 2082 N MET A 136 6.500 -4.061 -6.913 1.00 0.00 N ATOM 2083 CA MET A 136 5.305 -4.875 -6.747 1.00 0.00 C ATOM 2084 C MET A 136 5.598 -6.317 -7.139 1.00 0.00 C ATOM 2085 O MET A 136 5.152 -7.256 -6.482 1.00 0.00 O ATOM 2086 CB MET A 136 4.161 -4.321 -7.598 1.00 0.00 C ATOM 2087 CG MET A 136 3.359 -3.230 -6.908 1.00 0.00 C ATOM 2088 SD MET A 136 1.957 -3.878 -5.978 1.00 0.00 S ATOM 2089 CE MET A 136 1.107 -4.807 -7.251 1.00 0.00 C ATOM 0 H MET A 136 6.543 -3.554 -7.797 1.00 0.00 H new ATOM 0 HA MET A 136 5.005 -4.846 -5.699 1.00 0.00 H new ATOM 0 HB2 MET A 136 4.570 -3.926 -8.528 1.00 0.00 H new ATOM 0 HB3 MET A 136 3.491 -5.138 -7.866 1.00 0.00 H new ATOM 0 HG2 MET A 136 4.012 -2.676 -6.234 1.00 0.00 H new ATOM 0 HG3 MET A 136 2.998 -2.523 -7.655 1.00 0.00 H new ATOM 0 HE1 MET A 136 0.116 -5.090 -6.895 1.00 0.00 H new ATOM 0 HE2 MET A 136 1.009 -4.193 -8.146 1.00 0.00 H new ATOM 0 HE3 MET A 136 1.677 -5.705 -7.488 1.00 0.00 H new ATOM 2099 N LYS A 137 6.363 -6.481 -8.214 1.00 0.00 N ATOM 2100 CA LYS A 137 6.729 -7.806 -8.696 1.00 0.00 C ATOM 2101 C LYS A 137 7.817 -8.425 -7.817 1.00 0.00 C ATOM 2102 O LYS A 137 8.063 -9.630 -7.877 1.00 0.00 O ATOM 2103 CB LYS A 137 7.193 -7.733 -10.156 1.00 0.00 C ATOM 2104 CG LYS A 137 8.551 -7.079 -10.350 1.00 0.00 C ATOM 2105 CD LYS A 137 8.704 -6.510 -11.756 1.00 0.00 C ATOM 2106 CE LYS A 137 8.309 -7.517 -12.827 1.00 0.00 C ATOM 2107 NZ LYS A 137 9.246 -8.674 -12.877 1.00 0.00 N ATOM 0 H LYS A 137 6.741 -5.712 -8.767 1.00 0.00 H new ATOM 0 HA LYS A 137 5.847 -8.445 -8.642 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.228 -8.743 -10.565 1.00 0.00 H new ATOM 0 HB3 LYS A 137 6.451 -7.181 -10.733 1.00 0.00 H new ATOM 0 HG2 LYS A 137 8.679 -6.281 -9.618 1.00 0.00 H new ATOM 0 HG3 LYS A 137 9.338 -7.811 -10.165 1.00 0.00 H new ATOM 0 HD2 LYS A 137 8.088 -5.616 -11.854 1.00 0.00 H new ATOM 0 HD3 LYS A 137 9.738 -6.203 -11.912 1.00 0.00 H new ATOM 0 HE2 LYS A 137 7.299 -7.877 -12.632 1.00 0.00 H new ATOM 0 HE3 LYS A 137 8.289 -7.024 -13.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 8.941 -9.336 -13.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 10.206 -8.334 -13.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 9.246 -9.161 -11.958 1.00 0.00 H new ATOM 2121 N GLU A 138 8.457 -7.596 -6.994 1.00 0.00 N ATOM 2122 CA GLU A 138 9.507 -8.065 -6.095 1.00 0.00 C ATOM 2123 C GLU A 138 8.893 -8.665 -4.839 1.00 0.00 C ATOM 2124 O GLU A 138 9.066 -9.847 -4.548 1.00 0.00 O ATOM 2125 CB GLU A 138 10.443 -6.913 -5.722 1.00 0.00 C ATOM 2126 CG GLU A 138 11.821 -7.019 -6.351 1.00 0.00 C ATOM 2127 CD GLU A 138 12.897 -7.378 -5.343 1.00 0.00 