USER MOD reduce.3.24.130724 H: found=0, std=0, add=1462, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1460 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: C 35 HIS : no HD1:sc= -16.2! C(o=-16!,f=-23!) USER MOD Set 1.2: C 78 THR OG1 : rot -64:sc= -0.0447! USER MOD Set 2.1: B 63 THR OG1 : rot -47:sc= -0.699! USER MOD Set 2.2: B 65 GLN : amide:sc= -0.561 K(o=-1.3,f=-0.71) USER MOD Set 3.1: B 13 THR OG1 : rot 95:sc= 0.17 USER MOD Set 3.2: C 27 HIS : no HD1:sc= -5.5! C(o=-5.3!,f=-3.6!) USER MOD Set 4.1: B 1 MET N :NH3+ -172:sc= 0.471 (180deg=0.369) USER MOD Set 4.2: B 64 SER OG : rot 99:sc= 0.798 USER MOD Single : A 1 VAL N :NH3+ 156:sc= -0.157 (180deg=-1.15!) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0.0693 USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= -0.124 X(o=-0.12,f=-0.0011) USER MOD Single : A 8 CYS SG : rot -48:sc= -5.29! USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 94:sc= -5.75! USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=-0.057) USER MOD Single : A 15 HIS : no HD1:sc= -0.0466 X(o=-0.047,f=0) USER MOD Single : B 1 MET CE :methyl -143:sc= -0.251 (180deg=-1.55!) USER MOD Single : B 6 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 10 HIS : no HD1:sc= -4.79! C(o=-4.8!,f=-6.2!) USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 THR OG1 : rot 71:sc= 0.59 USER MOD Single : B 16 THR OG1 : rot 170:sc= -2.74! USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 21 SER OG : rot 180:sc= 0 USER MOD Single : B 22 SER OG : rot -104:sc= 0.957! USER MOD Single : B 23 THR OG1 : rot 170:sc= -0.607 USER MOD Single : B 28 LYS NZ :NH3+ 163:sc= -1.68! (180deg=-2.04!) USER MOD Single : B 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 42 GLN : amide:sc= -4.28! C(o=-4.3!,f=-4.2!) USER MOD Single : B 45 TYR OH : rot 180:sc= 0 USER MOD Single : B 46 LYS NZ :NH3+ -172:sc= 0.7 (180deg=0.642) USER MOD Single : B 49 GLN : amide:sc= -0.979 K(o=-0.98,f=-2.2!) USER MOD Single : B 55 LYS NZ :NH3+ 151:sc= -0.0675 (180deg=-0.104) USER MOD Single : B 56 THR OG1 : rot 180:sc= 0.15 USER MOD Single : B 60 CYS SG : rot 130:sc= -2.05 USER MOD Single : B 66 THR OG1 : rot 63:sc= 0.671 USER MOD Single : B 70 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 74 THR OG1 : rot 160:sc= 0 USER MOD Single : B 89 CYS SG : rot 180:sc= -0.0501 USER MOD Single : C 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 18 TYR OH : rot -17:sc= -0.0814 USER MOD Single : C 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 23 SER OG : rot -81:sc= 0.024! USER MOD Single : C 24 SER OG : rot 70:sc= -0.863! USER MOD Single : C 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 38 THR OG1 : rot 92:sc= -5.04! USER MOD Single : C 39 SER OG : rot 111:sc= -4.8! USER MOD Single : C 41 THR OG1 : rot 171:sc= 0.555 USER MOD Single : C 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 45 MET CE :methyl 178:sc= 0 (180deg=-0.00475) USER MOD Single : C 58 ASN : amide:sc= -2.28! C(o=-2.3!,f=-6.8!) USER MOD Single : C 61 ASN : amide:sc= -0.402 K(o=-0.4,f=-2.6!) USER MOD Single : C 67 SER OG : rot 180:sc= 0.177 USER MOD Single : C 68 HIS : no HD1:sc= -0.15 X(o=-0.15,f=-0.15) USER MOD Single : C 71 SER OG : rot 180:sc= 0 USER MOD Single : C 72 LYS NZ :NH3+ -102:sc= 1.28 (180deg=-0.779) USER MOD Single : C 74 CYS SG : rot 134:sc= -2.67! USER MOD Single : C 75 MET CE :methyl -105:sc= -4.84! (180deg=-9.93!) USER MOD Single : C 76 TYR OH : rot 150:sc= -1.51! USER MOD Single : C 79 TYR OH : rot -90:sc= -1.14 USER MOD Single : C 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 83 TYR OH : rot 180:sc= 0 USER MOD Single : C 105 MET CE :methyl -126:sc= -0.114 (180deg=-0.664) USER MOD Single : C 108 ASN : amide:sc= -0.604 K(o=-0.6,f=-2.3!) USER MOD Single : C 112 CYS SG : rot -55:sc= -0.103 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 14.937 3.991 16.847 1.00 0.00 N ATOM 2 CA VAL A 1 14.105 4.398 15.680 1.00 0.00 C ATOM 3 C VAL A 1 13.487 5.752 15.893 1.00 0.00 C ATOM 4 O VAL A 1 13.049 6.124 16.964 1.00 0.00 O ATOM 5 CB VAL A 1 13.015 3.377 15.503 1.00 0.00 C ATOM 6 CG1 VAL A 1 12.202 3.311 16.783 1.00 0.00 C ATOM 7 CG2 VAL A 1 12.112 3.818 14.349 1.00 0.00 C ATOM 0 H1 VAL A 1 15.012 2.954 16.875 1.00 0.00 H new ATOM 0 H2 VAL A 1 15.887 4.404 16.757 1.00 0.00 H new ATOM 0 H3 VAL A 1 14.494 4.330 17.725 1.00 0.00 H new ATOM 0 HA VAL A 1 14.738 4.454 14.795 1.00 0.00 H new ATOM 0 HB VAL A 1 13.440 2.398 15.284 1.00 0.00 H new ATOM 0 HG11 VAL A 1 11.406 2.574 16.671 1.00 0.00 H new ATOM 0 HG12 VAL A 1 12.850 3.023 17.611 1.00 0.00 H new ATOM 0 HG13 VAL A 1 11.765 4.289 16.987 1.00 0.00 H new ATOM 0 HG21 VAL A 1 11.316 3.086 14.209 1.00 0.00 H new ATOM 0 HG22 VAL A 1 11.675 4.789 14.580 1.00 0.00 H new ATOM 0 HG23 VAL A 1 12.701 3.893 13.435 1.00 0.00 H new ATOM 19 N ALA A 2 13.479 6.475 14.850 1.00 0.00 N ATOM 20 CA ALA A 2 12.924 7.851 14.861 1.00 0.00 C ATOM 21 C ALA A 2 11.750 7.969 13.895 1.00 0.00 C ATOM 22 O ALA A 2 11.615 7.200 12.964 1.00 0.00 O ATOM 23 CB ALA A 2 14.072 8.709 14.361 1.00 0.00 C ATOM 0 H ALA A 2 13.844 6.175 13.946 1.00 0.00 H new ATOM 0 HA ALA A 2 12.558 8.140 15.846 1.00 0.00 H new ATOM 0 HB1 ALA A 2 13.760 9.753 14.332 1.00 0.00 H new ATOM 0 HB2 ALA A 2 14.924 8.603 15.032 1.00 0.00 H new ATOM 0 HB3 ALA A 2 14.357 8.388 13.359 1.00 0.00 H new ATOM 29 N THR A 3 10.917 8.950 14.087 1.00 0.00 N ATOM 30 CA THR A 3 9.778 9.139 13.155 1.00 0.00 C ATOM 31 C THR A 3 10.292 9.832 11.895 1.00 0.00 C ATOM 32 O THR A 3 11.221 10.615 11.947 1.00 0.00 O ATOM 33 CB THR A 3 8.789 10.034 13.905 1.00 0.00 C ATOM 34 OG1 THR A 3 9.000 9.902 15.304 1.00 0.00 O ATOM 35 CG2 THR A 3 7.358 9.618 13.561 1.00 0.00 C ATOM 0 H THR A 3 10.976 9.627 14.848 1.00 0.00 H new ATOM 0 HA THR A 3 9.308 8.203 12.854 1.00 0.00 H new ATOM 0 HB THR A 3 8.943 11.072 13.610 1.00 0.00 H new ATOM 0 HG1 THR A 3 8.368 10.476 15.786 1.00 0.00 H new ATOM 0 HG21 THR A 3 6.655 10.256 14.096 1.00 0.00 H new ATOM 0 HG22 THR A 3 7.197 9.721 12.488 1.00 0.00 H new ATOM 0 HG23 THR A 3 7.201 8.580 13.854 1.00 0.00 H new ATOM 43 N LEU A 4 9.711 9.558 10.765 1.00 0.00 N ATOM 44 CA LEU A 4 10.185 10.210 9.510 1.00 0.00 C ATOM 45 C LEU A 4 10.437 11.706 9.748 1.00 0.00 C ATOM 46 O LEU A 4 11.109 12.364 8.982 1.00 0.00 O ATOM 47 CB LEU A 4 9.037 10.020 8.513 1.00 0.00 C ATOM 48 CG LEU A 4 9.569 10.009 7.075 1.00 0.00 C ATOM 49 CD1 LEU A 4 8.479 10.524 6.133 1.00 0.00 C ATOM 50 CD2 LEU A 4 10.793 10.918 6.955 1.00 0.00 C ATOM 0 H LEU A 4 8.929 8.912 10.652 1.00 0.00 H new ATOM 0 HA LEU A 4 11.121 9.782 9.152 1.00 0.00 H new ATOM 0 HB2 LEU A 4 8.518 9.085 8.722 1.00 0.00 H new ATOM 0 HB3 LEU A 4 8.309 10.822 8.631 1.00 0.00 H new ATOM 0 HG LEU A 4 9.850 8.990 6.810 1.00 0.00 H new ATOM 0 HD11 LEU A 4 8.851 10.519 5.109 1.00 0.00 H new ATOM 0 HD12 LEU A 4 7.603 9.880 6.204 1.00 0.00 H new ATOM 0 HD13 LEU A 4 8.206 11.541 6.414 1.00 0.00 H new ATOM 0 HD21 LEU A 4 11.160 10.900 5.929 1.00 0.00 H new ATOM 0 HD22 LEU A 4 10.517 11.938 7.224 1.00 0.00 H new ATOM 0 HD23 LEU A 4 11.576 10.565 7.626 1.00 0.00 H new ATOM 62 N GLN A 5 9.883 12.252 10.797 1.00 0.00 N ATOM 63 CA GLN A 5 10.066 13.708 11.073 1.00 0.00 C ATOM 64 C GLN A 5 11.527 14.035 11.407 1.00 0.00 C ATOM 65 O GLN A 5 12.017 15.101 11.096 1.00 0.00 O ATOM 66 CB GLN A 5 9.173 13.989 12.281 1.00 0.00 C ATOM 67 CG GLN A 5 9.430 15.410 12.786 1.00 0.00 C ATOM 68 CD GLN A 5 9.625 15.386 14.303 1.00 0.00 C ATOM 69 OE1 GLN A 5 10.679 15.027 14.786 1.00 0.00 O ATOM 70 NE2 GLN A 5 8.642 15.753 15.080 1.00 0.00 N ATOM 0 H GLN A 5 9.310 11.752 11.477 1.00 0.00 H new ATOM 0 HA GLN A 5 9.808 14.316 10.206 1.00 0.00 H new ATOM 0 HB2 GLN A 5 8.125 13.873 12.006 1.00 0.00 H new ATOM 0 HB3 GLN A 5 9.377 13.268 13.073 1.00 0.00 H new ATOM 0 HG2 GLN A 5 10.314 15.825 12.302 1.00 0.00 H new ATOM 0 HG3 GLN A 5 8.592 16.056 12.527 1.00 0.00 H new ATOM 0 HE21 GLN A 5 7.756 16.055 14.674 1.00 0.00 H new ATOM 0 HE22 GLN A 5 8.760 15.738 16.093 1.00 0.00 H new ATOM 79 N HIS A 6 12.220 13.140 12.056 1.00 0.00 N ATOM 80 CA HIS A 6 13.638 13.425 12.425 1.00 0.00 C ATOM 81 C HIS A 6 14.563 13.303 11.209 1.00 0.00 C ATOM 82 O HIS A 6 15.390 14.158 10.961 1.00 0.00 O ATOM 83 CB HIS A 6 13.991 12.368 13.471 1.00 0.00 C ATOM 84 CG HIS A 6 14.562 13.038 14.690 1.00 0.00 C ATOM 85 ND1 HIS A 6 15.721 12.592 15.304 1.00 0.00 N ATOM 86 CD2 HIS A 6 14.144 14.123 15.420 1.00 0.00 C ATOM 87 CE1 HIS A 6 15.959 13.399 16.355 1.00 0.00 C ATOM 88 NE2 HIS A 6 15.028 14.349 16.470 1.00 0.00 N ATOM 0 H HIS A 6 11.869 12.227 12.346 1.00 0.00 H new ATOM 0 HA HIS A 6 13.760 14.441 12.801 1.00 0.00 H new ATOM 0 HB2 HIS A 6 13.103 11.797 13.740 1.00 0.00 H new ATOM 0 HB3 HIS A 6 14.712 11.661 13.060 1.00 0.00 H new ATOM 0 HD2 HIS A 6 13.263 14.712 15.211 1.00 0.00 H new ATOM 0 HE1 HIS A 6 16.800 13.291 17.023 1.00 0.00 H new ATOM 0 HE2 HIS A 6 14.976 15.083 17.176 1.00 0.00 H new ATOM 96 N LEU A 7 14.443 12.245 10.457 1.00 0.00 N ATOM 97 CA LEU A 7 15.329 12.074 9.268 1.00 0.00 C ATOM 98 C LEU A 7 14.979 13.087 8.174 1.00 0.00 C ATOM 99 O LEU A 7 15.844 13.588 7.484 1.00 0.00 O ATOM 100 CB LEU A 7 15.071 10.647 8.787 1.00 0.00 C ATOM 101 CG LEU A 7 16.265 9.763 9.154 1.00 0.00 C ATOM 102 CD1 LEU A 7 16.736 10.095 10.571 1.00 0.00 C ATOM 103 CD2 LEU A 7 15.845 8.295 9.092 1.00 0.00 C ATOM 0 H LEU A 7 13.772 11.492 10.612 1.00 0.00 H new ATOM 0 HA LEU A 7 16.378 12.241 9.514 1.00 0.00 H new ATOM 0 HB2 LEU A 7 14.161 10.257 9.244 1.00 0.00 H new ATOM 0 HB3 LEU A 7 14.916 10.638 7.708 1.00 0.00 H new ATOM 0 HG LEU A 7 17.078 9.944 8.451 1.00 0.00 H new ATOM 0 HD11 LEU A 7 17.586 9.464 10.829 1.00 0.00 H new ATOM 0 HD12 LEU A 7 17.034 11.142 10.619 1.00 0.00 H new ATOM 0 HD13 LEU A 7 15.924 9.916 11.276 1.00 0.00 H new ATOM 0 HD21 LEU A 7 16.693 7.662 9.353 1.00 0.00 H new ATOM 0 HD22 LEU A 7 15.031 8.119 9.796 1.00 0.00 H new ATOM 0 HD23 LEU A 7 15.510 8.055 8.083 1.00 0.00 H new ATOM 115 N CYS A 8 13.723 13.388 8.004 1.00 0.00 N ATOM 116 CA CYS A 8 13.326 14.359 6.952 1.00 0.00 C ATOM 117 C CYS A 8 14.011 15.710 7.186 1.00 0.00 C ATOM 118 O CYS A 8 14.352 16.412 6.255 1.00 0.00 O ATOM 119 CB CYS A 8 11.810 14.480 7.098 1.00 0.00 C ATOM 120 SG CYS A 8 11.410 15.575 8.484 1.00 0.00 S ATOM 0 H CYS A 8 12.953 13.002 8.550 1.00 0.00 H new ATOM 0 HA CYS A 8 13.617 14.038 5.952 1.00 0.00 H new ATOM 0 HB2 CYS A 8 11.377 14.871 6.177 1.00 0.00 H new ATOM 0 HB3 CYS A 8 11.372 13.496 7.263 1.00 0.00 H new ATOM 0 HG CYS A 8 12.116 15.237 9.522 1.00 0.00 H new ATOM 126 N ARG A 9 14.216 16.076 8.420 1.00 0.00 N ATOM 127 CA ARG A 9 14.879 17.380 8.710 1.00 0.00 C ATOM 128 C ARG A 9 16.368 17.306 8.358 1.00 0.00 C ATOM 129 O ARG A 9 16.993 18.302 8.048 1.00 0.00 O ATOM 130 CB ARG A 9 14.693 17.595 10.213 1.00 0.00 C ATOM 131 CG ARG A 9 15.337 18.919 10.625 1.00 0.00 C ATOM 132 CD ARG A 9 14.497 20.084 10.096 1.00 0.00 C ATOM 133 NE ARG A 9 13.440 20.294 11.124 1.00 0.00 N ATOM 134 CZ ARG A 9 12.361 20.964 10.824 1.00 0.00 C ATOM 135 NH1 ARG A 9 12.203 21.446 9.622 1.00 0.00 N ATOM 136 NH2 ARG A 9 11.438 21.150 11.728 1.00 0.00 N ATOM 0 H ARG A 9 13.954 15.530 9.241 1.00 0.00 H new ATOM 0 HA ARG A 9 14.455 18.197 8.127 1.00 0.00 H new ATOM 0 HB2 ARG A 9 13.632 17.603 10.461 1.00 0.00 H new ATOM 0 HB3 ARG A 9 15.144 16.772 10.767 1.00 0.00 H new ATOM 0 HG2 ARG A 9 15.413 18.976 11.711 1.00 0.00 H new ATOM 0 HG3 ARG A 9 16.351 18.980 10.231 1.00 0.00 H new ATOM 0 HD2 ARG A 9 15.103 20.980 9.964 1.00 0.00 H new ATOM 0 HD3 ARG A 9 14.062 19.848 9.125 1.00 0.00 H new ATOM 0 HE ARG A 9 13.559 19.914 12.063 1.00 0.00 H new ATOM 0 HH11 ARG A 9 12.923 21.299 8.915 1.00 0.00 H new ATOM 0 HH12 ARG A 9 11.359 21.969 9.389 1.00 0.00 H new ATOM 0 HH21 ARG A 9 11.561 20.772 12.667 1.00 0.00 H new ATOM 0 HH22 ARG A 9 10.594 21.673 11.495 1.00 0.00 H new ATOM 150 N LYS A 10 16.942 16.135 8.405 1.00 0.00 N ATOM 151 CA LYS A 10 18.389 15.999 8.074 1.00 0.00 C ATOM 152 C LYS A 10 18.625 16.266 6.585 1.00 0.00 C ATOM 153 O LYS A 10 19.610 16.863 6.200 1.00 0.00 O ATOM 154 CB LYS A 10 18.741 14.550 8.419 1.00 0.00 C ATOM 155 CG LYS A 10 20.223 14.459 8.791 1.00 0.00 C ATOM 156 CD LYS A 10 20.993 13.773 7.661 1.00 0.00 C ATOM 157 CE LYS A 10 22.380 14.406 7.530 1.00 0.00 C ATOM 158 NZ LYS A 10 23.138 13.491 6.632 1.00 0.00 N ATOM 0 H LYS A 10 16.471 15.266 8.658 1.00 0.00 H new ATOM 0 HA LYS A 10 19.003 16.712 8.624 1.00 0.00 H new ATOM 0 HB2 LYS A 10 18.125 14.203 9.248 1.00 0.00 H new ATOM 0 HB3 LYS A 10 18.528 13.901 7.570 1.00 0.00 H new ATOM 0 HG2 LYS A 10 20.626 15.456 8.967 1.00 0.00 H new ATOM 0 HG3 LYS A 10 20.342 13.899 9.718 1.00 0.00 H new ATOM 0 HD2 LYS A 10 21.086 12.706 7.866 1.00 0.00 H new ATOM 0 HD3 LYS A 10 20.447 13.871 6.723 1.00 0.00 H new ATOM 0 HE2 LYS A 10 22.318 15.410 7.109 1.00 0.00 H new ATOM 0 HE3 LYS A 10 22.866 14.497 8.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 24.101 13.859 6.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 23.187 12.545 7.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 22.656 13.429 5.712 1.00 0.00 H new ATOM 172 N THR A 11 17.727 15.830 5.745 1.00 0.00 N ATOM 173 CA THR A 11 17.902 16.058 4.281 1.00 0.00 C ATOM 174 C THR A 11 17.994 17.557 3.986 1.00 0.00 C ATOM 175 O THR A 11 18.911 18.016 3.333 1.00 0.00 O ATOM 176 CB THR A 11 16.651 15.462 3.635 1.00 0.00 C ATOM 177 OG1 THR A 11 16.556 14.084 3.971 1.00 0.00 O ATOM 178 CG2 THR A 11 16.739 15.614 2.116 1.00 0.00 C ATOM 0 H THR A 11 16.880 15.326 6.008 1.00 0.00 H new ATOM 0 HA THR A 11 18.816 15.602 3.899 1.00 0.00 H new ATOM 0 HB THR A 11 15.768 15.986 4.000 1.00 0.00 H new ATOM 0 HG1 THR A 11 15.991 13.979 4.765 1.00 0.00 H new ATOM 0 HG21 THR A 11 15.847 15.189 1.656 1.00 0.00 H new ATOM 0 HG22 THR A 11 16.811 16.671 1.860 1.00 0.00 H new ATOM 0 HG23 THR A 11 17.622 15.090 1.748 1.00 0.00 H new ATOM 186 N VAL A 12 17.052 18.324 4.461 1.00 0.00 N ATOM 187 CA VAL A 12 17.086 19.794 4.208 1.00 0.00 C ATOM 188 C VAL A 12 18.360 20.404 4.796 1.00 0.00 C ATOM 189 O VAL A 12 18.968 21.278 4.210 1.00 0.00 O ATOM 190 CB VAL A 12 15.849 20.342 4.918 1.00 0.00 C ATOM 191 CG1 VAL A 12 15.672 21.822 4.568 1.00 0.00 C ATOM 192 CG2 VAL A 12 14.614 19.561 4.466 1.00 0.00 C ATOM 0 H VAL A 12 16.259 17.997 5.014 1.00 0.00 H new ATOM 0 HA VAL A 12 17.086 20.032 3.144 1.00 0.00 H new ATOM 0 HB VAL A 12 15.973 20.236 5.996 1.00 0.00 H new ATOM 0 HG11 VAL A 12 14.789 22.213 5.075 1.00 0.00 H new ATOM 0 HG12 VAL A 12 16.552 22.380 4.890 1.00 0.00 H new ATOM 0 HG13 VAL A 12 15.549 21.929 3.490 1.00 0.00 H new ATOM 0 HG21 VAL A 12 13.731 19.951 4.972 1.00 0.00 H new ATOM 0 HG22 VAL A 12 14.491 19.667 3.388 1.00 0.00 H new ATOM 0 HG23 VAL A 12 14.739 18.507 4.715 1.00 0.00 H new ATOM 202 N ASN A 13 18.769 19.951 5.948 1.00 0.00 N ATOM 203 CA ASN A 13 20.005 20.506 6.573 1.00 0.00 C ATOM 204 C ASN A 13 21.233 20.130 5.739 1.00 0.00 C ATOM 205 O ASN A 13 22.151 20.911 5.581 1.00 0.00 O ATOM 206 CB ASN A 13 20.076 19.857 7.955 1.00 0.00 C ATOM 207 CG ASN A 13 20.509 20.898 8.988 1.00 0.00 C ATOM 208 OD1 ASN A 13 19.836 21.890 9.186 1.00 0.00 O ATOM 209 ND2 ASN A 13 21.612 20.713 9.660 1.00 0.00 N ATOM 0 H ASN A 13 18.302 19.220 6.485 1.00 0.00 H new ATOM 0 HA ASN A 13 19.984 21.594 6.635 1.00 0.00 H new ATOM 0 HB2 ASN A 13 19.104 19.445 8.225 1.00 0.00 H new ATOM 0 HB3 ASN A 13 20.782 19.027 7.942 1.00 0.00 H new ATOM 0 HD21 ASN A 13 21.909 21.401 10.352 1.00 0.00 H new ATOM 0 HD22 ASN A 13 22.177 19.880 9.494 1.00 0.00 H new ATOM 216 N GLY A 14 21.257 18.940 5.205 1.00 0.00 N ATOM 217 CA GLY A 14 22.426 18.514 4.383 1.00 0.00 C ATOM 218 C GLY A 14 22.520 19.390 3.132 1.00 0.00 C ATOM 219 O GLY A 14 23.592 19.775 2.711 1.00 0.00 O ATOM 0 H GLY A 14 20.518 18.244 5.302 1.00 0.00 H new ATOM 0 HA2 GLY A 14 23.343 18.596 4.967 1.00 0.00 H new ATOM 0 HA3 GLY A 14 22.322 17.467 4.099 1.00 0.00 H new ATOM 223 N HIS A 15 21.405 19.706 2.532 1.00 0.00 N ATOM 224 CA HIS A 15 21.433 20.556 1.307 1.00 0.00 C ATOM 225 C HIS A 15 21.030 21.992 1.650 1.00 0.00 C ATOM 226 O HIS A 15 20.417 22.249 2.666 1.00 0.00 O ATOM 227 CB HIS A 15 20.410 19.924 0.363 1.00 0.00 C ATOM 228 CG HIS A 15 21.004 18.694 -0.269 1.00 0.00 C ATOM 229 ND1 HIS A 15 20.657 17.415 0.136 1.00 0.00 N ATOM 230 CD2 HIS A 15 21.922 18.533 -1.276 1.00 0.00 C ATOM 231 CE1 HIS A 15 21.357 16.547 -0.618 1.00 0.00 C ATOM 232 NE2 HIS A 15 22.144 17.177 -1.495 1.00 0.00 N ATOM 0 H HIS A 15 20.477 19.413 2.836 1.00 0.00 H new ATOM 0 HA HIS A 15 22.426 20.603 0.860 1.00 0.00 H new ATOM 0 HB2 HIS A 15 19.505 19.663 0.912 1.00 0.00 H new ATOM 0 HB3 HIS A 15 20.120 20.638 -0.408 1.00 0.00 H new ATOM 0 HD2 HIS A 15 22.400 19.337 -1.817 1.00 0.00 H new ATOM 0 HE1 HIS A 15 21.291 15.473 -0.525 1.00 0.00 H new ATOM 0 HE2 HIS A 15 22.773 16.755 -2.178 1.00 0.00 H new ATOM 241 N MET B 1 13.517 -16.142 12.789 1.00 0.00 N ATOM 242 CA MET B 1 12.288 -16.511 13.550 1.00 0.00 C ATOM 243 C MET B 1 11.103 -15.655 13.091 1.00 0.00 C ATOM 244 O MET B 1 9.957 -15.991 13.318 1.00 0.00 O ATOM 245 CB MET B 1 12.635 -16.238 15.020 1.00 0.00 C ATOM 246 CG MET B 1 12.077 -14.878 15.457 1.00 0.00 C ATOM 247 SD MET B 1 12.946 -13.555 14.579 1.00 0.00 S ATOM 248 CE MET B 1 14.567 -13.800 15.345 1.00 0.00 C ATOM 0 H1 MET B 1 14.278 -16.816 13.010 1.00 0.00 H new ATOM 0 H2 MET B 1 13.315 -16.170 11.769 1.00 0.00 H new ATOM 0 H3 MET B 1 13.816 -15.183 13.057 1.00 0.00 H new ATOM 0 HA MET B 1 11.996 -17.550 13.394 1.00 0.00 H new ATOM 0 HB2 MET B 1 12.223 -17.027 15.650 1.00 0.00 H new ATOM 0 HB3 MET B 1 13.717 -16.255 15.154 1.00 0.00 H new ATOM 0 HG2 MET B 1 11.009 -14.827 15.247 1.00 0.00 H new ATOM 0 HG3 MET B 1 12.196 -14.753 16.533 1.00 0.00 H new ATOM 0 HE1 MET B 1 15.045 -12.833 15.502 1.00 0.00 H new ATOM 0 HE2 MET B 1 14.444 -14.304 16.303 1.00 0.00 H new ATOM 0 HE3 MET B 1 15.190 -14.410 14.691 1.00 0.00 H new ATOM 260 N ASP B 2 11.368 -14.551 12.448 1.00 0.00 N ATOM 261 CA ASP B 2 10.257 -13.677 11.976 1.00 0.00 C ATOM 262 C ASP B 2 10.519 -13.222 10.539 1.00 0.00 C ATOM 263 O ASP B 2 11.614 -12.824 10.193 1.00 0.00 O ATOM 264 CB ASP B 2 10.262 -12.481 12.928 1.00 0.00 C ATOM 265 CG ASP B 2 9.400 -11.360 12.343 1.00 0.00 C ATOM 266 OD1 ASP B 2 8.642 -11.638 11.428 1.00 0.00 O ATOM 267 OD2 ASP B 2 9.512 -10.242 12.820 1.00 0.00 O ATOM 0 H ASP B 2 12.306 -14.216 12.229 1.00 0.00 H new ATOM 0 HA ASP B 2 9.296 -14.192 11.976 1.00 0.00 H new ATOM 0 HB2 ASP B 2 9.878 -12.778 13.904 1.00 0.00 H new ATOM 0 HB3 ASP B 2 11.282 -12.128 13.080 1.00 0.00 H new ATOM 272 N VAL B 3 9.523 -13.276 9.698 1.00 0.00 N ATOM 273 CA VAL B 3 9.716 -12.847 8.284 1.00 0.00 C ATOM 274 C VAL B 3 8.659 -11.808 7.898 1.00 0.00 C ATOM 275 O VAL B 3 7.540 -11.842 8.370 1.00 0.00 O ATOM 276 CB VAL B 3 9.546 -14.122 7.458 1.00 0.00 C ATOM 277 CG1 VAL B 3 8.111 -14.631 7.595 1.00 0.00 C ATOM 278 CG2 VAL B 3 9.842 -13.820 5.988 1.00 0.00 C ATOM 0 H VAL B 3 8.583 -13.599 9.929 1.00 0.00 H new ATOM 0 HA VAL B 3 10.689 -12.383 8.120 1.00 0.00 H new ATOM 0 HB VAL B 3 10.237 -14.884 7.819 1.00 0.00 H new ATOM 0 HG11 VAL B 3 7.990 -15.540 7.006 1.00 0.00 H new ATOM 0 HG12 VAL B 3 7.900 -14.846 8.642 1.00 0.00 H new ATOM 0 HG13 VAL B 3 7.419 -13.870 7.234 1.00 0.00 H new ATOM 0 HG21 VAL B 3 9.721 -14.729 5.398 1.00 0.00 H new ATOM 0 HG22 VAL B 3 9.151 -13.058 5.627 1.00 0.00 H new ATOM 0 HG23 VAL B 3 10.865 -13.457 5.890 1.00 0.00 H new ATOM 288 N PHE B 4 9.006 -10.886 7.043 1.00 0.00 N ATOM 289 CA PHE B 4 8.022 -9.845 6.628 1.00 0.00 C ATOM 290 C PHE B 4 7.575 -10.087 5.184 1.00 0.00 C ATOM 291 O PHE B 4 8.379 -10.344 4.310 1.00 0.00 O ATOM 292 CB PHE B 4 8.775 -8.519 6.741 1.00 0.00 C ATOM 293 CG PHE B 4 8.918 -8.144 8.197 1.00 0.00 C ATOM 294 CD1 PHE B 4 9.658 -8.959 9.061 1.00 0.00 C ATOM 295 CD2 PHE B 4 8.307 -6.981 8.682 1.00 0.00 C ATOM 296 CE1 PHE B 4 9.789 -8.611 10.411 1.00 0.00 C ATOM 297 CE2 PHE B 4 8.437 -6.633 10.032 1.00 0.00 C ATOM 298 CZ PHE B 4 9.179 -7.448 10.896 1.00 0.00 C ATOM 0 H PHE B 4 9.928 -10.808 6.613 1.00 0.00 H new ATOM 0 HA PHE B 4 7.124 -9.857 7.245 1.00 0.00 H new ATOM 0 HB2 PHE B 4 9.758 -8.606 6.279 1.00 0.00 H new ATOM 0 HB3 PHE B 4 8.238 -7.737 6.204 1.00 0.00 H new ATOM 0 HD1 PHE B 4 10.128 -9.856 8.687 1.00 0.00 H new ATOM 0 HD2 PHE B 4 7.736 -6.353 8.015 1.00 0.00 H new ATOM 0 HE1 PHE B 4 10.360 -9.240 11.078 1.00 0.00 H new ATOM 0 HE2 PHE B 4 7.965 -5.737 10.407 1.00 0.00 H new ATOM 0 HZ PHE B 4 9.281 -7.179 11.937 1.00 0.00 H new ATOM 308 N LEU B 5 6.298 -10.009 4.926 1.00 0.00 N ATOM 309 CA LEU B 5 5.805 -10.238 3.538 1.00 0.00 C ATOM 310 C LEU B 5 5.028 -9.019 3.037 1.00 0.00 C ATOM 311 O LEU B 5 4.443 -8.280 3.802 1.00 0.00 O ATOM 312 CB LEU B 5 4.882 -11.453 