USER MOD reduce.3.24.130724 H: found=0, std=0, add=1238, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 1232 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: B 70 HIS : no HE2:sc= -5.04! C(o=-2.2!,f=-21!) USER MOD Set 1.2: B 106 LYS NZ :NH3+ -161:sc= 2.87 (180deg=1.14) USER MOD Set 2.1: B 81 ASN : amide:sc= 0.829 K(o=1.5,f=0.65) USER MOD Set 2.2: B 84 THR OG1 : rot 74:sc= 0.712 USER MOD Set 3.1: B 45 HIS : no HE2:sc= -3.03! C(o=-2.8!,f=-5.4!) USER MOD Set 3.2: B 75 THR OG1 : rot -135:sc= 0.201 USER MOD Set 4.1: B 66 GLN : amide:sc= -4.81! C(o=-7.6!,f=-11!) USER MOD Set 4.2: B 76 ASN : amide:sc= -2.78! C(o=-7.6!,f=-12!) USER MOD Set 5.1: A 129 SER OG : rot 94:sc= 1.89 USER MOD Set 5.2: B 60 LYS NZ :NH3+ 177:sc= 0.421! (180deg=-0.65!) USER MOD Set 5.3: B 62 LYS NZ :NH3+ -161:sc= -1.66! (180deg=-3.07!) USER MOD Set 5.4: B 64 GLN : amide:sc= -1.24! C(o=-0.58!,f=-12!) USER MOD Set 6.1: B 51 LYS NZ :NH3+ -138:sc= 2.29 (180deg=1.06) USER MOD Set 6.2: B 108 ASN : amide:sc= 1.19 K(o=3.5,f=-11!) USER MOD Set 7.1: B 1 MET N :NH3+ 154:sc= 2 (180deg=-0.116!) USER MOD Set 7.2: B 4 SER OG : rot -150:sc= 1.01 USER MOD Single : A 110 HIS : no HE2:sc= -0.426 K(o=-0.43,f=-9.4!) USER MOD Single : A 111 HIS : no HE2:sc= -1.87! C(o=-1.9!,f=-6!) USER MOD Single : A 113 LYS NZ :NH3+ 165:sc= 1.61! (180deg=0.82!) USER MOD Single : A 117 THR OG1 : rot -50:sc= 0.733 USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 SER OG : rot 78:sc= 1.14 USER MOD Single : A 123 ASN : amide:sc= -2.63! X(o=-2.6!,f=-2.3) USER MOD Single : A 131 ASN :FLIP amide:sc= -0.0135 F(o=-3.1!,f=-0.014) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 150 SER OG : rot 42:sc= 2.05 USER MOD Single : A 151 THR OG1 : rot 67:sc= 0.526 USER MOD Single : A 154 SER OG : rot 10:sc= 0.393 USER MOD Single : A 156 SER OG : rot 180:sc= -0.0652 USER MOD Single : B 1 MET CE :methyl -169:sc= 0 (180deg=-0.127) USER MOD Single : B 3 THR OG1 : rot 180:sc= -0.103 USER MOD Single : B 5 SER OG : rot 180:sc= 0 USER MOD Single : B 13 LYS NZ :NH3+ -169:sc= 0.823 (180deg=0.555) USER MOD Single : B 14 LYS NZ :NH3+ -167:sc= 0.811 (180deg=0.445) USER MOD Single : B 17 GLN : amide:sc= -0.325 K(o=-0.32,f=-4.8!) USER MOD Single : B 18 LYS NZ :NH3+ -171:sc= 3.59 (180deg=2.76) USER MOD Single : B 19 LYS NZ :NH3+ -137:sc= 1.97 (180deg=-1.71) USER MOD Single : B 20 GLN :FLIP amide:sc= -0.0494 F(o=-1.7!,f=-0.049) USER MOD Single : B 25 TYR OH : rot 180:sc= 0 USER MOD Single : B 27 MET CE :methyl -113:sc= -1.47 (180deg=-4.51!) USER MOD Single : B 38 LYS NZ :NH3+ 173:sc= 1.13 (180deg=0.912) USER MOD Single : B 42 THR OG1 : rot 170:sc= -1.03 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 46 MET CE :methyl -155:sc= -0.213 (180deg=-0.901) USER MOD Single : B 47 TYR OH : rot 174:sc= 1.21 USER MOD Single : B 52 CYS SG : rot 33:sc= 0.815 USER MOD Single : B 53 GLN : amide:sc= -6.99! C(o=-7!,f=-11!) USER MOD Single : B 54 LYS NZ :NH3+ 164:sc= 1.04 (180deg=0.744) USER MOD Single : B 56 SER OG : rot 24:sc= -0.179! USER MOD Single : B 74 THR OG1 : rot 180:sc= 0 USER MOD Single : B 78 HIS : no HE2:sc= -3.28 K(o=-3.3,f=-4.5) USER MOD Single : B 80 SER OG : rot 15:sc= -2.49! USER MOD Single : B 83 SER OG : rot 59:sc= 1.05 USER MOD Single : B 87 LYS NZ :NH3+ -165:sc= 1.27 (180deg=1.22) USER MOD Single : B 93 LYS NZ :NH3+ -143:sc= 2.2 (180deg=-1.46) USER MOD Single : B 97 GLN :FLIP amide:sc= -1.36 F(o=-3.2!,f=-1.4) USER MOD Single : B 98 GLN : amide:sc= 1.12 K(o=1.1,f=-0.016) USER MOD Single : B 102 LYS NZ :NH3+ -136:sc= 1.14 (180deg=-0.582!) USER MOD Single : B 104 LYS NZ :NH3+ -170:sc= 2.24 (180deg=1.59) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 109 19.165 10.455 4.347 1.00 0.00 N ATOM 2 CA ALA A 109 20.565 10.119 4.684 1.00 0.00 C ATOM 3 C ALA A 109 20.997 10.830 5.959 1.00 0.00 C ATOM 4 O ALA A 109 21.605 10.230 6.848 1.00 0.00 O ATOM 5 CB ALA A 109 21.489 10.492 3.536 1.00 0.00 C ATOM 0 HA ALA A 109 20.628 9.044 4.851 1.00 0.00 H new ATOM 0 HB1 ALA A 109 22.516 10.239 3.799 1.00 0.00 H new ATOM 0 HB2 ALA A 109 21.197 9.943 2.641 1.00 0.00 H new ATOM 0 HB3 ALA A 109 21.417 11.563 3.344 1.00 0.00 H new ATOM 11 N HIS A 110 20.681 12.113 6.050 1.00 0.00 N ATOM 12 CA HIS A 110 21.038 12.902 7.215 1.00 0.00 C ATOM 13 C HIS A 110 19.924 12.830 8.245 1.00 0.00 C ATOM 14 O HIS A 110 19.088 13.729 8.319 1.00 0.00 O ATOM 15 CB HIS A 110 21.289 14.367 6.837 1.00 0.00 C ATOM 16 CG HIS A 110 22.191 14.562 5.656 1.00 0.00 C ATOM 17 ND1 HIS A 110 21.801 15.189 4.496 1.00 0.00 N ATOM 18 CD2 HIS A 110 23.489 14.216 5.475 1.00 0.00 C ATOM 19 CE1 HIS A 110 22.847 15.208 3.663 1.00 0.00 C ATOM 20 NE2 HIS A 110 23.900 14.629 4.211 1.00 0.00 N ATOM 0 H HIS A 110 20.177 12.629 5.329 1.00 0.00 H new ATOM 0 HA HIS A 110 21.957 12.491 7.633 1.00 0.00 H new ATOM 0 HB2 HIS A 110 20.331 14.844 6.628 1.00 0.00 H new ATOM 0 HB3 HIS A 110 21.721 14.881 7.696 1.00 0.00 H new ATOM 0 HD1 HIS A 110 20.876 15.573 4.304 1.00 0.00 H new ATOM 0 HD2 HIS A 110 24.106 13.702 6.197 1.00 0.00 H new ATOM 0 HE1 HIS A 110 22.833 15.640 2.673 1.00 0.00 H new ATOM 28 N HIS A 111 19.899 11.752 9.017 1.00 0.00 N ATOM 29 CA HIS A 111 18.882 11.570 10.049 1.00 0.00 C ATOM 30 C HIS A 111 18.884 12.762 11.007 1.00 0.00 C ATOM 31 O HIS A 111 19.900 13.049 11.653 1.00 0.00 O ATOM 32 CB HIS A 111 19.127 10.264 10.817 1.00 0.00 C ATOM 33 CG HIS A 111 17.905 9.732 11.505 1.00 0.00 C ATOM 34 ND1 HIS A 111 17.258 8.573 11.137 1.00 0.00 N ATOM 35 CD2 HIS A 111 17.213 10.225 12.563 1.00 0.00 C ATOM 36 CE1 HIS A 111 16.217 8.403 11.960 1.00 0.00 C ATOM 37 NE2 HIS A 111 16.146 9.379 12.846 1.00 0.00 N ATOM 0 H HIS A 111 20.572 10.988 8.950 1.00 0.00 H new ATOM 0 HA HIS A 111 17.905 11.509 9.570 1.00 0.00 H new ATOM 0 HB2 HIS A 111 19.501 9.510 10.124 1.00 0.00 H new ATOM 0 HB3 HIS A 111 19.908 10.430 11.559 1.00 0.00 H new ATOM 0 HD1 HIS A 111 17.525 7.954 10.372 1.00 0.00 H new ATOM 0 HD2 HIS A 111 17.453 11.131 13.100 1.00 0.00 H new ATOM 0 HE1 HIS A 111 15.525 7.575 11.906 1.00 0.00 H new ATOM 45 N LEU A 112 17.759 13.482 11.042 1.00 0.00 N ATOM 46 CA LEU A 112 17.588 14.660 11.899 1.00 0.00 C ATOM 47 C LEU A 112 18.472 15.808 11.421 1.00 0.00 C ATOM 48 O LEU A 112 18.617 16.820 12.105 1.00 0.00 O ATOM 49 CB LEU A 112 17.892 14.332 13.368 1.00 0.00 C ATOM 50 CG LEU A 112 16.913 13.366 14.035 1.00 0.00 C ATOM 51 CD1 LEU A 112 17.409 12.984 15.422 1.00 0.00 C ATOM 52 CD2 LEU A 112 15.524 13.982 14.114 1.00 0.00 C ATOM 0 H LEU A 112 16.939 13.264 10.476 1.00 0.00 H new ATOM 0 HA LEU A 112 16.545 14.968 11.830 1.00 0.00 H new ATOM 0 HB2 LEU A 112 18.894 13.908 13.429 1.00 0.00 H new ATOM 0 HB3 LEU A 112 17.904 15.262 13.936 1.00 0.00 H new ATOM 0 HG LEU A 112 16.851 12.462 13.429 1.00 0.00 H new ATOM 0 HD11 LEU A 112 16.702 12.296 15.885 1.00 0.00 H new ATOM 0 HD12 LEU A 112 18.383 12.502 15.340 1.00 0.00 H new ATOM 0 HD13 LEU A 112 17.498 13.880 16.036 1.00 0.00 H new ATOM 0 HD21 LEU A 112 14.841 13.280 14.592 1.00 0.00 H new ATOM 0 HD22 LEU A 112 15.566 14.901 14.698 1.00 0.00 H new ATOM 0 HD23 LEU A 112 15.168 14.207 13.109 1.00 0.00 H new ATOM 64 N LYS A 113 19.065 15.626 10.241 1.00 0.00 N ATOM 65 CA LYS A 113 19.946 16.617 9.622 1.00 0.00 C ATOM 66 C LYS A 113 21.132 16.956 10.522 1.00 0.00 C ATOM 67 O LYS A 113 21.771 17.998 10.365 1.00 0.00 O ATOM 68 CB LYS A 113 19.165 17.887 9.256 1.00 0.00 C ATOM 69 CG LYS A 113 18.426 17.792 7.926 1.00 0.00 C ATOM 70 CD LYS A 113 17.290 16.782 7.983 1.00 0.00 C ATOM 71 CE LYS A 113 17.119 16.054 6.660 1.00 0.00 C ATOM 72 NZ LYS A 113 16.972 14.589 6.853 1.00 0.00 N ATOM 0 H LYS A 113 18.947 14.780 9.683 1.00 0.00 H new ATOM 0 HA LYS A 113 20.341 16.177 8.706 1.00 0.00 H new ATOM 0 HB2 LYS A 113 18.446 18.101 10.046 1.00 0.00 H new ATOM 0 HB3 LYS A 113 19.856 18.729 9.218 1.00 0.00 H new ATOM 0 HG2 LYS A 113 18.029 18.772 7.660 1.00 0.00 H new ATOM 0 HG3 LYS A 113 19.126 17.508 7.140 1.00 0.00 H new ATOM 0 HD2 LYS A 113 17.486 16.058 8.774 1.00 0.00 H new ATOM 0 HD3 LYS A 113 16.362 17.292 8.240 1.00 0.00 H new ATOM 0 HE2 LYS A 113 16.242 16.442 6.142 1.00 0.00 H new ATOM 0 HE3 LYS A 113 17.980 16.252 6.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 16.609 14.158 5.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 17.897 14.175 7.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 16.307 14.406 7.631 1.00 0.00 H new ATOM 86 N ARG A 114 21.438 16.064 11.455 1.00 0.00 N ATOM 87 CA ARG A 114 22.547 16.287 12.368 1.00 0.00 C ATOM 88 C ARG A 114 23.266 14.985 12.700 1.00 0.00 C ATOM 89 O ARG A 114 24.450 14.997 13.031 1.00 0.00 O ATOM 90 CB ARG A 114 22.057 16.971 13.647 1.00 0.00 C ATOM 91 CG ARG A 114 23.117 17.828 14.325 1.00 0.00 C ATOM 92 CD ARG A 114 23.809 18.756 13.333 1.00 0.00 C ATOM 93 NE ARG A 114 25.097 18.220 12.887 1.00 0.00 N ATOM 94 CZ ARG A 114 25.419 17.999 11.609 1.00 0.00 C ATOM 95 NH1 ARG A 114 24.545 18.253 10.640 1.00 0.00 N ATOM 96 NH2 ARG A 114 26.615 17.511 11.302 1.00 0.00 N ATOM 0 H ARG A 114 20.938 15.187 11.598 1.00 0.00 H new ATOM 0 HA ARG A 114 23.262 16.943 11.871 1.00 0.00 H new ATOM 0 HB2 ARG A 114 21.196 17.595 13.408 1.00 0.00 H new ATOM 0 HB3 ARG A 114 21.715 16.210 14.348 1.00 0.00 H new ATOM 0 HG2 ARG A 114 22.656 18.419 15.116 1.00 0.00 H new ATOM 0 HG3 ARG A 114 23.858 17.184 14.799 1.00 0.00 H new ATOM 0 HD2 ARG A 114 23.162 18.911 12.469 1.00 0.00 H new ATOM 0 HD3 ARG A 114 23.963 19.731 13.795 1.00 0.00 H new ATOM 0 HE ARG A 114 25.794 18.001 13.599 1.00 0.00 H new ATOM 0 HH11 ARG A 114 23.621 18.619 10.870 1.00 0.00 H new ATOM 0 HH12 ARG A 114 24.798 18.082 9.667 1.00 0.00 H new ATOM 0 HH21 ARG A 114 27.287 17.305 12.041 1.00 0.00 H new ATOM 0 HH22 ARG A 114 26.862 17.342 10.327 1.00 0.00 H new ATOM 110 N GLY A 115 22.553 13.867 12.600 1.00 0.00 N ATOM 111 CA GLY A 115 23.156 12.578 12.889 1.00 0.00 C ATOM 112 C GLY A 115 24.136 12.146 11.815 1.00 0.00 C ATOM 113 O GLY A 115 24.984 11.288 12.046 1.00 0.00 O ATOM 0 H GLY A 115 21.571 13.830 12.325 1.00 0.00 H new ATOM 0 HA2 GLY A 115 23.671 12.627 13.849 1.00 0.00 H new ATOM 0 HA3 GLY A 115 22.372 11.827 12.986 1.00 0.00 H new ATOM 117 N ALA A 116 24.017 12.746 10.639 1.00 0.00 N ATOM 118 CA ALA A 116 24.894 12.428 9.523 1.00 0.00 C ATOM 119 C ALA A 116 25.098 13.656 8.649 1.00 0.00 C ATOM 120 O ALA A 116 24.312 14.605 8.706 1.00 0.00 O ATOM 121 CB ALA A 116 24.320 11.282 8.702 1.00 0.00 C ATOM 0 H ALA A 116 23.317 13.459 10.433 1.00 0.00 H new ATOM 0 HA ALA A 116 25.860 12.116 9.919 1.00 0.00 H new ATOM 0 HB1 ALA A 116 24.990 11.058 7.872 1.00 0.00 H new ATOM 0 HB2 ALA A 116 24.216 10.399 9.333 1.00 0.00 H new ATOM 0 HB3 ALA A 116 23.342 11.567 8.313 1.00 0.00 H new ATOM 127 N THR A 117 26.165 13.647 7.864 1.00 0.00 N ATOM 128 CA THR A 117 26.477 14.750 6.966 1.00 0.00 C ATOM 129 C THR A 117 27.318 14.249 5.793 1.00 0.00 C ATOM 130 O THR A 117 28.454 13.816 5.975 1.00 0.00 O ATOM 131 CB THR A 117 27.227 15.887 7.698 1.00 0.00 C ATOM 132 OG1 THR A 117 26.460 16.327 8.829 1.00 0.00 O ATOM 133 CG2 THR A 117 27.478 17.065 6.768 1.00 0.00 C ATOM 0 H THR A 117 26.836 12.880 7.831 1.00 0.00 H new ATOM 0 HA THR A 117 25.534 15.152 6.596 1.00 0.00 H new ATOM 0 HB THR A 117 28.189 15.498 8.032 1.00 0.00 H new ATOM 0 HG1 THR A 117 25.539 16.508 8.549 1.00 0.00 H new ATOM 0 HG21 THR A 117 28.007 17.850 7.309 1.00 0.00 H new ATOM 0 HG22 THR A 117 28.082 16.738 5.921 1.00 0.00 H new ATOM 0 HG23 THR A 117 26.526 17.452 6.406 1.00 0.00 H new ATOM 141 N MET A 118 26.738 14.283 4.602 1.00 0.00 N ATOM 142 CA MET A 118 27.425 13.833 3.399 1.00 0.00 C ATOM 143 C MET A 118 27.265 14.857 2.277 1.00 0.00 C ATOM 144 O MET A 118 28.184 15.622 1.995 1.00 0.00 O ATOM 145 CB MET A 118 26.879 12.467 2.960 1.00 0.00 C ATOM 146 CG MET A 118 27.546 11.904 1.713 1.00 0.00 C ATOM 147 SD MET A 118 26.476 11.978 0.259 1.00 0.00 S ATOM 148 CE MET A 118 27.453 11.052 -0.924 1.00 0.00 C ATOM 0 H MET A 118 25.788 14.619 4.442 1.00 0.00 H new ATOM 0 HA MET A 118 28.487 13.731 3.621 1.00 0.00 H new ATOM 0 HB2 MET A 118 27.004 11.758 3.778 1.00 0.00 H new ATOM 0 HB3 MET A 118 25.808 12.557 2.777 1.00 0.00 H new ATOM 0 HG2 MET A 118 28.463 12.459 1.514 1.00 0.00 H new ATOM 0 HG3 MET A 118 27.834 10.869 1.895 1.00 0.00 H new ATOM 0 HE1 MET A 118 26.925 11.008 -1.877 1.00 0.00 H new ATOM 0 HE2 MET A 118 28.416 11.543 -1.065 1.00 0.00 H new ATOM 0 HE3 MET A 118 27.613 10.040 -0.551 1.00 0.00 H new ATOM 158 N ASN A 119 26.085 14.869 1.662 1.00 0.00 N ATOM 159 CA ASN A 119 25.774 15.784 0.563 1.00 0.00 C ATOM 160 C ASN A 119 24.363 15.517 0.064 1.00 0.00 C ATOM 161 O ASN A 119 23.522 16.411 0.022 1.00 0.00 O ATOM 162 CB ASN A 119 26.766 15.615 -0.600 1.00 0.00 C ATOM 163 CG ASN