C ATOM 2128 OE1 GLU A 138 13.143 -8.585 -5.142 1.00 0.00 O ATOM 2129 OE2 GLU A 138 13.492 -6.450 -4.756 1.00 0.00 O ATOM 0 H GLU A 138 8.266 -6.596 -6.932 1.00 0.00 H new ATOM 0 HA GLU A 138 10.085 -8.834 -6.608 1.00 0.00 H new ATOM 0 HB2 GLU A 138 9.986 -5.972 -6.027 1.00 0.00 H new ATOM 0 HB3 GLU A 138 10.550 -6.880 -4.638 1.00 0.00 H new ATOM 0 HG2 GLU A 138 11.800 -7.773 -7.138 1.00 0.00 H new ATOM 0 HG3 GLU A 138 12.074 -6.070 -6.825 1.00 0.00 H new ATOM 2136 N ALA A 139 8.163 -7.833 -4.108 1.00 0.00 N ATOM 2137 CA ALA A 139 7.501 -8.266 -2.885 1.00 0.00 C ATOM 2138 C ALA A 139 6.504 -9.387 -3.175 1.00 0.00 C ATOM 2139 O ALA A 139 6.099 -10.122 -2.277 1.00 0.00 O ATOM 2140 CB ALA A 139 6.799 -7.088 -2.226 1.00 0.00 C ATOM 0 H ALA A 139 8.014 -6.851 -4.342 1.00 0.00 H new ATOM 0 HA ALA A 139 8.257 -8.653 -2.202 1.00 0.00 H new ATOM 0 HB1 ALA A 139 6.307 -7.422 -1.313 1.00 0.00 H new ATOM 0 HB2 ALA A 139 7.531 -6.318 -1.983 1.00 0.00 H new ATOM 0 HB3 ALA A 139 6.055 -6.679 -2.910 1.00 0.00 H new ATOM 2146 N GLN A 140 6.107 -9.510 -4.435 1.00 0.00 N ATOM 2147 CA GLN A 140 5.154 -10.534 -4.839 1.00 0.00 C ATOM 2148 C GLN A 140 5.589 -11.928 -4.386 1.00 0.00 C ATOM 2149 O GLN A 140 4.763 -12.829 -4.254 1.00 0.00 O ATOM 2150 CB GLN A 140 4.971 -10.513 -6.358 1.00 0.00 C ATOM 2151 CG GLN A 140 3.681 -9.849 -6.807 1.00 0.00 C ATOM 2152 CD GLN A 140 2.884 -10.715 -7.765 1.00 0.00 C ATOM 2153 OE1 GLN A 140 2.389 -11.843 -7.271 1.00 0.00 O flip ATOM 2154 NE2 GLN A 140 2.718 -10.373 -8.936 1.00 0.00 N flip ATOM 0 H GLN A 140 6.431 -8.912 -5.195 1.00 0.00 H new ATOM 0 HA GLN A 140 4.205 -10.308 -4.354 1.00 0.00 H new ATOM 0 HB2 GLN A 140 5.815 -9.991 -6.810 1.00 0.00 H new ATOM 0 HB3 GLN A 140 4.992 -11.537 -6.732 1.00 0.00 H new ATOM 0 HG2 GLN A 140 3.070 -9.622 -5.933 1.00 0.00 H new ATOM 0 HG3 GLN A 140 3.914 -8.899 -7.289 1.00 0.00 H new ATOM 0 HE21 GLN A 140 3.117 -9.497 -9.273 1.00 0.00 H new ATOM 0 HE22 GLN A 140 2.181 -10.966 -9.569 1.00 0.00 H new ATOM 2163 N GLU A 141 6.887 -12.105 -4.156 1.00 0.00 N ATOM 2164 CA GLU A 141 7.412 -13.397 -3.728 1.00 0.00 C ATOM 2165 C GLU A 141 8.180 -13.290 -2.412 1.00 0.00 C ATOM 2166 O GLU A 141 8.098 -14.177 -1.561 1.00 0.00 O ATOM 2167 CB GLU A 141 8.307 -13.984 -4.807 1.00 0.00 C ATOM 2168 CG GLU A 141 9.575 -13.201 -4.969 1.00 0.00 C ATOM 2169 CD GLU A 141 10.435 -13.687 -6.119 1.00 0.00 C ATOM 2170 OE1 GLU A 141 10.986 -14.804 -6.019 1.00 0.00 O ATOM 2171 OE2 GLU A 141 10.558 -12.952 -7.120 1.00 0.00 O ATOM 0 H GLU A 141 7.591 -11.374 -4.258 1.00 0.00 H new ATOM 0 HA GLU A 141 6.562 -14.059 -3.563 1.00 0.00 H new ATOM 0 HB2 GLU A 141 