3.645 1.00 0.00 C ATOM 313 CG LEU B 5 5.720 -12.733 3.623 1.00 0.00 C ATOM 314 CD1 LEU B 5 6.563 -12.769 2.347 1.00 0.00 C ATOM 315 CD2 LEU B 5 6.643 -12.756 4.844 1.00 0.00 C ATOM 0 H LEU B 5 5.576 -9.797 5.615 1.00 0.00 H new ATOM 0 HA LEU B 5 6.621 -10.401 2.834 1.00 0.00 H new ATOM 0 HB2 LEU B 5 4.301 -11.402 4.566 1.00 0.00 H new ATOM 0 HB3 LEU B 5 4.171 -11.457 2.819 1.00 0.00 H new ATOM 0 HG LEU B 5 5.061 -13.601 3.647 1.00 0.00 H new ATOM 0 HD11 LEU B 5 7.160 -13.681 2.331 1.00 0.00 H new ATOM 0 HD12 LEU B 5 5.907 -12.750 1.477 1.00 0.00 H new ATOM 0 HD13 LEU B 5 7.224 -11.902 2.323 1.00 0.00 H new ATOM 0 HD21 LEU B 5 7.241 -13.667 4.831 1.00 0.00 H new ATOM 0 HD22 LEU B 5 7.302 -11.888 4.818 1.00 0.00 H new ATOM 0 HD23 LEU B 5 6.043 -12.729 5.754 1.00 0.00 H new ATOM 327 N MET B 6 5.011 -8.811 1.752 1.00 0.00 N ATOM 328 CA MET B 6 4.266 -7.651 1.190 1.00 0.00 C ATOM 329 C MET B 6 3.289 -8.150 0.128 1.00 0.00 C ATOM 330 O MET B 6 3.572 -9.089 -0.589 1.00 0.00 O ATOM 331 CB MET B 6 5.334 -6.751 0.566 1.00 0.00 C ATOM 332 CG MET B 6 6.117 -6.043 1.673 1.00 0.00 C ATOM 333 SD MET B 6 7.051 -4.663 0.964 1.00 0.00 S ATOM 334 CE MET B 6 6.556 -3.410 2.171 1.00 0.00 C ATOM 0 H MET B 6 5.483 -9.397 1.063 1.00 0.00 H new ATOM 0 HA MET B 6 3.687 -7.115 1.942 1.00 0.00 H new ATOM 0 HB2 MET B 6 6.010 -7.344 -0.049 1.00 0.00 H new ATOM 0 HB3 MET B 6 4.867 -6.017 -0.090 1.00 0.00 H new ATOM 0 HG2 MET B 6 5.434 -5.678 2.440 1.00 0.00 H new ATOM 0 HG3 MET B 6 6.796 -6.744 2.159 1.00 0.00 H new ATOM 0 HE1 MET B 6 7.026 -2.459 1.922 1.00 0.00 H new ATOM 0 HE2 MET B 6 5.472 -3.295 2.152 1.00 0.00 H new ATOM 0 HE3 MET B 6 6.871 -3.720 3.167 1.00 0.00 H new ATOM 344 N ILE B 7 2.144 -7.540 0.013 1.00 0.00 N ATOM 345 CA ILE B 7 1.172 -8.001 -1.008 1.00 0.00 C ATOM 346 C ILE B 7 0.971 -6.894 -2.033 1.00 0.00 C ATOM 347 O ILE B 7 0.865 -5.732 -1.689 1.00 0.00 O ATOM 348 CB ILE B 7 -0.102 -8.302 -0.218 1.00 0.00 C ATOM 349 CG1 ILE B 7 -0.333 -9.820 -0.220 1.00 0.00 C ATOM 350 CG2 ILE B 7 -1.298 -7.570 -0.839 1.00 0.00 C ATOM 351 CD1 ILE B 7 -1.685 -10.162 -0.848 1.00 0.00 C ATOM 0 H ILE B 7 1.842 -6.747 0.579 1.00 0.00 H new ATOM 0 HA ILE B 7 1.496 -8.881 -1.564 1.00 0.00 H new ATOM 0 HB ILE B 7 0.006 -7.952 0.809 1.00 0.00 H new ATOM 0 HG12 ILE B 7 0.466 -10.313 -0.774 1.00 0.00 H new ATOM 0 HG13 ILE B 7 -0.295 -10.200 0.801 1.00 0.00 H new ATOM 0 HG21 ILE B 7 -2.198 -7.793 -0.267 1.00 0.00 H new ATOM 0 HG22 ILE B 7 -1.115 -6.496 -0.823 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -1.432 -7.900 -1.869 1.00 0.00 H new ATOM 0 HD11 ILE B 7 -1.827 -11.243 -0.839 1.00 0.00 H new ATOM 0 HD12 ILE B 7 -2.482 -9.686 -0.277 1.00 0.00 H new ATOM 0 HD13 ILE B 7 -1.710 -9.801 -1.876 1.00 0.00 H new ATOM 363 N ARG B 8 0.943 -7.230 -3.292 1.00 0.00 N ATOM 364 CA ARG B 8 0.782 -6.166 -4.313 1.00 0.00 C ATOM 365 C ARG B 8 -0.556 -6.284 -5.044 1.00 0.00 C ATOM 366 O ARG B 8 -0.988 -7.351 -5.447 1.00 0.00 O ATOM 367 CB ARG B 8 1.947 -6.381 -5.278 1.00 0.00 C ATOM 368 CG ARG B 8 2.537 -5.027 -5.681 1.00 0.00 C ATOM 369 CD ARG B 8 3.937 -4.877 -5.082 1.00 0.00 C ATOM 370 NE ARG B 8 4.419 -3.553 -5.565 1.00 0.00 N ATOM 371 CZ ARG B 8 5.439 -2.978 -4.989 1.00 0.00 C ATOM 372 NH1 ARG B 8 6.040 -3.563 -3.988 1.00 0.00 N ATOM 373 NH2 ARG B 8 5.859 -1.818 -5.414 1.00 0.00 N ATOM 0 H ARG B 8 1.023 -8.181 -3.652 1.00 0.00 H new ATOM 0 HA ARG B 8 0.786 -5.172 -3.865 1.00 0.00 H new ATOM 0 HB2 ARG B 8 2.713 -6.997 -4.807 1.00 0.00 H new ATOM 0 HB3 ARG B 8 1.605 -6.918 -6.163 1.00 0.00 H new ATOM 0 HG2 ARG B 8 2.585 -4.949 -6.767 1.00 0.00 H new ATOM 0 HG3 ARG B 8 1.893 -4.220 -5.332 1.00 0.00 H new ATOM 0 HD2 ARG B 8 3.907 -4.914 -3.993 1.00 0.00 H new ATOM 0 HD3 ARG B 8 4.596 -5.681 -5.410 1.00 0.00 H new ATOM 0 HE ARG B 8 3.951 -3.095 -6.347 1.00 0.00 H new ATOM 0 HH11 ARG B 8 5.712 -4.470 -3.656 1.00 0.00 H new ATOM 0 HH12 ARG B 8 6.837 -3.113 -3.538 1.00 0.00 H new ATOM 0 HH21 ARG B 8 5.390 -1.361 -6.196 1.00 0.00 H new ATOM 0 HH22 ARG B 8 6.656 -1.368 -4.964 1.00 0.00 H new ATOM 387 N ARG B 9 -1.189 -5.164 -5.225 1.00 0.00 N ATOM 388 CA ARG B 9 -2.491 -5.100 -5.930 1.00 0.00 C ATOM 389 C ARG B 9 -2.586 -3.735 -6.609 1.00 0.00 C ATOM 390 O ARG B 9 -2.016 -2.769 -6.140 1.00 0.00 O ATOM 391 CB ARG B 9 -3.556 -5.246 -4.844 1.00 0.00 C ATOM 392 CG ARG B 9 -4.476 -6.420 -5.185 1.00 0.00 C ATOM 393 CD ARG B 9 -5.211 -6.130 -6.495 1.00 0.00 C ATOM 394 NE ARG B 9 -6.649 -6.366 -6.190 1.00 0.00 N ATOM 395 CZ ARG B 9 -7.559 -6.115 -7.092 1.00 0.00 C ATOM 396 NH1 ARG B 9 -7.210 -5.658 -8.264 1.00 0.00 N ATOM 397 NH2 ARG B 9 -8.818 -6.323 -6.822 1.00 0.00 N ATOM 0 H ARG B 9 -0.844 -4.260 -4.901 1.00 0.00 H new ATOM 0 HA ARG B 9 -2.613 -5.872 -6.689 1.00 0.00 H new ATOM 0 HB2 ARG B 9 -3.083 -5.410 -3.876 1.00 0.00 H new ATOM 0 HB3 ARG B 9 -4.136 -4.327 -4.763 1.00 0.00 H new ATOM 0 HG2 ARG B 9 -3.894 -7.337 -5.278 1.00 0.00 H new ATOM 0 HG3 ARG B 9 -5.194 -6.579 -4.380 1.00 0.00 H new ATOM 0 HD2 ARG B 9 -5.040 -5.105 -6.825 1.00 0.00 H new ATOM 0 HD3 ARG B 9 -4.865 -6.784 -7.295 1.00 0.00 H new ATOM 0 HE ARG B 9 -6.924 -6.724 -5.275 1.00 0.00 H new ATOM 0 HH11 ARG B 9 -6.225 -5.497 -8.476 1.00 0.00 H new ATOM 0 HH12 ARG B 9 -7.922 -5.462 -8.968 1.00 0.00 H new ATOM 0 HH21 ARG B 9 -9.091 -6.681 -5.907 1.00 0.00 H new ATOM 0 HH22 ARG B 9 -9.530 -6.127 -7.526 1.00 0.00 H new ATOM 411 N HIS B 10 -3.275 -3.621 -7.702 1.00 0.00 N ATOM 412 CA HIS B 10 -3.336 -2.290 -8.360 1.00 0.00 C ATOM 413 C HIS B 10 -3.787 -1.257 -7.374 1.00 0.00 C ATOM 414 O HIS B 10 -4.615 -1.507 -6.525 1.00 0.00 O ATOM 415 CB HIS B 10 -4.433 -2.334 -9.358 1.00 0.00 C ATOM 416 CG HIS B 10 -4.067 -3.160 -10.559 1.00 0.00 C ATOM 417 ND1 HIS B 10 -3.504 -2.600 -11.696 1.00 0.00 N ATOM 418 CD2 HIS B 10 -4.202 -4.499 -10.827 1.00 0.00 C ATOM 419 CE1 HIS B 10 -3.325 -3.591 -12.588 1.00 0.00 C ATOM 420 NE2 HIS B 10 -3.734 -4.769 -12.109 1.00 0.00 N ATOM 0 H HIS B 10 -3.789 -4.372 -8.163 1.00 0.00 H new ATOM 0 HA HIS B 10 -2.357 -2.059 -8.780 1.00 0.00 H new ATOM 0 HB2 HIS B 10 -5.329 -2.746 -8.894 1.00 0.00 H new ATOM 0 HB3 HIS B 10 -4.676 -1.320 -9.675 1.00 0.00 H new ATOM 0 HD2 HIS B 10 -4.610 -5.232 -10.146 1.00 0.00 H new ATOM 0 HE1 HIS B 10 -2.902 -3.451 -13.572 1.00 0.00 H new ATOM 0 HE2 HIS B 10 -3.709 -5.672 -12.582 1.00 0.00 H new ATOM 428 N LYS B 11 -3.263 -0.099 -7.503 1.00 0.00 N ATOM 429 CA LYS B 11 -3.638 1.009 -6.586 1.00 0.00 C ATOM 430 C LYS B 11 -3.756 0.478 -5.156 1.00 0.00 C ATOM 431 O LYS B 11 -3.689 1.222 -4.199 1.00 0.00 O ATOM 432 CB LYS B 11 -4.995 1.501 -7.091 1.00 0.00 C ATOM 433 CG LYS B 11 -4.882 2.966 -7.516 1.00 0.00 C ATOM 434 CD LYS B 11 -4.472 3.040 -8.989 1.00 0.00 C ATOM 435 CE LYS B 11 -5.693 2.776 -9.872 1.00 0.00 C ATOM 436 NZ LYS B 11 -5.144 2.161 -11.112 1.00 0.00 N ATOM 0 H LYS B 11 -2.575 0.147 -8.215 1.00 0.00 H new ATOM 0 HA LYS B 11 -2.898 1.810 -6.573 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -5.324 0.892 -7.933 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -5.746 1.396 -6.308 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -5.835 3.474 -7.367 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -4.147 3.480 -6.897 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -4.054 4.022 -9.212 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -3.693 2.307 -9.198 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -6.400 2.108 -9.379 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -6.228 3.700 -10.093 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -5.922 1.951 -11.769 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -4.480 2.822 -11.563 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -4.646 1.280 -10.872 1.00 0.00 H new ATOM 450 N THR B 12 -3.951 -0.806 -5.006 1.00 0.00 N ATOM 451 CA THR B 12 -4.093 -1.372 -3.625 1.00 0.00 C ATOM 452 C THR B 12 -2.864 -2.191 -3.198 1.00 0.00 C ATOM 453 O THR B 12 -2.502 -3.171 -3.819 1.00 0.00 O ATOM 454 CB THR B 12 -5.324 -2.271 -3.682 1.00 0.00 C ATOM 455 OG1 THR B 12 -6.083 -1.972 -4.845 1.00 0.00 O ATOM 456 CG2 THR B 12 -6.178 -2.040 -2.437 1.00 0.00 C ATOM 0 H THR B 12 -4.018 -1.482 -5.767 1.00 0.00 H new ATOM 0 HA THR B 12 -4.187 -0.571 -2.892 1.00 0.00 H new ATOM 0 HB THR B 12 -5.010 -3.314 -3.719 1.00 0.00 H new ATOM 0 HG1 THR B 12 -5.603 -2.288 -5.639 1.00 0.00 H new ATOM 0 HG21 THR B 12 -7.058 -2.681 -2.476 1.00 0.00 H new ATOM 0 HG22 THR B 12 -5.595 -2.277 -1.547 1.00 0.00 H new ATOM 0 HG23 THR B 12 -6.491 -0.997 -2.399 1.00 0.00 H new ATOM 464 N THR B 13 -2.248 -1.798 -2.116 1.00 0.00 N ATOM 465 CA THR B 13 -1.059 -2.535 -1.580 1.00 0.00 C ATOM 466 C THR B 13 -1.256 -2.784 -0.082 1.00 0.00 C ATOM 467 O THR B 13 -1.581 -1.881 0.663 1.00 0.00 O ATOM 468 CB THR B 13 0.130 -1.603 -1.819 1.00 0.00 C ATOM 469 OG1 THR B 13 0.006 -0.999 -3.099 1.00 0.00 O ATOM 470 CG2 THR B 13 1.431 -2.405 -1.754 1.00 0.00 C ATOM 0 H THR B 13 -2.521 -0.982 -1.568 1.00 0.00 H new ATOM 0 HA THR B 13 -0.910 -3.503 -2.059 1.00 0.00 H new ATOM 0 HB THR B 13 0.145 -0.829 -1.052 1.00 0.00 H new ATOM 0 HG1 THR B 13 -0.427 -0.125 -3.008 1.00 0.00 H new ATOM 0 HG21 THR B 13 2.277 -1.740 -1.924 1.00 0.00 H new ATOM 0 HG22 THR B 13 1.525 -2.867 -0.771 1.00 0.00 H new ATOM 0 HG23 THR B 13 1.419 -3.180 -2.520 1.00 0.00 H new ATOM 478 N ILE B 14 -1.072 -3.993 0.373 1.00 0.00 N ATOM 479 CA ILE B 14 -1.264 -4.265 1.829 1.00 0.00 C ATOM 480 C ILE B 14 0.030 -4.766 2.460 1.00 0.00 C ATOM 481 O ILE B 14 0.675 -5.662 1.953 1.00 0.00 O ATOM 482 CB ILE B 14 -2.348 -5.351 1.913 1.00 0.00 C ATOM 483 CG1 ILE B 14 -3.284 -5.055 3.086 1.00 0.00 C ATOM 484 CG2 ILE B 14 -1.702 -6.720 2.143 1.00 0.00 C ATOM 485 CD1 ILE B 14 -2.495 -5.122 4.394 1.00 0.00 C ATOM 0 H ILE B 14 -0.800 -4.798 -0.192 1.00 0.00 H new ATOM 0 HA ILE B 14 -1.552 -3.361 2.365 1.00 0.00 H new ATOM 0 HB ILE B 14 -2.907 -5.358 0.977 1.00 0.00 H new ATOM 0 HG12 ILE B 14 -3.732 -4.068 2.968 1.00 0.00 H new ATOM 0 HG13 ILE B 14 -4.102 -5.776 3.104 1.00 0.00 H new ATOM 0 HG21 ILE B 14 -2.478 -7.483 2.201 1.00 0.00 H new ATOM 0 HG22 ILE B 14 -1.029 -6.948 1.316 1.00 0.00 H new ATOM 0 HG23 ILE B 14 -1.138 -6.704 3.076 1.00 0.00 H new ATOM 0 HD11 ILE B 14 -3.160 -4.911 5.231 1.00 0.00 H new ATOM 0 HD12 ILE B 14 -2.069 -6.118 4.511 1.00 0.00 H new ATOM 0 HD13 ILE B 14 -1.693 -4.384 4.373 1.00 0.00 H new ATOM 497 N PHE B 15 0.400 -4.222 3.582 1.00 0.00 N ATOM 498 CA PHE B 15 1.631 -4.710 4.249 1.00 0.00 C ATOM 499 C PHE B 15 1.252 -5.926 5.091 1.00 0.00 C ATOM 500 O PHE B 15 0.501 -5.826 6.040 1.00 0.00 O ATOM 501 CB PHE B 15 2.098 -3.556 5.136 1.00 0.00 C ATOM 502 CG PHE B 15 3.219 -4.031 6.029 1.00 0.00 C ATOM 503 CD1 PHE B 15 4.387 -4.558 5.463 1.00 0.00 C ATOM 504 CD2 PHE B 15 3.090 -3.948 7.420 1.00 0.00 C ATOM 505 CE1 PHE B 15 5.426 -5.000 6.290 1.00 0.00 C ATOM 506 CE2 PHE B 15 4.129 -4.391 8.247 1.00 0.00 C ATOM 507 CZ PHE B 15 5.298 -4.917 7.682 1.00 0.00 C ATOM 0 H PHE B 15 -0.092 -3.468 4.061 1.00 0.00 H new ATOM 0 HA PHE B 15 2.418 -5.003 3.554 1.00 0.00 H new ATOM 0 HB2 PHE B 15 2.437 -2.723 4.520 1.00 0.00 H new ATOM 0 HB3 PHE B 15 1.268 -3.188 5.740 1.00 0.00 H new ATOM 0 HD1 PHE B 15 4.486 -4.623 4.389 1.00 0.00 H new ATOM 0 HD2 PHE B 15 2.189 -3.542 7.855 1.00 0.00 H new ATOM 0 HE1 PHE B 15 6.327 -5.405 5.854 1.00 0.00 H new ATOM 0 HE2 PHE B 15 4.029 -4.327 9.321 1.00 0.00 H new ATOM 0 HZ PHE B 15 6.100 -5.258 8.320 1.00 0.00 H new ATOM 517 N THR B 16 1.740 -7.078 4.733 1.00 0.00 N ATOM 518 CA THR B 16 1.375 -8.303 5.494 1.00 0.00 C ATOM 519 C THR B 16 2.572 -8.819 6.296 1.00 0.00 C ATOM 520 O THR B 16 3.702 -8.755 5.857 1.00 0.00 O ATOM 521 CB THR B 16 0.968 -9.318 4.428 1.00 0.00 C ATOM 522 OG1 THR B 16 0.314 -10.416 5.046 1.00 0.00 O ATOM 523 CG2 THR B 16 2.214 -9.814 3.699 1.00 0.00 C ATOM 0 H THR B 16 2.375 -7.225 3.948 1.00 0.00 H new ATOM 0 HA THR B 16 0.577 -8.116 6.213 1.00 0.00 H new ATOM 0 HB THR B 16 0.292 -8.846 3.715 1.00 0.00 H new ATOM 0 HG1 THR B 16 -0.088 -10.986 4.358 1.00 0.00 H new ATOM 0 HG21 THR B 16 1.926 -10.539 2.938 1.00 0.00 H new ATOM 0 HG22 THR B 16 2.718 -8.971 3.226 1.00 0.00 H new ATOM 0 HG23 THR B 16 2.889 -10.287 4.413 1.00 0.00 H new ATOM 531 N ASP B 17 2.332 -9.337 7.465 1.00 0.00 N ATOM 532 CA ASP B 17 3.456 -9.867 8.288 1.00 0.00 C ATOM 533 C ASP B 17 3.181 -11.322 8.670 1.00 0.00 C ATOM 534 O ASP B 17 2.056 -11.705 8.924 1.00 0.00 O ATOM 535 CB ASP B 17 3.491 -8.980 9.533 1.00 0.00 C ATOM 536 CG ASP B 17 4.931 -8.865 10.036 1.00 0.00 C ATOM 537 OD1 ASP B 17 5.833 -9.133 9.258 1.00 0.00 O ATOM 538 OD2 ASP B 17 5.109 -8.512 11.190 1.00 0.00 O ATOM 0 H ASP B 17 1.407 -9.417 7.888 1.00 0.00 H new ATOM 0 HA ASP B 17 4.406 -9.851 7.754 1.00 0.00 H new ATOM 0 HB2 ASP B 17 3.096 -7.991 9.300 1.00 0.00 H new ATOM 0 HB3 ASP B 17 2.855 -9.402 10.311 1.00 0.00 H new ATOM 543 N ALA B 18 4.198 -12.136 8.713 1.00 0.00 N ATOM 544 CA ALA B 18 3.995 -13.565 9.077 1.00 0.00 C ATOM 545 C ALA B 18 5.320 -14.188 9.519 1.00 0.00 C ATOM 546 O ALA B 18 6.368 -13.586 9.403 1.00 0.00 O ATOM 547 CB ALA B 18 3.488 -14.232 7.798 1.00 0.00 C ATOM 0 H ALA B 18 5.163 -11.873 8.511 1.00 0.00 H new ATOM 0 HA ALA B 18 3.295 -13.686 9.903 1.00 0.00 H new ATOM 0 HB1 ALA B 18 3.314 -15.292 7.985 1.00 0.00 H new ATOM 0 HB2 ALA B 18 2.556 -13.760 7.487 1.00 0.00 H new ATOM 0 HB3 ALA B 18 4.232 -14.120 7.010 1.00 0.00 H new ATOM 553 N LYS B 19 5.284 -15.393 10.019 1.00 0.00 N ATOM 554 CA LYS B 19 6.545 -16.052 10.457 1.00 0.00 C ATOM 555 C LYS B 19 7.133 -16.867 9.304 1.00 0.00 C ATOM 556 O LYS B 19 6.416 -17.429 8.500 1.00 0.00 O ATOM 557 CB LYS B 19 6.135 -16.967 11.611 1.00 0.00 C ATOM 558 CG LYS B 19 5.466 -16.138 12.709 1.00 0.00 C ATOM 559 CD LYS B 19 6.506 -15.230 13.370 1.00 0.00 C ATOM 560 CE LYS B 19 6.117 -14.988 14.830 1.00 0.00 C ATOM 561 NZ LYS B 19 5.069 -13.931 14.778 1.00 0.00 N ATOM 0 H LYS B 19 4.437 -15.948 10.143 1.00 0.00 H new ATOM 0 HA LYS B 19 7.306 -15.334 10.762 1.00 0.00 H new ATOM 0 HB2 LYS B 19 5.450 -17.736 11.253 1.00 0.00 H new ATOM 0 HB3 LYS B 19 7.010 -17.480 12.010 1.00 0.00 H new ATOM 0 HG2 LYS B 19 4.660 -15.538 12.286 1.00 0.00 H new ATOM 0 HG3 LYS B 19 5.017 -16.796 13.453 1.00 0.00 H new ATOM 0 HD2 LYS B 19 7.493 -15.690 13.317 1.00 0.00 H new ATOM 0 HD3 LYS B 19 6.568 -14.281 12.837 1.00 0.00 H new ATOM 0 HE2 LYS B 19 5.737 -15.898 15.294 1.00 0.00 H new ATOM 0 HE3 LYS B 19 6.975 -14.665 15.419 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 4.751 -13.710 15.743 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 5.462 -13.074 14.338 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 4.262 -14.270 14.217 1.00 0.00 H new ATOM 575 N GLU B 20 8.432 -16.936 9.215 1.00 0.00 N ATOM 576 CA GLU B 20 9.060 -17.715 8.111 1.00 0.00 C ATOM 577 C GLU B 20 8.524 -19.147 8.123 1.00 0.00 C ATOM 578 O GLU B 20 8.414 -19.791 7.099 1.00 0.00 O ATOM 579 CB GLU B 20 10.562 -17.691 8.410 1.00 0.00 C ATOM 580 CG GLU B 20 10.929 -18.868 9.318 1.00 0.00 C ATOM 581 CD GLU B 20 12.431 -18.843 9.605 1.00 0.00 C ATOM 582 OE1 GLU B 20 13.158 -18.276 8.806 1.00 0.00 O ATOM 583 OE2 GLU B 20 12.829 -19.393 10.620 1.00 0.00 O ATOM 0 H GLU B 20 9.085 -16.488 9.858 1.00 0.00 H new ATOM 0 HA GLU B 20 8.843 -17.300 7.127 1.00 0.00 H new ATOM 0 HB2 GLU B 20 11.128 -17.747 7.480 1.00 0.00 H new ATOM 0 HB3 GLU B 20 10.831 -16.751 8.891 1.00 0.00 H new ATOM 0 HG2 GLU B 20 10.369 -18.809 10.251 1.00 0.00 H new ATOM 0 HG3 GLU B 20 10.655 -19.809 8.840 1.00 0.00 H new ATOM 590 N SER B 21 8.186 -19.646 9.279 1.00 0.00 N ATOM 591 CA SER B 21 7.653 -21.031 9.367 1.00 0.00 C ATOM 592 C SER B 21 6.130 -20.997 9.508 1.00 0.00 C ATOM 593 O SER B 21 5.506 -21.986 9.843 1.00 0.00 O ATOM 594 CB SER B 21 8.295 -21.626 10.620 1.00 0.00 C ATOM 595 OG SER B 21 7.442 -21.403 11.735 1.00 0.00 O ATOM 0 H SER B 21 8.257 -19.152 10.168 1.00 0.00 H new ATOM 0 HA SER B 21 7.879 -21.620 8.478 1.00 0.00 H new ATOM 0 HB2 SER B 21 8.463 -22.694 10.484 1.00 0.00 H new ATOM 0 HB3 SER B 21 9.269 -21.169 10.795 1.00 0.00 H new ATOM 0 HG SER B 21 7.850 -21.785 12.540 1.00 0.00 H new ATOM 601 N SER B 22 5.522 -19.870 9.249 1.00 0.00 N ATOM 602 CA SER B 22 4.041 -19.786 9.365 1.00 0.00 C ATOM 603 C SER B 22 3.396 -20.675 8.305 1.00 0.00 C ATOM 604 O SER B 22 3.311 -21.877 8.457 1.00 0.00 O ATOM 605 CB SER B 22 3.705 -18.316 9.121 1.00 0.00 C ATOM 606 OG SER B 22 4.026 -17.978 7.779 1.00 0.00 O ATOM 0 H SER B 22 5.987 -19.008 8.963 1.00 0.00 H new ATOM 0 HA SER B 22 3.674 -20.122 10.335 1.00 0.00 H new ATOM 0 HB2 SER B 22 2.647 -18.137 9.310 1.00 0.00 H new ATOM 0 HB3 SER B 22 4.264 -17.684 9.811 1.00 0.00 H new ATOM 0 HG SER B 22 4.853 -17.453 7.763 1.00 0.00 H new ATOM 612 N THR B 23 2.948 -20.094 7.228 1.00 0.00 N ATOM 613 CA THR B 23 2.314 -20.905 6.147 1.00 0.00 C ATOM 614 C THR B 23 1.564 -19.992 5.178 1.00 0.00 C ATOM 615 O THR B 23 0.749 -19.185 5.579 1.00 0.00 O ATOM 616 CB THR B 23 1.333 -21.841 6.860 1.00 0.00 C ATOM 617 OG1 THR B 23 0.354 -22.288 5.932 1.00 0.00 O ATOM 618 CG2 THR B 23 0.647 -21.097 8.007 1.00 0.00 C ATOM 0 H THR B 23 2.993 -19.091 7.047 1.00 0.00 H new ATOM 0 HA THR B 23 3.052 -21.459 5.567 1.00 0.00 H new ATOM 0 HB THR B 23 1.876 -22.696 7.263 1.00 0.00 H new ATOM 0 HG1 THR B 23 -0.176 -23.006 6.336 1.00 0.00 H new ATOM 0 HG21 THR B 23 -0.050 -21.767 8.510 1.00 0.00 H new ATOM 0 HG22 THR B 23 1.398 -20.753 8.718 1.00 0.00 H new ATOM 0 HG23 THR B 23 0.103 -20.240 7.611 1.00 0.00 H new ATOM 626 N VAL B 24 1.827 -20.113 3.905 1.00 0.00 N ATOM 627 CA VAL B 24 1.114 -19.251 2.922 1.00 0.00 C ATOM 628 C VAL B 24 -0.362 -19.151 3.310 1.00 0.00 C ATOM 629 O VAL B 24 -1.024 -18.172 3.031 1.00 0.00 O ATOM 630 CB VAL B 24 1.273 -19.959 1.578 1.00 0.00 C ATOM 631 CG1 VAL B 24 0.546 -19.162 0.493 1.00 0.00 C ATOM 632 CG2 VAL B 24 2.759 -20.057 1.226 1.00 0.00 C ATOM 0 H VAL B 24 2.500 -20.767 3.506 1.00 0.00 H new ATOM 0 HA VAL B 24 1.511 -18.236 2.887 1.00 0.00 H new ATOM 0 HB VAL B 24 0.847 -20.960 1.642 1.00 0.00 H new ATOM 0 HG11 VAL B 24 0.659 -19.667 -0.467 1.00 0.00 H new ATOM 0 HG12 VAL B 24 -0.513 -19.090 0.742 1.00 0.00 H new ATOM 0 HG13 VAL B 24 0.973 -18.161 0.429 1.00 0.00 H new ATOM 0 HG21 VAL B 24 2.873 -20.562 0.267 1.00 0.00 H new ATOM 0 HG22 VAL B 24 3.184 -19.056 1.162 1.00 0.00 H new ATOM 0 HG23 VAL B 24 3.279 -20.623 1.999 1.00 0.00 H new ATOM 642 N PHE B 25 -0.876 -20.158 3.964 1.00 0.00 N ATOM 643 CA PHE B 25 -2.303 -20.121 4.386 1.00 0.00 C ATOM 644 C PHE B 25 -2.524 -18.945 5.340 1.00 0.00 C ATOM 645 O PHE B 25 -3.493 -18.220 5.233 1.00 0.00 O ATOM 646 CB PHE B 25 -2.540 -21.450 5.104 1.00 0.00 C ATOM 647 CG PHE B 25 -3.949 -21.487 5.644 1.00 0.00 C ATOM 648 CD1 PHE B 25 -5.036 -21.368 4.771 1.00 0.00 C ATOM 649 CD2 PHE B 25 -4.169 -21.643 7.018 1.00 0.00 C ATOM 650 CE1 PHE B 25 -6.344 -21.403 5.271 1.00 0.00 C ATOM 651 CE2 PHE B 25 -5.475 -21.678 7.518 1.00 0.00 C ATOM 652 CZ PHE B 25 -6.563 -21.558 6.646 1.00 0.00 C ATOM 0 H PHE B 25 -0.368 -21.004 4.223 1.00 0.00 H new ATOM 0 HA PHE B 25 -2.986 -19.991 3.547 1.00 0.00 H new ATOM 0 HB2 PHE B 25 -2.381 -22.280 4.416 1.00 0.00 H new ATOM 0 HB3 PHE B 25 -1.824 -21.569 5.918 1.00 0.00 H new ATOM 0 HD1 PHE B 25 -4.866 -21.249 3.711 1.00 0.00 H new ATOM 0 HD2 PHE B 25 -3.330 -21.736 7.692 1.00 0.00 H new ATOM 0 HE1 PHE B 25 -7.183 -21.311 4.597 1.00 0.00 H new ATOM 0 HE2 PHE B 25 -5.644 -21.798 8.578 1.00 0.00 H new ATOM 0 HZ PHE B 25 -7.571 -21.585 7.033 1.00 0.00 H new ATOM 662 N GLU B 26 -1.626 -18.744 6.266 1.00 0.00 N ATOM 663 CA GLU B 26 -1.781 -17.607 7.215 1.00 0.00 C ATOM 664 C GLU B 26 -1.782 -16.294 6.432 1.00 0.00 C ATOM 665 O GLU B 26 -2.628 -15.443 6.626 1.00 0.00 O ATOM 666 CB GLU B 26 -0.563 -17.684 8.136 1.00 0.00 C ATOM 667 CG GLU B 26 -0.927 -18.460 9.403 1.00 0.00 C ATOM 668 CD GLU B 26 -0.087 -17.950 10.574 1.00 0.00 C ATOM 669 OE1 GLU B 26 0.841 -17.196 10.327 1.00 0.00 O ATOM 670 OE2 GLU B 26 -0.384 -18.321 11.697 1.00 0.00 O ATOM 0 H GLU B 26 -0.794 -19.317 6.406 1.00 0.00 H new ATOM 0 HA GLU B 26 -2.712 -17.653 7.781 1.00 0.00 H new ATOM 0 HB2 GLU B 26 0.264 -18.174 7.622 1.00 0.00 H new ATOM 0 HB3 GLU B 26 -0.227 -16.680 8.396 1.00 0.00 H new ATOM 0 HG2 GLU B 26 -1.988 -18.340 9.623 1.00 0.00 H new ATOM 0 HG3 GLU B 26 -0.751 -19.525 9.253 1.00 0.00 H new ATOM 677 N LEU B 27 -0.847 -16.131 5.536 1.00 0.00 N ATOM 678 CA LEU B 27 -0.807 -14.879 4.726 1.00 0.00 C ATOM 679 C LEU B 27 -2.125 -14.722 3.962 1.00 0.00 C ATOM 680 O LEU B 27 -2.601 -13.627 3.736 1.00 0.00 O ATOM 681 CB LEU B 27 0.361 -15.070 3.757 1.00 0.00 C ATOM 682 CG LEU B 27 1.620 -14.434 4.348 1.00 0.00 C ATOM 683 CD1 LEU B 27 2.756 -15.458 4.353 1.00 0.00 C ATOM 684 CD2 LEU B 27 2.026 -13.226 3.500 1.00 0.00 C