A 119 26.473 16.548 -1.763 1.00 0.00 C ATOM 164 OD1 ASN A 119 26.898 17.700 -1.773 1.00 0.00 O ATOM 165 ND2 ASN A 119 25.752 16.053 -2.761 1.00 0.00 N ATOM 0 H ASN A 119 25.317 14.246 1.910 1.00 0.00 H new ATOM 0 HA ASN A 119 25.853 16.805 0.937 1.00 0.00 H new ATOM 0 HB2 ASN A 119 27.778 15.799 -0.238 1.00 0.00 H new ATOM 0 HB3 ASN A 119 26.735 14.583 -0.951 1.00 0.00 H new ATOM 0 HD21 ASN A 119 25.534 16.634 -3.570 1.00 0.00 H new ATOM 0 HD22 ASN A 119 25.415 15.091 -2.719 1.00 0.00 H new ATOM 172 N GLU A 120 24.118 14.269 -0.305 1.00 0.00 N ATOM 173 CA GLU A 120 22.816 13.852 -0.801 1.00 0.00 C ATOM 174 C GLU A 120 21.975 13.344 0.371 1.00 0.00 C ATOM 175 O GLU A 120 22.528 12.844 1.352 1.00 0.00 O ATOM 176 CB GLU A 120 23.002 12.770 -1.868 1.00 0.00 C ATOM 177 CG GLU A 120 21.999 12.851 -3.005 1.00 0.00 C ATOM 178 CD GLU A 120 20.621 12.423 -2.571 1.00 0.00 C ATOM 179 OE1 GLU A 120 20.423 11.216 -2.349 1.00 0.00 O ATOM 180 OE2 GLU A 120 19.747 13.297 -2.397 1.00 0.00 O ATOM 0 H GLU A 120 24.811 13.521 -0.269 1.00 0.00 H new ATOM 0 HA GLU A 120 22.295 14.692 -1.259 1.00 0.00 H new ATOM 0 HB2 GLU A 120 24.009 12.847 -2.278 1.00 0.00 H new ATOM 0 HB3 GLU A 120 22.924 11.791 -1.396 1.00 0.00 H new ATOM 0 HG2 GLU A 120 21.960 13.873 -3.382 1.00 0.00 H new ATOM 0 HG3 GLU A 120 22.332 12.220 -3.829 1.00 0.00 H new ATOM 187 N ASP A 121 20.652 13.448 0.271 1.00 0.00 N ATOM 188 CA ASP A 121 19.779 13.030 1.370 1.00 0.00 C ATOM 189 C ASP A 121 18.678 12.061 0.930 1.00 0.00 C ATOM 190 O ASP A 121 18.092 11.367 1.761 1.00 0.00 O ATOM 191 CB ASP A 121 19.136 14.260 2.012 1.00 0.00 C ATOM 192 CG ASP A 121 19.130 14.183 3.523 1.00 0.00 C ATOM 193 OD1 ASP A 121 19.277 13.068 4.060 1.00 0.00 O ATOM 194 OD2 ASP A 121 19.012 15.240 4.178 1.00 0.00 O ATOM 0 H ASP A 121 20.164 13.813 -0.547 1.00 0.00 H new ATOM 0 HA ASP A 121 20.408 12.501 2.086 1.00 0.00 H new ATOM 0 HB2 ASP A 121 19.675 15.154 1.698 1.00 0.00 H new ATOM 0 HB3 ASP A 121 18.112 14.362 1.652 1.00 0.00 H new ATOM 199 N SER A 122 18.416 11.986 -0.367 1.00 0.00 N ATOM 200 CA SER A 122 17.358 11.121 -0.888 1.00 0.00 C ATOM 201 C SER A 122 17.810 9.664 -1.024 1.00 0.00 C ATOM 202 O SER A 122 17.063 8.820 -1.521 1.00 0.00 O ATOM 203 CB SER A 122 16.891 11.642 -2.249 1.00 0.00 C ATOM 204 OG SER A 122 17.039 13.052 -2.335 1.00 0.00 O ATOM 0 H SER A 122 18.920 12.512 -1.081 1.00 0.00 H new ATOM 0 HA SER A 122 16.537 11.143 -0.172 1.00 0.00 H new ATOM 0 HB2 SER A 122 17.466 11.164 -3.042 1.00 0.00 H new ATOM 0 HB3 SER A 122 15.847 11.373 -2.406 1.00 0.00 H new ATOM 0 HG SER A 122 17.978 13.272 -2.508 1.00 0.00 H new ATOM 210 N ASN A 123 19.016 9.366 -0.566 1.00 0.00 N ATOM 211 CA ASN A 123 19.558 8.013 -0.660 1.00 0.00 C ATOM 212 C ASN A 123 19.175 7.161 0.549 1.00 0.00 C ATOM 213 O ASN A 123 20.037 6.631 1.249 1.00 0.00 O ATOM 214 CB ASN A 123 21.083 8.047 -0.841 1.00 0.00 C ATOM 215 CG ASN A 123 21.782 8.965 0.144 1.00 0.00 C ATOM 216 OD1 ASN A 123 22.312 8.524 1.161 1.00 0.00 O ATOM 217 ND2 ASN A 123 21.793 10.253 -0.156 1.00 0.00 N ATOM 0 H ASN A 123 19.641 10.041 -0.125 1.00 0.00 H new ATOM 0 HA ASN A 123 19.115 7.547 -1.540 1.00 0.00 H new ATOM 0 HB2 ASN A 123 21.478 7.037 -0.730 1.00 0.00 H new ATOM 0 HB3 ASN A 123 21.315 8.370 -1.856 1.00 0.00 H new ATOM 0 HD21 ASN A 123 22.252 10.918 0.466 1.00 0.00 H new ATOM 0 HD22 ASN A 123 21.342 10.582 -1.010 1.00 0.00 H new ATOM 224 N GLU A 124 17.866 7.043 0.775 1.00 0.00 N ATOM 225 CA GLU A 124 17.311 6.239 1.866 1.00 0.00 C ATOM 226 C GLU A 124 17.632 6.800 3.253 1.00 0.00 C ATOM 227 O GLU A 124 18.306 7.828 3.391 1.00 0.00 O ATOM 228 CB GLU A 124 17.792 4.787 1.765 1.00 0.00 C ATOM 229 CG GLU A 124 16.730 3.827 1.254 1.00 0.00 C ATOM 230 CD GLU A 124 15.481 3.839 2.112 1.00 0.00 C ATOM 231 OE1 GLU A 124 15.613 3.943 3.352 1.00 0.00 O ATOM 232 OE2 GLU A 124 14.370 3.756 1.548 1.00 0.00 O ATOM 0 H GLU A 124 17.157 7.504 0.204 1.00 0.00 H new ATOM 0 HA GLU A 124 16.228 6.277 1.751 1.00 0.00 H new ATOM 0 HB2 GLU A 124 18.657 4.745 1.103 1.00 0.00 H new ATOM 0 HB3 GLU A 124 18.127 4.455 2.748 1.00 0.00 H new ATOM 0 HG2 GLU A 124 16.467 4.092 0.230 1.00 0.00 H new ATOM 0 HG3 GLU A 124 17.139 2.817 1.227 1.00 0.00 H new ATOM 239 N GLU A 125 17.116 6.095 4.266 1.00 0.00 N ATOM 240 CA GLU A 125 17.280 6.435 5.682 1.00 0.00 C ATOM 241 C GLU A 125 16.987 7.904 5.968 1.00 0.00 C ATOM 242 O GLU A 125 17.878 8.753 5.962 1.00 0.00 O ATOM 243 CB GLU A 125 18.664 6.052 6.204 1.00 0.00 C ATOM 244 CG GLU A 125 18.605 5.333 7.545 1.00 0.00 C ATOM 245 CD GLU A 125 17.504 5.870 8.448 1.00 0.00 C ATOM 246 OE1 GLU A 125 16.338 5.421 8.311 1.00 0.00 O ATOM 247 OE2 GLU A 125 17.794 6.753 9.278 1.00 0.00 O ATOM 0 H GLU A 125 16.560 5.253 4.119 1.00 0.00 H new ATOM 0 HA GLU A 125 16.539 5.843 6.220 1.00 0.00 H new ATOM 0 HB2 GLU A 125 19.159 5.412 5.474 1.00 0.00 H new ATOM 0 HB3 GLU A 125 19.272 6.951 6.304 1.00 0.00 H new ATOM 0 HG2 GLU A 125 18.444 4.268 7.376 1.00 0.00 H new ATOM 0 HG3 GLU A 125 19.566 5.434 8.050 1.00 0.00 H new ATOM 254 N GLU A 126 15.727 8.178 6.248 1.00 0.00 N ATOM 255 CA GLU A 126 15.263 9.522 6.531 1.00 0.00 C ATOM 256 C GLU A 126 14.090 9.476 7.499 1.00 0.00 C ATOM 257 O GLU A 126 13.578 8.400 7.805 1.00 0.00 O ATOM 258 CB GLU A 126 14.819 10.189 5.234 1.00 0.00 C ATOM 259 CG GLU A 126 15.944 10.856 4.470 1.00 0.00 C ATOM 260 CD GLU A 126 16.418 12.109 5.155 1.00 0.00 C ATOM 261 OE1 GLU A 126 15.844 13.188 4.891 1.00 0.00 O ATOM 262 OE2 GLU A 126 17.347 12.021 5.978 1.00 0.00 O ATOM 0 H GLU A 126 14.993 7.471 6.286 1.00 0.00 H new ATOM 0 HA GLU A 126 16.076 10.092 6.980 1.00 0.00 H new ATOM 0 HB2 GLU A 126 14.352 9.441 4.594 1.00 0.00 H new ATOM 0 HB3 GLU A 126 14.057 10.934 5.462 1.00 0.00 H new ATOM 0 HG2 GLU A 126 16.777 10.160 4.368 1.00 0.00 H new ATOM 0 HG3 GLU A 126 15.606 11.098 3.463 1.00 0.00 H new ATOM 269 N GLU A 127 13.664 10.640 7.969 1.00 0.00 N ATOM 270 CA GLU A 127 12.528 10.733 8.880 1.00 0.00 C ATOM 271 C GLU A 127 11.244 10.554 8.077 1.00 0.00 C ATOM 272 O GLU A 127 10.571 11.524 7.713 1.00 0.00 O ATOM 273 CB GLU A 127 12.514 12.087 9.604 1.00 0.00 C ATOM 274 CG GLU A 127 13.894 12.595 10.007 1.00 0.00 C ATOM 275 CD GLU A 127 14.598 13.346 8.888 1.00 0.00 C ATOM 276 OE1 GLU A 127 14.040 13.420 7.770 1.00 0.00 O ATOM 277 OE2 GLU A 127 15.713 13.856 9.118 1.00 0.00 O ATOM 0 H GLU A 127 14.089 11.537 7.734 1.00 0.00 H new ATOM 0 HA GLU A 127 12.609 9.953 9.637 1.00 0.00 H new ATOM 0 HB2 GLU A 127 12.041 12.827 8.958 1.00 0.00 H new ATOM 0 HB3 GLU A 127 11.895 12.002 10.497 1.00 0.00 H new ATOM 0 HG2 GLU A 127 13.796 13.251 10.872 1.00 0.00 H new ATOM 0 HG3 GLU A 127 14.511 11.751 10.315 1.00 0.00 H new ATOM 284 N GLU A 128 10.902 9.309 7.800 1.00 0.00 N ATOM 285 CA GLU A 128 9.738 9.011 6.990 1.00 0.00 C ATOM 286 C GLU A 128 8.792 8.043 7.694 1.00 0.00 C ATOM 287 O GLU A 128 8.286 7.113 7.068 1.00 0.00 O ATOM 288 CB GLU A 128 10.199 8.423 5.652 1.00 0.00 C ATOM 289 CG GLU A 128 9.277 8.748 4.493 1.00 0.00 C ATOM 290 CD GLU A 128 9.661 10.019 3.764 1.00 0.00 C ATOM 291 OE1 GLU A 128 9.635 11.093 4.393 1.00 0.00 O ATOM 292 OE2 GLU A 128 9.974 9.948 2.559 1.00 0.00 O ATOM 0 H GLU A 128 11.414 8.489 8.125 1.00 0.00 H new ATOM 0 HA GLU A 128 9.187 9.936 6.822 1.00 0.00 H new ATOM 0 HB2 GLU A 128 11.198 8.797 5.426 1.00 0.00 H new ATOM 0 HB3 GLU A 128 10.278 7.340 5.749 1.00 0.00 H new ATOM 0 HG2 GLU A 128 9.283 7.917 3.788 1.00 0.00 H new ATOM 0 HG3 GLU A 128 8.257 8.844 4.864 1.00 0.00 H new ATOM 299 N SER A 129 8.556 8.282 8.986 1.00 0.00 N ATOM 300 CA SER A 129 7.671 7.440 9.803 1.00 0.00 C ATOM 301 C SER A 129 8.273 6.047 9.973 1.00 0.00 C ATOM 302 O SER A 129 8.840 5.485 9.041 1.00 0.00 O ATOM 303 CB SER A 129 6.267 7.373 9.199 1.00 0.00 C ATOM 304 OG SER A 129 5.768 8.681 8.938 1.00 0.00 O ATOM 0 H SER A 129 8.970 9.062 9.497 1.00 0.00 H new ATOM 0 HA SER A 129 7.578 7.891 10.791 1.00 0.00 H new ATOM 0 HB2 SER A 129 6.291 6.796 8.274 1.00 0.00 H new ATOM 0 HB3 SER A 129 5.596 6.852 9.882 1.00 0.00 H new ATOM 0 HG SER A 129 5.964 8.927 8.010 1.00 0.00 H new ATOM 310 N GLU A 130 8.147 5.482 11.162 1.00 0.00 N ATOM 311 CA GLU A 130 8.762 4.190 11.442 1.00 0.00 C ATOM 312 C GLU A 130 7.875 3.317 12.322 1.00 0.00 C ATOM 313 O GLU A 130 7.480 2.219 11.935 1.00 0.00 O ATOM 314 CB GLU A 130 10.109 4.428 12.133 1.00 0.00 C ATOM 315 CG GLU A 130 10.616 5.861 11.984 1.00 0.00 C ATOM 316 CD GLU A 130 11.467 6.059 10.735 1.00 0.00 C ATOM 317 OE1 GLU A 130 12.227 5.136 10.374 1.00 0.00 O ATOM 318 OE2 GLU A 130 11.366 7.136 10.100 1.00 0.00 O ATOM 0 H GLU A 130 7.631 5.889 11.942 1.00 0.00 H new ATOM 0 HA GLU A 130 8.903 3.662 10.499 1.00 0.00 H new ATOM 0 HB2 GLU A 130 10.013 4.192 13.193 1.00 0.00 H new ATOM 0 HB3 GLU A 130 10.849 3.743 11.719 1.00 0.00 H new ATOM 0 HG2 GLU A 130 9.765 6.541 11.950 1.00 0.00 H new ATOM 0 HG3 GLU A 130 11.202 6.128 12.864 1.00 0.00 H new ATOM 325 N ASN A 131 7.570 3.817 13.504 1.00 0.00 N ATOM 326 CA ASN A 131 6.737 3.104 14.467 1.00 0.00 C ATOM 327 C ASN A 131 5.467 3.895 14.731 1.00 0.00 C ATOM 328 O ASN A 131 5.092 4.135 15.877 1.00 0.00 O ATOM 329 CB ASN A 131 7.507 2.893 15.778 1.00 0.00 C ATOM 330 CG ASN A 131 8.337 4.107 16.187 1.00 0.00 C ATOM 331 OD1 ASN A 131 7.829 5.310 15.934 1.00 0.00 O flip ATOM 332 ND2 ASN A 131 9.428 3.964 16.734 1.00 0.00 N flip ATOM 0 H ASN A 131 7.891 4.729 13.829 1.00 0.00 H new ATOM 0 HA ASN A 131 6.473 2.130 14.056 1.00 0.00 H new ATOM 0 HB2 ASN A 131 6.800 2.659 16.574 1.00 0.00 H new ATOM 0 HB3 ASN A 131 8.164 2.030 15.671 1.00 0.00 H new ATOM 0 HD21 ASN A 131 9.789 3.027 16.914 1.00 0.00 H new ATOM 0 HD22 ASN A 131 9.972 4.782 17.008 1.00 0.00 H new ATOM 339 N ASP A 132 4.816 4.300 13.660 1.00 0.00 N ATOM 340 CA ASP A 132 3.615 5.107 13.750 1.00 0.00 C ATOM 341 C ASP A 132 2.711 4.883 12.556 1.00 0.00 C ATOM 342 O ASP A 132 2.509 5.769 11.723 1.00 0.00 O ATOM 343 CB ASP A 132 3.966 6.580 13.866 1.00 0.00 C ATOM 344 CG ASP A 132 5.300 6.963 13.225 1.00 0.00 C ATOM 345 OD1 ASP A 132 5.718 6.322 12.238 1.00 0.00 O ATOM 346 OD2 ASP A 132 5.909 7.954 13.673 1.00 0.00 O ATOM 0 H ASP A 132 5.102 4.081 12.706 1.00 0.00 H new ATOM 0 HA ASP A 132 3.079 4.799 14.648 1.00 0.00 H new ATOM 0 HB2 ASP A 132 3.173 7.168 13.404 1.00 0.00 H new ATOM 0 HB3 ASP A 132 3.992 6.853 14.921 1.00 0.00 H new ATOM 351 N TRP A 133 2.169 3.686 12.486 1.00 0.00 N ATOM 352 CA TRP A 133 1.282 3.299 11.404 1.00 0.00 C ATOM 353 C TRP A 133 0.131 2.462 11.934 1.00 0.00 C ATOM 354 O TRP A 133 0.310 1.669 12.857 1.00 0.00 O ATOM 355 CB TRP A 133 2.026 2.441 10.376 1.00 0.00 C ATOM 356 CG TRP A 133 3.415 2.870 10.016 1.00 0.00 C ATOM 357 CD1 TRP A 133 4.540 2.751 10.770 1.00 0.00 C ATOM 358 CD2 TRP A 133 3.832 3.433 8.779 1.00 0.00 C ATOM 359 NE1 TRP A 133 5.620 3.243 10.084 1.00 0.00 N ATOM 360 CE2 TRP A 133 5.212 3.670 8.864 1.00 0.00 C ATOM 361 CE3 TRP A 133 3.172 3.772 7.612 1.00 0.00 C ATOM 362 CZ2 TRP A 133 5.939 4.232 7.829 1.00 0.00 C ATOM 363 CZ3 TRP A 133 3.897 4.326 6.586 1.00 0.00 C ATOM 364 CH2 TRP A 133 5.267 4.554 6.697 1.00 0.00 C ATOM 0 H TRP A 133 2.329 2.952 13.176 1.00 0.00 H new ATOM 0 HA TRP A 133 0.914 4.216 10.944 1.00 0.00 H new ATOM 0 HB2 TRP A 133 2.074 1.421 10.756 1.00 0.00 H new ATOM 0 HB3 TRP A 133 1.432 2.414 9.463 1.00 0.00 H new ATOM 0 HD1 TRP A 133 4.577 2.330 11.764 1.00 0.00 H new ATOM 0 HE1 TRP A 133 6.577 3.282 10.435 1.00 0.00 H new ATOM 0 HE3 TRP A 133 2.110 3.605 7.510 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 7.001 4.407 7.920 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 3.392 4.592 5.669 1.00 0.00 H new ATOM 0 HH2 TRP A 133 5.802 4.994 5.868 1.00 0.00 H new ATOM 375 N GLU A 134 -1.047 2.657 11.360 1.00 0.00 N ATOM 376 CA GLU A 134 -2.194 1.847 11.704 1.00 0.00 C ATOM 377 C GLU A 134 -1.935 0.530 11.003 1.00 0.00 C ATOM 378 O GLU A 134 -2.105 0.416 9.789 1.00 0.00 O ATOM 379 CB GLU A 134 -3.501 2.483 11.211 1.00 0.00 C ATOM 380 CG GLU A 134 -3.601 3.977 11.483 1.00 0.00 C ATOM 381 CD GLU A 134 -4.697 4.648 10.674 1.00 0.00 C ATOM 382 OE1 GLU A 134 -5.879 4.492 11.031 1.00 0.00 O ATOM 383 OE2 GLU A 134 -4.370 5.336 9.679 1.00 0.00 O ATOM 0 H GLU A 134 -1.228 3.371 10.654 1.00 0.00 H new ATOM 0 HA GLU A 134 -2.313 1.736 12.782 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -3.595 2.312 10.139 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -4.341 1.980 11.689 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -3.789 4.137 12.545 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -2.645 4.449 11.254 1.00 0.00 H new ATOM 390 N GLU A 135 -1.455 -0.434 11.752 1.00 0.00 N ATOM 391 CA GLU A 135 -1.063 -1.703 11.183 1.00 0.00 C ATOM 392 C GLU