8.548 -15.017 -4.556 1.00 0.00 H new ATOM 0 HB3 GLU A 141 7.769 -14.003 -5.755 1.00 0.00 H new ATOM 0 HG2 GLU A 141 9.328 -12.151 -5.127 1.00 0.00 H new ATOM 0 HG3 GLU A 141 10.150 -13.258 -4.045 1.00 0.00 H new ATOM 2178 N ARG A 142 8.931 -12.207 -2.254 1.00 0.00 N ATOM 2179 CA ARG A 142 9.721 -11.994 -1.043 1.00 0.00 C ATOM 2180 C ARG A 142 8.880 -11.393 0.083 1.00 0.00 C ATOM 2181 O ARG A 142 9.293 -11.396 1.242 1.00 0.00 O ATOM 2182 CB ARG A 142 10.914 -11.085 -1.342 1.00 0.00 C ATOM 2183 CG ARG A 142 10.519 -9.734 -1.911 1.00 0.00 C ATOM 2184 CD ARG A 142 10.499 -8.661 -0.837 1.00 0.00 C ATOM 2185 NE ARG A 142 11.779 -8.567 -0.137 1.00 0.00 N ATOM 2186 CZ ARG A 142 11.921 -8.072 1.092 1.00 0.00 C ATOM 2187 NH1 ARG A 142 10.867 -7.623 1.760 1.00 0.00 N ATOM 2188 NH2 ARG A 142 13.123 -8.027 1.653 1.00 0.00 N ATOM 0 H ARG A 142 9.011 -11.463 -2.947 1.00 0.00 H new ATOM 0 HA ARG A 142 10.080 -12.968 -0.710 1.00 0.00 H new ATOM 0 HB2 ARG A 142 11.483 -10.932 -0.425 1.00 0.00 H new ATOM 0 HB3 ARG A 142 11.576 -11.588 -2.047 1.00 0.00 H new ATOM 0 HG2 ARG A 142 11.219 -9.450 -2.697 1.00 0.00 H new ATOM 0 HG3 ARG A 142 9.534 -9.806 -2.372 1.00 0.00 H new ATOM 0 HD2 ARG A 142 10.261 -7.698 -1.290 1.00 0.00 H new ATOM 0 HD3 ARG A 142 9.708 -8.880 -0.120 1.00 0.00 H new ATOM 0 HE ARG A 142 12.614 -8.901 -0.619 1.00 0.00 H new ATOM 0 HH11 ARG A 142 9.941 -7.655 1.333 1.00 0.00 H new ATOM 0 HH12 ARG A 142 10.982 -7.245 2.700 1.00 0.00 H new ATOM 0 HH21 ARG A 142 13.937 -8.371 1.143 1.00 0.00 H new ATOM 0 HH22 ARG A 142 13.233 -7.648 2.594 1.00 0.00 H new ATOM 2202 N LEU A 143 7.701 -10.875 -0.258 1.00 0.00 N ATOM 2203 CA LEU A 143 6.822 -10.273 0.739 1.00 0.00 C ATOM 2204 C LEU A 143 5.617 -11.169 1.018 1.00 0.00 C ATOM 2205 O LEU A 143 5.042 -11.131 2.106 1.00 0.00 O ATOM 2206 CB LEU A 143 6.356 -8.896 0.264 1.00 0.00 C ATOM 2207 CG LEU A 143 5.550 -8.081 1.276 1.00 0.00 C ATOM 2208 CD1 LEU A 143 6.222 -8.084 2.640 1.00 0.00 C ATOM 2209 CD2 LEU A 143 5.371 -6.659 0.772 1.00 0.00 C ATOM 0 H LEU A 143 7.336 -10.861 -1.210 1.00 0.00 H new ATOM 0 HA LEU A 143 7.384 -10.160 1.666 1.00 0.00 H new ATOM 0 HB2 LEU A 143 7.233 -8.316 -0.025 1.00 0.00 H new ATOM 0 HB3 LEU A 143 5.751 -9.027 -0.633 1.00 0.00 H new ATOM 0 HG LEU A 143 4.569 -8.543 1.387 1.00 0.00 H new ATOM 0 HD11 LEU A 143 5.627 -7.497 3.340 1.00 0.00 H new ATOM 0 HD12 LEU A 143 6.303 -9.108 3.003 1.00 0.00 H new ATOM 0 HD13 LEU A 143 7.218 -7.649 2.556 1.00 0.00 H new ATOM 0 HD21 LEU A 143 4.796 -6.085 1.499 1.00 0.00 H new ATOM 0 HD22 LEU A 143 6.348 -6.196 0.635 1.00 0.00 H new ATOM 0 HD23 LEU A 143 4.840 -6.674 -0.180 1.00 0.00 