ATOM 0 H LEU B 27 -0.112 -16.807 5.330 1.00 0.00 H new ATOM 0 HA LEU B 27 -0.679 -13.986 5.337 1.00 0.00 H new ATOM 0 HB2 LEU B 27 0.527 -16.132 3.575 1.00 0.00 H new ATOM 0 HB3 LEU B 27 0.128 -14.615 2.794 1.00 0.00 H new ATOM 0 HG LEU B 27 1.419 -14.111 5.369 1.00 0.00 H new ATOM 0 HD11 LEU B 27 3.653 -15.004 4.774 1.00 0.00 H new ATOM 0 HD12 LEU B 27 2.467 -16.319 4.956 1.00 0.00 H new ATOM 0 HD13 LEU B 27 2.958 -15.782 3.332 1.00 0.00 H new ATOM 0 HD21 LEU B 27 2.923 -12.772 3.920 1.00 0.00 H new ATOM 0 HD22 LEU B 27 2.227 -13.549 2.479 1.00 0.00 H new ATOM 0 HD23 LEU B 27 1.217 -12.496 3.497 1.00 0.00 H new ATOM 696 N LYS B 28 -2.718 -15.816 3.572 1.00 0.00 N ATOM 697 CA LYS B 28 -4.012 -15.758 2.831 1.00 0.00 C ATOM 698 C LYS B 28 -5.056 -15.000 3.656 1.00 0.00 C ATOM 699 O LYS B 28 -5.898 -14.302 3.126 1.00 0.00 O ATOM 700 CB LYS B 28 -4.429 -17.217 2.642 1.00 0.00 C ATOM 701 CG LYS B 28 -4.344 -17.585 1.160 1.00 0.00 C ATOM 702 CD LYS B 28 -5.746 -17.886 0.627 1.00 0.00 C ATOM 703 CE LYS B 28 -5.660 -18.267 -0.853 1.00 0.00 C ATOM 704 NZ LYS B 28 -7.068 -18.262 -1.334 1.00 0.00 N ATOM 0 H LYS B 28 -2.359 -16.757 3.736 1.00 0.00 H new ATOM 0 HA LYS B 28 -3.921 -15.237 1.878 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -3.782 -17.870 3.227 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -5.445 -17.366 3.007 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -3.897 -16.766 0.596 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -3.699 -18.453 1.027 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -6.196 -18.699 1.197 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -6.389 -17.015 0.752 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -5.050 -17.555 -1.409 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -5.202 -19.248 -0.982 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -7.080 -18.226 -2.373 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -7.548 -19.127 -1.012 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -7.562 -17.430 -0.954 1.00 0.00 H new ATOM 718 N ARG B 29 -5.012 -15.142 4.952 1.00 0.00 N ATOM 719 CA ARG B 29 -6.005 -14.443 5.818 1.00 0.00 C ATOM 720 C ARG B 29 -5.916 -12.929 5.609 1.00 0.00 C ATOM 721 O ARG B 29 -6.912 -12.235 5.620 1.00 0.00 O ATOM 722 CB ARG B 29 -5.610 -14.810 7.249 1.00 0.00 C ATOM 723 CG ARG B 29 -6.716 -14.376 8.212 1.00 0.00 C ATOM 724 CD ARG B 29 -8.040 -15.019 7.793 1.00 0.00 C ATOM 725 NE ARG B 29 -8.987 -14.697 8.896 1.00 0.00 N ATOM 726 CZ ARG B 29 -9.453 -13.485 9.026 1.00 0.00 C ATOM 727 NH1 ARG B 29 -9.089 -12.551 8.190 1.00 0.00 N ATOM 728 NH2 ARG B 29 -10.283 -13.206 9.993 1.00 0.00 N ATOM 0 H ARG B 29 -4.330 -15.713 5.451 1.00 0.00 H new ATOM 0 HA ARG B 29 -7.030 -14.735 5.590 1.00 0.00 H new ATOM 0 HB2 ARG B 29 -5.446 -15.885 7.328 1.00 0.00 H new ATOM 0 HB3 ARG B 29 -4.671 -14.324 7.514 1.00 0.00 H new ATOM 0 HG2 ARG B 29 -6.463 -14.671 9.230 1.00 0.00 H new ATOM 0 HG3 ARG B 29 -6.810 -13.290 8.209 1.00 0.00 H new ATOM 0 HD2 ARG B 29 -8.390 -14.618 6.842 1.00 0.00 H new ATOM 0 HD3 ARG B 29 -7.933 -16.096 7.665 1.00 0.00 H new ATOM 0 HE ARG B 29 -9.272 -15.425 9.551 1.00 0.00 H new ATOM 0 HH11 ARG B 29 -8.440 -12.768 7.434 1.00 0.00 H new ATOM 0 HH12 ARG B 29 -9.454 -11.604 8.293 1.00 0.00 H new ATOM 0 HH21 ARG B 29 -10.567 -13.935 10.647 1.00 0.00 H new ATOM 0 HH22 ARG B 29 -10.647 -12.259 10.095 1.00 0.00 H new ATOM 742 N ILE B 30 -4.735 -12.408 5.416 1.00 0.00 N ATOM 743 CA ILE B 30 -4.595 -10.945 5.208 1.00 0.00 C ATOM 744 C ILE B 30 -5.428 -10.507 3.998 1.00 0.00 C ATOM 745 O ILE B 30 -6.146 -9.531 4.052 1.00 0.00 O ATOM 746 CB ILE B 30 -3.099 -10.739 4.945 1.00 0.00 C ATOM 747 CG1 ILE B 30 -2.395 -10.398 6.259 1.00 0.00 C ATOM 748 CG2 ILE B 30 -2.897 -9.596 3.950 1.00 0.00 C ATOM 749 CD1 ILE B 30 -3.146 -9.266 6.953 1.00 0.00 C ATOM 0 H ILE B 30 -3.862 -12.935 5.394 1.00 0.00 H new ATOM 0 HA ILE B 30 -4.945 -10.359 6.058 1.00 0.00 H new ATOM 0 HB ILE B 30 -2.679 -11.655 4.529 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -2.359 -11.276 6.904 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -1.364 -10.102 6.066 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -1.831 -9.456 3.768 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -3.396 -9.838 3.012 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -3.319 -8.678 4.360 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -2.647 -9.020 7.890 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -3.159 -8.388 6.307 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -4.169 -9.580 7.158 1.00 0.00 H new ATOM 761 N VAL B 31 -5.350 -11.223 2.911 1.00 0.00 N ATOM 762 CA VAL B 31 -6.152 -10.834 1.720 1.00 0.00 C ATOM 763 C VAL B 31 -7.636 -10.780 2.102 1.00 0.00 C ATOM 764 O VAL B 31 -8.334 -9.841 1.782 1.00 0.00 O ATOM 765 CB VAL B 31 -5.896 -11.927 0.678 1.00 0.00 C ATOM 766 CG1 VAL B 31 -6.138 -11.352 -0.712 1.00 0.00 C ATOM 767 CG2 VAL B 31 -4.446 -12.414 0.764 1.00 0.00 C ATOM 0 H VAL B 31 -4.770 -12.054 2.797 1.00 0.00 H new ATOM 0 HA VAL B 31 -5.879 -9.852 1.334 1.00 0.00 H new ATOM 0 HB VAL B 31 -6.568 -12.764 0.868 1.00 0.00 H new ATOM 0 HG11 VAL B 31 -5.958 -12.123 -1.461 1.00 0.00 H new ATOM 0 HG12 VAL B 31 -7.169 -11.006 -0.788 1.00 0.00 H new ATOM 0 HG13 VAL B 31 -5.461 -10.515 -0.883 1.00 0.00 H new ATOM 0 HG21 VAL B 31 -4.278 -13.191 0.018 1.00 0.00 H new ATOM 0 HG22 VAL B 31 -3.770 -11.579 0.577 1.00 0.00 H new ATOM 0 HG23 VAL B 31 -4.257 -12.819 1.758 1.00 0.00 H new ATOM 777 N GLU B 32 -8.113 -11.779 2.796 1.00 0.00 N ATOM 778 CA GLU B 32 -9.546 -11.793 3.217 1.00 0.00 C ATOM 779 C GLU B 32 -9.715 -11.027 4.533 1.00 0.00 C ATOM 780 O GLU B 32 -10.816 -10.825 5.008 1.00 0.00 O ATOM 781 CB GLU B 32 -9.885 -13.272 3.410 1.00 0.00 C ATOM 782 CG GLU B 32 -11.400 -13.434 3.551 1.00 0.00 C ATOM 783 CD GLU B 32 -11.765 -13.548 5.033 1.00 0.00 C ATOM 784 OE1 GLU B 32 -11.028 -13.014 5.846 1.00 0.00 O ATOM 785 OE2 GLU B 32 -12.773 -14.168 5.329 1.00 0.00 O ATOM 0 H GLU B 32 -7.570 -12.590 3.091 1.00 0.00 H new ATOM 0 HA GLU B 32 -10.199 -11.317 2.485 1.00 0.00 H new ATOM 0 HB2 GLU B 32 -9.524 -13.853 2.561 1.00 0.00 H new ATOM 0 HB3 GLU B 32 -9.383 -13.658 4.297 1.00 0.00 H new ATOM 0 HG2 GLU B 32 -11.911 -12.581 3.104 1.00 0.00 H new ATOM 0 HG3 GLU B 32 -11.733 -14.322 3.014 1.00 0.00 H new ATOM 792 N GLY B 33 -8.634 -10.600 5.123 1.00 0.00 N ATOM 793 CA GLY B 33 -8.728 -9.850 6.405 1.00 0.00 C ATOM 794 C GLY B 33 -8.828 -8.352 6.113 1.00 0.00 C ATOM 795 O GLY B 33 -9.548 -7.626 6.768 1.00 0.00 O ATOM 0 H GLY B 33 -7.687 -10.739 4.771 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -9.600 -10.180 6.969 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -7.853 -10.053 7.023 1.00 0.00 H new ATOM 799 N ILE B 34 -8.113 -7.888 5.126 1.00 0.00 N ATOM 800 CA ILE B 34 -8.166 -6.437 4.778 1.00 0.00 C ATOM 801 C ILE B 34 -8.733 -6.272 3.372 1.00 0.00 C ATOM 802 O ILE B 34 -9.607 -5.465 3.126 1.00 0.00 O ATOM 803 CB ILE B 34 -6.714 -5.944 4.842 1.00 0.00 C ATOM 804 CG1 ILE B 34 -6.509 -4.784 3.856 1.00 0.00 C ATOM 805 CG2 ILE B 34 -5.742 -7.080 4.514 1.00 0.00 C ATOM 806 CD1 ILE B 34 -6.268 -5.325 2.442 1.00 0.00 C ATOM 0 H ILE B 34 -7.493 -8.450 4.543 1.00 0.00 H new ATOM 0 HA ILE B 34 -8.804 -5.869 5.455 1.00 0.00 H new ATOM 0 HB ILE B 34 -6.514 -5.596 5.855 1.00 0.00 H new ATOM 0 HG12 ILE B 34 -7.385 -4.135 3.860 1.00 0.00 H new ATOM 0 HG13 ILE B 34 -5.660 -4.176 4.170 1.00 0.00 H new ATOM 0 HG21 ILE B 34 -4.718 -6.709 4.565 1.00 0.00 H new ATOM 0 HG22 ILE B 34 -5.871 -7.889 5.233 1.00 0.00 H new ATOM 0 HG23 ILE B 34 -5.943 -7.452 3.510 1.00 0.00 H new ATOM 0 HD11 ILE B 34 -6.124 -4.492 1.753 1.00 0.00 H new ATOM 0 HD12 ILE B 34 -5.379 -5.955 2.440 1.00 0.00 H new ATOM 0 HD13 ILE B 34 -7.130 -5.913 2.126 1.00 0.00 H new ATOM 818 N LEU B 35 -8.238 -7.042 2.453 1.00 0.00 N ATOM 819 CA LEU B 35 -8.736 -6.951 1.051 1.00 0.00 C ATOM 820 C LEU B 35 -10.015 -7.780 0.900 1.00 0.00 C ATOM 821 O LEU B 35 -10.714 -7.686 -0.089 1.00 0.00 O ATOM 822 CB LEU B 35 -7.613 -7.529 0.190 1.00 0.00 C ATOM 823 CG LEU B 35 -6.944 -6.401 -0.598 1.00 0.00 C ATOM 824 CD1 LEU B 35 -5.425 -6.570 -0.545 1.00 0.00 C ATOM 825 CD2 LEU B 35 -7.411 -6.451 -2.054 1.00 0.00 C ATOM 0 H LEU B 35 -7.506 -7.735 2.608 1.00 0.00 H new ATOM 0 HA LEU B 35 -8.980 -5.929 0.760 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -6.879 -8.032 0.820 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -8.013 -8.278 -0.494 1.00 0.00 H new ATOM 0 HG LEU B 35 -7.217 -5.441 -0.160 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -4.950 -5.766 -1.107 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -5.091 -6.535 0.492 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -5.150 -7.530 -0.982 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -6.935 -5.648 -2.617 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -7.138 -7.411 -2.491 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -8.493 -6.329 -2.093 1.00 0.00 H new ATOM 837 N LYS B 36 -10.331 -8.581 1.882 1.00 0.00 N ATOM 838 CA LYS B 36 -11.570 -9.404 1.805 1.00 0.00 C ATOM 839 C LYS B 36 -11.577 -10.267 0.538 1.00 0.00 C ATOM 840 O LYS B 36 -12.562 -10.323 -0.172 1.00 0.00 O ATOM 841 CB LYS B 36 -12.713 -8.391 1.768 1.00 0.00 C ATOM 842 CG LYS B 36 -12.613 -7.462 2.980 1.00 0.00 C ATOM 843 CD LYS B 36 -13.180 -8.168 4.213 1.00 0.00 C ATOM 844 CE LYS B 36 -14.299 -7.317 4.819 1.00 0.00 C ATOM 845 NZ LYS B 36 -14.994 -8.223 5.776 1.00 0.00 N ATOM 0 H LYS B 36 -9.784 -8.700 2.734 1.00 0.00 H new ATOM 0 HA LYS B 36 -11.653 -10.092 2.647 1.00 0.00 H new ATOM 0 HB2 LYS B 36 -12.668 -7.810 0.847 1.00 0.00 H new ATOM 0 HB3 LYS B 36 -13.672 -8.909 1.772 1.00 0.00 H new ATOM 0 HG2 LYS B 36 -11.573 -7.184 3.153 1.00 0.00 H new ATOM 0 HG3 LYS B 36 -13.163 -6.540 2.791 1.00 0.00 H new ATOM 0 HD2 LYS B 36 -13.564 -9.150 3.938 1.00 0.00 H new ATOM 0 HD3 LYS B 36 -12.391 -8.328 4.948 1.00 0.00 H new ATOM 0 HE2 LYS B 36 -13.898 -6.440 5.326 1.00 0.00 H new ATOM 0 HE3 LYS B 36 -14.982 -6.956 4.050 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 -15.776 -7.711 6.233 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 -15.371 -9.046 5.264 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 -14.321 -8.545 6.500 1.00 0.00 H new ATOM 859 N ARG B 37 -10.495 -10.940 0.242 1.00 0.00 N ATOM 860 CA ARG B 37 -10.476 -11.787 -0.987 1.00 0.00 C ATOM 861 C ARG B 37 -10.860 -13.230 -0.642 1.00 0.00 C ATOM 862 O ARG B 37 -10.315 -13.817 0.272 1.00 0.00 O ATOM 863 CB ARG B 37 -9.034 -11.722 -1.487 1.00 0.00 C ATOM 864 CG ARG B 37 -8.809 -10.404 -2.230 1.00 0.00 C ATOM 865 CD ARG B 37 -9.478 -10.473 -3.605 1.00 0.00 C ATOM 866 NE ARG B 37 -10.832 -9.887 -3.402 1.00 0.00 N ATOM 867 CZ ARG B 37 -10.968 -8.602 -3.215 1.00 0.00 C ATOM 868 NH1 ARG B 37 -9.917 -7.828 -3.202 1.00 0.00 N ATOM 869 NH2 ARG B 37 -12.156 -8.090 -3.040 1.00 0.00 N ATOM 0 H ARG B 37 -9.635 -10.940 0.790 1.00 0.00 H new ATOM 0 HA ARG B 37 -11.186 -11.441 -1.739 1.00 0.00 H new ATOM 0 HB2 ARG B 37 -8.343 -11.801 -0.648 1.00 0.00 H new ATOM 0 HB3 ARG B 37 -8.829 -12.564 -2.148 1.00 0.00 H new ATOM 0 HG2 ARG B 37 -9.221 -9.575 -1.655 1.00 0.00 H new ATOM 0 HG3 ARG B 37 -7.741 -10.215 -2.342 1.00 0.00 H new ATOM 0 HD2 ARG B 37 -8.912 -9.912 -4.348 1.00 0.00 H new ATOM 0 HD3 ARG B 37 -9.542 -11.501 -3.962 1.00 0.00 H new ATOM 0 HE ARG B 37 -11.654 -10.490 -3.409 1.00 0.00 H new ATOM 0 HH11 ARG B 37 -8.988 -8.227 -3.338 1.00 0.00 H new ATOM 0 HH12 ARG B 37 -10.025 -6.824 -3.056 1.00 0.00 H new ATOM 0 HH21 ARG B 37 -12.978 -8.694 -3.049 1.00 0.00 H new ATOM 0 HH22 ARG B 37 -12.262 -7.086 -2.894 1.00 0.00 H new ATOM 883 N PRO B 38 -11.796 -13.748 -1.392 1.00 0.00 N ATOM 884 CA PRO B 38 -12.273 -15.135 -1.173 1.00 0.00 C ATOM 885 C PRO B 38 -11.274 -16.149 -1.739 1.00 0.00 C ATOM 886 O PRO B 38 -10.649 -15.908 -2.753 1.00 0.00 O ATOM 887 CB PRO B 38 -13.585 -15.187 -1.949 1.00 0.00 C ATOM 888 CG PRO B 38 -13.459 -14.136 -3.008 1.00 0.00 C ATOM 889 CD PRO B 38 -12.494 -13.093 -2.503 1.00 0.00 C ATOM 0 HA PRO B 38 -12.390 -15.381 -0.118 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -13.743 -16.172 -2.389 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -14.436 -14.989 -1.297 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -13.098 -14.572 -3.939 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -14.430 -13.688 -3.221 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -11.798 -12.785 -3.283 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -13.017 -12.196 -2.170 1.00 0.00 H new ATOM 897 N PRO B 39 -11.165 -17.259 -1.060 1.00 0.00 N ATOM 898 CA PRO B 39 -10.242 -18.333 -1.497 1.00 0.00 C ATOM 899 C PRO B 39 -10.835 -19.092 -2.689 1.00 0.00 C ATOM 900 O PRO B 39 -11.981 -18.907 -3.047 1.00 0.00 O ATOM 901 CB PRO B 39 -10.145 -19.239 -0.274 1.00 0.00 C ATOM 902 CG PRO B 39 -11.413 -19.008 0.488 1.00 0.00 C ATOM 903 CD PRO B 39 -11.885 -17.611 0.168 1.00 0.00 C ATOM 0 HA PRO B 39 -9.272 -17.959 -1.824 1.00 0.00 H new ATOM 0 HB2 PRO B 39 -10.046 -20.285 -0.566 1.00 0.00 H new ATOM 0 HB3 PRO B 39 -9.272 -18.992 0.330 1.00 0.00 H new ATOM 0 HG2 PRO B 39 -12.168 -19.742 0.207 1.00 0.00 H new ATOM 0 HG3 PRO B 39 -11.243 -19.120 1.559 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -12.964 -17.580 0.019 1.00 0.00 H new ATOM 0 HD3 PRO B 39 -11.655 -16.918 0.977 1.00 0.00 H new ATOM 911 N ASP B 40 -10.063 -19.946 -3.306 1.00 0.00 N ATOM 912 CA ASP B 40 -10.582 -20.719 -4.474 1.00 0.00 C ATOM 913 C ASP B 40 -10.777 -19.794 -5.678 1.00 0.00 C ATOM 914 O ASP B 40 -11.240 -20.208 -6.724 1.00 0.00 O ATOM 915 CB ASP B 40 -11.924 -21.287 -4.012 1.00 0.00 C ATOM 916 CG ASP B 40 -12.230 -22.570 -4.787 1.00 0.00 C ATOM 917 OD1 ASP B 40 -11.616 -22.773 -5.822 1.00 0.00 O ATOM 918 OD2 ASP B 40 -13.072 -23.328 -4.334 1.00 0.00 O ATOM 0 H ASP B 40 -9.095 -20.143 -3.052 1.00 0.00 H new ATOM 0 HA ASP B 40 -9.893 -21.504 -4.786 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -11.894 -21.494 -2.942 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -12.715 -20.555 -4.173 1.00 0.00 H new ATOM 923 N GLU B 41 -10.425 -18.546 -5.542 1.00 0.00 N ATOM 924 CA GLU B 41 -10.586 -17.595 -6.679 1.00 0.00 C ATOM 925 C GLU B 41 -9.499 -16.520 -6.617 1.00 0.00 C ATOM 926 O GLU B 41 -9.689 -15.402 -7.052 1.00 0.00 O ATOM 927 CB GLU B 41 -11.969 -16.972 -6.484 1.00 0.00 C ATOM 928 CG GLU B 41 -12.375 -16.226 -7.756 1.00 0.00 C ATOM 929 CD GLU B 41 -13.032 -14.897 -7.381 1.00 0.00 C ATOM 930 OE1 GLU B 41 -12.506 -14.222 -6.511 1.00 0.00 O ATOM 931 OE2 GLU B 41 -14.053 -14.575 -7.968 1.00 0.00 O ATOM 0 H GLU B 41 -10.032 -18.142 -4.692 1.00 0.00 H new ATOM 0 HA GLU B 41 -10.497 -18.087 -7.648 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -12.700 -17.747 -6.255 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -11.955 -16.287 -5.636 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -11.500 -16.048 -8.381 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -13.066 -16.833 -8.341 1.00 0.00 H new ATOM 938 N GLN B 42 -8.360 -16.855 -6.077 1.00 0.00 N ATOM 939 CA GLN B 42 -7.257 -15.860 -5.981 1.00 0.00 C ATOM 940 C GLN B 42 -5.913 -16.536 -6.268 1.00 0.00 C ATOM 941 O GLN B 42 -5.775 -17.738 -6.162 1.00 0.00 O ATOM 942 CB GLN B 42 -7.305 -15.353 -4.539 1.00 0.00 C ATOM 943 CG GLN B 42 -5.991 -14.646 -4.199 1.00 0.00 C ATOM 944 CD GLN B 42 -5.941 -14.350 -2.698 1.00 0.00 C ATOM 945 OE1 GLN B 42 -6.953 -14.058 -2.091 1.00 0.00 O ATOM 946 NE2 GLN B 42 -4.799 -14.413 -2.071 1.00 0.00 N ATOM 0 H GLN B 42 -8.146 -17.777 -5.697 1.00 0.00 H new ATOM 0 HA GLN B 42 -7.367 -15.049 -6.701 1.00 0.00 H new ATOM 0 HB2 GLN B 42 -8.142 -14.667 -4.412 1.00 0.00 H new ATOM 0 HB3 GLN B 42 -7.469 -16.186 -3.855 1.00 0.00 H new ATOM 0 HG2 GLN B 42 -5.145 -15.271 -4.485 1.00 0.00 H new ATOM 0 HG3 GLN B 42 -5.908 -13.719 -4.766 1.00 0.00 H new ATOM 0 HE21 GLN B 42 -3.950 -14.658 -2.581 1.00 0.00 H new ATOM 0 HE22 GLN B 42 -4.755 -14.217 -1.071 1.00 0.00 H new ATOM 955 N ARG B 43 -4.924 -15.770 -6.630 1.00 0.00 N ATOM 956 CA ARG B 43 -3.589 -16.360 -6.924 1.00 0.00 C ATOM 957 C ARG B 43 -2.487 -15.425 -6.423 1.00 0.00 C ATOM 958 O ARG B 43 -2.660 -14.223 -6.363 1.00 0.00 O ATOM 959 CB ARG B 43 -3.537 -16.489 -8.446 1.00 0.00 C ATOM 960 CG ARG B 43 -4.074 -17.860 -8.859 1.00 0.00 C ATOM 961 CD ARG B 43 -3.693 -18.141 -10.315 1.00 0.00 C ATOM 962 NE ARG B 43 -4.783 -17.525 -11.122 1.00 0.00 N ATOM 963 CZ ARG B 43 -4.949 -17.872 -12.370 1.00 0.00 C ATOM 964 NH1 ARG B 43 -4.162 -18.763 -12.911 1.00 0.00 N ATOM 965 NH2 ARG B 43 -5.902 -17.329 -13.076 1.00 0.00 N ATOM 0 H ARG B 43 -4.982 -14.757 -6.735 1.00 0.00 H new ATOM 0 HA ARG B 43 -3.441 -17.322 -6.433 1.00 0.00 H new ATOM 0 HB2 ARG B 43 -4.129 -15.700 -8.909 1.00 0.00 H new ATOM 0 HB3 ARG B 43 -2.512 -16.367 -8.797 1.00 0.00 H new ATOM 0 HG2 ARG B 43 -3.665 -18.633 -8.209 1.00 0.00 H new ATOM 0 HG3 ARG B 43 -5.158 -17.888 -8.744 1.00 0.00 H new ATOM 0 HD2 ARG B 43 -2.725 -17.705 -10.561 1.00 0.00 H new ATOM 0 HD3 ARG B 43 -3.618 -19.212 -10.504 1.00 0.00 H new ATOM 0 HE ARG B 43 -5.400 -16.832 -10.699 1.00 0.00 H new ATOM 0 HH11 ARG B 43 -3.417 -19.188 -12.359 1.00 0.00 H new ATOM 0 HH12 ARG B 43 -4.292 -19.034 -13.886 1.00 0.00 H new ATOM 0 HH21 ARG B 43 -6.517 -16.634 -12.653 1.00 0.00 H new ATOM 0 HH22 ARG B 43 -6.032 -17.600 -14.051 1.00 0.00 H new ATOM 979 N LEU B 44 -1.356 -15.962 -6.059 1.00 0.00 N ATOM 980 CA LEU B 44 -0.254 -15.095 -5.559 1.00 0.00 C ATOM 981 C LEU B 44 0.965 -15.206 -6.477 1.00 0.00 C ATOM 982 O LEU B 44 1.179 -16.215 -7.119 1.00 0.00 O ATOM 983 CB LEU B 44 0.074 -15.637 -4.168 1.00 0.00 C ATOM 984 CG LEU B 44 -1.050 -15.265 -3.200 1.00 0.00 C ATOM 985 CD1 LEU B 44 -1.322 -16.440 -2.261 1.00 0.00 C ATOM 986 CD2 LEU B 44 -0.632 -14.044 -2.379 1.00 0.00 C ATOM 0 H LEU B 44 -1.148 -16.960 -6.086 1.00 0.00 H new ATOM 0 HA LEU B 44 -0.537 -14.043 -5.532 1.00 0.00 H new ATOM 0 HB2 LEU B 44 0.192 -16.720 -4.206 1.00 0.00 H new ATOM 0 HB3 LEU B 44 1.021 -15.225 -3.819 1.00 0.00 H new ATOM 0 HG LEU B 44 -1.953 -15.032 -3.764 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -2.123 -16.176 -1.570 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -1.619 -17.311 -2.845 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -0.418 -16.672 -1.697 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -1.433 -13.778 -1.689 1.00 0.00 H new ATOM 0 HD22 LEU B 44 0.271 -14.277 -1.815 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -0.436 -13.206 -3.048 1.00 0.00 H new ATOM 998 N TYR B 45 1.768 -14.179 -6.545 1.00 0.00 N ATOM 999 CA TYR B 45 2.967 -14.236 -7.419 1.00 0.00 C ATOM 1000 C TYR B 45 4.223 -13.940 -6.598 1.00 0.00 C ATOM 1001 O TYR B 45 4.273 -12.996 -5.835 1.00 0.00 O ATOM 1002 CB TYR B 45 2.744 -13.148 -8.469 1.00 0.00 C ATOM 1003 CG TYR B 45 2.608 -13.783 -9.833 1.00 0.00 C ATOM 1004 CD1 TYR B 45 1.467 -14.532 -10.147 1.00 0.00 C ATOM 1005 CD2 TYR B 45 3.623 -13.623 -10.784 1.00 0.00 C ATOM 1006 CE1 TYR B 45 1.341 -15.119 -11.412 1.00 0.00 C ATOM 1007 CE2 TYR B 45 3.497 -14.210 -12.047 1.00 0.00 C ATOM 1008 CZ TYR B 45 2.357 -14.958 -12.362 1.00 0.00 C ATOM 1009 OH TYR B 45 2.233 -15.537 -13.609 1.00 0.00 O ATOM 0 H TYR B 45 1.643 -13.306 -6.033 1.00 0.00 H new ATOM 0 HA TYR B 45 3.104 -15.217 -7.875 1.00 0.00 H new ATOM 0 HB2 TYR B 45 1.847 -12.577 -8.231 1.00 0.00 H new ATOM 0 HB3 TYR B 45 3.579 -12.447 -8.464 1.00 0.00 H new ATOM 0 HD1 TYR B 45 0.684 -14.657 -9.413 1.00 0.00 H new ATOM 0 HD2 TYR B 45 4.503 -13.046 -10.542 1.00 0.00 H new ATOM 0 HE1 TYR B 45 0.461 -15.696 -11.655 1.00 0.00 H new ATOM 0 HE2 TYR B 45 4.280 -14.086 -12.780 1.00 0.00 H new ATOM 0 HH TYR B 45 3.025 -15.327 -14.147 1.00 0.00 H new ATOM 1019 N LYS B 46 5.232 -14.744 -6.751 1.00 0.00 N ATOM 1020 CA LYS B 46 6.490 -14.520 -5.982 1.00 0.00 C ATOM 1021 C LYS B 46 7.530 -13.811 -6.856 1.00 0.00 C ATOM 1022 O LYS B 46 8.060 -14.378 -7.790 1.00 0.00 O ATOM 1023 CB LYS B 46 6.974 -15.921 -5.603 1.00 0.00 C ATOM 1024 CG LYS B 46 8.393 -15.836 -5.038 1.00 0.00 C ATOM 1025 CD LYS B 46 8.743 -17.151 -4.339 1.00 0.00 C ATOM 1026 CE LYS B 46 8.852 -18.268 -5.378 1.00 0.00 C ATOM 1027 NZ LYS B 46 10.167 -18.914 -5.112 1.00 0.00 N ATOM 0 H LYS B 46 5.244 -15.550 -7.376 1.00 0.00 H new ATOM 0 HA LYS B 46 6.332 -13.890 -5.107 1.00 0.00 H new ATOM 0 HB2 LYS B 46 6.303 -16.362 -4.865 1.00 0.00 H new ATOM 0 HB3 LYS B 46 6.958 -16.572 -6.477 1.00 0.00 H new ATOM 0 HG2 LYS B 46 9.104 -15.638 -5.840 1.00 0.00 H new ATOM 0 HG3 LYS B 46 8.467 -15.007 -4.334 1.00 0.00 H new ATOM 0 HD2 LYS B 46 9.684 -17.049 -3.799 1.00 0.00 H new ATOM 0 HD3 LYS B 46 7.979 -17.398 -3.602 1.00 0.00 H new ATOM 0 HE2 LYS B 