A 135 -2.219 -2.521 10.623 1.00 0.00 C ATOM 393 O GLU A 135 -3.086 -3.013 11.339 1.00 0.00 O ATOM 394 CB GLU A 135 -0.225 -2.468 12.201 1.00 0.00 C ATOM 395 CG GLU A 135 -0.797 -2.524 13.603 1.00 0.00 C ATOM 396 CD GLU A 135 0.297 -2.728 14.628 1.00 0.00 C ATOM 397 OE1 GLU A 135 1.233 -1.895 14.665 1.00 0.00 O ATOM 398 OE2 GLU A 135 0.256 -3.729 15.363 1.00 0.00 O ATOM 0 H GLU A 135 -1.326 -0.364 12.761 1.00 0.00 H new ATOM 0 HA GLU A 135 -0.453 -1.499 10.303 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -0.089 -3.488 11.841 1.00 0.00 H new ATOM 0 HB3 GLU A 135 0.764 -2.012 12.248 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -1.333 -1.600 13.818 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -1.521 -3.336 13.672 1.00 0.00 H new ATOM 405 N VAL A 136 -2.191 -2.619 9.298 1.00 0.00 N ATOM 406 CA VAL A 136 -3.154 -3.363 8.505 1.00 0.00 C ATOM 407 C VAL A 136 -2.757 -4.829 8.380 1.00 0.00 C ATOM 408 O VAL A 136 -1.579 -5.174 8.229 1.00 0.00 O ATOM 409 CB VAL A 136 -3.269 -2.753 7.107 1.00 0.00 C ATOM 410 CG1 VAL A 136 -4.205 -3.526 6.235 1.00 0.00 C ATOM 411 CG2 VAL A 136 -3.677 -1.312 7.204 1.00 0.00 C ATOM 0 H VAL A 136 -1.473 -2.167 8.732 1.00 0.00 H new ATOM 0 HA VAL A 136 -4.116 -3.305 9.015 1.00 0.00 H new ATOM 0 HB VAL A 136 -2.288 -2.806 6.636 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -4.257 -3.058 5.252 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -3.844 -4.549 6.131 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -5.198 -3.535 6.685 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -3.756 -0.888 6.203 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -4.642 -1.240 7.706 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -2.930 -0.760 7.774 1.00 0.00 H new ATOM 421 N GLU A 137 -3.757 -5.672 8.444 1.00 0.00 N ATOM 422 CA GLU A 137 -3.588 -7.120 8.393 1.00 0.00 C ATOM 423 C GLU A 137 -4.297 -7.732 7.192 1.00 0.00 C ATOM 424 O GLU A 137 -5.201 -7.124 6.620 1.00 0.00 O ATOM 425 CB GLU A 137 -4.124 -7.732 9.679 1.00 0.00 C ATOM 426 CG GLU A 137 -4.518 -6.679 10.693 1.00 0.00 C ATOM 427 CD GLU A 137 -5.952 -6.203 10.518 1.00 0.00 C ATOM 428 OE1 GLU A 137 -6.224 -5.480 9.528 1.00 0.00 O ATOM 429 OE2 GLU A 137 -6.801 -6.552 11.363 1.00 0.00 O ATOM 0 H GLU A 137 -4.729 -5.377 8.534 1.00 0.00 H new ATOM 0 HA GLU A 137 -2.524 -7.335 8.289 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -4.989 -8.355 9.450 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -3.366 -8.385 10.112 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -4.394 -7.083 11.698 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -3.844 -5.827 10.607 1.00 0.00 H new ATOM 436 N GLU A 138 -3.810 -8.896 6.765 1.00 0.00 N ATOM 437 CA GLU A 138 -4.389 -9.632 5.644 1.00 0.00 C ATOM 438 C GLU A 138 -5.918 -9.670 5.728 1.00 0.00 C ATOM 439 O GLU A 138 -6.496 -10.184 6.684 1.00 0.00 O ATOM 440 CB GLU A 138 -3.833 -11.059 5.599 1.00 0.00 C ATOM 441 CG GLU A 138 -3.601 -11.682 6.966 1.00 0.00 C ATOM 442 CD GLU A 138 -2.155 -11.585 7.400 1.00 0.00 C ATOM 443 OE1 GLU A 138 -1.602 -10.468 7.376 1.00 0.00 O ATOM 444 OE2 GLU A 138 -1.558 -12.629 7.736 1.00 0.00 O ATOM 0 H GLU A 138 -3.003 -9.355 7.187 1.00 0.00 H new ATOM 0 HA GLU A 138 -4.113 -9.110 4.728 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -4.524 -11.688 5.038 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -2.891 -11.053 5.051 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -4.234 -11.185 7.702 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -3.902 -12.729 6.942 1.00 0.00 H new ATOM 451 N LEU A 139 -6.555 -9.135 4.702 1.00 0.00 N ATOM 452 CA LEU A 139 -8.001 -9.062 4.633 1.00 0.00 C ATOM 453 C LEU A 139 -8.533 -9.933 3.498 1.00 0.00 C ATOM 454 O LEU A 139 -8.001 -9.921 2.392 1.00 0.00 O ATOM 455 CB LEU A 139 -8.412 -7.607 4.431 1.00 0.00 C ATOM 456 CG LEU A 139 -9.708 -7.371 3.651 1.00 0.00 C ATOM 457 CD1 LEU A 139 -10.922 -7.730 4.497 1.00 0.00 C ATOM 458 CD2 LEU A 139 -9.801 -5.927 3.184 1.00 0.00 C ATOM 0 H LEU A 139 -6.081 -8.738 3.891 1.00 0.00 H new ATOM 0 HA LEU A 139 -8.428 -9.436 5.564 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -8.513 -7.141 5.411 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -7.603 -7.091 3.914 1.00 0.00 H new ATOM 0 HG LEU A 139 -9.694 -8.018 2.774 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -11.831 -7.554 3.922 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -10.870 -8.781 4.781 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -10.935 -7.112 5.395 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -10.730 -5.782 2.632 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -9.785 -5.263 4.048 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -8.955 -5.699 2.536 1.00 0.00 H new ATOM 470 N SER A 140 -9.582 -10.682 3.775 1.00 0.00 N ATOM 471 CA SER A 140 -10.178 -11.552 2.773 1.00 0.00 C ATOM 472 C SER A 140 -11.511 -10.984 2.298 1.00 0.00 C ATOM 473 O SER A 140 -12.188 -10.274 3.045 1.00 0.00 O ATOM 474 CB SER A 140 -10.375 -12.953 3.350 1.00 0.00 C ATOM 475 OG SER A 140 -9.252 -13.336 4.126 1.00 0.00 O ATOM 0 H SER A 140 -10.042 -10.708 4.685 1.00 0.00 H new ATOM 0 HA SER A 140 -9.505 -11.613 1.917 1.00 0.00 H new ATOM 0 HB2 SER A 140 -11.274 -12.975 3.966 1.00 0.00 H new ATOM 0 HB3 SER A 140 -10.525 -13.668 2.541 1.00 0.00 H new ATOM 0 HG SER A 140 -9.396 -14.235 4.489 1.00 0.00 H new ATOM 481 N GLU A 141 -11.868 -11.282 1.054 1.00 0.00 N ATOM 482 CA GLU A 141 -13.120 -10.810 0.473 1.00 0.00 C ATOM 483 C GLU A 141 -14.317 -11.252 1.311 1.00 0.00 C ATOM 484 O GLU A 141 -14.383 -12.399 1.760 1.00 0.00 O ATOM 485 CB GLU A 141 -13.271 -11.336 -0.955 1.00 0.00 C ATOM 486 CG GLU A 141 -12.586 -10.478 -2.008 1.00 0.00 C ATOM 487 CD GLU A 141 -11.074 -10.536 -1.926 1.00 0.00 C ATOM 488 OE1 GLU A 141 -10.528 -11.617 -1.612 1.00 0.00 O ATOM 489 OE2 GLU A 141 -10.419 -9.509 -2.193 1.00 0.00 O ATOM 0 H GLU A 141 -11.304 -11.852 0.424 1.00 0.00 H new ATOM 0 HA GLU A 141 -13.092 -9.720 0.458 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -12.864 -12.346 -1.004 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -14.332 -11.408 -1.194 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -12.904 -10.805 -2.998 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -12.911 -9.444 -1.894 1.00 0.00 H new ATOM 496 N PRO A 142 -15.274 -10.340 1.541 1.00 0.00 N ATOM 497 CA PRO A 142 -16.473 -10.631 2.323 1.00 0.00 C ATOM 498 C PRO A 142 -17.403 -11.597 1.608 1.00 0.00 C ATOM 499 O PRO A 142 -18.159 -11.215 0.713 1.00 0.00 O ATOM 500 CB PRO A 142 -17.154 -9.271 2.495 1.00 0.00 C ATOM 501 CG PRO A 142 -16.151 -8.256 2.053 1.00 0.00 C ATOM 502 CD PRO A 142 -15.262 -8.952 1.063 1.00 0.00 C ATOM 0 HA PRO A 142 -16.223 -11.110 3.270 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -18.063 -9.210 1.896 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -17.445 -9.108 3.533 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -16.642 -7.396 1.598 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -15.575 -7.883 2.900 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -15.646 -8.870 0.046 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -14.255 -8.534 1.058 1.00 0.00 H new ATOM 510 N VAL A 143 -17.325 -12.850 2.003 1.00 0.00 N ATOM 511 CA VAL A 143 -18.155 -13.890 1.425 1.00 0.00 C ATOM 512 C VAL A 143 -19.265 -14.265 2.392 1.00 0.00 C ATOM 513 O VAL A 143 -19.059 -14.295 3.607 1.00 0.00 O ATOM 514 CB VAL A 143 -17.338 -15.148 1.054 1.00 0.00 C ATOM 515 CG1 VAL A 143 -16.504 -14.890 -0.190 1.00 0.00 C ATOM 516 CG2 VAL A 143 -16.451 -15.586 2.213 1.00 0.00 C ATOM 0 H VAL A 143 -16.689 -13.177 2.730 1.00 0.00 H new ATOM 0 HA VAL A 143 -18.583 -13.492 0.505 1.00 0.00 H new ATOM 0 HB VAL A 143 -18.037 -15.957 0.842 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -15.934 -15.786 -0.438 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -17.161 -14.635 -1.022 1.00 0.00 H new ATOM 0 HG13 VAL A 143 -15.818 -14.064 -0.003 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -15.887 -16.473 1.925 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -15.759 -14.783 2.465 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -17.071 -15.816 3.079 1.00 0.00 H new ATOM 526 N LEU A 144 -20.441 -14.535 1.858 1.00 0.00 N ATOM 527 CA LEU A 144 -21.582 -14.890 2.679 1.00 0.00 C ATOM 528 C LEU A 144 -22.212 -16.185 2.189 1.00 0.00 C ATOM 529 O LEU A 144 -22.304 -16.426 0.985 1.00 0.00 O ATOM 530 CB LEU A 144 -22.610 -13.757 2.669 1.00 0.00 C ATOM 531 CG LEU A 144 -22.137 -12.447 3.306 1.00 0.00 C ATOM 532 CD1 LEU A 144 -23.082 -11.310 2.950 1.00 0.00 C ATOM 533 CD2 LEU A 144 -22.032 -12.598 4.817 1.00 0.00 C ATOM 0 H LEU A 144 -20.631 -14.515 0.856 1.00 0.00 H new ATOM 0 HA LEU A 144 -21.240 -15.043 3.703 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -22.899 -13.558 1.637 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -23.505 -14.095 3.191 1.00 0.00 H new ATOM 0 HG LEU A 144 -21.149 -12.210 2.913 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -22.731 -10.387 3.411 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -23.111 -11.187 1.867 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -24.083 -11.540 3.316 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -21.695 -11.658 5.254 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -23.009 -12.858 5.225 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -21.317 -13.386 5.055 1.00 0.00 H new ATOM 545 N GLY A 145 -22.629 -17.015 3.130 1.00 0.00 N ATOM 546 CA GLY A 145 -23.240 -18.282 2.798 1.00 0.00 C ATOM 547 C GLY A 145 -23.268 -19.204 3.995 1.00 0.00 C ATOM 548 O GLY A 145 -23.766 -18.830 5.055 1.00 0.00 O ATOM 0 H GLY A 145 -22.554 -16.830 4.130 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -24.256 -18.116 2.439 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -22.688 -18.753 1.985 1.00 0.00 H new ATOM 552 N ASP A 146 -22.715 -20.395 3.839 1.00 0.00 N ATOM 553 CA ASP A 146 -22.680 -21.361 4.927 1.00 0.00 C ATOM 554 C ASP A 146 -21.314 -21.338 5.597 1.00 0.00 C ATOM 555 O ASP A 146 -20.285 -21.257 4.924 1.00 0.00 O ATOM 556 CB ASP A 146 -22.991 -22.771 4.418 1.00 0.00 C ATOM 557 CG ASP A 146 -23.383 -23.721 5.536 1.00 0.00 C ATOM 558 OD1 ASP A 146 -22.566 -23.939 6.459 1.00 0.00 O ATOM 559 OD2 ASP A 146 -24.517 -24.246 5.503 1.00 0.00 O ATOM 0 H ASP A 146 -22.285 -20.717 2.972 1.00 0.00 H new ATOM 0 HA ASP A 146 -23.443 -21.085 5.655 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -23.800 -22.720 3.689 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -22.118 -23.167 3.899 1.00 0.00 H new ATOM 564 N VAL A 147 -21.310 -21.394 6.919 1.00 0.00 N ATOM 565 CA VAL A 147 -20.074 -21.379 7.687 1.00 0.00 C ATOM 566 C VAL A 147 -20.162 -22.397 8.826 1.00 0.00 C ATOM 567 O VAL A 147 -19.442 -22.328 9.822 1.00 0.00 O ATOM 568 CB VAL A 147 -19.779 -19.955 8.227 1.00 0.00 C ATOM 569 CG1 VAL A 147 -20.749 -19.574 9.340 1.00 0.00 C ATOM 570 CG2 VAL A 147 -18.333 -19.827 8.690 1.00 0.00 C ATOM 0 H VAL A 147 -22.155 -21.451 7.487 1.00 0.00 H new ATOM 0 HA VAL A 147 -19.247 -21.659 7.035 1.00 0.00 H new ATOM 0 HB VAL A 147 -19.926 -19.255 7.405 1.00 0.00 H new ATOM 0 HG11 VAL A 147 -20.517 -18.571 9.698 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -21.769 -19.595 8.957 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -20.656 -20.283 10.163 1.00 0.00 H new ATOM 0 HG21 VAL A 147 -18.158 -18.818 9.063 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -18.141 -20.546 9.486 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -17.664 -20.025 7.853 1.00 0.00 H new ATOM 580 N ARG A 148 -21.047 -23.362 8.648 1.00 0.00 N ATOM 581 CA ARG A 148 -21.257 -24.402 9.642 1.00 0.00 C ATOM 582 C ARG A 148 -20.914 -25.770 9.066 1.00 0.00 C ATOM 583 O ARG A 148 -20.519 -26.680 9.797 1.00 0.00 O ATOM 584 CB ARG A 148 -22.713 -24.384 10.129 1.00 0.00 C ATOM 585 CG ARG A 148 -23.105 -25.596 10.967 1.00 0.00 C ATOM 586 CD ARG A 148 -24.361 -26.274 10.429 1.00 0.00 C ATOM 587 NE ARG A 148 -24.125 -26.966 9.158 1.00 0.00 N ATOM 588 CZ ARG A 148 -24.416 -26.451 7.961 1.00 0.00 C ATOM 589 NH1 ARG A 148 -24.964 -25.248 7.868 1.00 0.00 N ATOM 590 NH2 ARG A 148 -24.164 -27.137 6.855 1.00 0.00 N ATOM 0 H ARG A 148 -21.635 -23.448 7.819 1.00 0.00 H new ATOM 0 HA ARG A 148 -20.599 -24.208 10.489 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -22.877 -23.481 10.717 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -23.373 -24.325 9.264 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -22.283 -26.311 10.979 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -23.273 -25.286 11.998 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -24.728 -26.989 11.166 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -25.143 -25.527 10.293 1.00 0.00 H new ATOM 0 HE ARG A 148 -23.713 -27.899 9.190 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -25.165 -24.712 8.713 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -25.185 -24.858 6.952 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -23.745 -28.065 6.915 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -24.389 -26.737 5.944 1.00 0.00 H new ATOM 604 N GLU A 149 -21.069 -25.911 7.756 1.00 0.00 N ATOM 605 CA GLU A 149 -20.794 -27.175 7.096 1.00 0.00 C ATOM 606 C GLU A 149 -19.332 -27.581 7.227 1.00 0.00 C ATOM 607 O GLU A 149 -18.422 -26.860 6.816 1.00 0.00 O ATOM 608 CB GLU A 149 -21.199 -27.130 5.620 1.00 0.00 C ATOM 609 CG GLU A 149 -21.313 -28.510 4.981 1.00 0.00 C ATOM 610 CD GLU A 149 -21.752 -29.580 5.970 1.00 0.00 C ATOM 611 OE1 GLU A 149 -22.825 -29.423 6.586 1.00 0.00 O ATOM 612 OE2 GLU A 149 -21.004 -30.569 6.151 1.00 0.00 O ATOM 0 H GLU A 149 -21.383 -25.167 7.133 1.00 0.00 H new ATOM 0 HA GLU A 149 -21.397 -27.930 7.601 1.00 0.00 H new ATOM 0 HB2 GLU A 149 -22.156 -26.615 5.529 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -20.467 -26.541 5.068 1.00 0.00 H new ATOM 0 HG2 GLU A 149 -22.026 -28.467 4.158 1.00 0.00 H new ATOM 0 HG3 GLU A 149 -20.350 -28.789 4.554 1.00 0.00 H new ATOM 619 N SER A 150 -19.140 -28.740 7.830 1.00 0.00 N ATOM 620 CA SER A 150 -17.832 -29.335 8.036 1.00 0.00 C ATOM 621 C SER A 150 -18.032 -30.788 8.437 1.00 0.00 C ATOM 622 O SER A 150 -17.221 -31.380 9.143 1.00 0.00 O ATOM 623 CB SER A 150 -17.039 -28.578 9.109 1.00 0.00 C ATOM 624 OG SER A 150 -16.436 -27.409 8.567 1.00 0.00 O ATOM 0 H SER A 150 -19.905 -29.306 8.198 1.00 0.00 H new ATOM 0 HA SER A 150 -17.253 -29.276 7.114 1.00 0.00 H new ATOM 0 HB2 SER A 150 -17.702 -28.303 9.930 1.00 0.00 H new ATOM 0 HB3 SER A 150 -16.270 -29.229 9.525 1.00 0.00 H new ATOM 0 HG SER A 150 -17.071 -26.960 7.970 1.00 0.00 H new ATOM 630 N THR A 151 -19.136 -31.351 7.968 1.00 0.00 N ATOM 631 CA THR A 151 -19.488 -32.722 8.267 1.00 0.00 C ATOM 632 C THR A 151 -19.384 -33.593 7.021 1.00 0.00 C ATOM 633 O THR A 151 -18.765 -34.656 7.046 1.00 0.00 O ATOM 634 CB THR A 151 -20.922 -32.797 8.826 1.00 0.00 C ATOM 635 OG1 THR A 151 -21.519 -31.489 8.806 1.00 0.00 O ATOM 636 CG2 THR A 151 -20.921 -33.337 10.249 1.00 0.00 C ATOM 0 H THR A 151 -19.808 -30.868 7.372 1.00 0.00 H new ATOM 0 HA THR A 151 -18.788 -33.092 9.016 1.00 0.00 H new ATOM 0 HB THR A 151 -21.502 -33.475 8.199 1.00 0.00 H new ATOM 0 HG1 THR A 151 -21.642 -31.200 7.878 1.00 0.00 H new ATOM 0 HG21 THR A 151 -21.944 -33.381 10.622 1.00 0.00 H new ATOM 0 HG22 THR A 151 -20.488 -34.337 10.258 1.00 0.00 H new ATOM 0 HG23 THR A 151 -20.330 -32.680 10.887 1.00 0.00 H new ATOM 644 N ALA A 152 -19.972 -33.117 5.927 1.00 0.00 N ATOM 645 CA ALA A 152 -19.960 -33.842 4.661 1.00 0.00 C ATOM 646 C ALA A 152 -18.545 -34.039 4.158 1.00 0.00 C ATOM 647 O ALA A 152 -18.038 -35.156 4.107 1.00 0.00 O ATOM 648 CB ALA A 152 -20.760 -33.089 3.624 1.00 0.00 C ATOM 0 H ALA A 152 -20.466 -32.225 5.893 1.00 0.00 H new ATOM 0 HA ALA A 152 -20.408 -34.821 4.832 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -20.745 -33.639 2.683 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -21.790 -32.983 3.965 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -20.324 -32.101 3.474 1.00 0.00 H new ATOM 654 N PHE A 153 -17.913 -32.937 3.781 1.00 0.00 N ATOM 655 CA PHE A 153 -16.543 -32.980 3.301 1.00 0.00 C ATOM 656 C PHE A 153 -15.616 -33.152 4.490 1.00 0.00 C ATOM 657 O PHE A 153 -14.428 -33.433 4.335 1.00 0.00 O ATOM 658 CB PHE A 153 -16.194 -31.711 2.511 1.00 0.00 C ATOM 659 CG PHE A 153 -16.313 -30.435 3.300 1.00 0.00 C ATOM 660 CD1 PHE A 153 -15.233 -29.944 4.017 1.00 0.00 C ATOM 661 CD2 PHE A 153 -17.501 -29.722 3.316 1.00 0.00 C ATOM 662 CE1 PHE A 153 -15.336 -28.771 4.735 1.00 0.00 C ATOM 663 CE2 PHE A 153 -17.608 -28.547 4.034 1.00 0.00 C ATOM 664 CZ PHE A 153 -16.523 -28.072 4.744 1.00 0.00 C ATOM 0 H PHE A 153 -18.327 -32.005 3.799 1.00 0.00 H new ATOM 0 HA PHE A 153 -16.424 -33.823 2.621 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -15.174 -31.799 2.138 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -16.847 -31.648 1.641 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -14.299 -30.487 4.013 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -18.352 -30.089 2.761 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -14.487 -28.401 5.290 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -18.539 -28.000 4.040 1.00 0.00 H new ATOM 0 HZ PHE A 153 -16.605 -27.153 5.306 1.00 0.00 H new ATOM 674 N SER A 154 -16.199 -32.970 5.679 1.00 0.00 N ATOM 675 CA SER A 154 -15.495 -33.104 6.942 1.00 0.00 C ATOM 676 C SER A 154 -14.449 -32.001 7.130 1.00 0.00 C ATOM 677 O SER A 154 -14.627 -31.104 7.956 1.00 0.00 O ATOM 678 CB SER A 154 -14.874 -34.496 7.036 1.00 0.00 C ATOM 679 OG SER A 154 -15.866 -35.480 7.279 1.00 0.00 O ATOM 0 H SER A 154 -17.183 -32.723 5.784 1.00 0.00 H new ATOM 0 HA SER A 154 -16.212 -32.987 7.755 1.00 0.00 H new ATOM 0 HB2 SER A 154 -14.347 -34.726 6.110 1.00 0.00 H new ATOM 0 HB3 SER A 154 -14.134 -34.515 7.836 1.00 0.00 H new ATOM 0 HG SER A 154 -16.755 -35.082 7.172 1.00 0.00 H new ATOM 685 N ARG A 155 -13.376 -32.038 6.358 1.00 0.00 N ATOM 686 CA ARG A 155 -12.345 -31.026 6.478 1.00 0.00 C ATOM 687 C ARG A 155 -11.691 -30.738 5.136 1.00 0.00 C ATOM 688 O ARG A 155 -11.168 -31.635 4.477 1.00 0.00 O ATOM 689 CB ARG A 155 -11.286 -31.441 7.501 1.00 0.00 C ATOM 690 CG ARG A 155 -10.339 -30.312 7.891 1.00 0.00 C ATOM 691 CD ARG A 155 -11.083 -29.133 8.506 1.00 0.00 C ATOM 692 NE ARG A 155 -11.571 -28.190 7.495 1.00 0.00 N ATOM 693 CZ ARG A 155 -12.798 -27.664 7.492 1.00 0.00 C ATOM 694 NH1 ARG A 155 -13.679 -28.005 8.429 1.00 0.00 N ATOM 695 NH2 ARG A 155 -13.142 -26.813 6.535 1.00 0.00 N ATOM 0 H ARG A 155 -13.199 -32.750 5.650 1.00 0.00 H new ATOM 0 HA ARG A 155 -12.827 -30.112 6.826 1.00 0.00 H new ATOM 0 HB2 ARG A 155 -11.784 -31.812 8.397 1.00 0.00 H new ATOM 0 HB3 ARG A 155 -10.704 -32.268 7.094 1.00 0.00 H new ATOM 0 HG2 ARG A 155 -9.601 -30.686 8.601 1.00 0.00 H new ATOM 0 HG3 ARG A 155 -9.792 -29.976 7.010 1.00 0.00 H new ATOM 0 HD2 ARG A 155 -11.926 -29.503 9.090 1.00 0.00 H new ATOM 0 HD3 ARG A 155 -10.422 -28.610 9.197 1.00 0.00 H new ATOM 0 HE ARG A 155 -10.933 -27.919 6.747 1.00 0.00 H new ATOM 0 HH11 ARG A 155 -13.419 -28.672 9.155 1.00 0.00 H new ATOM 0 HH12 ARG A 155 -14.615 -27.599 8.421 1.00 0.00 H new ATOM 0 HH21 ARG A 155 -12.471 -26.565 5.808 1.00 0.00 H new ATOM 0 HH22 ARG A 155 -14.078 -26.407 6.526 1.00 0.00 H new ATOM 709 N SER A 156 -11.750 -29.480 4.747 1.00 0.00 N ATOM 710 CA SER A 156 -11.163 -29.001 3.511 1.00 0.00 C ATOM 711 C SER A 156 -10.854 -27.521 3.686 1.00 0.00 C ATOM 712 O SER A 156 -10.297 -26.908 2.761 1.00 0.00 O ATOM 713 CB SER A 156 -12.118 -29.217 2.332 1.00 0.00 C ATOM 714 OG SER A 156 -12.523 -30.575 2.242 1.00 0.00 O ATOM 715 OXT SER A 156 -11.180 -26.990 4.779 1.00 0.00 O ATOM 0 H SER A 156 -12.214 -28.751 5.289 1.00 0.00 H new ATOM 0 HA SER A 156 -10.250 -29.555 3.292 1.00 0.00 H new ATOM 0 HB2 SER A 156 -12.995 -28.580 2.449 1.00 0.00 H new ATOM 0 HB3 SER A 156 -11.629 -28.918 1.405 1.00 0.00 H new ATOM 0 HG SER A 156 -13.133 -30.685 1.483 1.00 0.00 H new TER 721 SER A 156 ATOM 722 N MET B 1 -7.018 -11.098 -15.073 1.00 0.00 N ATOM 723 CA MET B 1 -8.170 -10.795 -14.195 1.00 0.00 C ATOM 724 C MET B 1 -7.818 -11.139 -12.757 1.00 0.00 C ATOM 725 O MET B 1 -7.882 -12.309 -12.368 1.00 0.00 O ATOM 726 CB MET B 1 -9.405 -11.591 -14.639 1.00 0.00 C ATOM 727 CG MET B 1 -10.725 -10.871 -14.390 1.00 0.00 C ATOM 728 SD MET B 1 -11.045 -10.560 -12.641 1.00 0.00 S ATOM 729 CE MET B 1 -11.395 -12.217 -12.051 1.00 0.00 C ATOM 0 H1 MET B 1 -7.358 -11.292 -16.037 1.00 0.00 H new ATOM 0 H2 MET B 1 -6.372 -10.284 -15.091 1.00 0.00 H new ATOM 0 H3 MET B 1 -6.514 -11.932 -14.709 1.00 0.00 H new ATOM 0 HA MET B 1 -8.400 -9.732 -14.266 1.00 0.00 H new ATOM 0 HB2 MET B 1 -9.319 -11.814 -15.703 1.00 0.00 H new ATOM 0 HB3 MET B 1 -9.418 -12.546 -14.113 1.00 0.00 H new ATOM 0 HG2 MET B 1 -10.721 -9.922 -14.926 1.00 0.00 H new ATOM 0 HG3 MET B 1 -11.540 -11.467 -14.802 1.00 0.00 H new ATOM 0 HE1 MET B 1 -11.800 -12.165 -11.040 1.00 0.00 H new ATOM 0 HE2 MET B 1 -12.123 -12.692 -12.709 1.00 0.00 H new ATOM 0 HE3 MET B 1 -10.476 -12.803 -12.044 1.00 0.00 H new ATOM 739 N ALA B 2 -7.414 -10.119 -11.993 1.00 0.00 N ATOM 740 CA ALA B 2 -7.028 -10.264 -10.584 1.00 0.00 C ATOM 741 C ALA B 2 -5.684 -10.975 -10.462 1.00 0.00 C ATOM 742 O ALA B 2 -4.733 -10.434 -9.903 1.00 0.00 O ATOM 743 CB ALA B 2 -8.102 -10.990 -9.779 1.00 0.00 C ATOM 0 H ALA B 2 -7.345 -9.161 -12.337 1.00 0.00 H new ATOM 0 HA ALA B 2 -6.926 -9.263 -10.166 1.00 0.00 H new ATOM 0 HB1 ALA B 2 -7.781 -11.079 -8.741 1.00 0.00 H new ATOM 0 HB2 ALA B 2 -9.034 -10.426 -9.824 1.00 0.00 H new ATOM 0 HB3 ALA B 2 -8.259 -11.985 -10.196 1.00 0.00 H new ATOM 749 N THR B 3 -5.616 -12.189 -10.982 1.00 0.00 N ATOM 750 CA THR B 3 -4.396 -12.971 -10.957 1.00 0.00 C ATOM 751 C THR B 3 -4.354 -13.920 -12.151 1.00 0.00 C ATOM 752 O THR B 3 -4.750 -15.081 -12.058 1.00 0.00 O ATOM 753 CB THR B 3 -4.259 -13.780 -9.650 1.00 0.00 C ATOM 754 OG1 THR B 3 -4.568 -12.946 -8.522 1.00 0.00 O ATOM 755 CG2 THR B 3 -2.848 -14.331 -9.508 1.00 0.00 C ATOM 0 H THR B 3 -6.403 -12.657 -11.431 1.00 0.00 H new ATOM 0 HA THR B 3 -3.561 -12.273 -11.011 1.00 0.00 H new ATOM 0 HB THR B 3 -4.960 -14.614 -9.686 1.00 0.00 H new ATOM 0 HG1 THR B 3 -4.480 -13.467 -7.696 1.00 0.00 H new ATOM 0 HG21 THR B 3 -2.771 -14.898 -8.581 1.00 0.00 H new ATOM 0 HG22 THR B 3 -2.626 -14.984 -10.352 1.00 0.00 H new ATOM 0 HG23 THR B 3 -2.136 -13.506 -9.489 1.00 0.00 H new ATOM 763 N SER B 4 -3.936 -13.396 -13.291 1.00 0.00 N ATOM 764 CA SER B 4 -3.827 -14.191 -14.505 1.00 0.00 C ATOM 765 C SER B 4 -2.481 -13.937 -15.172 1.00 0.00 C ATOM 766 O SER B 4 -1.941 -14.800 -15.863 1.00 0.00 O ATOM 767 CB SER B 4 -4.967 -13.845 -15.466 1.00 0.00 C ATOM 768 OG SER B 4 -6.195 -13.701 -14.763 1.00 0.00 O ATOM 0 H SER B 4 -3.665 -12.419 -13.402 1.00 0.00 H new ATOM 0 HA SER B 4 -3.899 -15.247 -14.245 1.00 0.00 H new ATOM 0 HB2 SER B 4 -4.735 -12.920 -15.995 1.00 0.00 H new ATOM 0 HB3 SER B 4 -5.064 -14.627 -16.219 1.00 0.00 H new ATOM 0 HG SER B 4 -6.939 -13.954 -15.349 1.00 0.00 H new ATOM 774 N SER B 5 -1.948 -12.742 -14.954 1.00 0.00 N ATOM 775 CA SER B 5 -0.670 -12.349 -15.517 1.00 0.00 C ATOM 776 C SER B 5 -0.124 -11.152 -14.747 1.00 0.00 C ATOM 777 O SER B 5 -0.635 -10.826 -13.677 1.00 0.00 O ATOM 778 CB SER B 5 -0.846 -12.005 -16.995 1.00 0.00 C ATOM 779 OG SER B 5 -2.061 -11.305 -17.210 1.00 0.00 O ATOM 0 H SER B 5 -2.391 -12.022 -14.383 1.00 0.00 H new ATOM 0 HA SER B 5 0.040 -13.172 -15.434 1.00 0.00 H new ATOM 0 HB2 SER B 5 -0.007 -11.398 -17.334 1.00 0.00 H new ATOM 0 HB3 SER B 5 -0.838 -12.919 -17.589 1.00 0.00 H new ATOM 0 HG SER B 5 -2.152 -11.093 -18.162 1.00 0.00 H new ATOM 785 N GLU B 6 0.893 -10.493 -15.287 1.00 0.00 N ATOM 786 CA GLU B 6 1.475 -9.332 -14.633 1.00 0.00 C ATOM 787 C GLU B 6 0.605 -8.108 -14.891 1.00 0.00 C ATOM 788 O GLU B 6 0.992 -7.179 -15.600 1.00 0.00 O ATOM 789 CB GLU B 6 2.898 -9.090 -15.134 1.00 0.00 C ATOM 790 CG GLU B 6 3.785 -8.410 -14.108 1.00 0.00 C ATOM 791 CD GLU B 6 3.923 -9.227 -12.842 1.00 0.00 C ATOM 792 OE1 GLU B 6 3.024 -9.155 -11.978 1.00 0.00 O ATOM 793 OE2 GLU B 6 4.926 -9.956 -12.711 1.00 0.00 O ATOM 0 H GLU B 6 1.330 -10.743 -16.174 1.00 0.00 H new ATOM 0 HA GLU B 6 1.520 -9.517 -13.560 1.00 0.00 H new ATOM 0 HB2 GLU B 6 3.344 -10.044 -15.416 1.00 0.00 H new ATOM 0 HB3 GLU B 6 2.860 -8.478 -16.035 1.00 0.00 H new ATOM 0 HG2 GLU B 6 4.772 -8.240 -14.539 1.00 0.00 H new ATOM 0 HG3 GLU B 6 3.371 -7.432 -13.864 1.00 0.00 H new ATOM 800 N GLU B 7 -0.588 -8.132 -14.326 1.00 0.00 N ATOM 801 CA GLU B 7 -1.537 -7.054 -14.496 1.00 0.00 C ATOM 802 C GLU B 7 -1.403 -6.018 -13.389 1.00 0.00 C ATOM 803 O GLU B 7 -1.761 -6.268 -12.238 1.00 0.00 O ATOM 804 CB GLU B 7 -2.962 -7.614 -14.544 1.00 0.00 C ATOM 805 CG GLU B 7 -3.212 -8.740 -13.554 1.00 0.00 C ATOM 806 CD GLU B 7 -4.293 -9.692 -14.017 1.00 0.00 C ATOM 807 OE1 GLU B 7 -5.473 -9.287 -14.055 1.00 0.00 O ATOM 808 OE2 GLU B 7 -3.972 -10.853 -14.347 1.00 0.00 O ATOM 0 H GLU B 7 -0.923 -8.897 -13.740 1.00 0.00 H new ATOM 0 HA GLU B 7 -1.321 -6.554 -15.440 1.00 0.00 H new ATOM 0 HB2 GLU B 7 -3.667 -6.806 -14.347 1.00 0.00 H new ATOM 0 HB3 GLU B 7 -3.166 -7.976 -15.551 1.00 0.00 H new ATOM 0 HG2 GLU B 7 -2.287 -9.295 -13.399 1.00 0.00 H new ATOM 0 HG3 GLU B 7 -3.495 -8.316 -12.591 1.00 