H new ATOM 2221 N THR A 144 5.244 -11.979 0.032 1.00 0.00 N ATOM 2222 CA THR A 144 4.114 -12.884 0.171 1.00 0.00 C ATOM 2223 C THR A 144 4.495 -14.104 1.007 1.00 0.00 C ATOM 2224 O THR A 144 4.483 -15.234 0.517 1.00 0.00 O ATOM 2225 CB THR A 144 3.628 -13.323 -1.208 1.00 0.00 C ATOM 2226 OG1 THR A 144 4.706 -13.809 -1.988 1.00 0.00 O ATOM 2227 CG2 THR A 144 2.957 -12.212 -1.989 1.00 0.00 C ATOM 0 H THR A 144 5.711 -12.025 -0.874 1.00 0.00 H new ATOM 0 HA THR A 144 3.310 -12.357 0.684 1.00 0.00 H new ATOM 0 HB THR A 144 2.893 -14.106 -1.020 1.00 0.00 H new ATOM 0 HG1 THR A 144 4.458 -13.791 -2.936 1.00 0.00 H new ATOM 0 HG21 THR A 144 2.636 -12.592 -2.959 1.00 0.00 H new ATOM 0 HG22 THR A 144 2.090 -11.850 -1.436 1.00 0.00 H new ATOM 0 HG23 THR A 144 3.661 -11.393 -2.135 1.00 0.00 H new ATOM 2235 N GLY A 145 4.836 -13.865 2.268 1.00 0.00 N ATOM 2236 CA GLY A 145 5.219 -14.948 3.154 1.00 0.00 C ATOM 2237 C GLY A 145 5.786 -14.443 4.465 1.00 0.00 C ATOM 2238 O GLY A 145 5.069 -13.847 5.269 1.00 0.00 O ATOM 0 H GLY A 145 4.854 -12.938 2.693 1.00 0.00 H new ATOM 0 HA2 GLY A 145 4.351 -15.576 3.354 1.00 0.00 H new ATOM 0 HA3 GLY A 145 5.959 -15.576 2.658 1.00 0.00 H new ATOM 2242 N ASP A 146 7.075 -14.677 4.682 1.00 0.00 N ATOM 2243 CA ASP A 146 7.735 -14.233 5.907 1.00 0.00 C ATOM 2244 C ASP A 146 9.226 -13.992 5.683 1.00 0.00 C ATOM 2245 O ASP A 146 10.003 -13.948 6.636 1.00 0.00 O ATOM 2246 CB ASP A 146 7.533 -15.259 7.024 1.00 0.00 C ATOM 2247 CG ASP A 146 7.793 -16.679 6.561 1.00 0.00 C ATOM 2248 OD1 ASP A 146 8.975 -17.072 6.487 1.00 0.00 O ATOM 2249 OD2 ASP A 146 6.813 -17.398 6.272 1.00 0.00 O ATOM 0 H ASP A 146 7.684 -15.170 4.029 1.00 0.00 H new ATOM 0 HA ASP A 146 7.280 -13.287 6.203 1.00 0.00 H new ATOM 0 HB2 ASP A 146 8.199 -15.023 7.854 1.00 0.00 H new ATOM 0 HB3 ASP A 146 6.513 -15.184 7.402 1.00 0.00 H new ATOM 2254 N ALA A 147 9.617 -13.822 4.425 1.00 0.00 N ATOM 2255 CA ALA A 147 11.012 -13.566 4.090 1.00 0.00 C ATOM 2256 C ALA A 147 11.346 -12.093 4.293 1.00 0.00 C ATOM 2257 O ALA A 147 12.509 -11.722 4.455 1.00 0.00 O ATOM 2258 CB ALA A 147 11.298 -13.984 2.656 1.00 0.00 C ATOM 0 H ALA A 147 8.989 -13.857 3.622 1.00 0.00 H new ATOM 0 HA ALA A 147 11.642 -14.157 4.754 1.00 0.00 H new ATOM 0 HB1 ALA A 147 12.344 -13.786 2.421 1.00 0.00 H new ATOM 0 HB2 ALA A 147 11.095 -15.049 2.540 1.00 0.00 H new ATOM 0 HB3 ALA A 147 10.660 -13.417 1.978 1.00 0.00 H new ATOM 2264 N PHE A 148 10.309 -11.258 4.285 1.00 0.00 N ATOM 2265 CA PHE A 148 10.470 -9.823 4.472 1.00 0.00 C ATOM 2266 C PHE A 148 10.800 -9.487 5.926 1.00 0.00 C ATOM 2267 O PHE A 148 11.274 -8.390 6.226 1.00 0.00 