46 8.034 -18.982 -5.278 1.00 0.00 H new ATOM 0 HE3 LYS B 46 8.805 -17.870 -6.392 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 10.376 -19.599 -5.866 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 10.912 -18.188 -5.088 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 10.133 -19.406 -4.196 1.00 0.00 H new ATOM 1041 N ASP B 47 7.827 -12.576 -6.553 1.00 0.00 N ATOM 1042 CA ASP B 47 8.833 -11.826 -7.358 1.00 0.00 C ATOM 1043 C ASP B 47 8.382 -11.728 -8.817 1.00 0.00 C ATOM 1044 O ASP B 47 7.939 -10.692 -9.272 1.00 0.00 O ATOM 1045 CB ASP B 47 10.117 -12.649 -7.249 1.00 0.00 C ATOM 1046 CG ASP B 47 11.261 -11.750 -6.774 1.00 0.00 C ATOM 1047 OD1 ASP B 47 11.068 -10.546 -6.743 1.00 0.00 O ATOM 1048 OD2 ASP B 47 12.310 -12.282 -6.450 1.00 0.00 O ATOM 0 H ASP B 47 7.415 -12.053 -5.780 1.00 0.00 H new ATOM 0 HA ASP B 47 8.969 -10.805 -7.001 1.00 0.00 H new ATOM 0 HB2 ASP B 47 9.975 -13.474 -6.551 1.00 0.00 H new ATOM 0 HB3 ASP B 47 10.363 -13.088 -8.216 1.00 0.00 H new ATOM 1053 N ASP B 48 8.489 -12.799 -9.551 1.00 0.00 N ATOM 1054 CA ASP B 48 8.065 -12.773 -10.980 1.00 0.00 C ATOM 1055 C ASP B 48 7.403 -14.100 -11.355 1.00 0.00 C ATOM 1056 O ASP B 48 7.296 -14.447 -12.514 1.00 0.00 O ATOM 1057 CB ASP B 48 9.358 -12.575 -11.773 1.00 0.00 C ATOM 1058 CG ASP B 48 10.290 -13.764 -11.534 1.00 0.00 C ATOM 1059 OD1 ASP B 48 10.437 -14.156 -10.387 1.00 0.00 O ATOM 1060 OD2 ASP B 48 10.841 -14.263 -12.501 1.00 0.00 O ATOM 0 H ASP B 48 8.852 -13.694 -9.223 1.00 0.00 H new ATOM 0 HA ASP B 48 7.339 -11.986 -11.183 1.00 0.00 H new ATOM 0 HB2 ASP B 48 9.135 -12.482 -12.836 1.00 0.00 H new ATOM 0 HB3 ASP B 48 9.846 -11.649 -11.468 1.00 0.00 H new ATOM 1065 N GLN B 49 6.955 -14.843 -10.381 1.00 0.00 N ATOM 1066 CA GLN B 49 6.299 -16.147 -10.675 1.00 0.00 C ATOM 1067 C GLN B 49 5.055 -16.315 -9.801 1.00 0.00 C ATOM 1068 O GLN B 49 4.615 -15.389 -9.151 1.00 0.00 O ATOM 1069 CB GLN B 49 7.347 -17.205 -10.328 1.00 0.00 C ATOM 1070 CG GLN B 49 7.638 -18.060 -11.563 1.00 0.00 C ATOM 1071 CD GLN B 49 8.555 -17.290 -12.513 1.00 0.00 C ATOM 1072 OE1 GLN B 49 8.092 -16.621 -13.416 1.00 0.00 O ATOM 1073 NE2 GLN B 49 9.848 -17.356 -12.348 1.00 0.00 N ATOM 0 H GLN B 49 7.015 -14.602 -9.392 1.00 0.00 H new ATOM 0 HA GLN B 49 5.973 -16.224 -11.712 1.00 0.00 H new ATOM 0 HB2 GLN B 49 8.262 -16.725 -9.981 1.00 0.00 H new ATOM 0 HB3 GLN B 49 6.988 -17.834 -9.513 1.00 0.00 H new ATOM 0 HG2 GLN B 49 8.109 -18.997 -11.267 1.00 0.00 H new ATOM 0 HG3 GLN B 49 6.707 -18.317 -12.068 1.00 0.00 H new ATOM 0 HE21 GLN B 49 10.237 -17.917 -11.590 1.00 0.00 H new ATOM 0 HE22 GLN B 49 10.469 -16.846 -12.977 1.00 0.00 H new ATOM 1082 N LEU B 50 4.489 -17.489 -9.780 1.00 0.00 N ATOM 1083 CA LEU B 50 3.274 -17.716 -8.947 1.00 0.00 C ATOM 1084 C LEU B 50 3.670 -18.301 -7.589 1.00 0.00 C ATOM 1085 O LEU B 50 4.453 -19.226 -7.506 1.00 0.00 O ATOM 1086 CB LEU B 50 2.429 -18.715 -9.737 1.00 0.00 C ATOM 1087 CG LEU B 50 0.947 -18.471 -9.449 1.00 0.00 C ATOM 1088 CD1 LEU B 50 0.098 -19.174 -10.510 1.00 0.00 C ATOM 1089 CD2 LEU B 50 0.600 -19.029 -8.067 1.00 0.00 C ATOM 0 H LEU B 50 4.815 -18.302 -10.303 1.00 0.00 H new ATOM 0 HA LEU B 50 2.729 -16.793 -8.750 1.00 0.00 H new ATOM 0 HB2 LEU B 50 2.625 -18.609 -10.804 1.00 0.00 H new ATOM 0 HB3 LEU B 50 2.701 -19.734 -9.462 1.00 0.00 H new ATOM 0 HG LEU B 50 0.743 -17.400 -9.472 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -0.958 -19.000 -10.305 1.00 0.00 H new ATOM 0 HD12 LEU B 50 0.346 -18.779 -11.495 1.00 0.00 H new ATOM 0 HD13 LEU B 50 0.301 -20.245 -10.487 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -0.456 -18.856 -7.859 1.00 0.00 H new ATOM 0 HD22 LEU B 50 0.804 -20.100 -8.045 1.00 0.00 H new ATOM 0 HD23 LEU B 50 1.205 -18.529 -7.310 1.00 0.00 H new ATOM 1101 N LEU B 51 3.134 -17.770 -6.524 1.00 0.00 N ATOM 1102 CA LEU B 51 3.481 -18.299 -5.175 1.00 0.00 C ATOM 1103 C LEU B 51 2.732 -19.609 -4.910 1.00 0.00 C ATOM 1104 O LEU B 51 1.586 -19.766 -5.286 1.00 0.00 O ATOM 1105 CB LEU B 51 3.029 -17.213 -4.198 1.00 0.00 C ATOM 1106 CG LEU B 51 3.263 -17.685 -2.762 1.00 0.00 C ATOM 1107 CD1 LEU B 51 4.723 -17.443 -2.377 1.00 0.00 C ATOM 1108 CD2 LEU B 51 2.351 -16.905 -1.814 1.00 0.00 C ATOM 0 H LEU B 51 2.472 -16.994 -6.530 1.00 0.00 H new ATOM 0 HA LEU B 51 4.544 -18.519 -5.077 1.00 0.00 H new ATOM 0 HB2 LEU B 51 3.580 -16.291 -4.383 1.00 0.00 H new ATOM 0 HB3 LEU B 51 1.973 -16.989 -4.350 1.00 0.00 H new ATOM 0 HG LEU B 51 3.039 -18.749 -2.689 1.00 0.00 H new ATOM 0 HD11 LEU B 51 4.890 -17.779 -1.354 1.00 0.00 H new ATOM 0 HD12 LEU B 51 5.374 -17.998 -3.052 1.00 0.00 H new ATOM 0 HD13 LEU B 51 4.947 -16.379 -2.450 1.00 0.00 H new ATOM 0 HD21 LEU B 51 2.517 -17.241 -0.791 1.00 0.00 H new ATOM 0 HD22 LEU B 51 2.575 -15.841 -1.887 1.00 0.00 H new ATOM 0 HD23 LEU B 51 1.310 -17.077 -2.087 1.00 0.00 H new ATOM 1120 N ASP B 52 3.368 -20.550 -4.268 1.00 0.00 N ATOM 1121 CA ASP B 52 2.690 -21.848 -3.982 1.00 0.00 C ATOM 1122 C ASP B 52 2.266 -21.915 -2.512 1.00 0.00 C ATOM 1123 O ASP B 52 3.088 -21.869 -1.616 1.00 0.00 O ATOM 1124 CB ASP B 52 3.740 -22.918 -4.286 1.00 0.00 C ATOM 1125 CG ASP B 52 3.074 -24.104 -4.986 1.00 0.00 C ATOM 1126 OD1 ASP B 52 2.850 -24.012 -6.182 1.00 0.00 O ATOM 1127 OD2 ASP B 52 2.798 -25.084 -4.314 1.00 0.00 O ATOM 0 H ASP B 52 4.327 -20.477 -3.929 1.00 0.00 H new ATOM 0 HA ASP B 52 1.787 -21.980 -4.577 1.00 0.00 H new ATOM 0 HB2 ASP B 52 4.525 -22.503 -4.919 1.00 0.00 H new ATOM 0 HB3 ASP B 52 4.216 -23.248 -3.363 1.00 0.00 H new ATOM 1132 N ASP B 53 0.991 -22.024 -2.256 1.00 0.00 N ATOM 1133 CA ASP B 53 0.518 -22.093 -0.843 1.00 0.00 C ATOM 1134 C ASP B 53 0.824 -23.469 -0.246 1.00 0.00 C ATOM 1135 O ASP B 53 0.526 -23.739 0.900 1.00 0.00 O ATOM 1136 CB ASP B 53 -0.992 -21.864 -0.917 1.00 0.00 C ATOM 1137 CG ASP B 53 -1.672 -23.111 -1.484 1.00 0.00 C ATOM 1138 OD1 ASP B 53 -1.435 -23.417 -2.641 1.00 0.00 O ATOM 1139 OD2 ASP B 53 -2.417 -23.740 -0.751 1.00 0.00 O ATOM 0 H ASP B 53 0.257 -22.068 -2.963 1.00 0.00 H new ATOM 0 HA ASP B 53 1.011 -21.357 -0.208 1.00 0.00 H new ATOM 0 HB2 ASP B 53 -1.386 -21.642 0.075 1.00 0.00 H new ATOM 0 HB3 ASP B 53 -1.209 -21.001 -1.546 1.00 0.00 H new ATOM 1144 N GLY B 54 1.419 -24.339 -1.014 1.00 0.00 N ATOM 1145 CA GLY B 54 1.745 -25.694 -0.490 1.00 0.00 C ATOM 1146 C GLY B 54 3.147 -25.682 0.116 1.00 0.00 C ATOM 1147 O GLY B 54 3.671 -26.702 0.515 1.00 0.00 O ATOM 0 H GLY B 54 1.693 -24.170 -1.982 1.00 0.00 H new ATOM 0 HA2 GLY B 54 1.014 -25.990 0.263 1.00 0.00 H new ATOM 0 HA3 GLY B 54 1.691 -26.429 -1.293 1.00 0.00 H new ATOM 1151 N LYS B 55 3.755 -24.532 0.200 1.00 0.00 N ATOM 1152 CA LYS B 55 5.097 -24.435 0.783 1.00 0.00 C ATOM 1153 C LYS B 55 5.157 -23.199 1.667 1.00 0.00 C ATOM 1154 O LYS B 55 4.553 -22.180 1.394 1.00 0.00 O ATOM 1155 CB LYS B 55 6.044 -24.297 -0.410 1.00 0.00 C ATOM 1156 CG LYS B 55 5.779 -25.426 -1.406 1.00 0.00 C ATOM 1157 CD LYS B 55 7.030 -25.666 -2.255 1.00 0.00 C ATOM 1158 CE LYS B 55 6.857 -24.998 -3.621 1.00 0.00 C ATOM 1159 NZ LYS B 55 5.987 -25.927 -4.394 1.00 0.00 N ATOM 0 H LYS B 55 3.361 -23.647 -0.120 1.00 0.00 H new ATOM 0 HA LYS B 55 5.361 -25.296 1.397 1.00 0.00 H new ATOM 0 HB2 LYS B 55 5.899 -23.331 -0.893 1.00 0.00 H new ATOM 0 HB3 LYS B 55 7.080 -24.332 -0.072 1.00 0.00 H new ATOM 0 HG2 LYS B 55 5.508 -26.338 -0.874 1.00 0.00 H new ATOM 0 HG3 LYS B 55 4.936 -25.169 -2.047 1.00 0.00 H new ATOM 0 HD2 LYS B 55 7.908 -25.263 -1.750 1.00 0.00 H new ATOM 0 HD3 LYS B 55 7.198 -26.736 -2.380 1.00 0.00 H new ATOM 0 HE2 LYS B 55 6.397 -24.014 -3.524 1.00 0.00 H new ATOM 0 HE3 LYS B 55 7.818 -24.854 -4.115 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 5.432 -25.386 -5.088 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 6.578 -26.624 -4.891 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 5.343 -26.421 -3.744 1.00 0.00 H new ATOM 1173 N THR B 56 5.886 -23.295 2.714 1.00 0.00 N ATOM 1174 CA THR B 56 6.033 -22.155 3.657 1.00 0.00 C ATOM 1175 C THR B 56 7.093 -21.187 3.137 1.00 0.00 C ATOM 1176 O THR B 56 7.761 -21.445 2.156 1.00 0.00 O ATOM 1177 CB THR B 56 6.481 -22.784 4.979 1.00 0.00 C ATOM 1178 OG1 THR B 56 6.524 -24.198 4.842 1.00 0.00 O ATOM 1179 CG2 THR B 56 5.495 -22.407 6.085 1.00 0.00 C ATOM 0 H THR B 56 6.406 -24.133 2.975 1.00 0.00 H new ATOM 0 HA THR B 56 5.109 -21.589 3.773 1.00 0.00 H new ATOM 0 HB THR B 56 7.473 -22.415 5.238 1.00 0.00 H new ATOM 0 HG1 THR B 56 6.812 -24.600 5.688 1.00 0.00 H new ATOM 0 HG21 THR B 56 5.815 -22.855 7.026 1.00 0.00 H new ATOM 0 HG22 THR B 56 5.465 -21.323 6.191 1.00 0.00 H new ATOM 0 HG23 THR B 56 4.502 -22.774 5.827 1.00 0.00 H new ATOM 1187 N LEU B 57 7.252 -20.073 3.789 1.00 0.00 N ATOM 1188 CA LEU B 57 8.269 -19.083 3.335 1.00 0.00 C ATOM 1189 C LEU B 57 9.630 -19.766 3.183 1.00 0.00 C ATOM 1190 O LEU B 57 10.357 -19.524 2.239 1.00 0.00 O ATOM 1191 CB LEU B 57 8.314 -18.030 4.442 1.00 0.00 C ATOM 1192 CG LEU B 57 7.017 -17.220 4.429 1.00 0.00 C ATOM 1193 CD1 LEU B 57 6.392 -17.230 5.826 1.00 0.00 C ATOM 1194 CD2 LEU B 57 7.321 -15.778 4.019 1.00 0.00 C ATOM 0 H LEU B 57 6.722 -19.803 4.618 1.00 0.00 H new ATOM 0 HA LEU B 57 8.023 -18.644 2.368 1.00 0.00 H new ATOM 0 HB2 LEU B 57 8.445 -18.511 5.411 1.00 0.00 H new ATOM 0 HB3 LEU B 57 9.169 -17.370 4.296 1.00 0.00 H new ATOM 0 HG LEU B 57 6.321 -17.663 3.717 1.00 0.00 H new ATOM 0 HD11 LEU B 57 5.468 -16.652 5.815 1.00 0.00 H new ATOM 0 HD12 LEU B 57 6.175 -18.257 6.120 1.00 0.00 H new ATOM 0 HD13 LEU B 57 7.088 -16.788 6.539 1.00 0.00 H new ATOM 0 HD21 LEU B 57 6.397 -15.200 4.009 1.00 0.00 H new ATOM 0 HD22 LEU B 57 8.018 -15.336 4.731 1.00 0.00 H new ATOM 0 HD23 LEU B 57 7.765 -15.769 3.024 1.00 0.00 H new ATOM 1206 N GLY B 58 9.975 -20.625 4.101 1.00 0.00 N ATOM 1207 CA GLY B 58 11.282 -21.333 4.009 1.00 0.00 C ATOM 1208 C GLY B 58 11.206 -22.376 2.894 1.00 0.00 C ATOM 1209 O GLY B 58 12.138 -22.560 2.136 1.00 0.00 O ATOM 0 H GLY B 58 9.407 -20.868 4.913 1.00 0.00 H new ATOM 0 HA2 GLY B 58 12.082 -20.621 3.805 1.00 0.00 H new ATOM 0 HA3 GLY B 58 11.517 -21.814 4.959 1.00 0.00 H new ATOM 1213 N GLU B 59 10.099 -23.056 2.786 1.00 0.00 N ATOM 1214 CA GLU B 59 9.954 -24.085 1.718 1.00 0.00 C ATOM 1215 C GLU B 59 9.465 -23.430 0.430 1.00 0.00 C ATOM 1216 O GLU B 59 9.186 -24.087 -0.554 1.00 0.00 O ATOM 1217 CB GLU B 59 8.912 -25.064 2.251 1.00 0.00 C ATOM 1218 CG GLU B 59 9.523 -26.462 2.342 1.00 0.00 C ATOM 1219 CD GLU B 59 8.446 -27.511 2.057 1.00 0.00 C ATOM 1220 OE1 GLU B 59 7.296 -27.251 2.369 1.00 0.00 O ATOM 1221 OE2 GLU B 59 8.789 -28.556 1.527 1.00 0.00 O ATOM 0 H GLU B 59 9.287 -22.944 3.392 1.00 0.00 H new ATOM 0 HA GLU B 59 10.896 -24.582 1.487 1.00 0.00 H new ATOM 0 HB2 GLU B 59 8.565 -24.743 3.233 1.00 0.00 H new ATOM 0 HB3 GLU B 59 8.042 -25.078 1.595 1.00 0.00 H new ATOM 0 HG2 GLU B 59 10.340 -26.561 1.627 1.00 0.00 H new ATOM 0 HG3 GLU B 59 9.947 -26.621 3.334 1.00 0.00 H new ATOM 1228 N CYS B 60 9.365 -22.137 0.437 1.00 0.00 N ATOM 1229 CA CYS B 60 8.900 -21.411 -0.777 1.00 0.00 C ATOM 1230 C CYS B 60 10.033 -20.542 -1.324 1.00 0.00 C ATOM 1231 O CYS B 60 10.183 -20.379 -2.519 1.00 0.00 O ATOM 1232 CB CYS B 60 7.735 -20.542 -0.303 1.00 0.00 C ATOM 1233 SG CYS B 60 6.923 -19.791 -1.735 1.00 0.00 S ATOM 0 H CYS B 60 9.586 -21.543 1.236 1.00 0.00 H new ATOM 0 HA CYS B 60 8.597 -22.087 -1.576 1.00 0.00 H new ATOM 0 HB2 CYS B 60 7.022 -21.146 0.258 1.00 0.00 H new ATOM 0 HB3 CYS B 60 8.097 -19.766 0.372 1.00 0.00 H new ATOM 0 HG CYS B 60 5.641 -19.992 -1.661 1.00 0.00 H new ATOM 1239 N GLY B 61 10.839 -19.990 -0.458 1.00 0.00 N ATOM 1240 CA GLY B 61 11.969 -19.142 -0.935 1.00 0.00 C ATOM 1241 C GLY B 61 11.955 -17.792 -0.214 1.00 0.00 C ATOM 1242 O GLY B 61 12.534 -16.828 -0.675 1.00 0.00 O ATOM 0 H GLY B 61 10.765 -20.089 0.554 1.00 0.00 H new ATOM 0 HA2 GLY B 61 12.916 -19.650 -0.754 1.00 0.00 H new ATOM 0 HA3 GLY B 61 11.890 -18.989 -2.011 1.00 0.00 H new ATOM 1246 N PHE B 62 11.307 -17.713 0.914 1.00 0.00 N ATOM 1247 CA PHE B 62 11.267 -16.422 1.658 1.00 0.00 C ATOM 1248 C PHE B 62 12.139 -16.518 2.914 1.00 0.00 C ATOM 1249 O PHE B 62 12.895 -15.621 3.230 1.00 0.00 O ATOM 1250 CB PHE B 62 9.798 -16.223 2.033 1.00 0.00 C ATOM 1251 CG PHE B 62 9.005 -15.881 0.795 1.00 0.00 C ATOM 1252 CD1 PHE B 62 9.055 -14.586 0.263 1.00 0.00 C ATOM 1253 CD2 PHE B 62 8.215 -16.859 0.178 1.00 0.00 C ATOM 1254 CE1 PHE B 62 8.318 -14.272 -0.885 1.00 0.00 C ATOM 1255 CE2 PHE B 62 7.478 -16.544 -0.969 1.00 0.00 C ATOM 1256 CZ PHE B 62 7.530 -15.250 -1.501 1.00 0.00 C ATOM 0 H PHE B 62 10.804 -18.484 1.353 1.00 0.00 H new ATOM 0 HA PHE B 62 11.648 -15.589 1.067 1.00 0.00 H new ATOM 0 HB2 PHE B 62 9.403 -17.129 2.492 1.00 0.00 H new ATOM 0 HB3 PHE B 62 9.704 -15.425 2.770 1.00 0.00 H new ATOM 0 HD1 PHE B 62 9.662 -13.830 0.739 1.00 0.00 H new ATOM 0 HD2 PHE B 62 8.175 -17.857 0.588 1.00 0.00 H new ATOM 0 HE1 PHE B 62 8.358 -13.274 -1.295 1.00 0.00 H new ATOM 0 HE2 PHE B 62 6.869 -17.299 -1.444 1.00 0.00 H new ATOM 0 HZ PHE B 62 6.962 -15.007 -2.387 1.00 0.00 H new ATOM 1266 N THR B 63 12.041 -17.606 3.628 1.00 0.00 N ATOM 1267 CA THR B 63 12.866 -17.770 4.861 1.00 0.00 C ATOM 1268 C THR B 63 12.886 -16.466 5.662 1.00 0.00 C ATOM 1269 O THR B 63 11.867 -15.836 5.868 1.00 0.00 O ATOM 1270 CB THR B 63 14.273 -18.113 4.360 1.00 0.00 C ATOM 1271 OG1 THR B 63 14.969 -16.913 4.055 1.00 0.00 O ATOM 1272 CG2 THR B 63 14.182 -18.982 3.104 1.00 0.00 C ATOM 0 H THR B 63 11.425 -18.390 3.411 1.00 0.00 H new ATOM 0 HA THR B 63 12.470 -18.543 5.520 1.00 0.00 H new ATOM 0 HB THR B 63 14.807 -18.661 5.136 1.00 0.00 H new ATOM 0 HG1 THR B 63 14.393 -16.328 3.520 1.00 0.00 H new ATOM 0 HG21 THR B 63 15.186 -19.222 2.754 1.00 0.00 H new ATOM 0 HG22 THR B 63 13.649 -19.904 3.337 1.00 0.00 H new ATOM 0 HG23 THR B 63 13.646 -18.440 2.325 1.00 0.00 H new ATOM 1280 N SER B 64 14.039 -16.053 6.113 1.00 0.00 N ATOM 1281 CA SER B 64 14.127 -14.788 6.895 1.00 0.00 C ATOM 1282 C SER B 64 15.204 -13.888 6.296 1.00 0.00 C ATOM 1283 O SER B 64 15.799 -13.070 6.971 1.00 0.00 O ATOM 1284 CB SER B 64 14.504 -15.216 8.312 1.00 0.00 C ATOM 1285 OG SER B 64 13.319 -15.430 9.069 1.00 0.00 O ATOM 0 H SER B 64 14.925 -16.538 5.973 1.00 0.00 H new ATOM 0 HA SER B 64 13.194 -14.225 6.884 1.00 0.00 H new ATOM 0 HB2 SER B 64 15.100 -16.128 8.282 1.00 0.00 H new ATOM 0 HB3 SER B 64 15.118 -14.449 8.785 1.00 0.00 H new ATOM 0 HG SER B 64 13.117 -16.389 9.096 1.00 0.00 H new ATOM 1291 N GLN B 65 15.450 -14.033 5.027 1.00 0.00 N ATOM 1292 CA GLN B 65 16.481 -13.190 4.359 1.00 0.00 C ATOM 1293 C GLN B 65 15.839 -12.400 3.219 1.00 0.00 C ATOM 1294 O GLN B 65 16.299 -11.338 2.847 1.00 0.00 O ATOM 1295 CB GLN B 65 17.513 -14.179 3.814 1.00 0.00 C ATOM 1296 CG GLN B 65 16.906 -14.961 2.647 1.00 0.00 C ATOM 1297 CD GLN B 65 17.752 -16.205 2.371 1.00 0.00 C ATOM 1298 OE1 GLN B 65 17.267 -17.173 1.820 1.00 0.00 O ATOM 1299 NE2 GLN B 65 19.007 -16.220 2.733 1.00 0.00 N ATOM 0 H GLN B 65 14.979 -14.703 4.418 1.00 0.00 H new ATOM 0 HA GLN B 65 16.935 -12.468 5.038 1.00 0.00 H new ATOM 0 HB2 GLN B 65 18.404 -13.645 3.483 1.00 0.00 H new ATOM 0 HB3 GLN B 65 17.826 -14.865 4.601 1.00 0.00 H new ATOM 0 HG2 GLN B 65 15.882 -15.250 2.883 1.00 0.00 H new ATOM 0 HG3 GLN B 65 16.863 -14.333 1.757 1.00 0.00 H new ATOM 0 HE21 GLN B 65 19.414 -15.407 3.196 1.00 0.00 H new ATOM 0 HE22 GLN B 65 19.580 -17.045 2.553 1.00 0.00 H new ATOM 1308 N THR B 66 14.773 -12.910 2.665 1.00 0.00 N ATOM 1309 CA THR B 66 14.091 -12.187 1.553 1.00 0.00 C ATOM 1310 C THR B 66 12.753 -11.630 2.041 1.00 0.00 C ATOM 1311 O THR B 66 11.840 -11.407 1.271 1.00 0.00 O ATOM 1312 CB THR B 66 13.875 -13.240 0.464 1.00 0.00 C ATOM 1313 OG1 THR B 66 14.129 -14.532 0.998 1.00 0.00 O ATOM 1314 CG2 THR B 66 14.827 -12.971 -0.703 1.00 0.00 C ATOM 0 H THR B 66 14.345 -13.796 2.934 1.00 0.00 H new ATOM 0 HA THR B 66 14.674 -11.343 1.185 1.00 0.00 H new ATOM 0 HB THR B 66 12.846 -13.191 0.109 1.00 0.00 H new ATOM 0 HG1 THR B 66 13.490 -14.720 1.717 1.00 0.00 H new ATOM 0 HG21 THR B 66 14.673 -13.721 -1.479 1.00 0.00 H new ATOM 0 HG22 THR B 66 14.630 -11.980 -1.112 1.00 0.00 H new ATOM 0 HG23 THR B 66 15.857 -13.020 -0.351 1.00 0.00 H new ATOM 1322 N ALA B 67 12.639 -11.401 3.318 1.00 0.00 N ATOM 1323 CA ALA B 67 11.371 -10.857 3.878 1.00 0.00 C ATOM 1324 C ALA B 67 11.615 -10.360 5.303 1.00 0.00 C ATOM 1325 O ALA B 67 11.609 -11.124 6.248 1.00 0.00 O ATOM 1326 CB ALA B 67 10.398 -12.034 3.877 1.00 0.00 C ATOM 0 H ALA B 67 13.375 -11.569 4.004 1.00 0.00 H new ATOM 0 HA ALA B 67 10.983 -10.016 3.302 1.00 0.00 H new ATOM 0 HB1 ALA B 67 9.437 -11.712 4.277 1.00 0.00 H new ATOM 0 HB2 ALA B 67 10.264 -12.394 2.857 1.00 0.00 H new ATOM 0 HB3 ALA B 67 10.798 -12.837 4.496 1.00 0.00 H new ATOM 1332 N ARG B 68 11.843 -9.086 5.465 1.00 0.00 N ATOM 1333 CA ARG B 68 12.103 -8.539 6.832 1.00 0.00 C ATOM 1334 C ARG B 68 11.823 -7.033 6.856 1.00 0.00 C ATOM 1335 O ARG B 68 11.262 -6.496 5.922 1.00 0.00 O ATOM 1336 CB ARG B 68 13.591 -8.810 7.108 1.00 0.00 C ATOM 1337 CG ARG B 68 14.148 -9.828 6.108 1.00 0.00 C ATOM 1338 CD ARG B 68 15.663 -9.945 6.290 1.00 0.00 C ATOM 1339 NE ARG B 68 15.859 -10.182 7.747 1.00 0.00 N ATOM 1340 CZ ARG B 68 17.018 -9.943 8.299 1.00 0.00 C ATOM 1341 NH1 ARG B 68 18.007 -9.494 7.576 1.00 0.00 N ATOM 1342 NH2 ARG B 68 17.187 -10.152 9.576 1.00 0.00 N ATOM 0 H ARG B 68 11.861 -8.398 4.712 1.00 0.00 H new ATOM 0 HA ARG B 68 11.463 -9.000 7.584 1.00 0.00 H new ATOM 0 HB2 ARG B 68 14.154 -7.879 7.040 1.00 0.00 H new ATOM 0 HB3 ARG B 68 13.716 -9.184 8.124 1.00 0.00 H new ATOM 0 HG2 ARG B 68 13.677 -10.799 6.260 1.00 0.00 H new ATOM 0 HG3 ARG B 68 13.916 -9.517 5.089 1.00 0.00 H new ATOM 0 HD2 ARG B 68 16.069 -10.765 5.699 1.00 0.00 H new ATOM 0 HD3 ARG B 68 16.171 -9.037 5.966 1.00 0.00 H new ATOM 0 HE ARG B 68 15.087 -10.531 8.315 1.00 0.00 H new ATOM 0 HH11 ARG B 68 17.875 -9.329 6.578 1.00 0.00 H new ATOM 0 HH12 ARG B 68 18.912 -9.308 8.009 1.00 0.00 H new ATOM 0 HH21 ARG B 68 16.414 -10.502 10.142 1.00 0.00 H new ATOM 0 HH22 ARG B 68 18.092 -9.966 10.008 1.00 0.00 H new ATOM 1356 N PRO B 69 12.229 -6.393 7.926 1.00 0.00 N ATOM 1357 CA PRO B 69 12.018 -4.931 8.053 1.00 0.00 C ATOM 1358 C PRO B 69 12.948 -4.188 7.092 1.00 0.00 C ATOM 1359 O PRO B 69 12.649 -3.103 6.634 1.00 0.00 O ATOM 1360 CB PRO B 69 12.368 -4.639 9.510 1.00 0.00 C ATOM 1361 CG PRO B 69 13.290 -5.743 9.914 1.00 0.00 C ATOM 1362 CD PRO B 69 12.914 -6.954 9.099 1.00 0.00 C ATOM 0 HA PRO B 69 11.006 -4.612 7.804 1.00 0.00 H new ATOM 0 HB2 PRO B 69 12.848 -3.666 9.613 1.00 0.00 H new ATOM 0 HB3 PRO B 69 11.475 -4.622 10.135 1.00 0.00 H new ATOM 0 HG2 PRO B 69 14.328 -5.464 9.733 1.00 0.00 H new ATOM 0 HG3 PRO B 69 13.197 -5.952 10.980 1.00 0.00 H new ATOM 0 HD2 PRO B 69 13.793 -7.530 8.810 1.00 0.00 H new ATOM 0 HD3 PRO B 69 12.263 -7.625 9.659 1.00 0.00 H new ATOM 1370 N GLN B 70 14.066 -4.778 6.765 1.00 0.00 N ATOM 1371 CA GLN B 70 15.006 -4.120 5.813 1.00 0.00 C ATOM 1372 C GLN B 70 14.547 -4.416 4.385 1.00 0.00 C ATOM 1373 O GLN B 70 14.042 -3.556 3.693 1.00 0.00 O ATOM 1374 CB GLN B 70 16.368 -4.760 6.088 1.00 0.00 C ATOM 1375 CG GLN B 70 16.826 -4.401 7.502 1.00 0.00 C ATOM 1376 CD GLN B 70 17.773 -5.483 8.024 1.00 0.00 C ATOM 1377 OE1 GLN B 70 17.392 -6.296 8.844 1.00 0.00 O ATOM 1378 NE2 GLN B 70 18.998 -5.529 7.580 1.00 0.00 N ATOM 0 H GLN B 70 14.369 -5.687 7.116 1.00 0.00 H new ATOM 0 HA GLN B 70 15.048 -3.037 5.932 1.00 0.00 H new ATOM 0 HB2 GLN B 70 16.301 -5.843 5.980 1.00 0.00 H new ATOM 0 HB3 GLN B 70 17.099 -4.412 5.358 1.00 0.00 H new ATOM 0 HG2 GLN B 70 17.329 -3.434 7.498 1.00 0.00 H new ATOM 0 HG3 GLN B 70 15.964 -4.309 8.162 1.00 0.00 H new ATOM 0 HE21 GLN B 70 19.317 -4.847 6.892 1.00 0.00 H new ATOM 0 HE22 GLN B 70 19.637 -6.247 7.920 1.00 0.00 H new ATOM 1387 N ALA B 71 14.694 -5.638 3.953 1.00 0.00 N ATOM 1388 CA ALA B 71 14.237 -6.004 2.584 1.00 0.00 C ATOM 1389 C ALA B 71 13.120 -7.044 2.698 1.00 0.00 C ATOM 1390 O ALA B 71 13.370 -8.197 2.988 1.00 0.00 O ATOM 1391 CB ALA B 71 15.466 -6.601 1.899 1.00 0.00 C ATOM 0 H ALA B 71 15.111 -6.399 4.489 1.00 0.00 H new ATOM 0 HA ALA B 71 13.845 -5.156 2.023 1.00 0.00 H new ATOM 0 HB1 ALA B 71 15.208 -6.896 0.882 1.00 0.00 H new ATOM 0 HB2 ALA B 71 16.263 -5.858 1.870 1.00 0.00 H new ATOM 0 HB3 ALA B 71 15.804 -7.475 2.456 1.00 0.00 H new ATOM 1397 N PRO B 72 11.918 -6.589 2.478 1.00 0.00 N ATOM 1398 CA PRO B 72 10.738 -7.470 2.570 1.00 0.00 C ATOM 1399 C PRO B 72 10.467 -8.175 1.241 1.00 0.00 C ATOM 1400 O PRO B 72 11.059 -7.872 0.225 1.00 0.00 O ATOM 1401 CB PRO B 72 9.609 -6.498 2.894 1.00 0.00 C ATOM 1402 CG PRO B 72 10.054 -5.164 2.362 1.00 0.00 C ATOM 1403 CD PRO