0.00 H new ATOM 815 N VAL B 8 -0.837 -4.872 -13.739 1.00 0.00 N ATOM 816 CA VAL B 8 -0.677 -3.777 -12.802 1.00 0.00 C ATOM 817 C VAL B 8 -2.045 -3.185 -12.489 1.00 0.00 C ATOM 818 O VAL B 8 -2.574 -2.369 -13.240 1.00 0.00 O ATOM 819 CB VAL B 8 0.254 -2.681 -13.361 1.00 0.00 C ATOM 820 CG1 VAL B 8 0.745 -1.777 -12.240 1.00 0.00 C ATOM 821 CG2 VAL B 8 1.425 -3.306 -14.110 1.00 0.00 C ATOM 0 H VAL B 8 -0.479 -4.679 -14.674 1.00 0.00 H new ATOM 0 HA VAL B 8 -0.218 -4.166 -11.893 1.00 0.00 H new ATOM 0 HB VAL B 8 -0.311 -2.071 -14.065 1.00 0.00 H new ATOM 0 HG11 VAL B 8 1.400 -1.010 -12.652 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -0.108 -1.303 -11.755 1.00 0.00 H new ATOM 0 HG13 VAL B 8 1.295 -2.370 -11.509 1.00 0.00 H new ATOM 0 HG21 VAL B 8 2.071 -2.518 -14.497 1.00 0.00 H new ATOM 0 HG22 VAL B 8 1.994 -3.941 -13.431 1.00 0.00 H new ATOM 0 HG23 VAL B 8 1.048 -3.906 -14.938 1.00 0.00 H new ATOM 831 N LEU B 9 -2.606 -3.631 -11.381 1.00 0.00 N ATOM 832 CA LEU B 9 -3.921 -3.211 -10.935 1.00 0.00 C ATOM 833 C LEU B 9 -3.942 -1.747 -10.519 1.00 0.00 C ATOM 834 O LEU B 9 -4.859 -1.005 -10.867 1.00 0.00 O ATOM 835 CB LEU B 9 -4.352 -4.077 -9.751 1.00 0.00 C ATOM 836 CG LEU B 9 -4.357 -5.587 -10.008 1.00 0.00 C ATOM 837 CD1 LEU B 9 -4.651 -6.346 -8.723 1.00 0.00 C ATOM 838 CD2 LEU B 9 -5.370 -5.948 -11.084 1.00 0.00 C ATOM 0 H LEU B 9 -2.157 -4.302 -10.758 1.00 0.00 H new ATOM 0 HA LEU B 9 -4.610 -3.331 -11.771 1.00 0.00 H new ATOM 0 HB2 LEU B 9 -3.688 -3.871 -8.911 1.00 0.00 H new ATOM 0 HB3 LEU B 9 -5.354 -3.774 -9.447 1.00 0.00 H new ATOM 0 HG LEU B 9 -3.367 -5.876 -10.361 1.00 0.00 H new ATOM 0 HD11 LEU B 9 -4.651 -7.417 -8.925 1.00 0.00 H new ATOM 0 HD12 LEU B 9 -3.886 -6.116 -7.981 1.00 0.00 H new ATOM 0 HD13 LEU B 9 -5.628 -6.049 -8.341 1.00 0.00 H new ATOM 0 HD21 LEU B 9 -5.356 -7.025 -11.250 1.00 0.00 H new ATOM 0 HD22 LEU B 9 -6.366 -5.643 -10.763 1.00 0.00 H new ATOM 0 HD23 LEU B 9 -5.115 -5.435 -12.011 1.00 0.00 H new ATOM 850 N LEU B 10 -2.934 -1.333 -9.772 1.00 0.00 N ATOM 851 CA LEU B 10 -2.875 0.040 -9.298 1.00 0.00 C ATOM 852 C LEU B 10 -1.522 0.693 -9.556 1.00 0.00 C ATOM 853 O LEU B 10 -0.473 0.070 -9.392 1.00 0.00 O ATOM 854 CB LEU B 10 -3.212 0.098 -7.812 1.00 0.00 C ATOM 855 CG LEU B 10 -3.772 1.439 -7.340 1.00 0.00 C ATOM 856 CD1 LEU B 10 -5.119 1.713 -7.991 1.00 0.00 C ATOM 857 CD2 LEU B 10 -3.898 1.466 -5.826 1.00 0.00 C ATOM 0 H LEU B 10 -2.152 -1.920 -9.482 1.00 0.00 H new ATOM 0 HA LEU B 10 -3.615 0.605 -9.865 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -3.937 -0.684 -7.586 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -2.312 -0.127 -7.239 1.00 0.00 H new ATOM 0 HG LEU B 10 -3.077 2.224 -7.639 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -5.503 2.672 -7.643 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -5.001 1.741 -9.074 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -5.820 0.923 -7.723 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -4.299 2.430 -5.511 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -4.570 0.671 -5.503 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -2.916 1.317 -5.376 1.00 0.00 H new ATOM 869 N ILE B 11 -1.566 1.957 -9.967 1.00 0.00 N ATOM 870 CA ILE B 11 -0.367 2.739 -10.235 1.00 0.00 C ATOM 871 C ILE B 11 -0.404 4.019 -9.419 1.00 0.00 C ATOM 872 O ILE B 11 -1.214 4.906 -9.675 1.00 0.00 O ATOM 873 CB ILE B 11 -0.221 3.102 -11.729 1.00 0.00 C ATOM 874 CG1 ILE B 11 -0.136 1.833 -12.582 1.00 0.00 C ATOM 875 CG2 ILE B 11 1.011 3.979 -11.941 1.00 0.00 C ATOM 876 CD1 ILE B 11 -0.143 2.095 -14.074 1.00 0.00 C ATOM 0 H ILE B 11 -2.436 2.467 -10.123 1.00 0.00 H new ATOM 0 HA ILE B 11 0.489 2.124 -9.956 1.00 0.00 H new ATOM 0 HB ILE B 11 -1.102 3.663 -12.041 1.00 0.00 H new ATOM 0 HG12 ILE B 11 0.774 1.293 -12.322 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -0.975 1.183 -12.333 1.00 0.00 H new ATOM 0 HG21 ILE B 11 1.103 4.228 -12.998 1.00 0.00 H new ATOM 0 HG22 ILE B 11 0.910 4.896 -11.360 1.00 0.00 H new ATOM 0 HG23 ILE B 11 1.901 3.440 -11.617 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -0.080 1.148 -14.610 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -1.065 2.607 -14.349 1.00 0.00 H new ATOM 0 HD13 ILE B 11 0.711 2.719 -14.338 1.00 0.00 H new ATOM 888 N VAL B 12 0.471 4.098 -8.436 1.00 0.00 N ATOM 889 CA VAL B 12 0.543 5.258 -7.567 1.00 0.00 C ATOM 890 C VAL B 12 1.696 6.164 -7.977 1.00 0.00 C ATOM 891 O VAL B 12 2.776 5.686 -8.339 1.00 0.00 O ATOM 892 CB VAL B 12 0.713 4.825 -6.098 1.00 0.00 C ATOM 893 CG1 VAL B 12 0.787 6.024 -5.170 1.00 0.00 C ATOM 894 CG2 VAL B 12 -0.426 3.907 -5.695 1.00 0.00 C ATOM 0 H VAL B 12 1.148 3.367 -8.217 1.00 0.00 H new ATOM 0 HA VAL B 12 -0.391 5.812 -7.664 1.00 0.00 H new ATOM 0 HB VAL B 12 1.655 4.284 -6.009 1.00 0.00 H new ATOM 0 HG11 VAL B 12 0.907 5.682 -4.142 1.00 0.00 H new ATOM 0 HG12 VAL B 12 1.638 6.646 -5.447 1.00 0.00 H new ATOM 0 HG13 VAL B 12 -0.131 6.606 -5.254 1.00 0.00 H new ATOM 0 HG21 VAL B 12 -0.299 3.605 -4.655 1.00 0.00 H new ATOM 0 HG22 VAL B 12 -1.374 4.433 -5.807 1.00 0.00 H new ATOM 0 HG23 VAL B 12 -0.424 3.023 -6.333 1.00 0.00 H new ATOM 904 N LYS B 13 1.463 7.464 -7.935 1.00 0.00 N ATOM 905 CA LYS B 13 2.486 8.432 -8.302 1.00 0.00 C ATOM 906 C LYS B 13 3.245 8.921 -7.073 1.00 0.00 C ATOM 907 O LYS B 13 2.872 8.594 -5.950 1.00 0.00 O ATOM 908 CB LYS B 13 1.875 9.613 -9.058 1.00 0.00 C ATOM 909 CG LYS B 13 1.664 9.344 -10.543 1.00 0.00 C ATOM 910 CD LYS B 13 2.987 9.244 -11.296 1.00 0.00 C ATOM 911 CE LYS B 13 3.449 7.799 -11.435 1.00 0.00 C ATOM 912 NZ LYS B 13 4.707 7.685 -12.224 1.00 0.00 N ATOM 0 H LYS B 13 0.574 7.876 -7.650 1.00 0.00 H new ATOM 0 HA LYS B 13 3.194 7.931 -8.962 1.00 0.00 H new ATOM 0 HB2 LYS B 13 0.917 9.868 -8.604 1.00 0.00 H new ATOM 0 HB3 LYS B 13 2.523 10.482 -8.943 1.00 0.00 H new ATOM 0 HG2 LYS B 13 1.104 8.417 -10.668 1.00 0.00 H new ATOM 0 HG3 LYS B 13 1.060 10.142 -10.974 1.00 0.00 H new ATOM 0 HD2 LYS B 13 2.877 9.687 -12.286 1.00 0.00 H new ATOM 0 HD3 LYS B 13 3.749 9.821 -10.771 1.00 0.00 H new ATOM 0 HE2 LYS B 13 3.603 7.372 -10.444 1.00 0.00 H new ATOM 0 HE3 LYS B 13 2.666 7.213 -11.916 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 4.884 6.686 -12.452 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 4.615 8.230 -13.105 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 5.501 8.059 -11.667 1.00 0.00 H new ATOM 926 N LYS B 14 4.267 9.749 -7.325 1.00 0.00 N ATOM 927 CA LYS B 14 5.165 10.315 -6.294 1.00 0.00 C ATOM 928 C LYS B 14 5.113 9.614 -4.937 1.00 0.00 C ATOM 929 O LYS B 14 4.570 10.141 -3.962 1.00 0.00 O ATOM 930 CB LYS B 14 4.906 11.813 -6.097 1.00 0.00 C ATOM 931 CG LYS B 14 5.774 12.710 -6.965 1.00 0.00 C ATOM 932 CD LYS B 14 5.347 12.701 -8.420 1.00 0.00 C ATOM 933 CE LYS B 14 6.414 13.333 -9.303 1.00 0.00 C ATOM 934 NZ LYS B 14 7.610 12.458 -9.448 1.00 0.00 N ATOM 0 H LYS B 14 4.503 10.054 -8.269 1.00 0.00 H new ATOM 0 HA LYS B 14 6.167 10.147 -6.689 1.00 0.00 H new ATOM 0 HB2 LYS B 14 3.858 12.021 -6.311 1.00 0.00 H new ATOM 0 HB3 LYS B 14 5.073 12.066 -5.050 1.00 0.00 H new ATOM 0 HG2 LYS B 14 5.731 13.730 -6.584 1.00 0.00 H new ATOM 0 HG3 LYS B 14 6.812 12.386 -6.893 1.00 0.00 H new ATOM 0 HD2 LYS B 14 5.162 11.676 -8.743 1.00 0.00 H new ATOM 0 HD3 LYS B 14 4.409 13.244 -8.531 1.00 0.00 H new ATOM 0 HE2 LYS B 14 5.994 13.539 -10.288 1.00 0.00 H new ATOM 0 HE3 LYS B 14 6.715 14.291 -8.878 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 8.391 13.004 -9.864 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 7.896 12.103 -8.513 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 7.380 11.655 -10.068 1.00 0.00 H new ATOM 948 N VAL B 15 5.692 8.426 -4.893 1.00 0.00 N ATOM 949 CA VAL B 15 5.779 7.651 -3.669 1.00 0.00 C ATOM 950 C VAL B 15 7.223 7.685 -3.199 1.00 0.00 C ATOM 951 O VAL B 15 8.084 7.041 -3.792 1.00 0.00 O ATOM 952 CB VAL B 15 5.350 6.182 -3.867 1.00 0.00 C ATOM 953 CG1 VAL B 15 4.846 5.592 -2.562 1.00 0.00 C ATOM 954 CG2 VAL B 15 4.294 6.062 -4.950 1.00 0.00 C ATOM 0 H VAL B 15 6.114 7.973 -5.704 1.00 0.00 H new ATOM 0 HA VAL B 15 5.101 8.089 -2.936 1.00 0.00 H new ATOM 0 HB VAL B 15 6.225 5.617 -4.187 1.00 0.00 H new ATOM 0 HG11 VAL B 15 4.548 4.556 -2.722 1.00 0.00 H new ATOM 0 HG12 VAL B 15 5.639 5.630 -1.815 1.00 0.00 H new ATOM 0 HG13 VAL B 15 3.988 6.166 -2.211 1.00 0.00 H new ATOM 0 HG21 VAL B 15 4.011 5.016 -5.068 1.00 0.00 H new ATOM 0 HG22 VAL B 15 3.417 6.646 -4.670 1.00 0.00 H new ATOM 0 HG23 VAL B 15 4.694 6.438 -5.892 1.00 0.00 H new ATOM 964 N ARG B 16 7.490 8.448 -2.156 1.00 0.00 N ATOM 965 CA ARG B 16 8.842 8.589 -1.651 1.00 0.00 C ATOM 966 C ARG B 16 9.141 7.601 -0.541 1.00 0.00 C ATOM 967 O ARG B 16 8.436 7.540 0.455 1.00 0.00 O ATOM 968 CB ARG B 16 9.084 10.011 -1.131 1.00 0.00 C ATOM 969 CG ARG B 16 8.774 11.097 -2.145 1.00 0.00 C ATOM 970 CD ARG B 16 9.436 12.420 -1.784 1.00 0.00 C ATOM 971 NE ARG B 16 10.866 12.431 -2.109 1.00 0.00 N ATOM 972 CZ ARG B 16 11.384 12.996 -3.203 1.00 0.00 C ATOM 973 NH1 ARG B 16 10.598 13.623 -4.074 1.00 0.00 N ATOM 974 NH2 ARG B 16 12.694 12.938 -3.422 1.00 0.00 N ATOM 0 H ARG B 16 6.788 8.980 -1.642 1.00 0.00 H new ATOM 0 HA ARG B 16 9.510 8.383 -2.487 1.00 0.00 H new ATOM 0 HB2 ARG B 16 8.473 10.172 -0.243 1.00 0.00 H new ATOM 0 HB3 ARG B 16 10.125 10.102 -0.822 1.00 0.00 H new ATOM 0 HG2 ARG B 16 9.112 10.779 -3.131 1.00 0.00 H new ATOM 0 HG3 ARG B 16 7.695 11.237 -2.208 1.00 0.00 H new ATOM 0 HD2 ARG B 16 8.938 13.231 -2.316 1.00 0.00 H new ATOM 0 HD3 ARG B 16 9.306 12.611 -0.719 1.00 0.00 H new ATOM 0 HE ARG B 16 11.507 11.978 -1.457 1.00 0.00 H new ATOM 0 HH11 ARG B 16 9.593 13.675 -3.909 1.00 0.00 H new ATOM 0 HH12 ARG B 16 11.001 14.052 -4.907 1.00 0.00 H new ATOM 0 HH21 ARG B 16 13.302 12.463 -2.755 1.00 0.00 H new ATOM 0 HH22 ARG B 16 13.091 13.369 -4.257 1.00 0.00 H new ATOM 988 N GLN B 17 10.183 6.820 -0.716 1.00 0.00 N ATOM 989 CA GLN B 17 10.591 5.896 0.313 1.00 0.00 C ATOM 990 C GLN B 17 11.826 6.484 0.973 1.00 0.00 C ATOM 991 O GLN B 17 12.912 6.513 0.394 1.00 0.00 O ATOM 992 CB GLN B 17 10.849 4.486 -0.241 1.00 0.00 C ATOM 993 CG GLN B 17 11.952 4.399 -1.282 1.00 0.00 C ATOM 994 CD GLN B 17 12.462 2.985 -1.461 1.00 0.00 C ATOM 995 OE1 GLN B 17 12.022 2.266 -2.350 1.00 0.00 O ATOM 996 NE2 GLN B 17 13.379 2.568 -0.602 1.00 0.00 N ATOM 0 H GLN B 17 10.760 6.807 -1.557 1.00 0.00 H new ATOM 0 HA GLN B 17 9.793 5.770 1.044 1.00 0.00 H new ATOM 0 HB2 GLN B 17 11.100 3.826 0.589 1.00 0.00 H new ATOM 0 HB3 GLN B 17 9.925 4.109 -0.680 1.00 0.00 H new ATOM 0 HG2 GLN B 17 11.579 4.772 -2.236 1.00 0.00 H new ATOM 0 HG3 GLN B 17 12.778 5.046 -0.988 1.00 0.00 H new ATOM 0 HE21 GLN B 17 13.721 3.197 0.125 1.00 0.00 H new ATOM 0 HE22 GLN B 17 13.744 1.618 -0.667 1.00 0.00 H new ATOM 1005 N LYS B 18 11.611 7.039 2.156 1.00 0.00 N ATOM 1006 CA LYS B 18 12.671 7.675 2.923 1.00 0.00 C ATOM 1007 C LYS B 18 13.328 8.795 2.110 1.00 0.00 C ATOM 1008 O LYS B 18 14.548 8.853 1.961 1.00 0.00 O ATOM 1009 CB LYS B 18 13.686 6.638 3.408 1.00 0.00 C ATOM 1010 CG LYS B 18 13.098 5.672 4.434 1.00 0.00 C ATOM 1011 CD LYS B 18 13.863 5.712 5.747 1.00 0.00 C ATOM 1012 CE LYS B 18 12.960 5.436 6.940 1.00 0.00 C ATOM 1013 NZ LYS B 18 13.651 5.700 8.236 1.00 0.00 N ATOM 0 H LYS B 18 10.698 7.061 2.611 1.00 0.00 H new ATOM 0 HA LYS B 18 12.236 8.135 3.810 1.00 0.00 H new ATOM 0 HB2 LYS B 18 14.057 6.072 2.554 1.00 0.00 H new ATOM 0 HB3 LYS B 18 14.542 7.151 3.847 1.00 0.00 H new ATOM 0 HG2 LYS B 18 12.053 5.924 4.614 1.00 0.00 H new ATOM 0 HG3 LYS B 18 13.117 4.659 4.033 1.00 0.00 H new ATOM 0 HD2 LYS B 18 14.666 4.975 5.722 1.00 0.00 H new ATOM 0 HD3 LYS B 18 14.331 6.689 5.865 1.00 0.00 H new ATOM 0 HE2 LYS B 18 12.068 6.058 6.871 1.00 0.00 H new ATOM 0 HE3 LYS B 18 12.628 4.398 6.911 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 13.060 5.358 9.020 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 14.565 5.205 8.249 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 13.810 6.722 8.343 1.00 0.00 H new ATOM 1027 N LYS B 19 12.461 9.662 1.570 1.00 0.00 N ATOM 1028 CA LYS B 19 12.841 10.848 0.788 1.00 0.00 C ATOM 1029 C LYS B 19 13.203 10.547 -0.669 1.00 0.00 C ATOM 1030 O LYS B 19 13.630 11.444 -1.392 1.00 0.00 O ATOM 1031 CB LYS B 19 13.956 11.649 1.473 1.00 0.00 C ATOM 1032 CG LYS B 19 13.435 12.652 2.501 1.00 0.00 C ATOM 1033 CD LYS B 19 12.627 11.963 3.590 1.00 0.00 C ATOM 1034 CE LYS B 19 12.187 12.920 4.686 1.00 0.00 C ATOM 1035 NZ LYS B 19 13.331 13.673 5.270 1.00 0.00 N ATOM 0 H LYS B 19 11.451 9.556 1.667 1.00 0.00 H new ATOM 0 HA LYS B 19 11.941 11.462 0.754 1.00 0.00 H new ATOM 0 HB2 LYS B 19 14.641 10.958 1.964 1.00 0.00 H new ATOM 