O ATOM 2268 CB PHE A 148 9.188 -9.101 4.050 1.00 0.00 C ATOM 2269 CG PHE A 148 8.009 -9.417 4.926 1.00 0.00 C ATOM 2270 CD1 PHE A 148 7.217 -10.525 4.672 1.00 0.00 C ATOM 2271 CD2 PHE A 148 7.697 -8.606 6.005 1.00 0.00 C ATOM 2272 CE1 PHE A 148 6.134 -10.816 5.479 1.00 0.00 C ATOM 2273 CE2 PHE A 148 6.615 -8.893 6.814 1.00 0.00 C ATOM 2274 CZ PHE A 148 5.832 -9.999 6.551 1.00 0.00 C ATOM 0 H PHE A 148 9.343 -11.556 4.150 1.00 0.00 H new ATOM 0 HA PHE A 148 11.301 -9.489 3.851 1.00 0.00 H new ATOM 0 HB2 PHE A 148 9.364 -8.025 4.065 1.00 0.00 H new ATOM 0 HB3 PHE A 148 8.950 -9.371 3.021 1.00 0.00 H new ATOM 0 HD1 PHE A 148 7.448 -11.167 3.835 1.00 0.00 H new ATOM 0 HD2 PHE A 148 8.307 -7.740 6.216 1.00 0.00 H new ATOM 0 HE1 PHE A 148 5.523 -11.682 5.272 1.00 0.00 H new ATOM 0 HE2 PHE A 148 6.382 -8.253 7.652 1.00 0.00 H new ATOM 0 HZ PHE A 148 4.985 -10.225 7.182 1.00 0.00 H new ATOM 2284 N ARG A 149 10.541 -10.433 6.827 1.00 0.00 N ATOM 2285 CA ARG A 149 10.802 -10.241 8.247 1.00 0.00 C ATOM 2286 C ARG A 149 12.186 -9.644 8.486 1.00 0.00 C ATOM 2287 O ARG A 149 13.193 -10.165 8.004 1.00 0.00 O ATOM 2288 CB ARG A 149 10.664 -11.567 8.982 1.00 0.00 C ATOM 2289 CG ARG A 149 9.225 -11.913 9.325 1.00 0.00 C ATOM 2290 CD ARG A 149 8.554 -10.818 10.144 1.00 0.00 C ATOM 2291 NE ARG A 149 9.317 -10.477 11.343 1.00 0.00 N ATOM 2292 CZ ARG A 149 8.801 -9.846 12.394 1.00 0.00 C ATOM 2293 NH1 ARG A 149 7.526 -9.476 12.396 1.00 0.00 N ATOM 2294 NH2 ARG A 149 9.562 -9.581 13.448 1.00 0.00 N ATOM 0 H ARG A 149 10.148 -11.345 6.594 1.00 0.00 H new ATOM 0 HA ARG A 149 10.067 -9.535 8.634 1.00 0.00 H new ATOM 0 HB2 ARG A 149 11.085 -12.362 8.367 1.00 0.00 H new ATOM 0 HB3 ARG A 149 11.251 -11.529 9.900 1.00 0.00 H new ATOM 0 HG2 ARG A 149 8.662 -12.075 8.406 1.00 0.00 H new ATOM 0 HG3 ARG A 149 9.200 -12.849 9.883 1.00 0.00 H new ATOM 0 HD2 ARG A 149 8.434 -9.928 9.527 1.00 0.00 H new ATOM 0 HD3 ARG A 149 7.554 -11.143 10.432 1.00 0.00 H new ATOM 0 HE ARG A 149 10.302 -10.738 11.376 1.00 0.00 H new ATOM 0 HH11 ARG A 149 6.936 -9.675 11.588 1.00 0.00 H new ATOM 0 HH12 ARG A 149 7.137 -8.992 13.205 1.00 0.00 H new ATOM 0 HH21 ARG A 149 10.543 -9.861 13.452 1.00 0.00 H new ATOM 0 HH22 ARG A 149 9.166 -9.097 14.254 1.00 0.00 H new ATOM 2308 N LYS A 150 12.221 -8.544 9.227 1.00 0.00 N ATOM 2309 CA LYS A 150 13.471 -7.856 9.532 1.00 0.00 C ATOM 2310 C LYS A 150 14.490 -8.803 10.165 1.00 0.00 C ATOM 2311 O LYS A 150 15.383 -9.312 9.486 1.00 0.00 O ATOM 2312 CB LYS A 150 13.209 -6.666 10.460 1.00 0.00 C ATOM 2313 CG LYS A 150 13.391 -5.317 9.783 1.00 0.00 C ATOM 2314 CD LYS A 150 13.013 -4.172 10.710 1.00 