B 72 11.548 -5.217 2.136 1.00 0.00 C ATOM 0 HA PRO B 72 10.859 -8.263 3.308 1.00 0.00 H new ATOM 0 HB2 PRO B 72 8.675 -6.813 2.428 1.00 0.00 H new ATOM 0 HB3 PRO B 72 9.429 -6.451 3.968 1.00 0.00 H new ATOM 0 HG2 PRO B 72 9.537 -4.935 1.430 1.00 0.00 H new ATOM 0 HG3 PRO B 72 9.805 -4.372 3.068 1.00 0.00 H new ATOM 0 HD2 PRO B 72 11.802 -4.983 1.102 1.00 0.00 H new ATOM 0 HD3 PRO B 72 12.071 -4.496 2.764 1.00 0.00 H new ATOM 1411 N ALA B 73 9.562 -9.110 1.252 1.00 0.00 N ATOM 1412 CA ALA B 73 9.221 -9.844 -0.002 1.00 0.00 C ATOM 1413 C ALA B 73 7.837 -9.408 -0.490 1.00 0.00 C ATOM 1414 O ALA B 73 6.930 -9.207 0.291 1.00 0.00 O ATOM 1415 CB ALA B 73 9.211 -11.322 0.389 1.00 0.00 C ATOM 0 H ALA B 73 9.039 -9.401 2.078 1.00 0.00 H new ATOM 0 HA ALA B 73 9.928 -9.647 -0.808 1.00 0.00 H new ATOM 0 HB1 ALA B 73 8.967 -11.928 -0.484 1.00 0.00 H new ATOM 0 HB2 ALA B 73 10.194 -11.606 0.764 1.00 0.00 H new ATOM 0 HB3 ALA B 73 8.464 -11.488 1.166 1.00 0.00 H new ATOM 1421 N THR B 74 7.671 -9.247 -1.775 1.00 0.00 N ATOM 1422 CA THR B 74 6.348 -8.806 -2.303 1.00 0.00 C ATOM 1423 C THR B 74 5.643 -9.948 -3.033 1.00 0.00 C ATOM 1424 O THR B 74 6.243 -10.690 -3.784 1.00 0.00 O ATOM 1425 CB THR B 74 6.668 -7.675 -3.279 1.00 0.00 C ATOM 1426 OG1 THR B 74 6.718 -6.442 -2.575 1.00 0.00 O ATOM 1427 CG2 THR B 74 5.591 -7.603 -4.365 1.00 0.00 C ATOM 0 H THR B 74 8.392 -9.401 -2.480 1.00 0.00 H new ATOM 0 HA THR B 74 5.681 -8.488 -1.502 1.00 0.00 H new ATOM 0 HB THR B 74 7.634 -7.867 -3.747 1.00 0.00 H new ATOM 0 HG1 THR B 74 7.222 -5.786 -3.100 1.00 0.00 H new ATOM 0 HG21 THR B 74 5.826 -6.794 -5.057 1.00 0.00 H new ATOM 0 HG22 THR B 74 5.558 -8.548 -4.908 1.00 0.00 H new ATOM 0 HG23 THR B 74 4.621 -7.416 -3.904 1.00 0.00 H new ATOM 1435 N VAL B 75 4.364 -10.068 -2.833 1.00 0.00 N ATOM 1436 CA VAL B 75 3.593 -11.133 -3.527 1.00 0.00 C ATOM 1437 C VAL B 75 2.486 -10.472 -4.353 1.00 0.00 C ATOM 1438 O VAL B 75 1.891 -9.496 -3.939 1.00 0.00 O ATOM 1439 CB VAL B 75 3.018 -12.036 -2.423 1.00 0.00 C ATOM 1440 CG1 VAL B 75 3.837 -11.888 -1.137 1.00 0.00 C ATOM 1441 CG2 VAL B 75 1.562 -11.657 -2.144 1.00 0.00 C ATOM 0 H VAL B 75 3.815 -9.471 -2.215 1.00 0.00 H new ATOM 0 HA VAL B 75 4.204 -11.725 -4.208 1.00 0.00 H new ATOM 0 HB VAL B 75 3.066 -13.071 -2.761 1.00 0.00 H new ATOM 0 HG11 VAL B 75 3.419 -12.533 -0.363 1.00 0.00 H new ATOM 0 HG12 VAL B 75 4.871 -12.175 -1.329 1.00 0.00 H new ATOM 0 HG13 VAL B 75 3.804 -10.851 -0.802 1.00 0.00 H new ATOM 0 HG21 VAL B 75 1.162 -12.301 -1.361 1.00 0.00 H new ATOM 0 HG22 VAL B 75 1.512 -10.618 -1.819 1.00 0.00 H new ATOM 0 HG23 VAL B 75 0.973 -11.782 -3.053 1.00 0.00 H new ATOM 1451 N GLY B 76 2.216 -10.977 -5.521 1.00 0.00 N ATOM 1452 CA GLY B 76 1.172 -10.369 -6.365 1.00 0.00 C ATOM 1453 C GLY B 76 -0.149 -11.058 -6.084 1.00 0.00 C ATOM 1454 O GLY B 76 -0.201 -12.177 -5.620 1.00 0.00 O ATOM 0 H GLY B 76 2.680 -11.791 -5.924 1.00 0.00 H new ATOM 0 HA2 GLY B 76 1.093 -9.302 -6.157 1.00 0.00 H new ATOM 0 HA3 GLY B 76 1.433 -10.469 -7.419 1.00 0.00 H new ATOM 1458 N LEU B 77 -1.213 -10.381 -6.347 1.00 0.00 N ATOM 1459 CA LEU B 77 -2.552 -10.953 -6.089 1.00 0.00 C ATOM 1460 C LEU B 77 -3.319 -11.106 -7.396 1.00 0.00 C ATOM 1461 O LEU B 77 -3.591 -10.152 -8.097 1.00 0.00 O ATOM 1462 CB LEU B 77 -3.244 -9.938 -5.180 1.00 0.00 C ATOM 1463 CG LEU B 77 -2.669 -10.035 -3.765 1.00 0.00 C ATOM 1464 CD1 LEU B 77 -2.952 -11.425 -3.195 1.00 0.00 C ATOM 1465 CD2 LEU B 77 -1.155 -9.801 -3.805 1.00 0.00 C ATOM 0 H LEU B 77 -1.216 -9.438 -6.737 1.00 0.00 H new ATOM 0 HA LEU B 77 -2.499 -11.942 -5.634 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -3.104 -8.930 -5.571 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -4.317 -10.126 -5.160 1.00 0.00 H new ATOM 0 HG LEU B 77 -3.135 -9.278 -3.134 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -2.543 -11.495 -2.187 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -4.029 -11.592 -3.162 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -2.487 -12.180 -3.829 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -0.749 -9.871 -2.796 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -0.687 -10.555 -4.437 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -0.951 -8.810 -4.210 1.00 0.00 H new ATOM 1477 N ALA B 78 -3.670 -12.307 -7.708 1.00 0.00 N ATOM 1478 CA ALA B 78 -4.433 -12.580 -8.959 1.00 0.00 C ATOM 1479 C ALA B 78 -5.782 -13.220 -8.613 1.00 0.00 C ATOM 1480 O ALA B 78 -5.933 -13.844 -7.583 1.00 0.00 O ATOM 1481 CB ALA B 78 -3.563 -13.554 -9.752 1.00 0.00 C ATOM 0 H ALA B 78 -3.461 -13.132 -7.146 1.00 0.00 H new ATOM 0 HA ALA B 78 -4.642 -11.673 -9.527 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -4.059 -13.804 -10.690 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -2.599 -13.092 -9.963 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -3.410 -14.462 -9.169 1.00 0.00 H new ATOM 1487 N PHE B 79 -6.762 -13.069 -9.459 1.00 0.00 N ATOM 1488 CA PHE B 79 -8.095 -13.671 -9.164 1.00 0.00 C ATOM 1489 C PHE B 79 -8.748 -14.176 -10.454 1.00 0.00 C ATOM 1490 O PHE B 79 -8.467 -13.695 -11.533 1.00 0.00 O ATOM 1491 CB PHE B 79 -8.918 -12.535 -8.558 1.00 0.00 C ATOM 1492 CG PHE B 79 -8.185 -11.956 -7.372 1.00 0.00 C ATOM 1493 CD1 PHE B 79 -8.230 -12.609 -6.135 1.00 0.00 C ATOM 1494 CD2 PHE B 79 -7.462 -10.764 -7.510 1.00 0.00 C ATOM 1495 CE1 PHE B 79 -7.551 -12.071 -5.035 1.00 0.00 C ATOM 1496 CE2 PHE B 79 -6.784 -10.226 -6.409 1.00 0.00 C ATOM 1497 CZ PHE B 79 -6.828 -10.879 -5.172 1.00 0.00 C ATOM 0 H PHE B 79 -6.700 -12.557 -10.339 1.00 0.00 H new ATOM 0 HA PHE B 79 -8.020 -14.525 -8.491 1.00 0.00 H new ATOM 0 HB2 PHE B 79 -9.092 -11.760 -9.305 1.00 0.00 H new ATOM 0 HB3 PHE B 79 -9.896 -12.905 -8.249 1.00 0.00 H new ATOM 0 HD1 PHE B 79 -8.788 -13.527 -6.029 1.00 0.00 H new ATOM 0 HD2 PHE B 79 -7.428 -10.260 -8.465 1.00 0.00 H new ATOM 0 HE1 PHE B 79 -7.585 -12.575 -4.081 1.00 0.00 H new ATOM 0 HE2 PHE B 79 -6.227 -9.307 -6.515 1.00 0.00 H new ATOM 0 HZ PHE B 79 -6.305 -10.464 -4.323 1.00 0.00 H new ATOM 1507 N ARG B 80 -9.619 -15.141 -10.348 1.00 0.00 N ATOM 1508 CA ARG B 80 -10.293 -15.675 -11.565 1.00 0.00 C ATOM 1509 C ARG B 80 -11.793 -15.370 -11.514 1.00 0.00 C ATOM 1510 O ARG B 80 -12.461 -15.660 -10.542 1.00 0.00 O ATOM 1511 CB ARG B 80 -10.052 -17.184 -11.522 1.00 0.00 C ATOM 1512 CG ARG B 80 -9.172 -17.597 -12.704 1.00 0.00 C ATOM 1513 CD ARG B 80 -9.603 -18.977 -13.203 1.00 0.00 C ATOM 1514 NE ARG B 80 -8.407 -19.845 -13.013 1.00 0.00 N ATOM 1515 CZ ARG B 80 -8.533 -21.144 -13.026 1.00 0.00 C ATOM 1516 NH1 ARG B 80 -9.707 -21.686 -13.206 1.00 0.00 N ATOM 1517 NH2 ARG B 80 -7.483 -21.902 -12.860 1.00 0.00 N ATOM 0 H ARG B 80 -9.893 -15.583 -9.471 1.00 0.00 H new ATOM 0 HA ARG B 80 -9.908 -15.227 -12.481 1.00 0.00 H new ATOM 0 HB2 ARG B 80 -9.571 -17.459 -10.584 1.00 0.00 H new ATOM 0 HB3 ARG B 80 -11.003 -17.716 -11.560 1.00 0.00 H new ATOM 0 HG2 ARG B 80 -9.257 -16.865 -13.507 1.00 0.00 H new ATOM 0 HG3 ARG B 80 -8.125 -17.619 -12.402 1.00 0.00 H new ATOM 0 HD2 ARG B 80 -10.457 -19.352 -12.639 1.00 0.00 H new ATOM 0 HD3 ARG B 80 -9.903 -18.942 -14.250 1.00 0.00 H new ATOM 0 HE ARG B 80 -7.489 -19.424 -12.873 1.00 0.00 H new ATOM 0 HH11 ARG B 80 -10.527 -21.094 -13.337 1.00 0.00 H new ATOM 0 HH12 ARG B 80 -9.804 -22.701 -13.216 1.00 0.00 H new ATOM 0 HH21 ARG B 80 -6.565 -21.479 -12.720 1.00 0.00 H new ATOM 0 HH22 ARG B 80 -7.580 -22.917 -12.870 1.00 0.00 H new ATOM 1599 N GLU B 86 -7.667 -11.565 -14.169 1.00 0.00 N ATOM 1600 CA GLU B 86 -7.528 -10.120 -13.828 1.00 0.00 C ATOM 1601 C GLU B 86 -6.284 -9.900 -12.965 1.00 0.00 C ATOM 1602 O GLU B 86 -5.472 -10.787 -12.791 1.00 0.00 O ATOM 1603 CB GLU B 86 -8.794 -9.775 -13.043 1.00 0.00 C ATOM 1604 CG GLU B 86 -9.043 -10.845 -11.980 1.00 0.00 C ATOM 1605 CD GLU B 86 -10.319 -11.617 -12.322 1.00 0.00 C ATOM 1606 OE1 GLU B 86 -11.379 -11.190 -11.896 1.00 0.00 O ATOM 1607 OE2 GLU B 86 -10.213 -12.624 -13.005 1.00 0.00 O ATOM 0 HA GLU B 86 -7.415 -9.494 -14.713 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -8.688 -8.798 -12.572 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -9.647 -9.713 -13.718 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -8.195 -11.528 -11.930 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -9.138 -10.382 -10.998 1.00 0.00 H new ATOM 1614 N ALA B 87 -6.127 -8.723 -12.423 1.00 0.00 N ATOM 1615 CA ALA B 87 -4.933 -8.449 -11.573 1.00 0.00 C ATOM 1616 C ALA B 87 -3.678 -9.039 -12.221 1.00 0.00 C ATOM 1617 O ALA B 87 -3.530 -9.028 -13.427 1.00 0.00 O ATOM 1618 CB ALA B 87 -5.227 -9.139 -10.241 1.00 0.00 C ATOM 0 H ALA B 87 -6.772 -7.941 -12.532 1.00 0.00 H new ATOM 0 HA ALA B 87 -4.752 -7.382 -11.445 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -4.392 -8.983 -9.558 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -6.134 -8.719 -9.806 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -5.365 -10.207 -10.407 1.00 0.00 H new ATOM 1624 N LEU B 88 -2.769 -9.543 -11.425 1.00 0.00 N ATOM 1625 CA LEU B 88 -1.510 -10.129 -11.976 1.00 0.00 C ATOM 1626 C LEU B 88 -0.502 -9.017 -12.262 1.00 0.00 C ATOM 1627 O LEU B 88 0.694 -9.223 -12.212 1.00 0.00 O ATOM 1628 CB LEU B 88 -1.906 -10.850 -13.266 1.00 0.00 C ATOM 1629 CG LEU B 88 -1.139 -12.170 -13.364 1.00 0.00 C ATOM 1630 CD1 LEU B 88 0.325 -11.942 -12.982 1.00 0.00 C ATOM 1631 CD2 LEU B 88 -1.760 -13.189 -12.405 1.00 0.00 C ATOM 0 H LEU B 88 -2.846 -9.574 -10.408 1.00 0.00 H new ATOM 0 HA LEU B 88 -1.041 -10.818 -11.274 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -2.980 -11.038 -13.276 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -1.685 -10.223 -14.129 1.00 0.00 H new ATOM 0 HG LEU B 88 -1.193 -12.546 -14.386 1.00 0.00 H new ATOM 0 HD11 LEU B 88 0.870 -12.883 -13.052 1.00 0.00 H new ATOM 0 HD12 LEU B 88 0.769 -11.214 -13.661 1.00 0.00 H new ATOM 0 HD13 LEU B 88 0.380 -11.566 -11.960 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -1.216 -14.131 -12.472 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -1.704 -12.810 -11.385 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -2.803 -13.353 -12.674 1.00 0.00 H new ATOM 1643 N CYS B 89 -0.974 -7.831 -12.526 1.00 0.00 N ATOM 1644 CA CYS B 89 -0.054 -6.702 -12.772 1.00 0.00 C ATOM 1645 C CYS B 89 -0.365 -5.647 -11.729 1.00 0.00 C ATOM 1646 O CYS B 89 -1.412 -5.035 -11.750 1.00 0.00 O ATOM 1647 CB CYS B 89 -0.383 -6.197 -14.176 1.00 0.00 C ATOM 1648 SG CYS B 89 -0.573 -7.603 -15.300 1.00 0.00 S ATOM 0 H CYS B 89 -1.966 -7.600 -12.581 1.00 0.00 H new ATOM 0 HA CYS B 89 1.001 -6.967 -12.707 1.00 0.00 H new ATOM 0 HB2 CYS B 89 -1.300 -5.609 -14.156 1.00 0.00 H new ATOM 0 HB3 CYS B 89 0.410 -5.539 -14.532 1.00 0.00 H new ATOM 0 HG CYS B 89 -0.855 -7.170 -16.493 1.00 0.00 H new ATOM 1654 N ILE B 90 0.503 -5.446 -10.794 1.00 0.00 N ATOM 1655 CA ILE B 90 0.192 -4.449 -9.747 1.00 0.00 C ATOM 1656 C ILE B 90 0.716 -3.084 -10.144 1.00 0.00 C ATOM 1657 O ILE B 90 1.902 -2.832 -10.135 1.00 0.00 O ATOM 1658 CB ILE B 90 0.912 -4.942 -8.500 1.00 0.00 C ATOM 1659 CG1 ILE B 90 0.535 -6.400 -8.238 1.00 0.00 C ATOM 1660 CG2 ILE B 90 0.501 -4.080 -7.307 1.00 0.00 C ATOM 1661 CD1 ILE B 90 1.778 -7.274 -8.385 1.00 0.00 C ATOM 0 H ILE B 90 1.402 -5.919 -10.707 1.00 0.00 H new ATOM 0 HA ILE B 90 -0.882 -4.348 -9.590 1.00 0.00 H new ATOM 0 HB ILE B 90 1.990 -4.870 -8.645 1.00 0.00 H new ATOM 0 HG12 ILE B 90 0.118 -6.506 -7.237 1.00 0.00 H new ATOM 0 HG13 ILE B 90 -0.235 -6.721 -8.940 1.00 0.00 H new ATOM 0 HG21 ILE B 90 1.014 -4.430 -6.411 1.00 0.00 H new ATOM 0 HG22 ILE B 90 0.771 -3.042 -7.498 1.00 0.00 H new ATOM 0 HG23 ILE B 90 -0.576 -4.153 -7.159 1.00 0.00 H new ATOM 0 HD11 ILE B 90 1.515 -8.315 -8.199 1.00 0.00 H new ATOM 0 HD12 ILE B 90 2.175 -7.175 -9.395 1.00 0.00 H new ATOM 0 HD13 ILE B 90 2.533 -6.957 -7.666 1.00 0.00 H new ATOM 1673 N GLU B 91 -0.172 -2.196 -10.472 1.00 0.00 N ATOM 1674 CA GLU B 91 0.265 -0.821 -10.850 1.00 0.00 C ATOM 1675 C GLU B 91 0.666 -0.073 -9.577 1.00 0.00 C ATOM 1676 O GLU B 91 -0.176 0.311 -8.790 1.00 0.00 O ATOM 1677 CB GLU B 91 -0.959 -0.173 -11.499 1.00 0.00 C ATOM 1678 CG GLU B 91 -0.520 1.030 -12.336 1.00 0.00 C ATOM 1679 CD GLU B 91 -1.755 1.760 -12.868 1.00 0.00 C ATOM 1680 OE1 GLU B 91 -2.779 1.115 -13.023 1.00 0.00 O ATOM 1681 OE2 GLU B 91 -1.655 2.952 -13.110 1.00 0.00 O ATOM 0 H GLU B 91 -1.179 -2.357 -10.496 1.00 0.00 H new ATOM 0 HA GLU B 91 1.118 -0.811 -11.529 1.00 0.00 H new ATOM 0 HB2 GLU B 91 -1.476 -0.898 -12.128 1.00 0.00 H new ATOM 0 HB3 GLU B 91 -1.665 0.144 -10.732 1.00 0.00 H new ATOM 0 HG2 GLU B 91 0.083 1.707 -11.731 1.00 0.00 H new ATOM 0 HG3 GLU B 91 0.106 0.700 -13.165 1.00 0.00 H new ATOM 1688 N PRO B 92 1.952 0.074 -9.401 1.00 0.00 N ATOM 1689 CA PRO B 92 2.490 0.734 -8.198 1.00 0.00 C ATOM 1690 C PRO B 92 2.668 2.237 -8.412 1.00 0.00 C ATOM 1691 O PRO B 92 2.227 2.800 -9.394 1.00 0.00 O ATOM 1692 CB PRO B 92 3.848 0.060 -8.027 1.00 0.00 C ATOM 1693 CG PRO B 92 4.243 -0.424 -9.397 1.00 0.00 C ATOM 1694 CD PRO B 92 3.026 -0.355 -10.293 1.00 0.00 C ATOM 0 HA PRO B 92 1.833 0.638 -7.334 1.00 0.00 H new ATOM 0 HB2 PRO B 92 4.585 0.760 -7.632 1.00 0.00 H new ATOM 0 HB3 PRO B 92 3.787 -0.769 -7.322 1.00 0.00 H new ATOM 0 HG2 PRO B 92 5.047 0.192 -9.800 1.00 0.00 H new ATOM 0 HG3 PRO B 92 4.619 -1.446 -9.345 1.00 0.00 H new ATOM 0 HD2 PRO B 92 3.172 0.352 -11.110 1.00 0.00 H new ATOM 0 HD3 PRO B 92 2.807 -1.323 -10.744 1.00 0.00 H new ATOM 1702 N PHE B 93 3.320 2.882 -7.486 1.00 0.00 N ATOM 1703 CA PHE B 93 3.553 4.351 -7.602 1.00 0.00 C ATOM 1704 C PHE B 93 4.264 4.673 -8.919 1.00 0.00 C ATOM 1705 O PHE B 93 4.228 3.903 -9.859 1.00 0.00 O ATOM 1706 CB PHE B 93 4.447 4.700 -6.407 1.00 0.00 C ATOM 1707 CG PHE B 93 5.493 3.625 -6.231 1.00 0.00 C ATOM 1708 CD1 PHE B 93 6.583 3.559 -7.105 1.00 0.00 C ATOM 1709 CD2 PHE B 93 5.369 2.690 -5.194 1.00 0.00 C ATOM 1710 CE1 PHE B 93 7.550 2.558 -6.945 1.00 0.00 C ATOM 1711 CE2 PHE B 93 6.336 1.691 -5.034 1.00 0.00 C ATOM 1712 CZ PHE B 93 7.427 1.625 -5.910 1.00 0.00 C ATOM 0 H PHE B 93 3.706 2.452 -6.645 1.00 0.00 H new ATOM 0 HA PHE B 93 2.624 4.921 -7.599 1.00 0.00 H new ATOM 0 HB2 PHE B 93 4.926 5.666 -6.567 1.00 0.00 H new ATOM 0 HB3 PHE B 93 3.845 4.789 -5.502 1.00 0.00 H new ATOM 0 HD1 PHE B 93 6.679 4.280 -7.903 1.00 0.00 H new ATOM 0 HD2 PHE B 93 4.528 2.741 -4.519 1.00 0.00 H new ATOM 0 HE1 PHE B 93 8.391 2.507 -7.621 1.00 0.00 H new ATOM 0 HE2 PHE B 93 6.241 0.971 -4.235 1.00 0.00 H new ATOM 0 HZ PHE B 93 8.173 0.854 -5.786 1.00 0.00 H new ATOM 2071 N MET C 17 -5.702 -4.616 14.531 1.00 0.00 N ATOM 2072 CA MET C 17 -6.398 -3.545 13.762 1.00 0.00 C ATOM 2073 C MET C 17 -5.616 -3.220 12.487 1.00 0.00 C ATOM 2074 O MET C 17 -4.431 -3.471 12.395 1.00 0.00 O ATOM 2075 CB MET C 17 -6.424 -2.336 14.699 1.00 0.00 C ATOM 2076 CG MET C 17 -7.518 -2.528 15.751 1.00 0.00 C ATOM 2077 SD MET C 17 -8.702 -1.162 15.646 1.00 0.00 S ATOM 2078 CE MET C 17 -10.205 -2.146 15.861 1.00 0.00 C ATOM 0 HA MET C 17 -7.401 -3.842 13.454 1.00 0.00 H new ATOM 0 HB2 MET C 17 -5.455 -2.218 15.184 1.00 0.00 H new ATOM 0 HB3 MET C 17 -6.608 -1.425 14.129 1.00 0.00 H new ATOM 0 HG2 MET C 17 -8.028 -3.478 15.592 1.00 0.00 H new ATOM 0 HG3 MET C 17 -7.077 -2.566 16.747 1.00 0.00 H new ATOM 0 HE1 MET C 17 -11.076 -1.492 15.829 1.00 0.00 H new ATOM 0 HE2 MET C 17 -10.275 -2.883 15.061 1.00 0.00 H new ATOM 0 HE3 MET C 17 -10.171 -2.657 16.823 1.00 0.00 H new ATOM 2088 N TYR C 18 -6.269 -2.667 11.503 1.00 0.00 N ATOM 2089 CA TYR C 18 -5.559 -2.332 10.236 1.00 0.00 C ATOM 2090 C TYR C 18 -5.919 -0.916 9.780 1.00 0.00 C ATOM 2091 O TYR C 18 -7.017 -0.443 10.000 1.00 0.00 O ATOM 2092 CB TYR C 18 -6.056 -3.361 9.219 1.00 0.00 C ATOM 2093 CG TYR C 18 -4.879 -4.089 8.614 1.00 0.00 C ATOM 2094 CD1 TYR C 18 -3.655 -3.429 8.454 1.00 0.00 C ATOM 2095 CD2 TYR C 18 -5.013 -5.423 8.214 1.00 0.00 C ATOM 2096 CE1 TYR C 18 -2.564 -4.104 7.894 1.00 0.00 C ATOM 2097 CE2 TYR C 18 -3.922 -6.098 7.654 1.00 0.00 C ATOM 2098 CZ TYR C 18 -2.698 -5.439 7.494 1.00 0.00 C ATOM 2099 OH TYR C 18 -1.623 -6.104 6.943 1.00 0.00 O ATOM 0 H TYR C 18 -7.262 -2.433 11.521 1.00 0.00 H new ATOM 0 HA TYR C 18 -4.476 -2.361 10.354 1.00 0.00 H new ATOM 0 HB2 TYR C 18 -6.725 -4.072 9.704 1.00 0.00 H new ATOM 0 HB3 TYR C 18 -6.630 -2.865 8.437 1.00 0.00 H new ATOM 0 HD1 TYR C 18 -3.552 -2.399 8.763 1.00 0.00 H new ATOM 0 HD2 TYR C 18 -5.958 -5.932 8.337 1.00 0.00 H new ATOM 0 HE1 TYR C 18 -1.619 -3.595 7.771 1.00 0.00 H new ATOM 0 HE2 TYR C 18 -4.025 -7.128 7.345 1.00 0.00 H new ATOM 0 HH TYR C 18 -0.951 -5.454 6.651 1.00 0.00 H new ATOM 2109 N VAL C 19 -5.004 -0.239 9.142 1.00 0.00 N ATOM 2110 CA VAL C 19 -5.296 1.144 8.666 1.00 0.00 C ATOM 2111 C VAL C 19 -4.826 1.305 7.214 1.00 0.00 C ATOM 2112 O VAL C 19 -3.778 0.820 6.835 1.00 0.00 O ATOM 2113 CB VAL C 19 -4.515 2.062 9.616 1.00 0.00 C ATOM 2114 CG1 VAL C 19 -3.225 2.550 8.948 1.00 0.00 C ATOM 2115 CG2 VAL C 19 -5.385 3.267 9.978 1.00 0.00 C ATOM 0 H VAL C 19 -4.067 -0.583 8.930 1.00 0.00 H new ATOM 0 HA VAL C 19 -6.360 1.380 8.674 1.00 0.00 H new ATOM 0 HB VAL C 19 -4.256 1.504 10.515 1.00 0.00 H new ATOM 0 HG11 VAL C 19 -2.683 3.200 9.635 1.00 0.00 H new ATOM 0 HG12 VAL C 19 -2.602 1.693 8.691 1.00 0.00 H new ATOM 0 HG13 VAL C 19 -3.471 3.104 8.042 1.00 0.00 H new ATOM 0 HG21 VAL C 19 -4.835 3.923 10.653 1.00 0.00 H new ATOM 0 HG22 VAL C 19 -5.644 3.814 9.072 1.00 0.00 H new ATOM 0 HG23 VAL C 19 -6.296 2.924 10.468 1.00 0.00 H new ATOM 2125 N LYS C 20 -5.599 1.965 6.394 1.00 0.00 N ATOM 2126 CA LYS C 20 -5.203 2.137 4.973 1.00 0.00 C ATOM 2127 C LYS C 20 -4.692 3.558 4.716 1.00 0.00 C ATOM 2128 O LYS C 20 -5.276 4.529 5.152 1.00 0.00 O ATOM 2129 CB LYS C 20 -6.481 1.876 4.176 1.00 0.00 C ATOM 2130 CG LYS C 20 -7.704 2.377 4.947 1.00 0.00 C ATOM 2131 CD LYS C 20 -8.925 2.364 4.026 1.00 0.00 C ATOM 2132 CE LYS C 20 -9.695 1.055 4.217 1.00 0.00 C ATOM 2133 NZ LYS C 20 -10.896 1.186 3.346 1.00 0.00 N ATOM 0 H LYS C 20 -6.489 2.392 6.651 1.00 0.00 H new ATOM 0 HA LYS C 20 -4.394 1.463 4.692 1.00 0.00 H new ATOM 0 HB2 LYS C 20 -6.423 2.377 3.210 1.00 0.00 H new ATOM 0 HB3 LYS C 20 -6.581 0.809 3.977 1.00 0.00 H new ATOM 0 HG2 LYS C 20 -7.884 1.745 5.816 1.00 0.00 H new ATOM 0 HG3 LYS C 20 -7.525 3.386 5.318 1.00 0.00 H new ATOM 0 HD2 LYS C 20 -9.570 3.214 4.248 1.00 0.00 H new ATOM 0 HD3 LYS C 20 -8.611 2.465 2.987 1.00 0.00 H new ATOM 0 HE2 LYS C 20 -9.090 0.195 3.929 1.00 0.00 H new ATOM 0 HE3 LYS C 20 -9.977 0.911 5.260 1.00 0.00 H new ATOM 0 HZ1 LYS C 20 -11.476 0.326 3.422 1.00 0.00 H new ATOM 0 HZ2 LYS C 20 -11.456 2.009 3.648 1.00 0.00 H new ATOM 0 HZ3 LYS C 20 -10.596 1.315 2.359 1.00 0.00 H new ATOM 2147 N LEU C 21 -3.608 3.683 3.998 1.00 0.00 N ATOM 2148 CA LEU C 21 -3.059 5.038 3.695 1.00 0.00 C ATOM 2149 C LEU C 21 -3.171 5.310 2.192 1.00 0.00 C ATOM 2150 O LEU C 21 -2.761 4.508 1.376 1.00 0.00 O ATOM 2151 CB LEU C 21 -1.586 4.999 4.123 1.00 0.00 C ATOM 2152 CG LEU C 21 -1.357 3.877 5.141 1.00 0.00 C ATOM 2153 CD1 LEU C 21 0.119 3.831 5.536 1.00 0.00 C ATOM 2154 CD2 LEU C 21 -2.204 4.135 6.387 1.00 0.00 C ATOM 0 H LEU C 21 -3.078 2.904 3.607 1.00 0.00 H new ATOM 0 HA LEU C 21 -3.601 5.827 4.217 1.00 0.00 H new ATOM 0 HB2 LEU C 21 -0.951 4.843 3.251 1.00 0.00 H new ATOM 0 HB3 LEU C 21 -1.301 5.957 4.558 1.00 0.00 H new ATOM 0 HG LEU C 21 -1.643 2.925 4.694 1.00 0.00 H new ATOM 0 HD11 LEU C 21 0.277 3.032 6.260 1.00 0.00 H new ATOM 0 HD12 LEU C 21 0.727 3.644 4.651 1.00 0.00 H new ATOM 0 HD13 LEU C 21 0.407 4.784 5.979 1.00 0.00 H new ATOM 0 HD21 LEU C 21 -2.040 3.336 7.110 1.00 0.00 H new ATOM 0 HD22 LEU C 21 -1.919 5.089 6.830 1.00 0.00 H new ATOM 0 HD23 LEU C 21 -3.258 4.164 6.111 1.00 0.00 H new ATOM 2166 N ILE C 22 -3.728 6.429 1.819 1.00 0.00 N ATOM 2167 CA ILE C 22 -3.870 6.741 0.371 1.00 0.00 C ATOM 2168 C ILE C 22 -2.986 7.931 -0.005 1.00 0.00 C ATOM 2169 O ILE C 22 -2.842 8.875 0.746 1.00 0.00 O ATOM 2170 CB ILE C 22 -5.346 7.092 0.190 1.00 0.00 C ATOM 2171 CG1 ILE C 22 -6.148 5.812 -0.057 1.00 0.00 C ATOM 2172 CG2 ILE C 22 -5.509 8.033 -1.003 1.00 0.00 C ATOM 2173 CD1 ILE C 22 -7.560 5.983 0.503 1.00 0.00 C ATOM 0 H ILE C 22 -4.090 7.140 2.455 1.00 0.00 H new ATOM 0 HA ILE C 22 -3.565 5.909 -0.264 1.00 0.00 H new ATOM 0 HB ILE C 22 -5.713 7.584 1.091 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -6.192 5.597 -1.125 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -5.656 4.964 0.419 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -6.563 8.281 -1.129 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -4.940 8.946 -0.827 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -5.141 7.544 -1.905 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -8.133 