0 HB3 LYS B 19 14.530 12.181 0.715 1.00 0.00 H new ATOM 0 HG2 LYS B 19 14.274 13.184 2.950 1.00 0.00 H new ATOM 0 HG3 LYS B 19 12.815 13.397 2.002 1.00 0.00 H new ATOM 0 HD2 LYS B 19 11.748 11.497 3.145 1.00 0.00 H new ATOM 0 HD3 LYS B 19 13.224 11.163 4.029 1.00 0.00 H new ATOM 0 HE2 LYS B 19 11.460 13.624 4.281 1.00 0.00 H new ATOM 0 HE3 LYS B 19 11.683 12.360 5.474 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 13.233 13.706 6.305 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 14.222 13.198 5.021 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 13.338 14.642 4.892 1.00 0.00 H new ATOM 1049 N GLN B 20 13.005 9.318 -1.119 1.00 0.00 N ATOM 1050 CA GLN B 20 13.286 8.974 -2.515 1.00 0.00 C ATOM 1051 C GLN B 20 11.960 8.733 -3.233 1.00 0.00 C ATOM 1052 O GLN B 20 11.258 7.783 -2.915 1.00 0.00 O ATOM 1053 CB GLN B 20 14.169 7.726 -2.572 1.00 0.00 C ATOM 1054 CG GLN B 20 14.418 7.207 -3.976 1.00 0.00 C ATOM 1055 CD GLN B 20 15.176 5.892 -3.985 1.00 0.00 C ATOM 1056 OE1 GLN B 20 15.015 5.105 -2.931 1.00 0.00 O flip ATOM 1057 NE2 GLN B 20 15.901 5.584 -4.930 1.00 0.00 N flip ATOM 0 H GLN B 20 12.655 8.546 -0.551 1.00 0.00 H new ATOM 0 HA GLN B 20 13.818 9.788 -3.006 1.00 0.00 H new ATOM 0 HB2 GLN B 20 15.127 7.950 -2.104 1.00 0.00 H new ATOM 0 HB3 GLN B 20 13.703 6.937 -1.982 1.00 0.00 H new ATOM 0 HG2 GLN B 20 13.463 7.076 -4.486 1.00 0.00 H new ATOM 0 HG3 GLN B 20 14.981 7.951 -4.540 1.00 0.00 H new ATOM 0 HE21 GLN B 20 16.000 6.216 -5.724 1.00 0.00 H new ATOM 0 HE22 GLN B 20 16.403 4.696 -4.919 1.00 0.00 H new ATOM 1066 N ASP B 21 11.628 9.563 -4.222 1.00 0.00 N ATOM 1067 CA ASP B 21 10.338 9.430 -4.908 1.00 0.00 C ATOM 1068 C ASP B 21 10.378 8.472 -6.077 1.00 0.00 C ATOM 1069 O ASP B 21 11.415 8.250 -6.700 1.00 0.00 O ATOM 1070 CB ASP B 21 9.779 10.794 -5.339 1.00 0.00 C ATOM 1071 CG ASP B 21 10.180 11.254 -6.726 1.00 0.00 C ATOM 1072 OD1 ASP B 21 11.391 11.355 -6.990 1.00 0.00 O ATOM 1073 OD2 ASP B 21 9.269 11.586 -7.524 1.00 0.00 O ATOM 0 H ASP B 21 12.219 10.321 -4.563 1.00 0.00 H new ATOM 0 HA ASP B 21 9.659 8.997 -4.173 1.00 0.00 H new ATOM 0 HB2 ASP B 21 8.691 10.754 -5.289 1.00 0.00 H new ATOM 0 HB3 ASP B 21 10.104 11.544 -4.618 1.00 0.00 H new ATOM 1078 N GLY B 22 9.222 7.894 -6.341 1.00 0.00 N ATOM 1079 CA GLY B 22 9.073 6.960 -7.420 1.00 0.00 C ATOM 1080 C GLY B 22 7.622 6.631 -7.660 1.00 0.00 C ATOM 1081 O GLY B 22 6.731 7.307 -7.144 1.00 0.00 O ATOM 0 H GLY B 22 8.367 8.063 -5.811 1.00 0.00 H new ATOM 0 HA2 GLY B 22 9.509 7.377 -8.328 1.00 0.00 H new ATOM 0 HA3 GLY B 22 9.623 6.047 -7.192 1.00 0.00 H new ATOM 1085 N ALA B 23 7.385 5.597 -8.433 1.00 0.00 N ATOM 1086 CA ALA B 23 6.040 5.169 -8.742 1.00 0.00 C ATOM 1087 C ALA B 23 5.786 3.808 -8.126 1.00 0.00 C ATOM 1088 O ALA B 23 6.647 2.928 -8.173 1.00 0.00 O ATOM 1089 CB ALA B 23 5.829 5.134 -10.244 1.00 0.00 C ATOM 0 H ALA B 23 8.116 5.031 -8.864 1.00 0.00 H new ATOM 0 HA ALA B 23 5.329 5.880 -8.321 1.00 0.00 H new ATOM 0 HB1 ALA B 23 4.811 4.810 -10.461 1.00 0.00 H new ATOM 0 HB2 ALA B 23 5.988 6.130 -10.657 1.00 0.00 H new ATOM 0 HB3 ALA B 23 6.536 4.437 -10.695 1.00 0.00 H new ATOM 1095 N LEU B 24 4.610 3.633 -7.556 1.00 0.00 N ATOM 1096 CA LEU B 24 4.266 2.383 -6.914 1.00 0.00 C ATOM 1097 C LEU B 24 3.351 1.587 -7.841 1.00 0.00 C ATOM 1098 O LEU B 24 2.252 2.032 -8.172 1.00 0.00 O ATOM 1099 CB LEU B 24 3.573 2.661 -5.578 1.00 0.00 C ATOM 1100 CG LEU B 24 3.817 1.630 -4.474 1.00 0.00 C ATOM 1101 CD1 LEU B 24 2.684 1.655 -3.461 1.00 0.00 C ATOM 1102 CD2 LEU B 24 4.005 0.235 -5.040 1.00 0.00 C ATOM 0 H LEU B 24 3.877 4.342 -7.525 1.00 0.00 H new ATOM 0 HA LEU B 24 5.167 1.803 -6.717 1.00 0.00 H new ATOM 0 HB2 LEU B 24 3.900 3.636 -5.217 1.00 0.00 H new ATOM 0 HB3 LEU B 24 2.500 2.729 -5.754 1.00 0.00 H new ATOM 0 HG LEU B 24 4.743 1.902 -3.967 1.00 0.00 H new ATOM 0 HD11 LEU B 24 2.875 0.915 -2.683 1.00 0.00 H new ATOM 0 HD12 LEU B 24 2.620 2.646 -3.011 1.00 0.00 H new ATOM 0 HD13 LEU B 24 1.744 1.422 -3.961 1.00 0.00 H new ATOM 0 HD21 LEU B 24 4.176 -0.468 -4.225 1.00 0.00 H new ATOM 0 HD22 LEU B 24 3.111 -0.058 -5.591 1.00 0.00 H new ATOM 0 HD23 LEU B 24 4.864 0.227 -5.712 1.00 0.00 H new ATOM 1114 N TYR B 25 3.811 0.421 -8.263 1.00 0.00 N ATOM 1115 CA TYR B 25 3.044 -0.417 -9.167 1.00 0.00 C ATOM 1116 C TYR B 25 2.540 -1.672 -8.465 1.00 0.00 C ATOM 1117 O TYR B 25 3.324 -2.522 -8.040 1.00 0.00 O ATOM 1118 CB TYR B 25 3.895 -0.809 -10.377 1.00 0.00 C ATOM 1119 CG TYR B 25 4.349 0.373 -11.202 1.00 0.00 C ATOM 1120 CD1 TYR B 25 3.518 0.933 -12.164 1.00 0.00 C ATOM 1121 CD2 TYR B 25 5.608 0.932 -11.017 1.00 0.00 C ATOM 1122 CE1 TYR B 25 3.928 2.016 -12.917 1.00 0.00 C ATOM 1123 CE2 TYR B 25 6.024 2.015 -11.766 1.00 0.00 C ATOM 1124 CZ TYR B 25 5.180 2.553 -12.714 1.00 0.00 C ATOM 1125 OH TYR B 25 5.591 3.636 -13.461 1.00 0.00 O ATOM 0 H TYR B 25 4.715 0.033 -7.993 1.00 0.00 H new ATOM 0 HA TYR B 25 2.181 0.158 -9.502 1.00 0.00 H new ATOM 0 HB2 TYR B 25 4.770 -1.360 -10.033 1.00 0.00 H new ATOM 0 HB3 TYR B 25 3.322 -1.486 -11.011 1.00 0.00 H new ATOM 0 HD1 TYR B 25 2.535 0.515 -12.326 1.00 0.00 H new ATOM 0 HD2 TYR B 25 6.272 0.513 -10.275 1.00 0.00 H new ATOM 0 HE1 TYR B 25 3.270 2.440 -13.661 1.00 0.00 H new ATOM 0 HE2 TYR B 25 7.005 2.438 -11.610 1.00 0.00 H new ATOM 0 HH TYR B 25 6.498 3.893 -13.193 1.00 0.00 H new ATOM 1135 N LEU B 26 1.230 -1.771 -8.339 1.00 0.00 N ATOM 1136 CA LEU B 26 0.602 -2.922 -7.715 1.00 0.00 C ATOM 1137 C LEU B 26 0.184 -3.911 -8.781 1.00 0.00 C ATOM 1138 O LEU B 26 -0.787 -3.680 -9.491 1.00 0.00 O ATOM 1139 CB LEU B 26 -0.623 -2.494 -6.909 1.00 0.00 C ATOM 1140 CG LEU B 26 -0.318 -1.782 -5.599 1.00 0.00 C ATOM 1141 CD1 LEU B 26 -1.590 -1.262 -4.967 1.00 0.00 C ATOM 1142 CD2 LEU B 26 0.380 -2.722 -4.647 1.00 0.00 C ATOM 0 H LEU B 26 0.574 -1.061 -8.664 1.00 0.00 H new ATOM 0 HA LEU B 26 1.320 -3.388 -7.040 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -1.234 -1.837 -7.528 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -1.223 -3.378 -6.693 1.00 0.00 H new ATOM 0 HG LEU B 26 0.337 -0.937 -5.812 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -1.351 -0.756 -4.031 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -2.073 -0.560 -5.646 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -2.264 -2.095 -4.767 1.00 0.00 H new ATOM 0 HD21 LEU B 26 0.593 -2.202 -3.713 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -0.262 -3.580 -4.446 1.00 0.00 H new ATOM 0 HD23 LEU B 26 1.314 -3.064 -5.093 1.00 0.00 H new ATOM 1154 N MET B 27 0.918 -4.998 -8.906 1.00 0.00 N ATOM 1155 CA MET B 27 0.601 -6.005 -9.907 1.00 0.00 C ATOM 1156 C MET B 27 -0.298 -7.084 -9.317 1.00 0.00 C ATOM 1157 O MET B 27 -0.847 -6.916 -8.226 1.00 0.00 O ATOM 1158 CB MET B 27 1.877 -6.607 -10.495 1.00 0.00 C ATOM 1159 CG MET B 27 2.381 -5.863 -11.720 1.00 0.00 C ATOM 1160 SD MET B 27 4.173 -5.663 -11.731 1.00 0.00 S ATOM 1161 CE MET B 27 4.420 -4.786 -10.193 1.00 0.00 C ATOM 0 H MET B 27 1.734 -5.209 -8.332 1.00 0.00 H new ATOM 0 HA MET B 27 0.057 -5.523 -10.719 1.00 0.00 H new ATOM 0 HB2 MET B 27 2.656 -6.607 -9.732 1.00 0.00 H new ATOM 0 HB3 MET B 27 1.691 -7.648 -10.761 1.00 0.00 H new ATOM 0 HG2 MET B 27 2.075 -6.401 -12.617 1.00 0.00 H new ATOM 0 HG3 MET B 27 1.910 -4.881 -11.761 1.00 0.00 H new ATOM 0 HE1 MET B 27 4.771 -3.776 -10.403 1.00 0.00 H new ATOM 0 HE2 MET B 27 3.478 -4.737 -9.647 1.00 0.00 H new ATOM 0 HE3 MET B 27 5.162 -5.310 -9.590 1.00 0.00 H new ATOM 1171 N ALA B 28 -0.441 -8.186 -10.035 1.00 0.00 N ATOM 1172 CA ALA B 28 -1.305 -9.274 -9.602 1.00 0.00 C ATOM 1173 C ALA B 28 -0.730 -10.062 -8.428 1.00 0.00 C ATOM 1174 O ALA B 28 -1.399 -10.237 -7.415 1.00 0.00 O ATOM 1175 CB ALA B 28 -1.581 -10.207 -10.768 1.00 0.00 C ATOM 0 H ALA B 28 0.032 -8.352 -10.924 1.00 0.00 H new ATOM 0 HA ALA B 28 -2.234 -8.823 -9.253 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -2.228 -11.020 -10.438 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -2.072 -9.654 -11.568 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -0.641 -10.618 -11.135 1.00 0.00 H new ATOM 1181 N GLU B 29 0.510 -10.525 -8.550 1.00 0.00 N ATOM 1182 CA GLU B 29 1.112 -11.328 -7.489 1.00 0.00 C ATOM 1183 C GLU B 29 2.160 -10.569 -6.678 1.00 0.00 C ATOM 1184 O GLU B 29 2.486 -10.968 -5.556 1.00 0.00 O ATOM 1185 CB GLU B 29 1.770 -12.576 -8.071 1.00 0.00 C ATOM 1186 CG GLU B 29 0.975 -13.264 -9.168 1.00 0.00 C ATOM 1187 CD GLU B 29 1.867 -14.108 -10.054 1.00 0.00 C ATOM 1188 OE1 GLU B 29 2.754 -14.804 -9.513 1.00 0.00 O ATOM 1189 OE2 GLU B 29 1.726 -14.034 -11.291 1.00 0.00 O ATOM 0 H GLU B 29 1.110 -10.362 -9.359 1.00 0.00 H new ATOM 0 HA GLU B 29 0.294 -11.594 -6.820 1.00 0.00 H new ATOM 0 HB2 GLU B 29 2.748 -12.302 -8.468 1.00 0.00 H new ATOM 0 HB3 GLU B 29 1.941 -13.289 -7.264 1.00 0.00 H new ATOM 0 HG2 GLU B 29 0.205 -13.893 -8.721 1.00 0.00 H new ATOM 0 HG3 GLU B 29 0.464 -12.515 -9.773 1.00 0.00 H new ATOM 1196 N ARG B 30 2.696 -9.485 -7.220 1.00 0.00 N ATOM 1197 CA ARG B 30 3.731 -8.750 -6.505 1.00 0.00 C ATOM 1198 C ARG B 30 3.588 -7.239 -6.635 1.00 0.00 C ATOM 1199 O ARG B 30 3.027 -6.727 -7.602 1.00 0.00 O ATOM 1200 CB ARG B 30 5.117 -9.183 -7.000 1.00 0.00 C ATOM 1201 CG ARG B 30 5.277 -9.122 -8.511 1.00 0.00 C ATOM 1202 CD ARG B 30 5.947 -10.374 -9.052 1.00 0.00 C ATOM 1203 NE ARG B 30 5.279 -10.860 -10.255 1.00 0.00 N ATOM 1204 CZ ARG B 30 4.635 -12.020 -10.344 1.00 0.00 C ATOM 1205 NH1 ARG B 30 4.651 -12.883 -9.333 1.00 0.00 N ATOM 1206 NH2 ARG B 30 3.988 -12.320 -11.461 1.00 0.00 N ATOM 0 H ARG B 30 2.440 -9.101 -8.130 1.00 0.00 H new ATOM 0 HA ARG B 30 3.614 -8.991 -5.448 1.00 0.00 H new ATOM 0 HB2 ARG B 30 5.872 -8.547 -6.538 1.00 0.00 H new ATOM 0 HB3 ARG B 30 5.310 -10.202 -6.665 1.00 0.00 H new ATOM 0 HG2 ARG B 30 4.299 -9.002 -8.977 1.00 0.00 H new ATOM 0 HG3 ARG B 30 5.868 -8.247 -8.780 1.00 0.00 H new ATOM 0 HD2 ARG B 30 6.992 -10.161 -9.276 1.00 0.00 H new ATOM 0 HD3 ARG B 30 5.937 -11.152 -8.289 1.00 0.00 H new ATOM 0 HE ARG B 30 5.308 -10.269 -11.086 1.00 0.00 H new ATOM 0 HH11 ARG B 30 5.161 -12.658 -8.479 1.00 0.00 H new ATOM 0 HH12 ARG B 30 4.154 -13.770 -9.412 1.00 0.00 H new ATOM 0 HH21 ARG B 30 3.987 -11.664 -12.242 1.00 0.00 H new ATOM 0 HH22 ARG B 30 3.491 -13.207 -11.540 1.00 0.00 H new ATOM 1220 N ILE B 31 4.103 -6.548 -5.631 1.00 0.00 N ATOM 1221 CA ILE B 31 4.099 -5.097 -5.588 1.00 0.00 C ATOM 1222 C ILE B 31 5.506 -4.608 -5.916 1.00 0.00 C ATOM 1223 O ILE B 31 6.484 -5.091 -5.341 1.00 0.00 O ATOM 1224 CB ILE B 31 3.659 -4.567 -4.198 1.00 0.00 C ATOM 1225 CG1 ILE B 31 3.968 -3.073 -4.061 1.00 0.00 C ATOM 1226 CG2 ILE B 31 4.327 -5.354 -3.077 1.00 0.00 C ATOM 1227 CD1 ILE B 31 3.483 -2.466 -2.762 1.00 0.00 C ATOM 0 H ILE B 31 4.539 -6.983 -4.818 1.00 0.00 H new ATOM 0 HA ILE B 31 3.381 -4.720 -6.317 1.00 0.00 H new ATOM 0 HB ILE B 31 2.581 -4.704 -4.115 1.00 0.00 H new ATOM 0 HG12 ILE B 31 5.045 -2.925 -4.140 1.00 0.00 H new ATOM 0 HG13 ILE B 31 3.511 -2.539 -4.894 1.00 0.00 H new ATOM 0 HG21 ILE B 31 4.001 -4.962 -2.113 1.00 0.00 H new ATOM 0 HG22 ILE B 31 4.048 -6.405 -3.154 1.00 0.00 H new ATOM 0 HG23 ILE B 31 5.410 -5.259 -3.160 1.00 0.00 H new ATOM 0 HD11 ILE B 31 3.738 -1.407 -2.738 1.00 0.00 H new ATOM 0 HD12 ILE B 31 2.402 -2.581 -2.688 1.00 0.00 H new ATOM 0 HD13 ILE B 31 3.960 -2.973 -1.923 1.00 0.00 H new ATOM 1239 N ALA B 32 5.623 -3.684 -6.850 1.00 0.00 N ATOM 1240 CA ALA B 32 6.928 -3.178 -7.235 1.00 0.00 C ATOM 1241 C ALA B 32 6.965 -1.662 -7.208 1.00 0.00 C ATOM 1242 O ALA B 32 5.937 -1.000 -7.327 1.00 0.00 O ATOM 1243 CB ALA B 32 7.316 -3.697 -8.607 1.00 0.00 C ATOM 0 H ALA B 32 4.838 -3.271 -7.353 1.00 0.00 H new ATOM 0 HA ALA B 32 7.654 -3.540 -6.507 1.00 0.00 H new ATOM 0 HB1 ALA B 32 8.297 -3.308 -8.879 1.00 0.00 H new ATOM 0 HB2 ALA B 32 7.351 -4.786 -8.588 1.00 0.00 H new ATOM 0 HB3 ALA B 32 6.579 -3.371 -9.341 1.00 0.00 H new ATOM 1249 N TRP B 33 8.159 -1.122 -7.061 1.00 0.00 N ATOM 1250 CA TRP B 33 8.349 0.313 -7.005 1.00 0.00 C ATOM 1251 C TRP B 33 9.621 0.704 -7.751 1.00 0.00 C ATOM 1252 O TRP B 33 10.602 -0.048 -7.771 1.00 0.00 O ATOM 1253 CB TRP B 33 8.414 0.758 -5.539 1.00 0.00 C ATOM 1254 CG TRP B 33 8.641 2.226 -5.339 1.00 0.00 C ATOM 1255 CD1 TRP B 33 7.691 3.194 -5.179 1.00 0.00 C ATOM 1256 CD2 TRP B 33 9.904 2.890 -5.264 1.00 0.00 C ATOM 1257 NE1 TRP B 33 8.291 4.418 -5.015 1.00 0.00 N ATOM 1258 CE2 TRP B 33 9.649 4.256 -5.064 1.00 0.00 C ATOM 1259 CE3 TRP B 33 11.227 2.457 -5.349 1.00 0.00 C ATOM 1260 CZ2 TRP B 33 10.668 5.192 -4.949 1.00 0.00 C ATOM 1261 CZ3 TRP B 33 12.241 3.388 -5.235 1.00 0.00 C ATOM 1262 CH2 TRP B 33 11.955 4.744 -5.036 1.00 0.00 C ATOM 0 H TRP B 33 9.020 -1.663 -6.977 1.00 0.00 