0.00 C ATOM 2315 CE LYS A 150 11.628 -3.632 10.395 1.00 0.00 C ATOM 2316 NZ LYS A 150 11.648 -2.681 9.250 1.00 0.00 N ATOM 0 H LYS A 150 11.393 -8.106 9.631 1.00 0.00 H new ATOM 0 HA LYS A 150 13.889 -7.492 8.593 1.00 0.00 H new ATOM 0 HB2 LYS A 150 12.193 -6.735 10.848 1.00 0.00 H new ATOM 0 HB3 LYS A 150 13.881 -6.728 11.316 1.00 0.00 H new ATOM 0 HG2 LYS A 150 14.428 -5.204 9.468 1.00 0.00 H new ATOM 0 HG3 LYS A 150 12.778 -5.275 8.883 1.00 0.00 H new ATOM 0 HD2 LYS A 150 13.044 -4.515 11.744 1.00 0.00 H new ATOM 0 HD3 LYS A 150 13.746 -3.371 10.618 1.00 0.00 H new ATOM 0 HE2 LYS A 150 10.959 -4.461 10.166 1.00 0.00 H new ATOM 0 HE3 LYS A 150 11.225 -3.131 11.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 10.674 -2.402 9.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 12.197 -1.837 9.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 12.086 -3.139 8.426 1.00 0.00 H new ATOM 2330 N LYS A 151 14.359 -9.026 11.467 1.00 0.00 N ATOM 2331 CA LYS A 151 15.276 -9.902 12.189 1.00 0.00 C ATOM 2332 C LYS A 151 14.522 -10.891 13.072 1.00 0.00 C ATOM 2333 O LYS A 151 13.309 -10.785 13.248 1.00 0.00 O ATOM 2334 CB LYS A 151 16.234 -9.071 13.045 1.00 0.00 C ATOM 2335 CG LYS A 151 15.533 -8.034 13.908 1.00 0.00 C ATOM 2336 CD LYS A 151 16.445 -7.513 15.007 1.00 0.00 C ATOM 2337 CE LYS A 151 15.698 -7.357 16.322 1.00 0.00 C ATOM 2338 NZ LYS A 151 14.644 -6.307 16.243 1.00 0.00 N ATOM 0 H LYS A 151 13.627 -8.613 12.045 1.00 0.00 H new ATOM 0 HA LYS A 151 15.845 -10.469 11.452 1.00 0.00 H new ATOM 0 HB2 LYS A 151 16.807 -9.739 13.688 1.00 0.00 H new ATOM 0 HB3 LYS A 151 16.947 -8.567 12.393 1.00 0.00 H new ATOM 0 HG2 LYS A 151 15.203 -7.204 13.284 1.00 0.00 H new ATOM 0 HG3 LYS A 151 14.640 -8.473 14.353 1.00 0.00 H new ATOM 0 HD2 LYS A 151 17.282 -8.198 15.142 1.00 0.00 H new ATOM 0 HD3 LYS A 151 16.864 -6.552 14.709 1.00 0.00 H new ATOM 0 HE2 LYS A 151 15.242 -8.309 16.595 1.00 0.00 H new ATOM 0 HE3 LYS A 151 16.404 -7.103 17.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 14.170 -6.221 17.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 15.079 -5.397 15.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 13.946 -6.570 15.518 1.00 0.00 H new ATOM 2352 N HIS A 152 15.256 -11.851 13.626 1.00 0.00 N ATOM 2353 CA HIS A 152 14.673 -12.865 14.498 1.00 0.00 C ATOM 2354 C HIS A 152 15.727 -13.454 15.428 1.00 0.00 C ATOM 2355 O HIS A 152 16.889 -13.049 15.401 1.00 0.00 O ATOM 2356 CB HIS A 152 14.039 -13.979 13.673 1.00 0.00 C ATOM 2357 CG HIS A 152 12.653 -13.668 13.200 1.00 0.00 C ATOM 2358 ND1 HIS A 152 11.677 -12.908 13.752 1.00 0.00 N flip ATOM 2359 CD2 HIS A 152 