5.073 0.328 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -7.506 6.178 1.574 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -8.049 6.821 0.006 1.00 0.00 H new ATOM 2185 N SER C 23 -2.401 7.893 -1.167 1.00 0.00 N ATOM 2186 CA SER C 23 -1.533 9.020 -1.606 1.00 0.00 C ATOM 2187 C SER C 23 -2.244 9.826 -2.693 1.00 0.00 C ATOM 2188 O SER C 23 -2.998 9.291 -3.481 1.00 0.00 O ATOM 2189 CB SER C 23 -0.274 8.359 -2.164 1.00 0.00 C ATOM 2190 OG SER C 23 -0.581 7.033 -2.570 1.00 0.00 O ATOM 0 H SER C 23 -2.486 7.127 -1.835 1.00 0.00 H new ATOM 0 HA SER C 23 -1.300 9.709 -0.794 1.00 0.00 H new ATOM 0 HB2 SER C 23 0.107 8.932 -3.010 1.00 0.00 H new ATOM 0 HB3 SER C 23 0.511 8.348 -1.407 1.00 0.00 H new ATOM 0 HG SER C 23 -0.577 6.442 -1.788 1.00 0.00 H new ATOM 2196 N SER C 24 -2.014 11.108 -2.742 1.00 0.00 N ATOM 2197 CA SER C 24 -2.683 11.940 -3.781 1.00 0.00 C ATOM 2198 C SER C 24 -1.899 11.883 -5.092 1.00 0.00 C ATOM 2199 O SER C 24 -2.089 12.694 -5.977 1.00 0.00 O ATOM 2200 CB SER C 24 -2.676 13.358 -3.214 1.00 0.00 C ATOM 2201 OG SER C 24 -3.574 13.428 -2.115 1.00 0.00 O ATOM 0 H SER C 24 -1.394 11.615 -2.110 1.00 0.00 H new ATOM 0 HA SER C 24 -3.692 11.593 -4.001 1.00 0.00 H new ATOM 0 HB2 SER C 24 -1.670 13.629 -2.894 1.00 0.00 H new ATOM 0 HB3 SER C 24 -2.969 14.072 -3.984 1.00 0.00 H new ATOM 0 HG SER C 24 -3.212 12.914 -1.363 1.00 0.00 H new ATOM 2207 N ASP C 25 -1.018 10.933 -5.225 1.00 0.00 N ATOM 2208 CA ASP C 25 -0.225 10.827 -6.482 1.00 0.00 C ATOM 2209 C ASP C 25 0.418 9.444 -6.587 1.00 0.00 C ATOM 2210 O ASP C 25 1.377 9.249 -7.308 1.00 0.00 O ATOM 2211 CB ASP C 25 0.849 11.909 -6.362 1.00 0.00 C ATOM 2212 CG ASP C 25 0.655 12.946 -7.469 1.00 0.00 C ATOM 2213 OD1 ASP C 25 -0.430 12.996 -8.023 1.00 0.00 O ATOM 2214 OD2 ASP C 25 1.596 13.671 -7.746 1.00 0.00 O ATOM 0 H ASP C 25 -0.812 10.226 -4.519 1.00 0.00 H new ATOM 0 HA ASP C 25 -0.841 10.958 -7.372 1.00 0.00 H new ATOM 0 HB2 ASP C 25 0.789 12.389 -5.385 1.00 0.00 H new ATOM 0 HB3 ASP C 25 1.840 11.462 -6.437 1.00 0.00 H new ATOM 2219 N GLY C 26 -0.098 8.478 -5.876 1.00 0.00 N ATOM 2220 CA GLY C 26 0.497 7.114 -5.945 1.00 0.00 C ATOM 2221 C GLY C 26 -0.614 6.064 -5.922 1.00 0.00 C ATOM 2222 O GLY C 26 -0.952 5.483 -6.934 1.00 0.00 O ATOM 0 H GLY C 26 -0.901 8.574 -5.254 1.00 0.00 H new ATOM 0 HA2 GLY C 26 1.089 7.011 -6.854 1.00 0.00 H new ATOM 0 HA3 GLY C 26 1.174 6.959 -5.105 1.00 0.00 H new ATOM 2226 N HIS C 27 -1.182 5.819 -4.776 1.00 0.00 N ATOM 2227 CA HIS C 27 -2.272 4.802 -4.679 1.00 0.00 C ATOM 2228 C HIS C 27 -2.690 4.628 -3.216 1.00 0.00 C ATOM 2229 O HIS C 27 -3.026 5.583 -2.543 1.00 0.00 O ATOM 2230 CB HIS C 27 -1.661 3.511 -5.226 1.00 0.00 C ATOM 2231 CG HIS C 27 -0.387 3.204 -4.487 1.00 0.00 C ATOM 2232 ND1 HIS C 27 -0.258 2.095 -3.666 1.00 0.00 N ATOM 2233 CD2 HIS C 27 0.823 3.851 -4.437 1.00 0.00 C ATOM 2234 CE1 HIS C 27 0.990 2.108 -3.161 1.00 0.00 C ATOM 2235 NE2 HIS C 27 1.691 3.156 -3.599 1.00 0.00 N ATOM 0 H HIS C 27 -0.940 6.279 -3.898 1.00 0.00 H new ATOM 0 HA HIS C 27 -3.164 5.091 -5.234 1.00 0.00 H new ATOM 0 HB2 HIS C 27 -2.366 2.687 -5.114 1.00 0.00 H new ATOM 0 HB3 HIS C 27 -1.459 3.615 -6.292 1.00 0.00 H new ATOM 0 HD2 HIS C 27 1.065 4.760 -4.967 1.00 0.00 H new ATOM 0 HE1 HIS C 27 1.377 1.361 -2.484 1.00 0.00 H new ATOM 0 HE2 HIS C 27 2.655 3.396 -3.369 1.00 0.00 H new ATOM 2243 N GLU C 28 -2.671 3.422 -2.712 1.00 0.00 N ATOM 2244 CA GLU C 28 -3.065 3.213 -1.291 1.00 0.00 C ATOM 2245 C GLU C 28 -2.234 2.100 -0.655 1.00 0.00 C ATOM 2246 O GLU C 28 -1.735 1.213 -1.319 1.00 0.00 O ATOM 2247 CB GLU C 28 -4.538 2.817 -1.330 1.00 0.00 C ATOM 2248 CG GLU C 28 -4.939 2.202 0.012 1.00 0.00 C ATOM 2249 CD GLU C 28 -6.401 1.753 -0.048 1.00 0.00 C ATOM 2250 OE1 GLU C 28 -6.791 1.210 -1.068 1.00 0.00 O ATOM 2251 OE2 GLU C 28 -7.104 1.960 0.927 1.00 0.00 O ATOM 0 H GLU C 28 -2.402 2.579 -3.220 1.00 0.00 H new ATOM 0 HA GLU C 28 -2.899 4.110 -0.695 1.00 0.00 H new ATOM 0 HB2 GLU C 28 -5.155 3.691 -1.540 1.00 0.00 H new ATOM 0 HB3 GLU C 28 -4.712 2.103 -2.135 1.00 0.00 H new ATOM 0 HG2 GLU C 28 -4.296 1.352 0.241 1.00 0.00 H new ATOM 0 HG3 GLU C 28 -4.804 2.929 0.812 1.00 0.00 H new ATOM 2258 N PHE C 29 -2.098 2.151 0.635 1.00 0.00 N ATOM 2259 CA PHE C 29 -1.315 1.113 1.365 1.00 0.00 C ATOM 2260 C PHE C 29 -1.982 0.834 2.710 1.00 0.00 C ATOM 2261 O PHE C 29 -2.416 1.738 3.390 1.00 0.00 O ATOM 2262 CB PHE C 29 0.071 1.726 1.566 1.00 0.00 C ATOM 2263 CG PHE C 29 1.122 0.792 1.015 1.00 0.00 C ATOM 2264 CD1 PHE C 29 1.453 -0.378 1.709 1.00 0.00 C ATOM 2265 CD2 PHE C 29 1.764 1.096 -0.191 1.00 0.00 C ATOM 2266 CE1 PHE C 29 2.427 -1.243 1.197 1.00 0.00 C ATOM 2267 CE2 PHE C 29 2.738 0.231 -0.703 1.00 0.00 C ATOM 2268 CZ PHE C 29 3.070 -0.939 -0.009 1.00 0.00 C ATOM 0 H PHE C 29 -2.501 2.877 1.227 1.00 0.00 H new ATOM 0 HA PHE C 29 -1.258 0.168 0.825 1.00 0.00 H new ATOM 0 HB2 PHE C 29 0.129 2.692 1.064 1.00 0.00 H new ATOM 0 HB3 PHE C 29 0.250 1.906 2.626 1.00 0.00 H new ATOM 0 HD1 PHE C 29 0.957 -0.613 2.639 1.00 0.00 H new ATOM 0 HD2 PHE C 29 1.508 1.998 -0.727 1.00 0.00 H new ATOM 0 HE1 PHE C 29 2.683 -2.145 1.732 1.00 0.00 H new ATOM 0 HE2 PHE C 29 3.234 0.466 -1.633 1.00 0.00 H new ATOM 0 HZ PHE C 29 3.822 -1.607 -0.404 1.00 0.00 H new ATOM 2278 N ILE C 30 -2.082 -0.402 3.101 1.00 0.00 N ATOM 2279 CA ILE C 30 -2.735 -0.702 4.405 1.00 0.00 C ATOM 2280 C ILE C 30 -1.699 -1.156 5.433 1.00 0.00 C ATOM 2281 O ILE C 30 -0.989 -2.121 5.235 1.00 0.00 O ATOM 2282 CB ILE C 30 -3.721 -1.825 4.106 1.00 0.00 C ATOM 2283 CG1 ILE C 30 -4.534 -1.472 2.855 1.00 0.00 C ATOM 2284 CG2 ILE C 30 -4.668 -2.001 5.295 1.00 0.00 C ATOM 2285 CD1 ILE C 30 -4.071 -2.332 1.676 1.00 0.00 C ATOM 0 H ILE C 30 -1.744 -1.212 2.581 1.00 0.00 H new ATOM 0 HA ILE C 30 -3.229 0.174 4.825 1.00 0.00 H new ATOM 0 HB ILE C 30 -3.174 -2.752 3.935 1.00 0.00 H new ATOM 0 HG12 ILE C 30 -5.595 -1.636 3.042 1.00 0.00 H new ATOM 0 HG13 ILE C 30 -4.411 -0.415 2.617 1.00 0.00 H new ATOM 0 HG21 ILE C 30 -5.374 -2.804 5.082 1.00 0.00 H new ATOM 0 HG22 ILE C 30 -4.091 -2.251 6.186 1.00 0.00 H new ATOM 0 HG23 ILE C 30 -5.214 -1.073 5.465 1.00 0.00 H new ATOM 0 HD11 ILE C 30 -4.652 -2.077 0.790 1.00 0.00 H new ATOM 0 HD12 ILE C 30 -3.014 -2.146 1.483 1.00 0.00 H new ATOM 0 HD13 ILE C 30 -4.217 -3.386 1.915 1.00 0.00 H new ATOM 2297 N VAL C 31 -1.617 -0.465 6.534 1.00 0.00 N ATOM 2298 CA VAL C 31 -0.637 -0.850 7.589 1.00 0.00 C ATOM 2299 C VAL C 31 -1.372 -1.135 8.902 1.00 0.00 C ATOM 2300 O VAL C 31 -2.464 -0.656 9.130 1.00 0.00 O ATOM 2301 CB VAL C 31 0.284 0.361 7.739 1.00 0.00 C ATOM 2302 CG1 VAL C 31 0.909 0.700 6.386 1.00 0.00 C ATOM 2303 CG2 VAL C 31 -0.525 1.559 8.240 1.00 0.00 C ATOM 0 H VAL C 31 -2.187 0.352 6.751 1.00 0.00 H new ATOM 0 HA VAL C 31 -0.080 -1.750 7.331 1.00 0.00 H new ATOM 0 HB VAL C 31 1.072 0.129 8.455 1.00 0.00 H new ATOM 0 HG11 VAL C 31 1.565 1.563 6.494 1.00 0.00 H new ATOM 0 HG12 VAL C 31 1.487 -0.152 6.028 1.00 0.00 H new ATOM 0 HG13 VAL C 31 0.121 0.931 5.669 1.00 0.00 H new ATOM 0 HG21 VAL C 31 0.132 2.422 8.347 1.00 0.00 H new ATOM 0 HG22 VAL C 31 -1.314 1.790 7.525 1.00 0.00 H new ATOM 0 HG23 VAL C 31 -0.970 1.319 9.206 1.00 0.00 H new ATOM 2313 N LYS C 32 -0.783 -1.917 9.764 1.00 0.00 N ATOM 2314 CA LYS C 32 -1.453 -2.240 11.057 1.00 0.00 C ATOM 2315 C LYS C 32 -1.434 -1.022 11.984 1.00 0.00 C ATOM 2316 O LYS C 32 -0.508 -0.235 11.970 1.00 0.00 O ATOM 2317 CB LYS C 32 -0.627 -3.379 11.654 1.00 0.00 C ATOM 2318 CG LYS C 32 -1.516 -4.609 11.851 1.00 0.00 C ATOM 2319 CD LYS C 32 -1.046 -5.387 13.082 1.00 0.00 C ATOM 2320 CE LYS C 32 -0.556 -6.773 12.655 1.00 0.00 C ATOM 2321 NZ LYS C 32 0.915 -6.748 12.891 1.00 0.00 N ATOM 0 H LYS C 32 0.132 -2.346 9.630 1.00 0.00 H new ATOM 0 HA LYS C 32 -2.498 -2.518 10.922 1.00 0.00 H new ATOM 0 HB2 LYS C 32 0.206 -3.622 10.995 1.00 0.00 H new ATOM 0 HB3 LYS C 32 -0.199 -3.070 12.608 1.00 0.00 H new ATOM 0 HG2 LYS C 32 -2.555 -4.304 11.975 1.00 0.00 H new ATOM 0 HG3 LYS C 32 -1.475 -5.246 10.967 1.00 0.00 H new ATOM 0 HD2 LYS C 32 -0.244 -4.845 13.583 1.00 0.00 H new ATOM 0 HD3 LYS C 32 -1.862 -5.483 13.798 1.00 0.00 H new ATOM 0 HE2 LYS C 32 -1.036 -7.559 13.238 1.00 0.00 H new ATOM 0 HE3 LYS C 32 -0.785 -6.968 11.607 1.00 0.00 H new ATOM 0 HZ1 LYS C 32 1.325 -7.665 12.622 1.00 0.00 H new ATOM 0 HZ2 LYS C 32 1.346 -5.994 12.318 1.00 0.00 H new ATOM 0 HZ3 LYS C 32 1.102 -6.567 13.898 1.00 0.00 H new ATOM 2335 N ARG C 33 -2.450 -0.864 12.792 1.00 0.00 N ATOM 2336 CA ARG C 33 -2.493 0.299 13.726 1.00 0.00 C ATOM 2337 C ARG C 33 -1.084 0.625 14.224 1.00 0.00 C ATOM 2338 O ARG C 33 -0.584 1.717 14.032 1.00 0.00 O ATOM 2339 CB ARG C 33 -3.380 -0.156 14.886 1.00 0.00 C ATOM 2340 CG ARG C 33 -3.581 1.006 15.862 1.00 0.00 C ATOM 2341 CD ARG C 33 -3.657 0.466 17.293 1.00 0.00 C ATOM 2342 NE ARG C 33 -3.939 1.658 18.139 1.00 0.00 N ATOM 2343 CZ ARG C 33 -5.143 2.159 18.183 1.00 0.00 C ATOM 2344 NH1 ARG C 33 -6.105 1.615 17.487 1.00 0.00 N ATOM 2345 NH2 ARG C 33 -5.388 3.206 18.925 1.00 0.00 N ATOM 0 H ARG C 33 -3.253 -1.491 12.845 1.00 0.00 H new ATOM 0 HA ARG C 33 -2.879 1.200 13.248 1.00 0.00 H new ATOM 0 HB2 ARG C 33 -4.343 -0.498 14.508 1.00 0.00 H new ATOM 0 HB3 ARG C 33 -2.921 -1.001 15.399 1.00 0.00 H new ATOM 0 HG2 ARG C 33 -2.758 1.715 15.773 1.00 0.00 H new ATOM 0 HG3 ARG C 33 -4.496 1.546 15.617 1.00 0.00 H new ATOM 0 HD2 ARG C 33 -4.443 -0.283 17.391 1.00 0.00 H new ATOM 0 HD3 ARG C 33 -2.722 -0.013 17.585 1.00 0.00 H new ATOM 0 HE ARG C 33 -3.190 2.084 18.685 1.00 0.00 H new ATOM 0 HH11 ARG C 33 -5.916 0.797 16.908 1.00 0.00 H new ATOM 0 HH12 ARG C 33 -7.046 2.008 17.523 1.00 0.00 H new ATOM 0 HH21 ARG C 33 -4.638 3.632 19.470 1.00 0.00 H new ATOM 0 HH22 ARG C 33 -6.329 3.598 18.959 1.00 0.00 H new ATOM 2359 N GLU C 34 -0.432 -0.316 14.851 1.00 0.00 N ATOM 2360 CA GLU C 34 0.949 -0.059 15.343 1.00 0.00 C ATOM 2361 C GLU C 34 1.797 0.505 14.202 1.00 0.00 C ATOM 2362 O GLU C 34 2.451 1.519 14.342 1.00 0.00 O ATOM 2363 CB GLU C 34 1.478 -1.425 15.784 1.00 0.00 C ATOM 2364 CG GLU C 34 1.845 -1.376 17.269 1.00 0.00 C ATOM 2365 CD GLU C 34 3.360 -1.521 17.426 1.00 0.00 C ATOM 2366 OE1 GLU C 34 4.056 -1.369 16.435 1.00 0.00 O ATOM 2367 OE2 GLU C 34 3.799 -1.781 18.535 1.00 0.00 O ATOM 0 H GLU C 34 -0.796 -1.249 15.043 1.00 0.00 H new ATOM 0 HA GLU C 34 0.978 0.663 16.159 1.00 0.00 H new ATOM 0 HB2 GLU C 34 0.724 -2.192 15.610 1.00 0.00 H new ATOM 0 HB3 GLU C 34 2.352 -1.697 15.192 1.00 0.00 H new ATOM 0 HG2 GLU C 34 1.512 -0.434 17.706 1.00 0.00 H new ATOM 0 HG3 GLU C 34 1.335 -2.175 17.807 1.00 0.00 H new ATOM 2374 N HIS C 35 1.773 -0.140 13.067 1.00 0.00 N ATOM 2375 CA HIS C 35 2.561 0.366 11.910 1.00 0.00 C ATOM 2376 C HIS C 35 2.232 1.842 11.681 1.00 0.00 C ATOM 2377 O HIS C 35 3.094 2.648 11.402 1.00 0.00 O ATOM 2378 CB HIS C 35 2.102 -0.480 10.722 1.00 0.00 C ATOM 2379 CG HIS C 35 3.047 -0.286 9.568 1.00 0.00 C ATOM 2380 ND1 HIS C 35 3.139 0.913 8.880 1.00 0.00 N ATOM 2381 CD2 HIS C 35 3.940 -1.134 8.962 1.00 0.00 C ATOM 2382 CE1 HIS C 35 4.058 0.756 7.910 1.00 0.00 C ATOM 2383 NE2 HIS C 35 4.578 -0.474 7.916 1.00 0.00 N ATOM 0 H HIS C 35 1.243 -0.994 12.892 1.00 0.00 H new ATOM 0 HA HIS C 35 3.638 0.292 12.064 1.00 0.00 H new ATOM 0 HB2 HIS C 35 2.068 -1.532 11.004 1.00 0.00 H new ATOM 0 HB3 HIS C 35 1.091 -0.195 10.429 1.00 0.00 H new ATOM 0 HD2 HIS C 35 4.120 -2.158 9.253 1.00 0.00 H new ATOM 0 HE1 HIS C 35 4.341 1.530 7.212 1.00 0.00 H new ATOM 0 HE2 HIS C 35 5.290 -0.849 7.289 1.00 0.00 H new ATOM 2391 N ALA C 36 0.986 2.203 11.810 1.00 0.00 N ATOM 2392 CA ALA C 36 0.597 3.627 11.614 1.00 0.00 C ATOM 2393 C ALA C 36 0.755 4.398 12.923 1.00 0.00 C ATOM 2394 O ALA C 36 0.810 5.611 12.937 1.00 0.00 O ATOM 2395 CB ALA C 36 -0.869 3.580 11.184 1.00 0.00 C ATOM 0 H ALA C 36 0.219 1.572 12.043 1.00 0.00 H new ATOM 0 HA ALA C 36 1.219 4.131 10.874 1.00 0.00 H new ATOM 0 HB1 ALA C 36 -1.232 4.594 11.019 1.00 0.00 H new ATOM 0 HB2 ALA C 36 -0.959 3.007 10.261 1.00 0.00 H new ATOM 0 HB3 ALA C 36 -1.462 3.105 11.965 1.00 0.00 H new ATOM 2401 N LEU C 37 0.842 3.703 14.023 1.00 0.00 N ATOM 2402 CA LEU C 37 1.013 4.406 15.324 1.00 0.00 C ATOM 2403 C LEU C 37 2.354 5.144 15.332 1.00 0.00 C ATOM 2404 O LEU C 37 2.632 5.940 16.207 1.00 0.00 O ATOM 2405 CB LEU C 37 0.997 3.304 16.381 1.00 0.00 C ATOM 2406 CG LEU C 37 0.639 3.907 17.740 1.00 0.00 C ATOM 2407 CD1 LEU C 37 -0.869 4.158 17.806 1.00 0.00 C ATOM 2408 CD2 LEU C 37 1.044 2.934 18.850 1.00 0.00 C ATOM 0 H LEU C 37 0.802 2.685 14.077 1.00 0.00 H new ATOM 0 HA LEU C 37 0.233 5.145 15.507 1.00 0.00 H new ATOM 0 HB2 LEU C 37 0.273 2.536 16.110 1.00 0.00 H new ATOM 0 HB3 LEU C 37 1.972 2.819 16.432 1.00 0.00 H new ATOM 0 HG LEU C 37 1.169 4.850 17.871 1.00 0.00 H new ATOM 0 HD11 LEU C 37 -1.124 4.588 18.775 1.00 0.00 H new ATOM 0 HD12 LEU C 37 -1.158 4.850 17.015 1.00 0.00 H new ATOM 0 HD13 LEU C 37 -1.401 3.215 17.676 1.00 0.00 H new ATOM 0 HD21 LEU C 37 0.790 3.362 19.820 1.00 0.00 H new ATOM 0 HD22 LEU C 37 0.513 1.991 18.719 1.00 0.00 H new ATOM 0 HD23 LEU C 37 2.118 2.755 18.803 1.00 0.00 H new ATOM 2420 N THR C 38 3.187 4.885 14.357 1.00 0.00 N ATOM 2421 CA THR C 38 4.507 5.572 14.303 1.00 0.00 C ATOM 2422 C THR C 38 4.342 6.996 13.776 1.00 0.00 C ATOM 2423 O THR C 38 5.303 7.706 13.556 1.00 0.00 O ATOM 2424 CB THR C 38 5.362 4.730 13.362 1.00 0.00 C ATOM 2425 OG1 THR C 38 4.516 3.969 12.514 1.00 0.00 O ATOM 2426 CG2 THR C 38 6.243 3.786 14.181 1.00 0.00 C ATOM 0 H THR C 38 3.008 4.228 13.598 1.00 0.00 H new ATOM 0 HA THR C 38 4.968 5.658 15.287 1.00 0.00 H new ATOM 0 HB THR C 38 5.993 5.383 12.759 1.00 0.00 H new ATOM 0 HG1 THR C 38 4.347 4.468 11.687 1.00 0.00 H new ATOM 0 HG21 THR C 38 6.854 3.184 13.509 1.00 0.00 H new ATOM 0 HG22 THR C 38 6.890 4.369 14.836 1.00 0.00 H new ATOM 0 HG23 THR C 38 5.613 3.131 14.783 1.00 0.00 H new ATOM 2434 N SER C 39 3.126 7.423 13.597 1.00 0.00 N ATOM 2435 CA SER C 39 2.878 8.802 13.114 1.00 0.00 C ATOM 2436 C SER C 39 1.970 9.518 14.109 1.00 0.00 C ATOM 2437 O SER C 39 0.804 9.200 14.241 1.00 0.00 O ATOM 2438 CB SER C 39 2.181 8.640 11.765 1.00 0.00 C ATOM 2439 OG SER C 39 0.913 9.281 11.809 1.00 0.00 O ATOM 0 H SER C 39 2.287 6.869 13.767 1.00 0.00 H new ATOM 0 HA SER C 39 3.792 9.388 13.016 1.00 0.00 H new ATOM 0 HB2 SER C 39 2.792 9.073 10.973 1.00 0.00 H new ATOM 0 HB3 SER C 39 2.058 7.582 11.531 1.00 0.00 H new ATOM 0 HG SER C 39 0.926 10.073 11.232 1.00 0.00 H new ATOM 2445 N GLY C 40 2.496 10.471 14.817 1.00 0.00 N ATOM 2446 CA GLY C 40 1.671 11.209 15.816 1.00 0.00 C ATOM 2447 C GLY C 40 0.416 11.779 15.147 1.00 0.00 C ATOM 2448 O GLY C 40 -0.354 12.489 15.764 1.00 0.00 O ATOM 0 H GLY C 40 3.467 10.775 14.749 1.00 0.00 H new ATOM 0 HA2 GLY C 40 1.387 10.541 16.629 1.00 0.00 H new ATOM 0 HA3 GLY C 40 2.256 12.016 16.256 1.00 0.00 H new ATOM 2452 N THR C 41 0.193 11.475 13.896 1.00 0.00 N ATOM 2453 CA THR C 41 -1.018 12.004 13.209 1.00 0.00 C ATOM 2454 C THR C 41 -1.999 10.866 12.925 1.00 0.00 C ATOM 2455 O THR C 41 -3.190 10.994 13.132 1.00 0.00 O ATOM 2456 CB THR C 41 -0.505 12.609 11.903 1.00 0.00 C ATOM 2457 OG1 THR C 41 0.114 13.857 12.175 1.00 0.00 O ATOM 2458 CG2 THR C 41 -1.674 12.816 10.938 1.00 0.00 C ATOM 0 H THR C 41 0.796 10.885 13.323 1.00 0.00 H new ATOM 0 HA THR C 41 -1.548 12.739 13.814 1.00 0.00 H new ATOM 0 HB THR C 41 0.220 11.933 11.449 1.00 0.00 H new ATOM 0 HG1 THR C 41 0.565 14.181 11.368 1.00 0.00 H new ATOM 0 HG21 THR C 41 -1.306 13.248 10.007 1.00 0.00 H new ATOM 0 HG22 THR C 41 -2.149 11.857 10.730 1.00 0.00 H new ATOM 0 HG23 THR C 41 -2.402 13.491 11.388 1.00 0.00 H new ATOM 2466 N ILE C 42 -1.509 9.750 12.459 1.00 0.00 N ATOM 2467 CA ILE C 42 -2.419 8.608 12.174 1.00 0.00 C ATOM 2468 C ILE C 42 -3.073 8.135 13.475 1.00 0.00 C ATOM 2469 O ILE C 42 -4.273 7.962 13.552 1.00 0.00 O ATOM 2470 CB ILE C 42 -1.520 7.520 11.582 1.00 0.00 C ATOM 2471 CG1 ILE C 42 -1.389 7.739 10.071 1.00 0.00 C ATOM 2472 CG2 ILE C 42 -2.133 6.143 11.842 1.00 0.00 C ATOM 2473 CD1 ILE C 42 0.089 7.879 9.700 1.00 0.00 C ATOM 0 H ILE C 42 -0.522 9.581 12.264 1.00 0.00 H new ATOM 0 HA ILE C 42 -3.226 8.872 11.490 1.00 0.00 H new ATOM 0 HB ILE C 42 -0.537 7.571 12.050 1.00 0.00 H new ATOM 0 HG12 ILE C 42 -1.832 6.902 9.532 1.00 0.00 H new ATOM 0 HG13 ILE C 42 -1.935 8.634 9.774 1.00 0.00 H new ATOM 0 HG21 ILE C 42 -1.489 5.372 11.419 1.00 0.00 H new ATOM 0 HG22 ILE C 42 -2.230 5.985 12.916 1.00 0.00 H new ATOM 0 HG23 ILE C 42 -3.117 6.089 11.377 1.00 0.00 H new ATOM 0 HD11 ILE C 42 0.181 8.035 8.625 1.00 0.00 H new ATOM 0 HD12 ILE C 42 0.518 8.731 10.228 1.00 0.00 H new ATOM 0 HD13 ILE C 42 0.623 6.971 9.982 1.00 0.00 H new ATOM 2485 N LYS C 43 -2.292 7.931 14.501 1.00 0.00 N ATOM 2486 CA LYS C 43 -2.870 7.477 15.797 1.00 0.00 C ATOM 2487 C LYS C 43 -3.843 8.530 16.336 1.00 0.00 C ATOM 2488 O LYS C 43 -4.843 8.210 16.948 1.00 0.00 O ATOM 2489 CB LYS C 43 -1.668 7.324 16.733 1.00 0.00 C ATOM 2490 CG LYS C 43 -1.246 8.697 17.259 1.00 0.00 C ATOM 2491 CD LYS C 43 0.048 8.559 18.066 1.00 0.00 C ATOM 2492 CE LYS C 43 0.388 9.898 18.722 1.00 0.00 C ATOM 2493 NZ LYS C 43 -0.277 9.855 20.054 1.00 0.00 N ATOM 0 H LYS C 43 -1.280 8.059 14.497 1.00 0.00 H new ATOM 0 HA LYS C 43 -3.430 6.547 15.700 1.00 0.00 H new ATOM 0 HB2 LYS C 43 -1.924 6.668 17.565 1.00 0.00 H new ATOM 0 HB3 LYS C 43 -0.839 6.857 16.202 1.00 0.00 H new ATOM 0 HG2 LYS C 43 -1.097 9.387 16.428 1.00 0.00 H new ATOM 0 HG3 LYS C 43 -2.034 9.117 17.884 1.00 0.00 H new ATOM 0 HD2 LYS C 43 -0.067 7.788 18.828 1.00 0.00 H new ATOM 0 HD3 LYS C 43 0.863 8.244 17.414 1.00 0.00 H new ATOM 0 HE2 LYS C 43 1.466 10.026 18.823 1.00 0.00 H new ATOM 0 HE3 LYS C 43 0.023 10.734 18.125 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 -0.089 10.741 20.565 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 -1.303 9.740 19.926 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 0.096 9.054 20.602 1.00 0.00 H new ATOM 2507 N ALA C 44 -3.557 9.786 16.115 1.00 0.00 N ATOM 2508 CA ALA C 44 -4.466 10.857 16.617 1.00 0.00 C ATOM 2509 C ALA C 44 -5.733 10.924 15.759 1.00 0.00 C ATOM 2510 O ALA C 44 -6.798 11.263 16.235 1.00 0.00 O ATOM 2511 CB ALA C 44 -3.662 12.151 16.487 1.00 0.00 C ATOM 0 H ALA C 44 -2.735 10.116 15.609 1.00 0.00 H new ATOM 0 HA ALA C 44 -4.788 10.677 17.643 1.00 0.00 H new ATOM 0 HB1 ALA C 44 -4.263 12.990 16.837 1.00 0.00 H new ATOM 0 HB2 ALA C 44 -2.756 12.078 17.088 1.00 0.00 H new ATOM 0 HB3 ALA C 44 -3.393 12.309 15.443 1.00 0.00 H new ATOM 2517 N MET C 45 -5.627 10.602 14.499 1.00 0.00 N ATOM 2518 CA MET C 45 -6.827 10.649 13.616 1.00 0.00 C ATOM 2519 C MET C 45 -7.566 9.309 13.656 1.00 0.00 C ATOM 2520 O MET C 45 -8.767 9.247 13.482 1.00 0.00 O ATOM 2521 CB MET C 45 -6.277 10.915 12.214 1.00 0.00 C ATOM 2522 CG MET C 45 -5.548 12.260 12.198 1.00 0.00 C ATOM 2523 SD MET C 45 -6.535 13.470 11.281 1.00 0.00 S ATOM 2524 CE MET C 45 -5.202 14.102 10.234 1.00 0.00 C ATOM 0 H MET C 45 -4.763 10.309 14.043 1.00 0.00 H new ATOM 0 HA MET C 45 -7.539 11.414 13.927 1.00 0.00 H new ATOM 0 HB2 MET C 45 -5.595 10.116 11.922 1.00 0.00 H new ATOM 0 HB3 MET C 45 -7.090 10.921 11.488 1.00 0.00 H new ATOM 0 HG2 MET C 45 -5.382 12.608 13.218 1.00 0.00 H new ATOM 0 HG3 MET C 45 -4.567 12.149 11.735 1.00 0.00 H new ATOM 0 HE1 MET C 45 -5.601 14.851 9.549 1.00 0.00 H new ATOM 0 HE2 MET C 45 -4.432 14.555 10.859 1.00 0.00 H new ATOM 0 HE3 MET C 45 -4.769 13.282 9.662 1.00 0.00 H new ATOM 2534 N LEU C 46 -6.859 8.235 13.881 1.00 0.00 N ATOM 2535 CA LEU C 46 -7.524 6.902 13.930 1.00 0.00 C ATOM 2536 C LEU C 46 -7.631 6.415 15.377 1.00 0.00 C ATOM 2537 O LEU C 46 -7.275 5.298 15.694 1.00 0.00 O ATOM 2538 CB LEU C 46 -6.617 5.979 13.119 1.00 0.00 C ATOM 2539 CG LEU C 46 -6.544 6.480 11.677 1.00 0.00 C ATOM 2540 CD1 LEU C 46 -5.211 6.061 11.057 1.00 0.00 C ATOM 2541 CD2 LEU C 46 -7.693 5.873 10.871 1.00 0.00 C ATOM 0 H LEU C 46 -5.850 8.223 14.033 1.00 0.00 H new ATOM 0 HA LEU C 46 -8.538 6.932 13.531 1.00 0.00 H new ATOM 0 HB2 LEU C 46 -5.620 5.953 13.558 1.00 0.00 H new ATOM 0 HB3 LEU C 46 -7.002 4.960 13.143 1.00 0.00 H new ATOM 0 HG LEU C 46 -6.623 7.567 11.665 1.00 0.00 H new ATOM 0 HD11 LEU C 46 -5.160 6.419 10.029 1.00 0.00 H new ATOM 0 HD12 LEU C 46 -4.391 6.491 11.632 1.00 0.00 H new ATOM 0 HD13 LEU C 46 -5.131 4.974 11.068 1.00 0.00 H new ATOM 0 HD21 LEU C 46 -7.643 6.229 9.842 1.00 0.00 H new ATOM 0 HD22 LEU C 46 -7.612 4.786 10.883 1.00 0.00 H new ATOM 0 HD23 LEU C 46 -8.644 6.171 11.312 1.00 0.00 H new ATOM 2697 N ASN C 58 -10.727 2.978 10.315 1.00 0.00 N ATOM 2698 CA ASN C 58 -9.252 3.142 10.462 1.00 0.00 C ATOM 2699 C ASN C 58 -8.605 3.367 9.092 1.00 0.00 C ATOM 2700 O ASN C 58 -8.079 2.454 8.485 1.00 0.00 O ATOM 2701 CB ASN C 58 -8.766 1.828 11.075 1.00 0.00 C ATOM 2702 CG ASN C 58 -8.100 2.110 12.423 1.00 0.00 C ATOM 2703 OD1 ASN C 58 -8.157 3.216 12.924 1.00 0.00 O ATOM 2704 ND2 ASN C 58 -7.464 1.149 13.036 1.00 0.00 N ATOM 0 HA ASN C 58 -8.992 4.001 11.081 1.00 0.00 H new ATOM 0 HB2 ASN C 58 -9.604 1.144 11.207 1.00 0.00 H new ATOM 0 HB3 ASN C 58 -8.060 1.340 10.403 1.00 0.00 H new ATOM 0 HD21 ASN C 58 -7.015 1.326 13.935 1.00 0.00 H new ATOM 0 HD22 ASN C 58 -7.416 0.221 12.616 1.00 0.00 H new ATOM 2711 N GLU C 59 -8.641 4.574 8.598 1.00 0.00 N ATOM 2712 CA GLU C 59 -8.028 4.846 7.268 1.00 0.00 C ATOM 2713 C GLU C 59 -7.245 6.162 7.299 1.00 0.00 C ATOM 2714 O GLU C 59 -7.550 7.063 8.054 1.00 0.00 O ATOM 2715 CB GLU C 59 -9.207 4.946 6.301 1.00 0.00 C ATOM 2716 CG GLU C 59 -10.303 5.815 6.918 1.00 0.00 C ATOM 2717 CD GLU C 59 -11.342 6.162 5.851 1.00 0.00 C ATOM 2718 OE1 GLU C 59 -11.004 6.100 4.681 1.00 0.00 O ATOM 2719 OE2 GLU C 59 -12.458 6.486 6.222 1.00 0.00 O ATOM 0 H GLU C 59 -9.066 5.380 9.056 1.00 0.00 H new ATOM 0 HA GLU C 59 -7.324 4.068 6.974 1.00 0.00 H new ATOM 0 HB2 GLU C 59 -8.879 5.375 5.354 1.00 0.00 H new ATOM 0 HB3 GLU C 59 -9.597 3.952 6.083 1.00 0.00 H new ATOM 0 HG2 GLU C 59 -10.778 5.287 7.745 1.00 0.00 H new ATOM 0 HG3 GLU C 59 -9.870 6.727 7.329 1.00 0.00 H new ATOM 2726 N VAL C 60 -6.237 6.273 6.479 1.00 0.00 N ATOM 2727 CA VAL C 60 -5.425 7.523 6.448 1.00 0.00 C ATOM 2728 C VAL C 60 -5.521 8.168 5.063 1.00 0.00 C ATOM 2729 O VAL C 60 -5.771 7.506 4.076 1.00 0.00 O ATOM 2730 CB VAL C 60 -3.992 7.077 6.736 1.00 0.00 C ATOM 2731 CG1 VAL C 60 -3.188 8.252 7.293 1.00 0.00 C ATOM 2732 CG2 VAL C 60 -4.004 5.944 7.765 1.00 0.00 C ATOM 0 H VAL C 60 -5.939 5.549 5.826 1.00 0.00 H new ATOM 0 HA VAL C 60 -5.769 8.261 7.172 1.00 0.00 H new ATOM 0 HB VAL C 60 -3.534 6.728 5.811 1.00 0.00 H new ATOM 0 HG11 VAL C 60 -2.167 7.930 7.497 1.00 0.00 H new ATOM 0 HG12 VAL C 60 -3.174 9.062 6.563 1.00 0.00 H new ATOM 0 HG13 VAL C 60 -3.649 8.603 8.216 1.00 0.00 H new ATOM 0 HG21 VAL C 60 -2.981 5.627 7.969 1.00 0.00 H new ATOM 0 HG22 VAL C 60 -4.466 6.295 8.688 1.00 0.00 H new ATOM 0 HG23 VAL C 60 -4.573 5.102 7.372 1.00 0.00 H new ATOM 2742 N ASN C 61 -5.330 9.454 4.981 1.00 0.00 N ATOM 2743 CA ASN C 61 -5.414 10.138 3.663 1.00 0.00 C ATOM 2744 C ASN C 61 -4.266 11.137 3.512 1.00 0.00 C ATOM 2745 O ASN C 61 -4.182 12.116 4.225 1.00 0.00 O ATOM 2746 CB ASN C 61 -6.760 10.864 3.680 1.00 0.00 C ATOM 2747 CG ASN C 61 -7.039 11.455 2.296 1.00 0.00 C ATOM 2748 OD1 ASN C 61 -6.260 12.236 1.788 1.00 0.00 O ATOM 2749 ND2 ASN C 61 -8.127 11.113 1.662 1.00 0.00 N ATOM 0 H ASN C 61 -5.119 10.062 5.772 1.00 0.00 H new ATOM 0 HA ASN C 61 -5.338 9.440 2.829 1.00 0.00 H new ATOM 0 HB2 ASN C 61 -7.555 10.172 3.959 1.00 0.00 H new ATOM 0 HB3 ASN C 61 -6.749 11.655 4.430 1.00 0.00 H new ATOM 0 HD21 ASN C 61 -8.323 11.502 0.740 1.00 0.00 H new ATOM 0 HD22 ASN C 61 -8.781 10.457 2.089 1.00 0.00 H new ATOM 2756 N PHE C 62 -3.386 10.892 2.587 1.00 0.00 N ATOM 2757 CA PHE C 62 -2.238 11.822 2.378 1.00 0.00 C ATOM 2758 C PHE C 62 -2.557 12.810 1.251 1.00 0.00 C ATOM 2759 O PHE C 62 -2.407 12.503 0.085 1.00 0.00 O ATOM 2760 CB PHE C 62 -1.066 10.923 1.984 1.00 0.00 C ATOM 2761 CG PHE C 62 -0.754 9.972 3.114 1.00 0.00 C ATOM 2762 CD1 PHE C 62 -0.884 10.394 4.443 1.00 0.00 C ATOM 2763 CD2 PHE C 62 -0.334 8.667 2.832 1.00 0.00 C ATOM 2764 CE1 PHE C 62 -0.594 9.510 5.489 1.00 0.00 C ATOM 2765 CE2 PHE C 62 -0.044 7.783 3.879 1.00 0.00 C ATOM 2766 CZ PHE C 62 -0.174 8.205 5.207 1.00 0.00 C ATOM 0 H PHE C 62 -3.409 10.086 1.963 1.00 0.00 H new ATOM 0 HA PHE C 62 -2.018 12.413 3.267 1.00 0.00 H new ATOM 0 HB2 PHE C 62 -1.312 10.363 1.082 1.00 0.00 H new ATOM 0 HB3 PHE C 62 -0.190 11.530 1.754 1.00 0.00 H new ATOM 0 HD1 PHE C 62 -1.208 11.401 4.661 1.00 0.00 H new ATOM 0 HD2 PHE C 62 -0.234 8.342 1.807 1.00 0.00 H new ATOM 0 HE1 PHE C 62 -0.694 9.835 6.514 1.00 0.00 H new ATOM 0 HE2 PHE C 62 0.280 6.776 3.662 1.00 0.00 H new ATOM 0 HZ PHE C 62 0.050 7.524 6.014 1.00 0.00 H new ATOM 2776 N ARG C 63 -2.992 13.993 1.590 1.00 0.00 N ATOM 2777 CA ARG C 63 -3.317 14.997 0.536 1.00 0.00 C ATOM 2778 C ARG C 63 -2.058 15.772 0.137 1.00 0.00 C ATOM 2779 O ARG C 63 -1.992 16.367 -0.920 1.00 0.00 O ATOM 2780 CB ARG C 63 -4.341 15.931 1.179 1.00 0.00 C ATOM 2781 CG ARG C 63 -4.759 17.004 0.172 1.00 0.00 C ATOM 2782 CD ARG C 63 -5.581 16.362 -0.948 1.00 0.00 C ATOM 2783 NE ARG C 63 -6.317 17.492 -1.582 1.00 0.00 N ATOM 2784 CZ ARG C 63 -6.964 17.305 -2.701 1.00 0.00 C ATOM 2785 NH1 ARG C 63 -6.969 16.129 -3.266 1.00 0.00 N ATOM 2786 NH2 ARG C 63 -7.606 18.298 -3.254 1.00 0.00 N ATOM 0 H ARG C 63 -3.136 14.308 2.549 1.00 0.00 H new ATOM 0 HA ARG C 63 -3.704 14.532 -0.371 1.00 0.00 H new ATOM 0 HB2 ARG C 63 -5.213 15.363 1.504 1.00 0.00 H new ATOM 0 HB3 ARG C 63 -3.915 16.398 2.067 1.00 0.00 H new ATOM 0 HG2 ARG C 63 -5.345 17.777 0.670 1.00 0.00 H new ATOM 0 HG3 ARG C 63 -3.877 17.491 -0.243 1.00 0.00 H new ATOM 0 HD2 ARG C 63 -4.939 15.856 -1.668 1.00 0.00 H new ATOM 0 HD3 ARG C 63 -6.269 15.614 -0.554 1.00 0.00 H new ATOM 0 HE ARG C 63 -6.315 18.412 -1.142 1.00 0.00 H new ATOM 0 HH11 ARG C 63 -6.467 15.353 -2.834 1.00 0.00 H new ATOM 0 HH12 ARG C 63 -7.475 15.985 -4.140 1.00 0.00 H new ATOM 0 HH21 ARG C 63 -7.602 19.217 -2.812 1.00 0.00 H new ATOM 0 HH22 ARG C 63 -8.112 18.155 -4.128 1.00 0.00 H new ATOM 2800 N GLU C 64 -1.058 15.768 0.975 1.00 0.00 N ATOM 2801 CA GLU C 64 0.197 16.504 0.645 1.00 0.00 C ATOM 2802 C GLU C 64 1.400 15.561 0.728 1.00 0.00 C ATOM 2803 O GLU C 64 2.393 15.861 1.361 1.00 0.00 O ATOM 2804 CB GLU C 64 0.303 17.603 1.702 1.00 0.00 C ATOM 2805 CG GLU C 64 0.526 16.968 3.076 1.00 0.00 C ATOM 2806 CD GLU C 64 -0.307 17.710 4.124 1.00 0.00 C ATOM 2807 OE1 GLU C 64 -1.480 17.396 4.250 1.00 0.00 O ATOM 2808 OE2 GLU C 64 0.242 18.578 4.782 1.00 0.00 O ATOM 0 H GLU C 64 -1.055 15.287 1.874 1.00 0.00 H new ATOM 0 HA GLU C 64 0.182 16.912 -0.366 1.00 0.00 H new ATOM 0 HB2 GLU C 64 1.127 18.275 1.462 1.00 0.00 H new ATOM 0 HB3 GLU C 64 -0.607 18.204 1.710 1.00 0.00 H new ATOM 0 HG2 GLU C 64 0.245 15.915 3.052 1.00 0.00 H new ATOM 0 HG3 GLU C 64 1.583 17.010 3.340 1.00 0.00 H new ATOM 2815 N ILE C 65 1.318 14.421 0.098 1.00 0.00 N ATOM 2816 CA ILE C 65 2.457 13.459 0.146 1.00 0.00 C ATOM 2817 C ILE C 65 2.439 12.554 -1.093 1.00 0.00 C ATOM 2818 O ILE C 65 1.495 11.821 -1.312 1.00 0.00 O ATOM 2819 CB ILE C 65 2.227 12.650 1.428 1.00 0.00 C ATOM 2820 CG1 ILE C 65 3.203 13.125 2.508 1.00 0.00 C ATOM 2821 CG2 ILE C 65 2.454 11.159 1.161 1.00 0.00 C ATOM 2822 CD1 ILE C 65 2.419 13.706 3.688 1.00 0.00 C ATOM 0 H ILE C 65 0.513 14.114 -0.447 1.00 0.00 H new ATOM 0 HA ILE C 65 3.428 13.955 0.150 1.00 0.00 H new ATOM 0 HB ILE C 65 1.200 12.799 1.763 1.00 0.00 H new ATOM 0 HG12 ILE C 65 3.823 12.293 2.844 1.00 0.00 H new ATOM 0 HG13 ILE C 65 3.876 13.879 2.099 1.00 0.00 H new ATOM 0 HG21 ILE C 65 2.288 10.596 2.079 1.00 0.00 H new ATOM 0 HG22 ILE C 65 1.759 10.817 0.394 1.00 0.00 H new ATOM 0 HG23 ILE C 65 3.477 11.002 0.819 1.00 0.00 H new ATOM 0 HD11 ILE C 65 3.115 14.044 4.456 1.00 0.00 H new ATOM 0 HD12 ILE C 65 1.819 14.549 3.346 1.00 0.00 H new ATOM 0 HD13 ILE C 65 1.765 12.939 4.103 1.00 0.00 H new ATOM 2834 N PRO C 66 3.492 12.638 -1.863 1.00 0.00 N ATOM 2835 CA PRO C 66 3.608 11.817 -3.094 1.00 0.00 C ATOM 2836 C PRO C 66 3.843 10.343 -2.742 1.00 0.00 C ATOM 2837 O PRO C 66 3.904 9.971 -1.586 1.00 0.00 O ATOM 2838 CB PRO C 66 4.821 12.409 -3.807 1.00 0.00 C ATOM 2839 CG PRO C 66 5.631 13.047 -2.725 1.00 0.00 C ATOM 2840 CD PRO C 66 4.663 13.498 -1.662 1.00 0.00 C ATOM 0 HA PRO C 66 2.707 11.838 -3.707 1.00 0.00 H new ATOM 0 HB2 PRO C 66 5.391 11.637 -4.324 1.00 0.00 H new ATOM 0 HB3 PRO C 66 4.520 13.140 -4.558 1.00 0.00 H new ATOM 0 HG2 PRO C 66 6.353 12.340 -2.315 1.00 0.00 H new ATOM 0 HG3 PRO C 66 6.198 13.892 -3.115 1.00 0.00 H new ATOM 0 HD2 PRO C 66 5.081 13.376 -0.663 1.00 0.00 H new ATOM 0 HD3 PRO C 66 4.409 14.552 -1.775 1.00 0.00 H new ATOM 2848 N SER C 67 3.967 9.501 -3.732 1.00 0.00 N ATOM 2849 CA SER C 67 4.187 8.049 -3.460 1.00 0.00 C ATOM 2850 C SER C 67 5.520 7.827 -2.737 1.00 0.00 C ATOM 2851 O SER C 67 5.579 7.209 -1.690 1.00 0.00 O ATOM 2852 CB SER C 67 4.213 7.391 -4.838 1.00 0.00 C ATOM 2853 OG SER C 67 3.629 8.272 -5.792 1.00 0.00 O ATOM 0 H SER C 67 3.926 9.755 -4.719 1.00 0.00 H new ATOM 0 HA SER C 67 3.411 7.633 -2.817 1.00 0.00 H new ATOM 0 HB2 SER C 67 5.239 7.157 -5.122 1.00 0.00 H new ATOM 0 HB3 SER C 67 3.666 6.448 -4.814 1.00 0.00 H new ATOM 0 HG SER C 67 3.646 7.853 -6.678 1.00 0.00 H new ATOM 2859 N HIS C 68 6.594 8.318 -3.287 1.00 0.00 N ATOM 2860 CA HIS C 68 7.916 8.125 -2.628 1.00 0.00 C ATOM 2861 C HIS C 68 7.775 8.237 -1.106 1.00 0.00 C ATOM 2862 O HIS C 68 8.523 7.636 -0.360 1.00 0.00 O ATOM 2863 CB HIS C 68 8.796 9.253 -3.167 1.00 0.00 C ATOM 2864 CG HIS C 68 9.028 9.051 -4.638 1.00 0.00 C ATOM 2865 ND1 HIS C 68 8.606 9.970 -5.586 1.00 0.00 N ATOM 2866 CD2 HIS C 68 9.636 8.041 -5.341 1.00 0.00 C ATOM 2867 CE1 HIS C 68 8.963 9.499 -6.795 1.00 0.00 C ATOM 2868 NE2 HIS C 68 9.594 8.325 -6.702 1.00 0.00 N ATOM 0 H HIS C 68 6.615 8.843 -4.161 1.00 0.00 H new ATOM 0 HA HIS C 68 8.338 7.142 -2.835 1.00 0.00 H new ATOM 0 HB2 HIS C 68 8.317 10.217 -2.993 1.00 0.00 H new ATOM 0 HB3 HIS C 68 9.748 9.270 -2.637 1.00 0.00 H new ATOM 0 HD2 HIS C 68 10.080 7.159 -4.903 1.00 0.00 H new ATOM 0 HE1 HIS C 68 8.764 10.008 -7.727 1.00 0.00 H new ATOM 0 HE2 HIS C 68 9.965 7.759 -7.465 1.00 0.00 H new ATOM 2876 N VAL C 69 6.832 9.011 -0.639 1.00 0.00 N ATOM 2877 CA VAL C 69 6.661 9.169 0.830 1.00 0.00 C ATOM 2878 C VAL C 69 5.820 8.031 1.426 1.00 0.00 C ATOM 2879 O VAL C 69 6.161 7.482 2.454 1.00 0.00 O ATOM 2880 CB VAL C 69 5.943 10.507 1.003 1.00 0.00 C ATOM 2881 CG1 VAL C 69 6.386 11.138 2.314 1.00 0.00 C ATOM 2882 CG2 VAL C 69 6.302 11.449 -0.150 1.00 0.00 C ATOM 0 H VAL C 69 6.174 9.539 -1.213 1.00 0.00 H new ATOM 0 HA VAL C 69 7.620 9.139 1.347 1.00 0.00 H new ATOM 0 HB VAL C 69 4.866 10.340 1.007 1.00 0.00 H new ATOM 0 HG11 VAL C 69 5.879 12.094 2.447 1.00 0.00 H new ATOM 0 HG12 VAL C 69 6.133 10.475 3.141 1.00 0.00 H new ATOM 0 HG13 VAL C 69 7.464 11.298 2.295 1.00 0.00 H new ATOM 0 HG21 VAL C 69 5.785 12.400 -0.018 1.00 0.00 H new ATOM 0 HG22 VAL C 69 7.379 11.619 -0.159 1.00 0.00 H new ATOM 0 HG23 VAL C 69 5.998 10.999 -1.095 1.00 0.00 H new ATOM 2892 N LEU C 70 4.723 7.671 0.809 1.00 0.00 N ATOM 2893 CA LEU C 70 3.888 6.573 1.389 1.00 0.00 C ATOM 2894 C LEU C 70 4.733 5.312 1.571 1.00 0.00 C ATOM 2895 O LEU C 70 4.362 4.403 2.285 1.00 0.00 O ATOM 2896 CB LEU C 70 2.741 6.326 0.401 1.00 0.00 C ATOM 2897 CG LEU C 70 3.276 6.195 -1.027 1.00 0.00 C ATOM 2898 CD1 LEU C 70 4.229 5.001 -1.124 1.00 0.00 C ATOM 2899 CD2 LEU C 70 2.101 5.977 -1.983 1.00 0.00 C ATOM 0 H LEU C 70 4.373 8.081 -0.057 1.00 0.00 H new ATOM 0 HA LEU C 70 3.498 6.844 2.370 1.00 0.00 H new ATOM 0 HB2 LEU C 70 2.205 5.419 0.678 1.00 0.00 H new ATOM 0 HB3 LEU C 70 2.026 7.147 0.453 1.00 0.00 H new ATOM 0 HG LEU C 70 3.814 7.105 -1.293 1.00 0.00 H new ATOM 0 HD11 LEU C 70 4.604 4.917 -2.144 1.00 0.00 H new ATOM 0 HD12 LEU C 70 5.066 5.147 -0.441 1.00 0.00 H new ATOM 0 HD13 LEU C 70 3.697 4.088 -0.856 1.00 0.00 H new ATOM 0 HD21 LEU C 70 2.474 5.883 -3.003 1.00 0.00 H new ATOM 0 HD22 LEU C 70 1.570 5.066 -1.705 1.00 0.00 H new ATOM 0 HD23 LEU C 70 1.421 6.826 -1.923 1.00 0.00 H new ATOM 2911 N SER C 71 5.871 5.255 0.936 1.00 0.00 N ATOM 2912 CA SER C 71 6.743 4.054 1.081 1.00 0.00 C ATOM 2913 C SER C 71 7.925 4.390 1.991 1.00 0.00 C ATOM 2914 O SER C 71 8.489 3.534 2.642 1.00 0.00 O ATOM 2915 CB SER C 71 7.223 3.738 -0.334 1.00 0.00 C ATOM 2916 OG SER C 71 6.641 2.515 -0.765 1.00 0.00 O ATOM 0 H SER C 71 6.235 5.986 0.324 1.00 0.00 H new ATOM 0 HA SER C 71 6.222 3.206 1.525 1.00 0.00 H new ATOM 0 HB2 SER C 71 6.947 4.545 -1.013 1.00 0.00 H new ATOM 0 HB3 SER C 71 8.310 3.663 -0.353 1.00 0.00 H new ATOM 0 HG SER C 71 6.946 2.310 -1.674 1.00 0.00 H new ATOM 2922 N LYS C 72 8.298 5.639 2.038 1.00 0.00 N ATOM 2923 CA LYS C 72 9.441 6.049 2.904 1.00 0.00 C ATOM 2924 C LYS C 72 9.037 6.007 4.378 1.00 0.00 C ATOM 2925 O LYS C 72 9.516 5.193 5.143 1.00 0.00 O ATOM 2926 CB LYS C 72 9.767 7.479 2.477 1.00 0.00 C ATOM 2927 CG LYS C 72 11.204 7.544 1.958 1.00 0.00 C ATOM 2928 CD LYS C 72 12.169 7.658 3.139 1.00 0.00 C ATOM 2929 CE LYS C 72 12.689 6.268 3.511 1.00 0.00 C ATOM 2930 NZ LYS C 72 13.884 6.519 4.363 1.00 0.00 N ATOM 0 H LYS C 72 7.860 6.396 1.513 1.00 0.00 H new ATOM 0 HA LYS C 72 10.298 5.384 2.795 1.00 0.00 H new ATOM 0 HB2 LYS C 72 9.074 7.804 1.701 1.00 0.00 H new ATOM 0 HB3 LYS C 72 9.643 8.158 3.320 1.00 0.00 H new ATOM 0 HG2 LYS C 72 11.431 6.652 1.374 1.00 0.00 H new ATOM 0 HG3 LYS C 72 11.323 8.400 1.293 1.00 0.00 H new ATOM 0 HD2 LYS C 72 13.002 8.312 2.880 1.00 0.00 H new ATOM 0 HD3 LYS C 72 11.663 8.109 3.993 1.00 0.00 H new ATOM 0 HE2 LYS C 72 11.934 5.695 4.049 1.00 0.00 H new ATOM 0 HE3 LYS C 72 12.951 5.694 2.622 1.00 0.00 H new ATOM 0 HZ1 LYS C 72 14.747 6.376 3.801 1.00 0.00 H new ATOM 0 HZ2 LYS C 72 13.859 7.497 4.717 1.00 0.00 H new ATOM 0 HZ3 LYS C 72 13.882 5.860 5.167 1.00 0.00 H new ATOM 2944 N VAL C 73 8.160 6.880 4.781 1.00 0.00 N ATOM 2945 CA VAL C 73 7.724 6.893 6.210 1.00 0.00 C ATOM 2946 C VAL C 73 7.068 5.559 6.566 1.00 0.00 C ATOM 2947 O VAL C 73 7.197 5.072 7.673 1.00 0.00 O ATOM 2948 CB VAL C 73 6.717 8.051 6.372 1.00 0.00 C ATOM 2949 CG1 VAL C 73 6.120 8.474 5.026 1.00 0.00 C ATOM 2950 CG2 VAL C 73 5.580 7.614 7.299 1.00 0.00 C ATOM 0 H VAL C 73 7.725 7.586 4.187 1.00 0.00 H new ATOM 0 HA VAL C 73 8.575 7.034 6.876 1.00 0.00 H new ATOM 0 HB VAL C 73 7.254 8.900 6.795 1.00 0.00 H new ATOM 0 HG11 VAL C 73 5.416 9.291 5.181 1.00 0.00 H new ATOM 0 HG12 VAL C 73 6.918 8.804 4.361 1.00 0.00 H new ATOM 0 HG13 VAL C 73 5.600 7.628 4.576 1.00 0.00 H new ATOM 0 HG21 VAL C 73 4.869 8.432 7.413 1.00 0.00 H new ATOM 0 HG22 VAL C 73 5.073 6.750 6.870 1.00 0.00 H new ATOM 0 HG23 VAL C 73 5.988 7.349 8.275 1.00 0.00 H new ATOM 2960 N CYS C 74 6.361 4.962 5.648 1.00 0.00 N ATOM 2961 CA CYS C 74 5.704 3.664 5.960 1.00 0.00 C ATOM 2962 C CYS C 74 6.765 2.656 6.406 1.00 0.00 C ATOM 2963 O CYS C 74 6.580 1.919 7.356 1.00 0.00 O ATOM 2964 CB CYS C 74 5.049 3.217 4.655 1.00 0.00 C ATOM 2965 SG CYS C 74 3.291 3.647 4.684 1.00 0.00 S ATOM 0 H CYS C 74 6.211 5.314 4.702 1.00 0.00 H new ATOM 0 HA CYS C 74 4.971 3.746 6.762 1.00 0.00 H new ATOM 0 HB2 CYS C 74 5.538 3.697 3.807 1.00 0.00 H new ATOM 0 HB3 CYS C 74 5.169 2.141 4.525 1.00 0.00 H new ATOM 0 HG CYS C 74 2.959 4.193 3.552 1.00 0.00 H new ATOM 2971 N MET C 75 7.888 2.631 5.744 1.00 0.00 N ATOM 2972 CA MET C 75 8.957 1.687 6.161 1.00 0.00 C ATOM 2973 C MET C 75 9.414 2.055 7.572 1.00 0.00 C ATOM 2974 O MET C 75 9.713 1.200 8.382 1.00 0.00 O ATOM 2975 CB MET C 75 10.087 1.879 5.149 1.00 0.00 C ATOM 2976 CG MET C 75 11.261 0.969 5.515 1.00 0.00 C ATOM 2977 SD MET C 75 11.519 -0.245 4.198 1.00 0.00 S ATOM 2978 CE MET C 75 12.889 -1.135 4.976 1.00 0.00 C ATOM 0 H MET C 75 8.109 3.218 4.940 1.00 0.00 H new ATOM 0 HA MET C 75 8.627 0.648 6.181 1.00 0.00 H new ATOM 0 HB2 MET C 75 9.733 1.647 4.145 1.00 0.00 H new ATOM 0 HB3 MET C 75 10.409 2.920 5.141 1.00 0.00 H new ATOM 0 HG2 MET C 75 12.164 1.563 5.659 1.00 0.00 H new ATOM 0 HG3 MET C 75 11.060 0.461 6.458 1.00 0.00 H new ATOM 0 HE1 MET C 75 13.824 -0.865 4.485 1.00 0.00 H new ATOM 0 HE2 MET C 75 12.943 -0.869 6.032 1.00 0.00 H new ATOM 0 HE3 MET C 75 12.726 -2.209 4.881 1.00 0.00 H new ATOM 2988 N TYR C 76 9.444 3.326 7.880 1.00 0.00 N ATOM 2989 CA TYR C 76 9.852 3.742 9.249 1.00 0.00 C ATOM 2990 C TYR C 76 8.716 3.420 10.219 1.00 0.00 C ATOM 2991 O TYR C 76 8.923 3.241 11.403 1.00 0.00 O ATOM 2992 CB TYR C 76 10.089 5.254 9.172 1.00 0.00 C ATOM 2993 CG TYR C 76 11.300 5.625 10.005 1.00 0.00 C ATOM 2994 CD1 TYR C 76 11.807 4.725 10.952 1.00 0.00 C ATOM 2995 CD2 TYR C 76 11.917 6.871 9.827 1.00 0.00 C ATOM 2996 CE1 TYR C 76 12.929 5.070 11.717 1.00 0.00 C ATOM 2997 CE2 TYR C 76 13.037 7.215 10.594 1.00 0.00 C ATOM 2998 CZ TYR C 76 13.543 6.315 11.538 1.00 0.00 C ATOM 2999 OH TYR C 76 14.648 6.653 12.292 1.00 0.00 O ATOM 0 H TYR C 76 9.205 4.087 7.245 1.00 0.00 H new ATOM 0 HA TYR C 76 10.747 3.227 9.597 1.00 0.00 H new ATOM 0 HB2 TYR C 76 10.242 5.555 8.136 1.00 0.00 H new ATOM 0 HB3 TYR C 76 9.210 5.788 9.533 1.00 0.00 H new ATOM 0 HD1 TYR C 76 11.333 3.765 11.092 1.00 0.00 H new ATOM 0 HD2 TYR C 76 11.528 7.566 9.098 1.00 0.00 H new ATOM 0 HE1 TYR C 76 13.320 4.375 12.445 1.00 0.00 H new ATOM 0 HE2 TYR C 76 13.511 8.176 10.457 1.00 0.00 H new ATOM 0 HH TYR C 76 15.222 7.258 11.778 1.00 0.00 H new ATOM 3009 N PHE C 77 7.511 3.322 9.715 1.00 0.00 N ATOM 3010 CA PHE C 77 6.360 2.984 10.598 1.00 0.00 C ATOM 3011 C PHE C 77 6.562 1.571 11.140 1.00 0.00 C ATOM 3012 O PHE C 77 6.220 1.265 12.265 1.00 0.00 O ATOM 3013 CB PHE C 77 5.131 3.023 9.686 1.00 0.00 C ATOM 3014 CG PHE C 77 4.477 4.391 9.703 1.00 0.00 C ATOM 3015 CD1 PHE C 77 4.945 5.407 10.553 1.00 0.00 C ATOM 3016 CD2 PHE C 77 3.397 4.645 8.845 1.00 0.00 C ATOM 3017 CE1 PHE C 77 4.333 6.666 10.540 1.00 0.00 C ATOM 3018 CE2 PHE C 77 2.787 5.903 8.837 1.00 0.00 C ATOM 3019 CZ PHE C 77 3.255 6.913 9.682 1.00 0.00 C ATOM 0 H PHE C 77 7.278 3.462 8.732 1.00 0.00 H new ATOM 0 HA PHE C 77 6.256 3.666 11.442 1.00 0.00 H new ATOM 0 HB2 PHE C 77 5.423 2.770 8.667 1.00 0.00 H new ATOM 0 HB3 PHE C 77 4.412 2.270 10.008 1.00 0.00 H new ATOM 0 HD1 PHE C 77 5.776 5.217 11.216 1.00 0.00 H new ATOM 0 HD2 PHE C 77 3.036 3.867 8.189 1.00 0.00 H new ATOM 0 HE1 PHE C 77 4.693 7.448 11.193 1.00 0.00 H new ATOM 0 HE2 PHE C 77 1.954 6.094 8.177 1.00 0.00 H new ATOM 0 HZ PHE C 77 2.784 7.885 9.673 1.00 0.00 H new ATOM 3029 N THR C 78 7.139 0.711 10.343 1.00 0.00 N ATOM 3030 CA THR C 78 7.392 -0.683 10.804 1.00 0.00 C ATOM 3031 C THR C 78 8.779 -0.760 11.440 1.00 0.00 C ATOM 3032 O THR C 78 8.987 -1.443 12.423 1.00 0.00 O ATOM 3033 CB THR C 78 7.331 -1.545 9.541 1.00 0.00 C ATOM 3034 OG1 THR C 78 6.925 -0.744 8.441 1.00 0.00 O ATOM 3035 CG2 THR C 78 6.330 -2.682 9.745 1.00 0.00 C ATOM 0 H THR C 78 7.446 0.915 9.392 1.00 0.00 H new ATOM 0 HA THR C 78 6.669 -1.017 11.548 1.00 0.00 H new ATOM 0 HB THR C 78 8.317 -1.965 9.340 1.00 0.00 H new ATOM 0 HG1 THR C 78 6.015 -0.414 8.595 1.00 0.00 H new ATOM 0 HG21 THR C 78 6.287 -3.295 8.845 1.00 0.00 H new ATOM 0 HG22 THR C 78 6.645 -3.297 10.588 1.00 0.00 H new ATOM 0 HG23 THR C 78 5.343 -2.266 9.948 1.00 0.00 H new ATOM 3043 N TYR C 79 9.726 -0.049 10.892 1.00 0.00 N ATOM 3044 CA TYR C 79 11.096 -0.066 11.472 1.00 0.00 C ATOM 3045 C TYR C 79 11.028 0.367 12.935 1.00 0.00 C ATOM 3046 O TYR C 79 11.895 0.060 13.730 1.00 0.00 O ATOM 3047 CB TYR C 79 11.888 0.949 10.647 1.00 0.00 C ATOM 3048 CG TYR C 79 13.088 0.274 10.030 1.00 0.00 C ATOM 3049 CD1 TYR C 79 12.981 -1.029 9.531 1.00 0.00 C ATOM 3050 CD2 TYR C 79 14.311 0.953 9.956 1.00 0.00 C ATOM 3051 CE1 TYR C 79 14.096 -1.653 8.957 1.00 0.00 C ATOM 3052 CE2 TYR C 79 15.425 0.329 9.384 1.00 0.00 C ATOM 3053 CZ TYR C 79 15.317 -0.975 8.884 1.00 0.00 C ATOM 3054 OH TYR C 79 16.416 -1.590 8.318 1.00 0.00 O ATOM 0 H TYR C 79 9.609 0.542 10.069 1.00 0.00 H new ATOM 0 HA TYR C 79 11.557 -1.053 11.443 1.00 0.00 H new ATOM 0 HB2 TYR C 79 11.255 1.372 9.867 1.00 0.00 H new ATOM 0 HB3 TYR C 79 12.209 1.776 11.280 1.00 0.00 H new ATOM 0 HD1 TYR C 79 12.039 -1.554 9.588 1.00 0.00 H new ATOM 0 HD2 TYR C 79 14.394 1.959 10.341 1.00 0.00 H new ATOM 0 HE1 TYR C 79 14.013 -2.658 8.571 1.00 0.00 H new ATOM 0 HE2 TYR C 79 16.368 0.853 9.328 1.00 0.00 H new ATOM 0 HH TYR C 79 16.914 -2.072 9.011 1.00 0.00 H new ATOM 3064 N LYS C 80 9.995 1.080 13.295 1.00 0.00 N ATOM 3065 CA LYS C 80 9.855 1.537 14.704 1.00 0.00 C ATOM 3066 C LYS C 80 9.606 0.340 15.624 1.00 0.00 C ATOM 3067 O LYS C 80 10.068 0.302 16.746 1.00 0.00 O ATOM 3068 CB LYS C 80 8.647 2.472 14.699 1.00 0.00 C ATOM 3069 CG LYS C 80 8.528 3.163 16.057 1.00 0.00 C ATOM 3070 CD LYS C 80 7.258 2.684 16.763 1.00 0.00 C ATOM 3071 CE LYS C 80 6.502 3.889 17.329 1.00 0.00 C ATOM 3072 NZ LYS C 80 5.331 3.309 18.040 1.00 0.00 N ATOM 0 H LYS C 80 9.241 1.366 12.671 1.00 0.00 H new ATOM 0 HA LYS C 80 10.753 2.036 15.069 1.00 0.00 H new ATOM 0 HB2 LYS C 80 8.753 3.216 13.909 1.00 0.00 H new ATOM 0 HB3 LYS C 80 7.739 1.908 14.486 1.00 0.00 H new ATOM 0 HG2 LYS C 80 9.403 2.940 16.668 1.00 0.00 H new ATOM 0 HG3 LYS C 80 8.498 4.245 15.925 1.00 0.00 H new ATOM 0 HD2 LYS C 80 6.624 2.139 16.063 1.00 0.00 H new ATOM 0 HD3 LYS C 80 7.514 1.992 17.566 1.00 0.00 H new ATOM 0 HE2 LYS C 80 7.130 4.466 