12.128 -14.174 12.031 1.00 0.00 C flip ATOM 2360 CE1 HIS A 152 10.591 -12.970 12.913 1.00 0.00 C flip ATOM 2361 NE2 HIS A 152 10.889 -13.739 11.883 1.00 0.00 N flip ATOM 0 H HIS A 152 16.262 -11.948 13.485 1.00 0.00 H new ATOM 0 HA HIS A 152 13.903 -12.384 15.101 1.00 0.00 H new ATOM 0 HB2 HIS A 152 14.671 -14.182 12.808 1.00 0.00 H new ATOM 0 HB3 HIS A 152 14.013 -14.891 14.270 1.00 0.00 H new ATOM 0 HD1 HIS A 152 11.737 -12.387 14.627 1.00 0.00 H new ATOM 0 HD2 HIS A 152 12.648 -14.824 11.343 1.00 0.00 H new ATOM 0 HE1 HIS A 152 9.647 -12.470 13.071 1.00 0.00 H new ATOM 2370 N LEU A 153 15.315 -14.416 16.247 1.00 0.00 N ATOM 2371 CA LEU A 153 16.224 -15.067 17.183 1.00 0.00 C ATOM 2372 C LEU A 153 16.594 -16.466 16.693 1.00 0.00 C ATOM 2373 O LEU A 153 17.683 -16.965 16.974 1.00 0.00 O ATOM 2374 CB LEU A 153 15.590 -15.145 18.574 1.00 0.00 C ATOM 2375 CG LEU A 153 16.153 -14.159 19.599 1.00 0.00 C ATOM 2376 CD1 LEU A 153 17.651 -14.362 19.765 1.00 0.00 C ATOM 2377 CD2 LEU A 153 15.850 -12.728 19.182 1.00 0.00 C ATOM 0 H LEU A 153 14.356 -14.762 16.281 1.00 0.00 H new ATOM 0 HA LEU A 153 17.135 -14.471 17.245 1.00 0.00 H new ATOM 0 HB2 LEU A 153 14.518 -14.973 18.478 1.00 0.00 H new ATOM 0 HB3 LEU A 153 15.717 -16.157 18.958 1.00 0.00 H new ATOM 0 HG LEU A 153 15.673 -14.346 20.559 1.00 0.00 H new ATOM 0 HD11 LEU A 153 18.035 -13.652 20.498 1.00 0.00 H new ATOM 0 HD12 LEU A 153 17.845 -15.378 20.108 1.00 0.00 H new ATOM 0 HD13 LEU A 153 18.148 -14.201 18.808 1.00 0.00 H new ATOM 0 HD21 LEU A 153 16.257 -12.039 19.922 1.00 0.00 H new ATOM 0 HD22 LEU A 153 16.304 -12.528 18.211 1.00 0.00 H new ATOM 0 HD23 LEU A 153 14.771 -12.590 19.113 1.00 0.00 H new ATOM 2389 N GLU A 154 15.676 -17.090 15.960 1.00 0.00 N ATOM 2390 CA GLU A 154 15.903 -18.429 15.429 1.00 0.00 C ATOM 2391 C GLU A 154 15.543 -18.492 13.947 1.00 0.00 C ATOM 2392 O GLU A 154 14.387 -18.299 13.571 1.00 0.00 O ATOM 2393 CB GLU A 154 15.081 -19.455 16.210 1.00 0.00 C ATOM 2394 CG GLU A 154 13.607 -19.101 16.317 1.00 0.00 C ATOM 2395 CD GLU A 154 13.238 -18.549 17.680 1.00 0.00 C ATOM 2396 OE1 GLU A 154 13.913 -17.604 18.141 1.00 0.00 O ATOM 2397 OE2 GLU A 154 12.275 -19.061 18.287 1.00 0.00 O ATOM 0 H GLU A 154 14.769 -16.690 15.721 1.00 0.00 H new ATOM 0 HA GLU A 154 16.962 -18.664 15.538 1.00 0.00 H new ATOM 0 HB2 GLU A 154 15.178 -20.428 15.729 1.00 0.00 H new ATOM 0 HB3 GLU A 154 15.496 -19.553 17.213 1.00 0.00 H new ATOM 0 HG2 GLU A 154 13.357 -18.366 15.552 1.00 0.00 H new ATOM 0 HG3 GLU A 154 13.008 -19.989 16.114 1.00 0.00 H new ATOM 2404 N ASP A 155 16.541 -18.762 13.112 1.00 0.00 N ATOM 2405 CA ASP A 155 16.328 -18.848 11.672 1.00 0.00 C ATOM 2406 C ASP A 155 16.116 -20.295 11.236 1.00 0.00 C ATOM 2407 O ASP A 155 15.149 -20.608 10.542 1.00 0.00 O ATOM 2408 CB ASP A 155 17.518 -18.244 10.922 1.00 0.00 C ATOM 2409 CG ASP A 155 17.230 -16.848 10.410 1.00 0.00 C ATOM 2410 OD1 ASP A 155 16.629 -16.726 9.322 1.00 0.00 O ATOM 2411 OD2 ASP A 155 17.605 -15.874 11.097 1.00 0.00 O ATOM 0 H ASP A 155 17.504 -18.925 13.407 1.00 0.00 H new ATOM 0 HA ASP A 155 15.429 -18.281 11.429 1.00 0.00 H new ATOM 0 HB2 ASP A 155 18.384 -18.214 11.584 1.00 0.00 H new ATOM 0 HB3 ASP A 155 17.780 -18.889 10.083 1.00 0.00 H new ATOM 2416 N GLU A 156 17.027 -21.172 11.646 1.00 0.00 N ATOM 2417 CA GLU A 156 16.938 -22.585 11.297 1.00 0.00 C ATOM 2418 C GLU A 156 16.989 -22.774 9.784 1.00 0.00 C ATOM 2419 O GLU A 156 16.002 -22.541 9.086 1.00 0.00 O ATOM 2420 CB GLU A 156 15.650 -23.192 11.855 1.00 0.00 C ATOM 2421 CG GLU A 156 15.757 -23.607 13.314 1.00 0.00 C ATOM 2422 CD GLU A 156 16.706 -24.773 13.519 1.00 0.00 C ATOM 2423 OE1 GLU A 156 17.928 -24.533 13.620 1.00 0.00 O ATOM 2424 OE2 GLU A 156 16.227 -25.925 13.578 1.00 0.00 O ATOM 0 H GLU A 156 17.835 -20.929 12.220 1.00 0.00 H new ATOM 0 HA GLU A 156 17.792 -23.097 11.740 1.00 0.00 H new ATOM 0 HB2 GLU A 156 14.842 -22.469 11.750 1.00 0.00 H new ATOM 0 HB3 GLU A 156 15.379 -24.062 11.257 1.00 0.00 H new ATOM 0 HG2 GLU A 156 16.097 -22.757 13.906 1.00 0.00 H new ATOM 0 HG3 GLU A 156 14.768 -23.878 13.685 1.00 0.00 H new ATOM 2431 N LEU A 157 18.146 -23.198 9.284 1.00 0.00 N ATOM 2432 CA LEU A 157 18.325 -23.418 7.853 1.00 0.00 C ATOM 2433 C LEU A 157 18.813 -24.837 7.579 1.00 0.00 C ATOM 2434 O LEU A 157 18.129 -25.562 6.827 1.00 0.00 O ATOM 2435 CB LEU A 157 19.317 -22.400 7.283 1.00 0.00 C ATOM 2436 CG LEU A 157 18.742 -21.470 6.212 1.00 0.00 C ATOM 2437 CD1 LEU A 157 19.352 -20.080 6.328 1.00 0.00 C ATOM 2438 CD2 LEU A 157 18.981 -22.045 4.824 1.00 0.00 C ATOM 2439 OXT LEU A 157 19.875 -25.212 8.118 1.00 0.00 O ATOM 0 H LEU A 157 18.973 -23.396 9.848 1.00 0.00 H new ATOM 0 HA LEU A 157 17.360 -23.287 7.363 1.00 0.00 H new ATOM 0 HB2 LEU A 157 19.703 -21.793 8.102 1.00 0.00 H new ATOM 0 HB3 LEU A 157 20.164 -22.939 6.859 1.00 0.00 H new ATOM 0 HG LEU A 157 17.667 -21.386 6.369 1.00 0.00 H new ATOM 0 HD11 LEU A 157 18.931 -19.433 5.559 1.00 0.00 H new ATOM 0 HD12 LEU A 157 19.130 -19.666 7.312 1.00 0.00 H new ATOM 0 HD13 LEU A 157 20.432 -20.145 6.197 1.00 0.00 H new ATOM 0 HD21 LEU A 157 18.566 -21.371 4.075 1.00 0.00 H new ATOM 0 HD22 LEU A 157 20.052 -22.158 4.657 1.00 0.00 H new ATOM 0 HD23 LEU A 157 18.497 -23.018 4.745 1.00 0.00 H new TER 2451 LEU A 157