18.008 1.00 0.00 H new ATOM 0 HE3 LYS C 80 6.186 4.566 16.535 1.00 0.00 H new ATOM 0 HZ1 LYS C 80 4.763 4.075 18.456 1.00 0.00 H new ATOM 0 HZ2 LYS C 80 4.748 2.771 17.367 1.00 0.00 H new ATOM 0 HZ3 LYS C 80 5.662 2.675 18.795 1.00 0.00 H new ATOM 3086 N VAL C 81 8.883 -0.644 15.156 1.00 0.00 N ATOM 3087 CA VAL C 81 8.618 -1.834 16.012 1.00 0.00 C ATOM 3088 C VAL C 81 9.943 -2.448 16.462 1.00 0.00 C ATOM 3089 O VAL C 81 10.065 -2.950 17.561 1.00 0.00 O ATOM 3090 CB VAL C 81 7.848 -2.806 15.118 1.00 0.00 C ATOM 3091 CG1 VAL C 81 7.539 -4.084 15.899 1.00 0.00 C ATOM 3092 CG2 VAL C 81 6.536 -2.155 14.670 1.00 0.00 C ATOM 0 H VAL C 81 8.468 -0.674 14.225 1.00 0.00 H new ATOM 0 HA VAL C 81 8.055 -1.586 16.912 1.00 0.00 H new ATOM 0 HB VAL C 81 8.452 -3.051 14.244 1.00 0.00 H new ATOM 0 HG11 VAL C 81 6.990 -4.777 15.261 1.00 0.00 H new ATOM 0 HG12 VAL C 81 8.471 -4.548 16.221 1.00 0.00 H new ATOM 0 HG13 VAL C 81 6.935 -3.839 16.773 1.00 0.00 H new ATOM 0 HG21 VAL C 81 5.986 -2.847 14.032 1.00 0.00 H new ATOM 0 HG22 VAL C 81 5.934 -1.911 15.545 1.00 0.00 H new ATOM 0 HG23 VAL C 81 6.754 -1.243 14.113 1.00 0.00 H new ATOM 3102 N ARG C 82 10.942 -2.398 15.625 1.00 0.00 N ATOM 3103 CA ARG C 82 12.262 -2.963 16.016 1.00 0.00 C ATOM 3104 C ARG C 82 12.796 -2.208 17.234 1.00 0.00 C ATOM 3105 O ARG C 82 13.675 -2.673 17.933 1.00 0.00 O ATOM 3106 CB ARG C 82 13.165 -2.742 14.803 1.00 0.00 C ATOM 3107 CG ARG C 82 14.276 -3.795 14.793 1.00 0.00 C ATOM 3108 CD ARG C 82 15.634 -3.103 14.919 1.00 0.00 C ATOM 3109 NE ARG C 82 16.267 -3.250 13.579 1.00 0.00 N ATOM 3110 CZ ARG C 82 17.502 -2.871 13.394 1.00 0.00 C ATOM 3111 NH1 ARG C 82 18.184 -2.361 14.384 1.00 0.00 N ATOM 3112 NH2 ARG C 82 18.055 -3.001 12.220 1.00 0.00 N ATOM 0 H ARG C 82 10.901 -1.992 14.690 1.00 0.00 H new ATOM 0 HA ARG C 82 12.207 -4.018 16.285 1.00 0.00 H new ATOM 0 HB2 ARG C 82 12.581 -2.806 13.885 1.00 0.00 H new ATOM 0 HB3 ARG C 82 13.598 -1.742 14.836 1.00 0.00 H new ATOM 0 HG2 ARG C 82 14.135 -4.496 15.616 1.00 0.00 H new ATOM 0 HG3 ARG C 82 14.235 -4.374 13.870 1.00 0.00 H new ATOM 0 HD2 ARG C 82 15.519 -2.053 15.188 1.00 0.00 H new ATOM 0 HD3 ARG C 82 16.242 -3.566 15.696 1.00 0.00 H new ATOM 0 HE ARG C 82 15.735 -3.647 12.805 1.00 0.00 H new ATOM 0 HH11 ARG C 82 17.751 -2.259 15.302 1.00 0.00 H new ATOM 0 HH12 ARG C 82 19.149 -2.065 14.239 1.00 0.00 H new ATOM 0 HH21 ARG C 82 17.522 -3.399 11.447 1.00 0.00 H new ATOM 0 HH22 ARG C 82 19.020 -2.705 12.075 1.00 0.00 H new ATOM 3126 N TYR C 83 12.262 -1.045 17.495 1.00 0.00 N ATOM 3127 CA TYR C 83 12.726 -0.253 18.669 1.00 0.00 C ATOM 3128 C TYR C 83 12.617 -1.094 19.939 1.00 0.00 C ATOM 3129 O TYR C 83 13.538 -1.171 20.726 1.00 0.00 O ATOM 3130 CB TYR C 83 11.777 0.940 18.743 1.00 0.00 C ATOM 3131 CG TYR C 83 12.356 1.982 19.671 1.00 0.00 C ATOM 3132 CD1 TYR C 83 13.719 2.292 19.606 1.00 0.00 C ATOM 3133 CD2 TYR C 83 11.532 2.635 20.593 1.00 0.00 C ATOM 3134 CE1 TYR C 83 14.259 3.256 20.465 1.00 0.00 C ATOM 3135 CE2 TYR C 83 12.072 3.599 21.454 1.00 0.00 C ATOM 3136 CZ TYR C 83 13.436 3.910 21.389 1.00 0.00 C ATOM 3137 OH TYR C 83 13.968 4.859 22.236 1.00 0.00 O ATOM 0 H TYR C 83 11.523 -0.609 16.944 1.00 0.00 H new ATOM 0 HA TYR C 83 13.766 0.058 18.573 1.00 0.00 H new ATOM 0 HB2 TYR C 83 11.629 1.363 17.750 1.00 0.00 H new ATOM 0 HB3 TYR C 83 10.799 0.620 19.102 1.00 0.00 H new ATOM 0 HD1 TYR C 83 14.354 1.787 18.893 1.00 0.00 H new ATOM 0 HD2 TYR C 83 10.480 2.396 20.641 1.00 0.00 H new ATOM 0 HE1 TYR C 83 15.311 3.495 20.415 1.00 0.00 H new ATOM 0 HE2 TYR C 83 11.437 4.102 22.168 1.00 0.00 H new ATOM 0 HH TYR C 83 13.261 5.216 22.813 1.00 0.00 H new ATOM 3274 N PHE C 93 17.714 4.713 8.957 1.00 0.00 N ATOM 3275 CA PHE C 93 17.059 4.948 7.637 1.00 0.00 C ATOM 3276 C PHE C 93 17.991 5.743 6.715 1.00 0.00 C ATOM 3277 O PHE C 93 18.559 6.739 7.117 1.00 0.00 O ATOM 3278 CB PHE C 93 15.808 5.762 7.963 1.00 0.00 C ATOM 3279 CG PHE C 93 14.573 4.967 7.619 1.00 0.00 C ATOM 3280 CD1 PHE C 93 14.575 3.574 7.755 1.00 0.00 C ATOM 3281 CD2 PHE C 93 13.423 5.626 7.170 1.00 0.00 C ATOM 3282 CE1 PHE C 93 13.425 2.839 7.439 1.00 0.00 C ATOM 3283 CE2 PHE C 93 12.273 4.892 6.855 1.00 0.00 C ATOM 3284 CZ PHE C 93 12.275 3.499 6.990 1.00 0.00 C ATOM 0 HA PHE C 93 16.822 4.018 7.120 1.00 0.00 H new ATOM 0 HB2 PHE C 93 15.799 6.024 9.021 1.00 0.00 H new ATOM 0 HB3 PHE C 93 15.816 6.697 7.403 1.00 0.00 H new ATOM 0 HD1 PHE C 93 15.462 3.066 8.103 1.00 0.00 H new ATOM 0 HD2 PHE C 93 13.423 6.701 7.066 1.00 0.00 H new ATOM 0 HE1 PHE C 93 13.426 1.764 7.542 1.00 0.00 H new ATOM 0 HE2 PHE C 93 11.385 5.400 6.508 1.00 0.00 H new ATOM 0 HZ PHE C 93 11.388 2.932 6.747 1.00 0.00 H new ATOM 3294 N PRO C 94 18.113 5.271 5.505 1.00 0.00 N ATOM 3295 CA PRO C 94 18.981 5.941 4.508 1.00 0.00 C ATOM 3296 C PRO C 94 18.294 7.186 3.940 1.00 0.00 C ATOM 3297 O PRO C 94 17.112 7.182 3.658 1.00 0.00 O ATOM 3298 CB PRO C 94 19.160 4.883 3.424 1.00 0.00 C ATOM 3299 CG PRO C 94 17.960 3.994 3.536 1.00 0.00 C ATOM 3300 CD PRO C 94 17.463 4.075 4.958 1.00 0.00 C ATOM 0 HA PRO C 94 19.926 6.284 4.929 1.00 0.00 H new ATOM 0 HB2 PRO C 94 19.221 5.339 2.436 1.00 0.00 H new ATOM 0 HB3 PRO C 94 20.082 4.320 3.572 1.00 0.00 H new ATOM 0 HG2 PRO C 94 17.183 4.310 2.840 1.00 0.00 H new ATOM 0 HG3 PRO C 94 18.219 2.967 3.279 1.00 0.00 H new ATOM 0 HD2 PRO C 94 16.377 4.161 4.995 1.00 0.00 H new ATOM 0 HD3 PRO C 94 17.731 3.183 5.524 1.00 0.00 H new ATOM 3308 N ILE C 95 19.028 8.251 3.762 1.00 0.00 N ATOM 3309 CA ILE C 95 18.425 9.496 3.203 1.00 0.00 C ATOM 3310 C ILE C 95 19.351 10.090 2.138 1.00 0.00 C ATOM 3311 O ILE C 95 20.552 10.150 2.314 1.00 0.00 O ATOM 3312 CB ILE C 95 18.292 10.447 4.391 1.00 0.00 C ATOM 3313 CG1 ILE C 95 17.504 9.760 5.510 1.00 0.00 C ATOM 3314 CG2 ILE C 95 17.554 11.714 3.951 1.00 0.00 C ATOM 3315 CD1 ILE C 95 16.015 9.739 5.154 1.00 0.00 C ATOM 0 H ILE C 95 20.022 8.313 3.980 1.00 0.00 H new ATOM 0 HA ILE C 95 17.462 9.312 2.726 1.00 0.00 H new ATOM 0 HB ILE C 95 19.284 10.713 4.756 1.00 0.00 H new ATOM 0 HG12 ILE C 95 17.868 8.743 5.653 1.00 0.00 H new ATOM 0 HG13 ILE C 95 17.655 10.288 6.452 1.00 0.00 H new ATOM 0 HG21 ILE C 95 17.459 12.393 4.799 1.00 0.00 H new ATOM 0 HG22 ILE C 95 18.115 12.204 3.155 1.00 0.00 H new ATOM 0 HG23 ILE C 95 16.562 11.449 3.586 1.00 0.00 H new ATOM 0 HD11 ILE C 95 15.457 9.249 5.952 1.00 0.00 H new ATOM 0 HD12 ILE C 95 15.655 10.761 5.034 1.00 0.00 H new ATOM 0 HD13 ILE C 95 15.871 9.192 4.222 1.00 0.00 H new ATOM 3327 N ALA C 96 18.808 10.523 1.033 1.00 0.00 N ATOM 3328 CA ALA C 96 19.669 11.101 -0.038 1.00 0.00 C ATOM 3329 C ALA C 96 18.881 12.110 -0.878 1.00 0.00 C ATOM 3330 O ALA C 96 17.702 12.310 -0.665 1.00 0.00 O ATOM 3331 CB ALA C 96 20.073 9.904 -0.898 1.00 0.00 C ATOM 0 H ALA C 96 17.809 10.502 0.826 1.00 0.00 H new ATOM 0 HA ALA C 96 20.529 11.633 0.370 1.00 0.00 H new ATOM 0 HB1 ALA C 96 20.711 10.242 -1.714 1.00 0.00 H new ATOM 0 HB2 ALA C 96 20.616 9.184 -0.287 1.00 0.00 H new ATOM 0 HB3 ALA C 96 19.180 9.432 -1.307 1.00 0.00 H new ATOM 3337 N PRO C 97 19.569 12.707 -1.816 1.00 0.00 N ATOM 3338 CA PRO C 97 18.931 13.700 -2.713 1.00 0.00 C ATOM 3339 C PRO C 97 18.016 12.986 -3.710 1.00 0.00 C ATOM 3340 O PRO C 97 18.343 12.833 -4.870 1.00 0.00 O ATOM 3341 CB PRO C 97 20.114 14.352 -3.424 1.00 0.00 C ATOM 3342 CG PRO C 97 21.208 13.334 -3.371 1.00 0.00 C ATOM 3343 CD PRO C 97 20.989 12.512 -2.125 1.00 0.00 C ATOM 0 HA PRO C 97 18.309 14.426 -2.189 1.00 0.00 H new ATOM 0 HB2 PRO C 97 19.863 14.608 -4.453 1.00 0.00 H new ATOM 0 HB3 PRO C 97 20.411 15.276 -2.929 1.00 0.00 H new ATOM 0 HG2 PRO C 97 21.189 12.701 -4.258 1.00 0.00 H new ATOM 0 HG3 PRO C 97 22.184 13.818 -3.346 1.00 0.00 H new ATOM 0 HD2 PRO C 97 21.220 11.460 -2.295 1.00 0.00 H new ATOM 0 HD3 PRO C 97 21.625 12.850 -1.307 1.00 0.00 H new ATOM 3351 N GLU C 98 16.876 12.543 -3.261 1.00 0.00 N ATOM 3352 CA GLU C 98 15.933 11.831 -4.162 1.00 0.00 C ATOM 3353 C GLU C 98 14.730 11.437 -3.328 1.00 0.00 C ATOM 3354 O GLU C 98 13.594 11.519 -3.753 1.00 0.00 O ATOM 3355 CB GLU C 98 16.691 10.597 -4.652 1.00 0.00 C ATOM 3356 CG GLU C 98 16.609 10.520 -6.177 1.00 0.00 C ATOM 3357 CD GLU C 98 17.879 11.115 -6.788 1.00 0.00 C ATOM 3358 OE1 GLU C 98 18.951 10.621 -6.478 1.00 0.00 O ATOM 3359 OE2 GLU C 98 17.759 12.056 -7.556 1.00 0.00 O ATOM 0 H GLU C 98 16.555 12.646 -2.298 1.00 0.00 H new ATOM 0 HA GLU C 98 15.592 12.426 -5.009 1.00 0.00 H new ATOM 0 HB2 GLU C 98 17.733 10.648 -4.335 1.00 0.00 H new ATOM 0 HB3 GLU C 98 16.266 9.696 -4.208 1.00 0.00 H new ATOM 0 HG2 GLU C 98 16.492 9.484 -6.493 1.00 0.00 H new ATOM 0 HG3 GLU C 98 15.733 11.063 -6.532 1.00 0.00 H new ATOM 3366 N ILE C 99 14.985 11.050 -2.112 1.00 0.00 N ATOM 3367 CA ILE C 99 13.883 10.691 -1.195 1.00 0.00 C ATOM 3368 C ILE C 99 14.163 11.328 0.167 1.00 0.00 C ATOM 3369 O ILE C 99 15.282 11.338 0.635 1.00 0.00 O ATOM 3370 CB ILE C 99 13.905 9.159 -1.116 1.00 0.00 C ATOM 3371 CG1 ILE C 99 12.532 8.611 -1.519 1.00 0.00 C ATOM 3372 CG2 ILE C 99 14.228 8.708 0.312 1.00 0.00 C ATOM 3373 CD1 ILE C 99 11.434 9.399 -0.802 1.00 0.00 C ATOM 0 H ILE C 99 15.921 10.968 -1.715 1.00 0.00 H new ATOM 0 HA ILE C 99 12.906 11.042 -1.528 1.00 0.00 H new ATOM 0 HB ILE C 99 14.671 8.780 -1.792 1.00 0.00 H new ATOM 0 HG12 ILE C 99 12.402 8.686 -2.599 1.00 0.00 H new ATOM 0 HG13 ILE C 99 12.462 7.554 -1.262 1.00 0.00 H new ATOM 0 HG21 ILE C 99 14.241 7.619 0.355 1.00 0.00 H new ATOM 0 HG22 ILE C 99 15.205 9.094 0.603 1.00 0.00 H new ATOM 0 HG23 ILE C 99 13.469 9.089 0.995 1.00 0.00 H new ATOM 0 HD11 ILE C 99 10.458 9.008 -1.090 1.00 0.00 H new ATOM 0 HD12 ILE C 99 11.561 9.301 0.276 1.00 0.00 H new ATOM 0 HD13 ILE C 99 11.500 10.451 -1.081 1.00 0.00 H new ATOM 3385 N ALA C 100 13.144 11.858 0.779 1.00 0.00 N ATOM 3386 CA ALA C 100 13.269 12.528 2.119 1.00 0.00 C ATOM 3387 C ALA C 100 12.891 14.004 1.991 1.00 0.00 C ATOM 3388 O ALA C 100 12.414 14.618 2.925 1.00 0.00 O ATOM 3389 CB ALA C 100 14.730 12.393 2.558 1.00 0.00 C ATOM 0 H ALA C 100 12.197 11.859 0.401 1.00 0.00 H new ATOM 0 HA ALA C 100 12.605 12.069 2.852 1.00 0.00 H new ATOM 0 HB1 ALA C 100 14.863 12.868 3.530 1.00 0.00 H new ATOM 0 HB2 ALA C 100 14.992 11.337 2.631 1.00 0.00 H new ATOM 0 HB3 ALA C 100 15.376 12.877 1.826 1.00 0.00 H new ATOM 3395 N LEU C 101 13.095 14.579 0.835 1.00 0.00 N ATOM 3396 CA LEU C 101 12.743 16.015 0.644 1.00 0.00 C ATOM 3397 C LEU C 101 11.259 16.236 0.954 1.00 0.00 C ATOM 3398 O LEU C 101 10.896 17.125 1.699 1.00 0.00 O ATOM 3399 CB LEU C 101 13.034 16.298 -0.831 1.00 0.00 C ATOM 3400 CG LEU C 101 12.434 17.649 -1.223 1.00 0.00 C ATOM 3401 CD1 LEU C 101 12.843 18.707 -0.198 1.00 0.00 C ATOM 3402 CD2 LEU C 101 12.951 18.052 -2.606 1.00 0.00 C ATOM 0 H LEU C 101 13.490 14.116 0.016 1.00 0.00 H new ATOM 0 HA LEU C 101 13.307 16.675 1.303 1.00 0.00 H new ATOM 0 HB2 LEU C 101 14.110 16.302 -1.005 1.00 0.00 H new ATOM 0 HB3 LEU C 101 12.614 15.508 -1.453 1.00 0.00 H new ATOM 0 HG LEU C 101 11.347 17.571 -1.248 1.00 0.00 H new ATOM 0 HD11 LEU C 101 12.415 19.670 -0.478 1.00 0.00 H new ATOM 0 HD12 LEU C 101 12.476 18.420 0.787 1.00 0.00 H new ATOM 0 HD13 LEU C 101 13.930 18.787 -0.172 1.00 0.00 H new ATOM 0 HD21 LEU C 101 12.525 19.015 -2.888 1.00 0.00 H new ATOM 0 HD22 LEU C 101 14.038 18.130 -2.580 1.00 0.00 H new ATOM 0 HD23 LEU C 101 12.659 17.298 -3.337 1.00 0.00 H new ATOM 3414 N GLU C 102 10.400 15.427 0.395 1.00 0.00 N ATOM 3415 CA GLU C 102 8.942 15.586 0.668 1.00 0.00 C ATOM 3416 C GLU C 102 8.641 15.182 2.113 1.00 0.00 C ATOM 3417 O GLU C 102 7.790 15.754 2.767 1.00 0.00 O ATOM 3418 CB GLU C 102 8.248 14.640 -0.313 1.00 0.00 C ATOM 3419 CG GLU C 102 8.293 15.241 -1.719 1.00 0.00 C ATOM 3420 CD GLU C 102 9.525 14.717 -2.460 1.00 0.00 C ATOM 3421 OE1 GLU C 102 9.678 13.509 -2.533 1.00 0.00 O ATOM 3422 OE2 GLU C 102 10.293 15.534 -2.941 1.00 0.00 O ATOM 0 H GLU C 102 10.644 14.665 -0.237 1.00 0.00 H new ATOM 0 HA GLU C 102 8.602 16.614 0.543 1.00 0.00 H new ATOM 0 HB2 GLU C 102 8.739 13.667 -0.306 1.00 0.00 H new ATOM 0 HB3 GLU C 102 7.214 14.477 -0.008 1.00 0.00 H new ATOM 0 HG2 GLU C 102 7.388 14.979 -2.267 1.00 0.00 H new ATOM 0 HG3 GLU C 102 8.327 16.329 -1.660 1.00 0.00 H new ATOM 3429 N LEU C 103 9.337 14.199 2.613 1.00 0.00 N ATOM 3430 CA LEU C 103 9.105 13.748 4.013 1.00 0.00 C ATOM 3431 C LEU C 103 9.385 14.897 4.988 1.00 0.00 C ATOM 3432 O LEU C 103 8.873 14.927 6.090 1.00 0.00 O ATOM 3433 CB LEU C 103 10.109 12.613 4.221 1.00 0.00 C ATOM 3434 CG LEU C 103 9.601 11.341 3.539 1.00 0.00 C ATOM 3435 CD1 LEU C 103 9.532 11.556 2.026 1.00 0.00 C ATOM 3436 CD2 LEU C 103 10.560 10.187 3.841 1.00 0.00 C ATOM 0 H LEU C 103 10.060 13.686 2.109 1.00 0.00 H new ATOM 0 HA LEU C 103 8.078 13.427 4.187 1.00 0.00 H new ATOM 0 HB2 LEU C 103 11.079 12.894 3.811 1.00 0.00 H new ATOM 0 HB3 LEU C 103 10.253 12.433 5.286 1.00 0.00 H new ATOM 0 HG LEU C 103 8.606 11.104 3.916 1.00 0.00 H new ATOM 0 HD11 LEU C 103 9.170 10.647 1.546 1.00 0.00 H new ATOM 0 HD12 LEU C 103 8.852 12.379 1.806 1.00 0.00 H new ATOM 0 HD13 LEU C 103 10.525 11.796 1.647 1.00 0.00 H new ATOM 0 HD21 LEU C 103 10.201 9.279 3.356 1.00 0.00 H new ATOM 0 HD22 LEU C 103 11.553 10.431 3.464 1.00 0.00 H new ATOM 0 HD23 LEU C 103 10.610 10.028 4.918 1.00 0.00 H new ATOM 3448 N LEU C 104 10.191 15.844 4.591 1.00 0.00 N ATOM 3449 CA LEU C 104 10.501 16.991 5.495 1.00 0.00 C ATOM 3450 C LEU C 104 9.210 17.554 6.095 1.00 0.00 C ATOM 3451 O LEU C 104 8.959 17.435 7.278 1.00 0.00 O ATOM 3452 CB LEU C 104 11.175 18.032 4.600 1.00 0.00 C ATOM 3453 CG LEU C 104 11.627 19.224 5.448 1.00 0.00 C ATOM 3454 CD1 LEU C 104 10.416 20.086 5.809 1.00 0.00 C ATOM 3455 CD2 LEU C 104 12.292 18.719 6.732 1.00 0.00 C ATOM 0 H LEU C 104 10.649 15.874 3.680 1.00 0.00 H new ATOM 0 HA LEU C 104 11.138 16.698 6.329 1.00 0.00 H new ATOM 0 HB2 LEU C 104 12.031 17.589 4.091 1.00 0.00 H new ATOM 0 HB3 LEU C 104 10.482 18.365 3.827 1.00 0.00 H new ATOM 0 HG LEU C 104 12.341 19.820 4.879 1.00 0.00 H new ATOM 0 HD11 LEU C 104 10.740 20.934 6.413 1.00 0.00 H new ATOM 0 HD12 LEU C 104 9.943 20.450 4.897 1.00 0.00 H new ATOM 0 HD13 LEU C 104 9.701 19.490 6.375 1.00 0.00 H new ATOM 0 HD21 LEU C 104 12.613 19.569 7.334 1.00 0.00 H new ATOM 0 HD22 LEU C 104 11.579 18.121 7.300 1.00 0.00 H new ATOM 0 HD23 LEU C 104 13.158 18.107 6.477 1.00 0.00 H new ATOM 3467 N MET C 105 8.389 18.169 5.288 1.00 0.00 N ATOM 3468 CA MET C 105 7.116 18.741 5.811 1.00 0.00 C ATOM 3469 C MET C 105 6.072 17.635 5.987 1.00 0.00 C ATOM 3470 O MET C 105 5.156 17.753 6.776 1.00 0.00 O ATOM 3471 CB MET C 105 6.663 19.738 4.744 1.00 0.00 C ATOM 3472 CG MET C 105 5.201 20.115 4.987 1.00 0.00 C ATOM 3473 SD MET C 105 4.125 18.977 4.081 1.00 0.00 S ATOM 3474 CE MET C 105 4.407 19.664 2.431 1.00 0.00 C ATOM 0 H MET C 105 8.545 18.300 4.289 1.00 0.00 H new ATOM 0 HA MET C 105 7.245 19.214 6.784 1.00 0.00 H new ATOM 0 HB2 MET C 105 7.290 20.629 4.775 1.00 0.00 H new ATOM 0 HB3 MET C 105 6.777 19.302 3.752 1.00 0.00 H new ATOM 0 HG2 MET C 105 4.976 20.074 6.053 1.00 0.00 H new ATOM 0 HG3 MET C 105 5.020 21.140 4.662 1.00 0.00 H new ATOM 0 HE1 MET C 105 3.450 19.910 1.971 1.00 0.00 H new ATOM 0 HE2 MET C 105 5.014 20.566 2.511 1.00 0.00 H new ATOM 0 HE3 MET C 105 4.927 18.930 1.815 1.00 0.00 H new ATOM 3484 N ALA C 106 6.203 16.563 5.256 1.00 0.00 N ATOM 3485 CA ALA C 106 5.216 15.452 5.381 1.00 0.00 C ATOM 3486 C ALA C 106 5.460 14.666 6.670 1.00 0.00 C ATOM 3487 O ALA C 106 4.534 14.258 7.340 1.00 0.00 O ATOM 3488 CB ALA C 106 5.458 14.564 4.159 1.00 0.00 C ATOM 0 H ALA C 106 6.949 16.407 4.578 1.00 0.00 H new ATOM 0 HA ALA C 106 4.190 15.818 5.423 1.00 0.00 H new ATOM 0 HB1 ALA C 106 4.767 13.721 4.179 1.00 0.00 H new ATOM 0 HB2 ALA C 106 5.296 15.144 3.250 1.00 0.00 H new ATOM 0 HB3 ALA C 106 6.483 14.194 4.176 1.00 0.00 H new ATOM 3494 N ALA C 107 6.696 14.451 7.026 1.00 0.00 N ATOM 3495 CA ALA C 107 6.986 13.692 8.270 1.00 0.00 C ATOM 3496 C ALA C 107 6.566 14.506 9.493 1.00 0.00 C ATOM 3497 O ALA C 107 5.918 14.007 10.391 1.00 0.00 O ATOM 3498 CB ALA C 107 8.497 13.483 8.261 1.00 0.00 C ATOM 0 H ALA C 107 7.516 14.768 6.509 1.00 0.00 H new ATOM 0 HA ALA C 107 6.444 12.748 8.315 1.00 0.00 H new ATOM 0 HB1 ALA C 107 8.793 12.928 9.151 1.00 0.00 H new ATOM 0 HB2 ALA C 107 8.781 12.921 7.371 1.00 0.00 H new ATOM 0 HB3 ALA C 107 8.998 14.451 8.254 1.00 0.00 H new ATOM 3504 N ASN C 108 6.932 15.756 9.536 1.00 0.00 N ATOM 3505 CA ASN C 108 6.552 16.599 10.702 1.00 0.00 C ATOM 3506 C ASN C 108 5.028 16.661 10.827 1.00 0.00 C ATOM 3507 O ASN C 108 4.484 16.715 11.913 1.00 0.00 O ATOM 3508 CB ASN C 108 7.124 17.984 10.396 1.00 0.00 C ATOM 3509 CG ASN C 108 6.550 19.003 11.383 1.00 0.00 C ATOM 3510 OD1 ASN C 108 5.390 19.356 11.303 1.00 0.00 O ATOM 3511 ND2 ASN C 108 7.319 19.493 12.316 1.00 0.00 N ATOM 0 H ASN C 108 7.477 16.229 8.815 1.00 0.00 H new ATOM 0 HA ASN C 108 6.934 16.203 11.643 1.00 0.00 H new ATOM 0 HB2 ASN C 108 8.211 17.964 10.469 1.00 0.00 H new ATOM 0 HB3 ASN C 108 6.878 18.273 9.374 1.00 0.00 H new ATOM 0 HD21 ASN C 108 6.947 20.173 12.979 1.00 0.00 H new ATOM 0 HD22 ASN C 108 8.293 19.196 12.383 1.00 0.00 H new ATOM 3518 N PHE C 109 4.334 16.651 9.721 1.00 0.00 N ATOM 3519 CA PHE C 109 2.845 16.706 9.772 1.00 0.00 C ATOM 3520 C PHE C 109 2.277 15.323 10.105 1.00 0.00 C ATOM 3521 O PHE C 109 1.188 15.200 10.629 1.00 0.00 O ATOM 3522 CB PHE C 109 2.418 17.137 8.367 1.00 0.00 C ATOM 3523 CG PHE C 109 0.951 16.839 8.170 1.00 0.00 C ATOM 3524 CD1 PHE C 109 -0.010 17.800 8.504 1.00 0.00 C ATOM 3525 CD2 PHE C 109 0.552 15.601 7.651 1.00 0.00 C ATOM 3526 CE1 PHE C 109 -1.370 17.524 8.319 1.00 0.00 C ATOM 3527 CE2 PHE C 109 -0.808 15.325 7.467 1.00 0.00 C ATOM 3528 CZ PHE C 109 -1.769 16.287 7.802 1.00 0.00 C ATOM 0 H PHE C 109 4.734 16.607 8.784 1.00 0.00 H new ATOM 0 HA PHE C 109 2.482 17.392 10.537 1.00 0.00 H new ATOM 0 HB2 PHE C 109 2.605 18.202 8.230 1.00 0.00 H new ATOM 0 HB3 PHE C 109 3.010 16.611 7.618 1.00 0.00 H new ATOM 0 HD1 PHE C 109 0.298 18.755 8.905 1.00 0.00 H new ATOM 0 HD2 PHE C 109 1.293 14.859 7.393 1.00 0.00 H new ATOM 0 HE1 PHE C 109 -2.111 18.266 8.576 1.00 0.00 H new ATOM 0 HE2 PHE C 109 -1.116 14.370 7.067 1.00 0.00 H new ATOM 0 HZ PHE C 109 -2.818 16.074 7.661 1.00 0.00 H new ATOM 3538 N LEU C 110 3.006 14.284 9.804 1.00 0.00 N ATOM 3539 CA LEU C 110 2.507 12.911 10.103 1.00 0.00 C ATOM 3540 C LEU C 110 2.768 12.560 11.570 1.00 0.00 C ATOM 3541 O LEU C 110 2.526 11.452 12.006 1.00 0.00 O ATOM 3542 CB LEU C 110 3.308 11.990 9.181 1.00 0.00 C ATOM 3543 CG LEU C 110 2.915 12.255 7.727 1.00 0.00 C ATOM 3544 CD1 LEU C 110 4.045 11.802 6.802 1.00 0.00 C ATOM 3545 CD2 LEU C 110 1.642 11.476 7.393 1.00 0.00 C ATOM 0 H LEU C 110 3.925 14.326 9.364 1.00 0.00 H new ATOM 0 HA LEU C 110 1.433 12.818 9.941 1.00 0.00 H new ATOM 0 HB2 LEU C 110 4.376 12.161 9.317 1.00 0.00 H new ATOM 0 HB3 LEU C 110 3.117 10.948 9.436 1.00 0.00 H new ATOM 0 HG LEU C 110 2.737 13.321 7.588 1.00 0.00 H new ATOM 0 HD11 LEU C 110 3.765 11.991 5.766 1.00 0.00 H new ATOM 0 HD12 LEU C 110 4.953 12.356 7.039 1.00 0.00 H new ATOM 0 HD13 LEU C 110 4.224 10.736 6.941 1.00 0.00 H new ATOM 0 HD21 LEU C 110 1.361 11.665 6.357 1.00 0.00 H new ATOM 0 HD22 LEU C 110 1.821 10.410 7.532 1.00 0.00 H new ATOM 0 HD23 LEU C 110 0.835 11.798 8.052 1.00 0.00 H new ATOM 3557 N ASP C 111 3.258 13.497 12.336 1.00 0.00 N ATOM 3558 CA ASP C 111 3.531 13.218 13.774 1.00 0.00 C ATOM 3559 C ASP C 111 3.676 14.530 14.550 1.00 0.00 C ATOM 3560 O ASP C 111 4.029 15.553 13.997 1.00 0.00 O ATOM 3561 CB ASP C 111 4.846 12.437 13.785 1.00 0.00 C ATOM 3562 CG ASP C 111 6.011 13.390 13.512 1.00 0.00 C ATOM 3563 OD1 ASP C 111 5.814 14.336 12.767 1.00 0.00 O ATOM 3564 OD2 ASP C 111 7.080 13.158 14.051 1.00 0.00 O ATOM 0 H ASP C 111 3.481 14.443 12.028 1.00 0.00 H new ATOM 0 HA ASP C 111 2.723 12.659 14.246 1.00 0.00 H new ATOM 0 HB2 ASP C 111 4.982 11.947 14.749 1.00 0.00 H new ATOM 0 HB3 ASP C 111 4.821 11.652 13.030 1.00 0.00 H new ATOM 3569 N CYS C 112 3.406 14.508 15.826 1.00 0.00 N ATOM 3570 CA CYS C 112 3.528 15.755 16.635 1.00 0.00 C ATOM 3571 C CYS C 112 4.799 15.711 17.487 1.00 0.00 C ATOM 3572 O CYS C 112 5.833 16.131 16.995 1.00 0.00 O ATOM 3573 CB CYS C 112 2.286 15.771 17.527 1.00 0.00 C ATOM 3574 SG CYS C 112 2.393 17.153 18.689 1.00 0.00 S ATOM 3575 OXT CYS C 112 4.716 15.258 18.617 1.00 0.00 O ATOM 0 H CYS C 112 3.106 13.682 16.344 1.00 0.00 H new ATOM 0 HA CYS C 112 3.594 16.647 16.012 1.00 0.00 H new ATOM 0 HB2 CYS C 112 1.388 15.865 16.916 1.00 0.00 H new ATOM 0 HB3 CYS C 112 2.204 14.830 18.071 1.00 0.00 H new ATOM 0 HG CYS C 112 3.510 17.078 19.350 1.00 0.00 H new