H new ATOM 0 HA TRP B 33 7.510 0.813 -7.488 1.00 0.00 H new ATOM 0 HB2 TRP B 33 7.483 0.478 -5.047 1.00 0.00 H new ATOM 0 HB3 TRP B 33 9.214 0.210 -5.042 1.00 0.00 H new ATOM 0 HD1 TRP B 33 6.625 3.022 -5.181 1.00 0.00 H new ATOM 0 HE1 TRP B 33 7.804 5.304 -4.879 1.00 0.00 H new ATOM 0 HE3 TRP B 33 11.455 1.412 -5.501 1.00 0.00 H new ATOM 0 HZ2 TRP B 33 10.450 6.239 -4.796 1.00 0.00 H new ATOM 0 HZ3 TRP B 33 13.270 3.065 -5.300 1.00 0.00 H new ATOM 0 HH2 TRP B 33 12.768 5.449 -4.950 1.00 0.00 H new ATOM 1273 N ALA B 34 9.588 1.870 -8.377 1.00 0.00 N ATOM 1274 CA ALA B 34 10.728 2.388 -9.119 1.00 0.00 C ATOM 1275 C ALA B 34 10.769 3.904 -8.998 1.00 0.00 C ATOM 1276 O ALA B 34 9.730 4.550 -9.107 1.00 0.00 O ATOM 1277 CB ALA B 34 10.638 1.975 -10.582 1.00 0.00 C ATOM 0 H ALA B 34 8.773 2.483 -8.386 1.00 0.00 H new ATOM 0 HA ALA B 34 11.645 1.973 -8.701 1.00 0.00 H new ATOM 0 HB1 ALA B 34 11.497 2.369 -11.125 1.00 0.00 H new ATOM 0 HB2 ALA B 34 10.632 0.887 -10.653 1.00 0.00 H new ATOM 0 HB3 ALA B 34 9.721 2.372 -11.016 1.00 0.00 H new ATOM 1283 N PRO B 35 11.959 4.490 -8.762 1.00 0.00 N ATOM 1284 CA PRO B 35 12.115 5.947 -8.628 1.00 0.00 C ATOM 1285 C PRO B 35 11.573 6.684 -9.846 1.00 0.00 C ATOM 1286 O PRO B 35 11.651 6.171 -10.969 1.00 0.00 O ATOM 1287 CB PRO B 35 13.631 6.140 -8.518 1.00 0.00 C ATOM 1288 CG PRO B 35 14.151 4.830 -8.039 1.00 0.00 C ATOM 1289 CD PRO B 35 13.241 3.783 -8.618 1.00 0.00 C ATOM 0 HA PRO B 35 11.565 6.344 -7.775 1.00 0.00 H new ATOM 0 HB2 PRO B 35 14.066 6.409 -9.481 1.00 0.00 H new ATOM 0 HB3 PRO B 35 13.878 6.941 -7.821 1.00 0.00 H new ATOM 0 HG2 PRO B 35 15.179 4.676 -8.366 1.00 0.00 H new ATOM 0 HG3 PRO B 35 14.152 4.786 -6.950 1.00 0.00 H new ATOM 0 HD2 PRO B 35 13.608 3.417 -9.577 1.00 0.00 H new ATOM 0 HD3 PRO B 35 13.152 2.919 -7.960 1.00 0.00 H new ATOM 1297 N GLU B 36 11.025 7.880 -9.645 1.00 0.00 N ATOM 1298 CA GLU B 36 10.475 8.626 -10.764 1.00 0.00 C ATOM 1299 C GLU B 36 11.593 9.068 -11.697 1.00 0.00 C ATOM 1300 O GLU B 36 12.465 9.851 -11.324 1.00 0.00 O ATOM 1301 CB GLU B 36 9.661 9.820 -10.274 1.00 0.00 C ATOM 1302 CG GLU B 36 8.368 9.417 -9.579 1.00 0.00 C ATOM 1303 CD GLU B 36 7.179 9.353 -10.515 1.00 0.00 C ATOM 1304 OE1 GLU B 36 6.982 8.314 -11.174 1.00 0.00 O ATOM 1305 OE2 GLU B 36 6.426 10.346 -10.586 1.00 0.00 O ATOM 0 H GLU B 36 10.952 8.342 -8.738 1.00 0.00 H new ATOM 0 HA GLU B 36 9.801 7.975 -11.320 1.00 0.00 H new ATOM 0 HB2 GLU B 36 10.268 10.408 -9.586 1.00 0.00 H new ATOM 0 HB3 GLU B 36 9.425 10.464 -11.121 1.00 0.00 H new ATOM 0 HG2 GLU B 36 8.505 8.443 -9.109 1.00 0.00 H new ATOM 0 HG3 GLU B 36 8.156 10.129 -8.781 1.00 0.00 H new ATOM 1312 N GLY B 37 11.561 8.544 -12.913 1.00 0.00 N ATOM 1313 CA GLY B 37 12.579 8.866 -13.888 1.00 0.00 C ATOM 1314 C GLY B 37 13.519 7.700 -14.121 1.00 0.00 C ATOM 1315 O GLY B 37 14.506 7.818 -14.847 1.00 0.00 O ATOM 0 H GLY B 37 10.843 7.898 -13.242 1.00 0.00 H new ATOM 0 HA2 GLY B 37 12.106 9.146 -14.829 1.00 0.00 H new ATOM 0 HA3 GLY B 37 13.149 9.731 -13.548 1.00 0.00 H new ATOM 1319 N LYS B 38 13.221 6.568 -13.492 1.00 0.00 N ATOM 1320 CA LYS B 38 14.045 5.379 -13.645 1.00 0.00 C ATOM 1321 C LYS B 38 13.485 4.457 -14.719 1.00 0.00 C ATOM 1322 O LYS B 38 12.287 4.445 -14.988 1.00 0.00 O ATOM 1323 CB LYS B 38 14.180 4.629 -12.319 1.00 0.00 C ATOM 1324 CG LYS B 38 15.542 4.798 -11.654 1.00 0.00 C ATOM 1325 CD LYS B 38 16.668 4.221 -12.506 1.00 0.00 C ATOM 1326 CE LYS B 38 17.299 5.279 -13.403 1.00 0.00 C ATOM 1327 NZ LYS B 38 18.246 4.686 -14.387 1.00 0.00 N ATOM 0 H LYS B 38 12.418 6.451 -12.874 1.00 0.00 H new ATOM 0 HA LYS B 38 15.037 5.706 -13.958 1.00 0.00 H new ATOM 0 HB2 LYS B 38 13.406 4.977 -11.635 1.00 0.00 H new ATOM 0 HB3 LYS B 38 13.999 3.568 -12.492 1.00 0.00 H new ATOM 0 HG2 LYS B 38 15.729 5.857 -11.474 1.00 0.00 H new ATOM 0 HG3 LYS B 38 15.534 4.306 -10.681 1.00 0.00 H new ATOM 0 HD2 LYS B 38 17.432 3.792 -11.857 1.00 0.00 H new ATOM 0 HD3 LYS B 38 16.279 3.409 -13.120 1.00 0.00 H new ATOM 0 HE2 LYS B 38 16.515 5.818 -13.935 1.00 0.00 H new ATOM 0 HE3 LYS B 38 17.826 6.008 -12.788 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 18.561 5.421 -15.052 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 19.070 4.297 -13.885 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 17.770 3.925 -14.912 1.00 0.00 H new ATOM 1341 N ASP B 39 14.377 3.680 -15.315 1.00 0.00 N ATOM 1342 CA ASP B 39 14.030 2.750 -16.382 1.00 0.00 C ATOM 1343 C ASP B 39 13.891 1.324 -15.861 1.00 0.00 C ATOM 1344 O ASP B 39 13.742 0.382 -16.639 1.00 0.00 O ATOM 1345 CB ASP B 39 15.126 2.787 -17.450 1.00 0.00 C ATOM 1346 CG ASP B 39 16.482 2.392 -16.888 1.00 0.00 C ATOM 1347 OD1 ASP B 39 16.989 3.106 -15.989 1.00 0.00 O ATOM 1348 OD2 ASP B 39 17.042 1.368 -17.328 1.00 0.00 O ATOM 0 H ASP B 39 15.368 3.676 -15.072 1.00 0.00 H new ATOM 0 HA ASP B 39 13.070 3.054 -16.800 1.00 0.00 H new ATOM 0 HB2 ASP B 39 14.861 2.113 -18.265 1.00 0.00 H new ATOM 0 HB3 ASP B 39 15.187 3.790 -17.873 1.00 0.00 H new ATOM 1353 N ARG B 40 13.936 1.160 -14.546 1.00 0.00 N ATOM 1354 CA ARG B 40 13.832 -0.166 -13.951 1.00 0.00 C ATOM 1355 C ARG B 40 13.312 -0.092 -12.526 1.00 0.00 C ATOM 1356 O ARG B 40 13.494 0.913 -11.838 1.00 0.00 O ATOM 1357 CB ARG B 40 15.197 -0.853 -13.962 1.00 0.00 C ATOM 1358 CG ARG B 40 15.276 -2.033 -14.913 1.00 0.00 C ATOM 1359 CD ARG B 40 16.717 -2.347 -15.277 1.00 0.00 C ATOM 1360 NE ARG B 40 17.305 -1.312 -16.127 1.00 0.00 N ATOM 1361 CZ ARG B 40 18.541 -1.359 -16.619 1.00 0.00 C ATOM 1362 NH1 ARG B 40 19.332 -2.394 -16.352 1.00 0.00 N ATOM 1363 NH2 ARG B 40 18.979 -0.364 -17.377 1.00 0.00 N ATOM 0 H ARG B 40 14.043 1.921 -13.875 1.00 0.00 H new ATOM 0 HA ARG B 40 13.125 -0.745 -14.545 1.00 0.00 H new ATOM 0 HB2 ARG B 40 15.959 -0.124 -14.237 1.00 0.00 H new ATOM 0 HB3 ARG B 40 15.431 -1.194 -12.953 1.00 0.00 H new ATOM 0 HG2 ARG B 40 14.815 -2.907 -14.452 1.00 0.00 H new ATOM 0 HG3 ARG B 40 14.709 -1.814 -15.818 1.00 0.00 H new ATOM 0 HD2 ARG B 40 17.308 -2.447 -14.366 1.00 0.00 H new ATOM 0 HD3 ARG B 40 16.760 -3.307 -15.792 1.00 0.00 H new ATOM 0 HE ARG B 40 16.730 -0.501 -16.358 1.00 0.00 H new ATOM 0 HH11 ARG B 40 18.993 -3.158 -15.767 1.00 0.00 H new ATOM 0 HH12 ARG B 40 20.278 -2.424 -16.732 1.00 0.00 H new ATOM 0 HH21 ARG B 40 18.370 0.429 -17.579 1.00 0.00 H new ATOM 0 HH22 ARG B 40 19.925 -0.391 -17.758 1.00 0.00 H new ATOM 1377 N PHE B 41 12.664 -1.167 -12.093 1.00 0.00 N ATOM 1378 CA PHE B 41 12.125 -1.252 -10.746 1.00 0.00 C ATOM 1379 C PHE B 41 13.227 -1.676 -9.787 1.00 0.00 C ATOM 1380 O PHE B 41 13.920 -2.663 -10.031 1.00 0.00 O ATOM 1381 CB PHE B 41 10.969 -2.257 -10.684 1.00 0.00 C ATOM 1382 CG PHE B 41 9.933 -2.060 -11.758 1.00 0.00 C ATOM 1383 CD1 PHE B 41 8.958 -1.087 -11.627 1.00 0.00 C ATOM 1384 CD2 PHE B 41 9.937 -2.853 -12.895 1.00 0.00 C ATOM 1385 CE1 PHE B 41 8.005 -0.906 -12.611 1.00 0.00 C ATOM 1386 CE2 PHE B 41 8.986 -2.676 -13.882 1.00 0.00 C ATOM 1387 CZ PHE B 41 8.019 -1.701 -13.740 1.00 0.00 C ATOM 0 H PHE B 41 12.500 -1.997 -12.663 1.00 0.00 H new ATOM 0 HA PHE B 41 11.743 -0.272 -10.460 1.00 0.00 H new ATOM 0 HB2 PHE B 41 11.373 -3.266 -10.763 1.00 0.00 H new ATOM 0 HB3 PHE B 41 10.487 -2.182 -9.709 1.00 0.00 H new ATOM 0 HD1 PHE B 41 8.942 -0.462 -10.746 1.00 0.00 H new ATOM 0 HD2 PHE B 41 10.691 -3.617 -13.011 1.00 0.00 H new ATOM 0 HE1 PHE B 41 7.249 -0.143 -12.497 1.00 0.00 H new ATOM 0 HE2 PHE B 41 8.999 -3.300 -14.764 1.00 0.00 H new ATOM 0 HZ PHE B 41 7.275 -1.560 -14.510 1.00 0.00 H new ATOM 1397 N THR B 42 13.393 -0.931 -8.710 1.00 0.00 N ATOM 1398 CA THR B 42 14.422 -1.234 -7.730 1.00 0.00 C ATOM 1399 C THR B 42 13.849 -1.998 -6.542 1.00 0.00 C ATOM 1400 O THR B 42 14.587 -2.487 -5.687 1.00 0.00 O ATOM 1401 CB THR B 42 15.089 0.060 -7.237 1.00 0.00 C ATOM 1402 OG1 THR B 42 14.102 1.096 -7.122 1.00 0.00 O ATOM 1403 CG2 THR B 42 16.186 0.503 -8.198 1.00 0.00 C ATOM 0 H THR B 42 12.828 -0.110 -8.491 1.00 0.00 H new ATOM 0 HA THR B 42 15.167 -1.863 -8.218 1.00 0.00 H new ATOM 0 HB THR B 42 15.538 -0.131 -6.262 1.00 0.00 H new ATOM 0 HG1 THR B 42 14.490 1.867 -6.659 1.00 0.00 H new ATOM 0 HG21 THR B 42 16.644 1.421 -7.829 1.00 0.00 H new ATOM 0 HG22 THR B 42 16.944 -0.277 -8.270 1.00 0.00 H new ATOM 0 HG23 THR B 42 15.756 0.683 -9.183 1.00 0.00 H new ATOM 1411 N ILE B 43 12.528 -2.102 -6.498 1.00 0.00 N ATOM 1412 CA ILE B 43 11.848 -2.795 -5.416 1.00 0.00 C ATOM 1413 C ILE B 43 10.737 -3.697 -5.949 1.00 0.00 C ATOM 1414 O ILE B 43 9.932 -3.277 -6.780 1.00 0.00 O ATOM 1415 CB ILE B 43 11.287 -1.780 -4.385 1.00 0.00 C ATOM 1416 CG1 ILE B 43 12.332 -1.520 -3.293 1.00 0.00 C ATOM 1417 CG2 ILE B 43 9.967 -2.249 -3.784 1.00 0.00 C ATOM 1418 CD1 ILE B 43 11.797 -0.783 -2.084 1.00 0.00 C ATOM 0 H ILE B 43 11.904 -1.712 -7.204 1.00 0.00 H new ATOM 0 HA ILE B 43 12.578 -3.429 -4.912 1.00 0.00 H new ATOM 0 HB ILE B 43 11.078 -0.846 -4.906 1.00 0.00 H new ATOM 0 HG12 ILE B 43 12.747 -2.474 -2.968 1.00 0.00 H new ATOM 0 HG13 ILE B 43 13.153 -0.945 -3.721 1.00 0.00 H new ATOM 0 HG21 ILE B 43 9.610 -1.509 -3.068 1.00 0.00 H new ATOM 0 HG22 ILE B 43 9.229 -2.372 -4.577 1.00 0.00 H new ATOM 0 HG23 ILE B 43 10.116 -3.202 -3.277 1.00 0.00 H new ATOM 0 HD11 ILE B 43 12.600 -0.640 -1.360 1.00 0.00 H new ATOM 0 HD12 ILE B 43 11.409 0.188 -2.392 1.00 0.00 H new ATOM 0 HD13 ILE B 43 10.997 -1.365 -1.628 1.00 0.00 H new ATOM 1430 N SER B 44 10.733 -4.947 -5.497 1.00 0.00 N ATOM 1431 CA SER B 44 9.727 -5.919 -5.897 1.00 0.00 C ATOM 1432 C SER B 44 9.470 -6.890 -4.744 1.00 0.00 C ATOM 1433 O SER B 44 10.380 -7.593 -4.305 1.00 0.00 O ATOM 1434 CB SER B 44 10.190 -6.679 -7.142 1.00 0.00 C ATOM 1435 OG SER B 44 9.132 -7.434 -7.710 1.00 0.00 O ATOM 0 H SER B 44 11.427 -5.312 -4.844 1.00 0.00 H new ATOM 0 HA SER B 44 8.800 -5.399 -6.139 1.00 0.00 H new ATOM 0 HB2 SER B 44 10.573 -5.974 -7.880 1.00 0.00 H new ATOM 0 HB3 SER B 44 11.013 -7.343 -6.880 1.00 0.00 H new ATOM 0 HG SER B 44 9.457 -7.907 -8.504 1.00 0.00 H new ATOM 1441 N HIS B 45 8.241 -6.915 -4.245 1.00 0.00 N ATOM 1442 CA HIS B 45 7.888 -7.796 -3.137 1.00 0.00 C ATOM 1443 C HIS B 45 6.655 -8.616 -3.468 1.00 0.00 C ATOM 1444 O HIS B 45 5.656 -8.088 -3.955 1.00 0.00 O ATOM 1445 CB HIS B 45 7.625 -6.991 -1.856 1.00 0.00 C ATOM 1446 CG HIS B 45 8.697 -6.001 -1.514 1.00 0.00 C ATOM 1447 ND1 HIS B 45 9.827 -6.303 -0.787 1.00 0.00 N ATOM 1448 CD2 HIS B 45 8.787 -4.682 -1.813 1.00 0.00 C ATOM 1449 CE1 HIS B 45 10.552 -5.183 -0.666 1.00 0.00 C ATOM 1450 NE2 HIS B 45 9.964 -4.171 -1.273 1.00 0.00 N ATOM 0 H HIS B 45 7.473 -6.338 -4.588 1.00 0.00 H new ATOM 0 HA HIS B 45 8.733 -8.465 -2.974 1.00 0.00 H new ATOM 0 HB2 HIS B 45 6.679 -6.461 -1.963 1.00 0.00 H new ATOM 0 HB3 HIS B 45 7.509 -7.685 -1.023 1.00 0.00 H new ATOM 0 HD1 HIS B 45 10.069 -7.218 -0.408 1.00 0.00 H new ATOM 0 HD2 HIS B 45 8.061 -4.118 -2.380 1.00 0.00 H new ATOM 0 HE1 HIS B 45 11.493 -5.118 -0.141 1.00 0.00 H new ATOM 1458 N MET B 46 6.733 -9.909 -3.217 1.00 0.00 N ATOM 1459 CA MET B 46 5.608 -10.793 -3.457 1.00 0.00 C ATOM 1460 C MET B 46 4.636 -10.664 -2.299 1.00 0.00 C ATOM 1461 O MET B 46 5.057 -10.613 -1.144 1.00 0.00 O ATOM 1462 CB MET B 46 6.073 -12.245 -3.594 1.00 0.00 C ATOM 1463 CG MET B 46 6.784 -12.544 -4.904 1.00 0.00 C ATOM 1464 SD MET B 46 5.650 -12.656 -6.304 1.00 0.00 S ATOM 1465 CE MET B 46 4.676 -14.089 -5.840 1.00 0.00 C ATOM 0 H MET B 46 7.564 -10.371 -2.847 1.00 0.00 H new ATOM 0 HA MET B 46 5.120 -10.510 -4.390 1.00 0.00 H new ATOM 0 HB2 MET B 46 6.742 -12.481 -2.767 1.00 0.00 H new ATOM 0 HB3 MET B 46 5.209 -12.903 -3.503 1.00 0.00 H new ATOM 0 HG2 MET B 46 7.520 -11.764 -5.099 1.00 0.00 H new ATOM 0 HG3 MET B 46 7.331 -13.482 -4.809 1.00 0.00 H new ATOM 0 HE1 MET B 46 4.262 -14.553 -6.735 1.00 0.00 H new ATOM 0 HE2 MET B 46 5.310 -14.807 -5.320 1.00 0.00 H new ATOM 0 HE3 MET B 46 3.864 -13.779 -5.183 1.00 0.00 H new ATOM 1475 N TYR B 47 3.345 -10.594 -2.600 1.00 0.00 N ATOM 1476 CA TYR B 47 2.326 -10.463 -1.556 1.00 0.00 C ATOM 1477 C TYR B 47 2.424 -11.620 -0.564 1.00 0.00 C ATOM 1478 O TYR B 47 2.072 -11.485 0.607 1.00 0.00 O ATOM 1479 CB TYR B 47 0.923 -10.405 -2.168 1.00 0.00 C ATOM 1480 CG TYR B 47 0.724 -9.256 -3.134 1.00 0.00 C ATOM 1481 CD1 TYR B 47 1.283 -8.008 -2.891 1.00 0.00 C ATOM 1482 CD2 TYR B 47 -0.020 -9.423 -4.294 1.00 0.00 C ATOM 1483 CE1 TYR B 47 1.107 -6.963 -3.778 1.00 0.00 C ATOM 1484 CE2 TYR B 47 -0.201 -8.381 -5.182 1.00 0.00 C ATOM 1485 CZ TYR B 47 0.364 -7.154 -4.920 1.00 0.00 C ATOM 1486 OH TYR B 47 0.193 -6.116 -5.807 1.00 0.00 O ATOM 0 H TYR B 47 2.977 -10.625 -3.551 1.00 0.00 H new ATOM 0 HA TYR B 47 2.506 -9.530 -1.022 1.00 0.00 H new ATOM 0 HB2 TYR B 47 0.724 -11.342 -2.687 1.00 0.00 H new ATOM 0 HB3 TYR B 47 0.190 -10.324 -1.365 1.00 0.00 H new ATOM 0 HD1 TYR B 47 1.865 -7.852 -1.994 1.00 0.00 H new ATOM 0 HD2 TYR B 47 -0.465 -10.384 -4.506 1.00 0.00 H new ATOM 0 HE1 TYR B 47 1.551 -6.000 -3.575 1.00 0.00 H new ATOM 0 HE2 TYR B 47 -0.784 -8.529 -6.079 1.00 0.00 H new ATOM 0 HH TYR B 47 -0.279 -6.440 -6.602 1.00 0.00 H new ATOM 1496 N ALA B 48 2.917 -12.753 -1.048 1.00 0.00 N ATOM 1497 CA ALA B 48 3.095 -13.942 -0.228 1.00 0.00 C ATOM 1498 C ALA B 48 4.151 -13.758 0.869 1.00 0.00 C ATOM 1499 O ALA B 48 4.242 -14.586 1.779 1.00 0.00 O ATOM 1500 CB ALA B 48 3.483 -15.116 -1.113 1.00 0.00 C ATOM 0 H ALA B 48 3.204 -12.872 -2.019 1.00 0.00 H new ATOM 0 HA ALA B 48 2.144 -14.133 0.270 1.00 0.00 H new ATOM 0 HB1 ALA B 48 3.616 -16.006 -0.499 1.00 0.00 H new ATOM 0 HB2 ALA B 48 2.696 -15.295 -1.846 1.00 0.00 H new ATOM 0 HB3 ALA B 48 4.415 -14.889 -1.630 1.00 0.00 H new ATOM 1506 N ASP B 49 4.951 -12.696 0.787 1.00 0.00 N ATOM 1507 CA ASP B 49 6.000 -12.456 1.767 1.00 0.00 C ATOM 1508 C ASP B 49 5.732 -11.228 2.625 1.00 0.00 C ATOM 1509 O ASP B 49 6.590 -10.816 3.410 1.00 0.00 O ATOM 1510 CB ASP B 49 7.336 -12.297 1.071 1.00 0.00 C ATOM 1511 CG ASP B 49 7.746 -13.543 0.310 1.00 0.00 C ATOM 1512 OD1 ASP B 49 8.316 -14.462 0.939 1.00 0.00 O ATOM 1513 OD2 ASP B 49 7.473 -13.618 -0.904 1.00 0.00 O ATOM 0 H ASP B 49 4.890 -11.991 0.052 1.00 0.00 H new ATOM 0 HA ASP B 49 6.017 -13.323 2.427 1.00 0.00 H new ATOM 0 HB2 ASP B 49 7.285 -11.454 0.381 1.00 0.00 H new ATOM 0 HB3 ASP B 49 8.101 -12.058 1.810 1.00 0.00 H new ATOM 1518 N ILE B 50 4.556 -10.638 2.501 1.00 0.00 N ATOM 1519 CA ILE B 50 4.240 -9.482 3.317 1.00 0.00 C ATOM 1520 C ILE B 50 3.614 -9.954 4.624 1.00 0.00 C ATOM 1521 O ILE B 50 2.578 -10.619 4.630 1.00 0.00 O ATOM 1522 CB ILE B 50 3.308 -8.474 2.616 1.00 0.00 C ATOM 1523 CG1 ILE B 50 3.508 -8.495 1.094 1.00 0.00 C ATOM 1524 CG2 ILE B 50 3.561 -7.074 3.161 1.00 0.00 C ATOM 1525 CD1 ILE B 50 4.776 -7.820 0.626 1.00 0.00 C ATOM 0 H ILE B 50 3.820 -10.932 1.859 1.00 0.00 H new ATOM 0 HA ILE B 50 5.174 -8.952 3.504 1.00 0.00 H new ATOM 0 HB ILE B 50 2.277 -8.762 2.821 1.00 0.00 H new ATOM 0 HG12 ILE B 50 3.514 -9.531 0.754 1.00 0.00 H new ATOM 0 HG13 ILE B 50 2.655 -8.009 0.620 1.00 0.00 H new ATOM 0 HG21 ILE B 50 2.900 -6.365 2.663 1.00 0.00 H new ATOM 0 HG22 ILE B 50 3.366 -7.060 4.233 1.00 0.00 H new ATOM 0 HG23 ILE B 50 4.598 -6.794 2.977 1.00 0.00 H new ATOM 0 HD11 ILE B 50 4.840 -7.879 -0.460 1.00 0.00 H new ATOM 0 HD12 ILE B 50 4.766 -6.774 0.932 1.00 0.00 H new ATOM 0 HD13 ILE B 50 5.638 -8.319 1.068 1.00 0.00 H new ATOM 1537 N LYS B 51 4.269 -9.627 5.723 1.00 0.00 N ATOM 1538 CA LYS B 51 3.827 -10.034 7.049 1.00 0.00 C ATOM 1539 C LYS B 51 2.678 -9.166 7.548 1.00 0.00 C ATOM 1540 O LYS B 51 1.681 -9.670 8.055 1.00 0.00 O ATOM 1541 CB LYS B 51 5.012 -9.943 8.011 1.00 0.00 C ATOM 1542 CG LYS B 51 4.685 -10.274 9.454 1.00 0.00 C ATOM 1543 CD LYS B 51 5.917 -10.129 10.331 1.00 0.00 C ATOM 1544 CE LYS B 51 5.784 -10.920 11.622 1.00 0.00 C ATOM 1545 NZ LYS B 51 6.044 -12.370 11.411 1.00 0.00 N ATOM 0 H LYS B 51 5.124 -9.071 5.724 1.00 0.00 H new ATOM 0 HA LYS B 51 3.461 -11.059 6.997 1.00 0.00 H new ATOM 0 HB2 LYS B 51 5.795 -10.619 7.666 1.00 0.00 H new ATOM 0 HB3 LYS B 51 5.420 -8.933 7.968 1.00 0.00 H new ATOM 0 HG2 LYS B 51 3.896 -9.613 9.814 1.00 0.00 H new ATOM 0 HG3 LYS B 51 4.303 -11.293 9.521 1.00 0.00 H new ATOM 0 HD2 LYS B 51 6.796 -10.471 9.784 1.00 0.00 H new ATOM 0 HD3 LYS B 51 6.076 -9.076 10.564 1.00 0.00 H new ATOM 0 HE2 LYS B 51 6.483 -10.529 12.361 1.00 0.00 H new ATOM 0 HE3 LYS B 51 4.782 -10.786 12.029 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 5.348 -12.929 11.945 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 5.964 -12.593 10.398 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 7.002 -12.603 11.742 1.00 0.00 H new ATOM 1559 N CYS B 52 2.831 -7.865 7.388 1.00 0.00 N ATOM 1560 CA CYS B 52 1.837 -6.901 7.833 1.00 0.00 C ATOM 1561 C CYS B 52 2.101 -5.576 7.143 1.00 0.00 C ATOM 1562 O CYS B 52 3.254 -5.192 6.959 1.00 0.00 O ATOM 1563 CB CYS B 52 1.918 -6.730 9.357 1.00 0.00 C ATOM 1564 SG CYS B 52 0.923 -5.371 10.019 1.00 0.00 S ATOM 0 H CYS B 52 3.648 -7.444 6.946 1.00 0.00 H new ATOM 0 HA CYS B 52 0.838 -7.254 7.579 1.00 0.00 H new ATOM 0 HB2 CYS B 52 1.601 -7.659 9.831 1.00 0.00 H new ATOM 0 HB3 CYS B 52 2.959 -6.569 9.636 1.00 0.00 H new ATOM 0 HG CYS B 52 -0.153 -5.232 9.303 1.00 0.00 H new ATOM 1570 N GLN B 53 1.056 -4.881 6.762 1.00 0.00 N ATOM 1571 CA GLN B 53 1.216 -3.603 6.096 1.00 0.00 C ATOM 1572 C GLN B 53 0.589 -2.539 6.952 1.00 0.00 C ATOM 1573 O GLN B 53 -0.553 -2.646 7.322 1.00 0.00 O ATOM 1574 CB GLN B 53 0.598 -3.625 4.700 1.00 0.00 C ATOM 1575 CG GLN B 53 -0.878 -3.945 4.703 1.00 0.00 C ATOM 1576 CD GLN B 53 -1.650 -3.108 3.716 1.00 0.00 C ATOM 1577 OE1 GLN B 53 -1.226 -2.027 3.324 1.00 0.00 O ATOM 1578 NE2 GLN B 53 -2.803 -3.594 3.333 1.00 0.00 N ATOM 0 H GLN B 53 0.089 -5.174 6.899 1.00 0.00 H new ATOM 0 HA GLN B 53 2.277 -3.389 5.966 1.00 0.00 H new ATOM 0 HB2 GLN B 53 0.751 -2.655 4.228 1.00 0.00 H new ATOM 0 HB3 GLN B 53 1.121 -4.362 4.091 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -1.019 -5.000 4.468 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -1.280 -3.785 5.704 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -3.117 -4.498 3.684 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -3.387 -3.068 2.683 1.00 0.00 H new ATOM 1587 N LYS B 54 1.327 -1.523 7.296 1.00 0.00 N ATOM 1588 CA LYS B 54 0.783 -0.501 8.148 1.00 0.00 C ATOM 1589 C LYS B 54 0.697 0.820 7.408 1.00 0.00 C ATOM 1590 O LYS B 54 1.342 1.008 6.386 1.00 0.00 O ATOM 1591 CB LYS B 54 1.609 -0.386 9.415 1.00 0.00 C ATOM 1592 CG LYS B 54 2.123 -1.715 9.951 1.00 0.00 C ATOM 1593 CD LYS B 54 2.836 -1.536 11.285 1.00 0.00 C ATOM 1594 CE LYS B 54 3.162 -2.873 11.936 1.00 0.00 C ATOM 1595 NZ LYS B 54 3.331 -2.747 13.409 1.00 0.00 N ATOM 0 H LYS B 54 2.294 -1.379 7.005 1.00 0.00 H new ATOM 0 HA LYS B 54 -0.232 -0.777 8.435 1.00 0.00 H new ATOM 0 HB2 LYS B 54 2.459 0.268 9.222 1.00 0.00 H new ATOM 0 HB3 LYS B 54 1.006 0.094 10.186 1.00 0.00 H new ATOM 0 HG2 LYS B 54 1.290 -2.407 10.072 1.00 0.00 H new ATOM 0 HG3 LYS B 54 2.806 -2.161 9.228 1.00 0.00 H new ATOM 0 HD2 LYS B 54 3.756 -0.972 11.132 1.00 0.00 H new ATOM 0 HD3 LYS B 54 2.210 -0.948 11.956 1.00 0.00 H new ATOM 0 HE2 LYS B 54 2.365 -3.585 11.722 1.00 0.00 H new ATOM 0 HE3 LYS B 54 4.076 -3.276 11.499 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 3.281 -3.689 13.846 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 4.255 -2.317 13.617 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 2.575 -2.146 13.795 1.00 0.00 H new ATOM 1609 N ILE B 55 -0.103 1.729 7.926 1.00 0.00 N ATOM 1610 CA ILE B 55 -0.318 3.015 7.280 1.00 0.00 C ATOM 1611 C ILE B 55 -0.127 4.181 8.249 1.00 0.00 C ATOM 1612 O ILE B 55 -0.685 4.180 9.334 1.00 0.00 O ATOM 1613 CB ILE B 55 -1.751 3.046 6.724 1.00 0.00 C ATOM 1614 CG1 ILE B 55 -2.746 2.841 7.872 1.00 0.00 C ATOM 1615 CG2 ILE B 55 -1.922 1.963 5.674 1.00 0.00 C ATOM 1616 CD1 ILE B 55 -3.995 2.093 7.498 1.00 0.00 C ATOM 0 H ILE B 55 -0.619 1.603 8.797 1.00 0.00 H new ATOM 0 HA ILE B 55 0.416 3.127 6.482 1.00 0.00 H new ATOM 0 HB ILE B 55 -1.941 4.013 6.257 1.00 0.00 H new ATOM 0 HG12 ILE B 55 -2.245 2.303 8.677 1.00 0.00 H new ATOM 0 HG13 ILE B 55 -3.028 3.817 8.268 1.00 0.00 H new ATOM 0 HG21 ILE B 55 -2.940 1.991 5.285 1.00 0.00 H new ATOM 0 HG22 ILE B 55 -1.217 2.131 4.860 1.00 0.00 H new ATOM 0 HG23 ILE B 55 -1.732 0.988 6.123 1.00 0.00 H new ATOM 0 HD11 ILE B 55 -4.637 1.997 8.373 1.00 0.00 H new ATOM 0 HD12 ILE B 55 -4.525 2.638 6.717 1.00 0.00 H new ATOM 0 HD13 ILE B 55 -3.729 1.101 7.132 1.00 0.00 H new ATOM 1628 N SER B 56 0.661 5.177 7.873 1.00 0.00 N ATOM 1629 CA SER B 56 0.860 6.316 8.749 1.00 0.00 C ATOM 1630 C SER B 56 -0.388 7.180 8.682 1.00 0.00 C ATOM 1631 O SER B 56 -0.731 7.710 7.610 1.00 0.00 O ATOM 1632 CB SER B 56 2.131 7.101 8.397 1.00 0.00 C ATOM 1633 OG SER B 56 1.897 8.083 7.409 1.00 0.00 O ATOM 0 H SER B 56 1.163 5.219 6.986 1.00 0.00 H new ATOM 0 HA SER B 56 1.012 5.972 9.772 1.00 0.00 H new ATOM 0 HB2 SER B 56 2.521 7.579 9.296 1.00 0.00 H new ATOM 0 HB3 SER B 56 2.897 6.410 8.045 1.00 0.00 H new ATOM 0 HG SER B 56 0.949 8.333 7.414 1.00 0.00 H new ATOM 1639 N PRO B 57 -1.090 7.271 9.827 1.00 0.00 N ATOM 1640 CA PRO B 57 -2.356 8.004 9.977 1.00 0.00 C ATOM 1641 C PRO B 57 -2.222 9.515 9.918 1.00 0.00 C ATOM 1642 O PRO B 57 -1.113 10.063 9.952 1.00 0.00 O ATOM 1643 CB PRO B 57 -2.845 7.587 11.365 1.00 0.00 C ATOM 1644 CG PRO B 57 -1.609 7.239 12.113 1.00 0.00 C ATOM 1645 CD PRO B 57 -0.670 6.652 11.102 1.00 0.00 C ATOM 0 HA PRO B 57 -3.031 7.764 9.155 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -3.388 8.396 11.853 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -3.525 6.737 11.306 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -1.175 8.122 12.583 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -1.822 6.526 12.909 1.00 0.00 H new ATOM 0 HD2 PRO B 57 0.368 6.886 11.337 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -0.751 5.566 11.065 1.00 0.00 H new ATOM 1653 N GLU B 58 -3.376 10.167 9.805 1.00 0.00 N ATOM 1654 CA GLU B 58 -3.456 11.616 9.760 1.00 0.00 C ATOM 1655 C GLU B 58 -2.809 12.227 10.993 1.00 0.00 C ATOM 1656 O GLU B 58 -2.718 11.590 12.046 1.00 0.00 O ATOM 1657 CB GLU B 58 -4.911 12.070 9.652 1.00 0.00 C ATOM 1658 CG GLU B 58 -5.372 12.273 8.220 1.00 0.00 C ATOM 1659 CD GLU B 58 -4.444 13.182 7.438 1.00 0.00 C ATOM 1660 OE1 GLU B 58 -3.825 14.076 8.059 1.00 0.00 O ATOM 1661 OE2 GLU B 58 -4.331 12.996 6.210 1.00 0.00 O ATOM 0 H GLU B 58 -4.281 9.701 9.742 1.00 0.00 H new ATOM 0 HA GLU B 58 -2.916 11.958 8.877 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -5.552 11.330 10.131 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -5.035 13.003 10.202 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -5.435 11.306 7.721 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -6.376 12.697 8.221 1.00 0.00 H new ATOM 1668 N GLY B 59 -2.376 13.461 10.860 1.00 0.00 N ATOM 1669 CA GLY B 59 -1.705 14.132 11.950 1.00 0.00 C ATOM 1670 C GLY B 59 -0.237 14.263 11.639 1.00 0.00 C ATOM 1671 O GLY B 59 0.465 15.112 12.186 1.00 0.00 O ATOM 0 H GLY B 59 -2.476 14.018 10.011 1.00 0.00 H new ATOM 0 HA2 GLY B 59 -2.143 15.118 12.107 1.00 0.00 H new ATOM 0 HA3 GLY B 59 -1.842 13.571 12.875 1.00 0.00 H new ATOM 1675 N LYS B 60 0.220 13.395 10.749 1.00 0.00 N ATOM 1676 CA LYS B 60 1.596 13.406 10.299 1.00 0.00 C ATOM 1677 C LYS B 60 1.702 14.370 9.126 1.00 0.00 C ATOM 1678 O LYS B 60 0.695 14.715 8.516 1.00 0.00 O ATOM 1679 CB LYS B 60 2.045 11.998 9.879 1.00 0.00 C ATOM 1680 CG LYS B 60 2.582 11.142 11.023 1.00 0.00 C ATOM 1681 CD LYS B 60 2.802 9.700 10.582 1.00 0.00 C ATOM 1682 CE LYS B 60 3.707 8.930 11.540 1.00 0.00 C ATOM 1683 NZ LYS B 60 5.093 9.462 11.562 1.00 0.00 N ATOM 0 H LYS B 60 -0.353 12.667 10.322 1.00 0.00 H new ATOM 0 HA LYS B 60 2.248 13.728 11.111 1.00 0.00 H new ATOM 0 HB2 LYS B 60 1.201 11.482 9.420 1.00 0.00 H new ATOM 0 HB3 LYS B 60 2.817 12.088 9.115 1.00 0.00 H new ATOM 0 HG2 LYS B 60 3.521 11.561 11.383 1.00 0.00 H new ATOM 0 HG3 LYS B 60 1.881 11.166 11.858 1.00 0.00 H new ATOM 0 HD2 LYS B 60 1.839 9.194 10.510 1.00 0.00 H new ATOM 0 HD3 LYS B 60 3.242 9.691 9.585 1.00 0.00 H new ATOM 0 HE2 LYS B 60 3.288 8.974 12.545 1.00 0.00 H new ATOM 0 HE3 LYS B 60 3.729 7.880 11.249 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 5.654 8.939 12.264 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 5.523 9.350 10.622 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 5.074 10.470 11.816 1.00 0.00 H new ATOM 1697 N ALA B 61 2.910 14.802 8.808 1.00 0.00 N ATOM 1698 CA ALA B 61 3.111 15.734 7.703 1.00 0.00 C ATOM 1699 C ALA B 61 2.931 15.054 6.352 1.00 0.00 C ATOM 1700 O ALA B 61 2.992 15.706 5.312 1.00 0.00 O ATOM 1701 CB ALA B 61 4.485 16.379 7.799 1.00 0.00 C ATOM 0 H ALA B 61 3.764 14.527 9.293 1.00 0.00 H new ATOM 0 HA ALA B 61 2.350 16.511 7.781 1.00 0.00 H new ATOM 0 HB1 ALA B 61 4.621 17.072 6.968 1.00 0.00 H new ATOM 0 HB2 ALA B 61 4.567 16.921 8.741 1.00 0.00 H new ATOM 0 HB3 ALA B 61 5.253 15.607 7.757 1.00 0.00 H new ATOM 1707 N LYS B 62 2.722 13.746 6.370 1.00 0.00 N ATOM 1708 CA LYS B 62 2.537 12.994 5.144 1.00 0.00 C ATOM 1709 C LYS B 62 1.884 11.649 5.424 1.00 0.00 C ATOM 1710 O LYS B 62 2.215 10.973 6.401 1.00 0.00 O ATOM 1711 CB LYS B 62 3.878 12.793 4.434 1.00 0.00 C ATOM 1712 CG LYS B 62 4.980 12.250 5.332 1.00 0.00 C ATOM 1713 CD LYS B 62 6.313 12.907 5.026 1.00 0.00 C ATOM 1714 CE LYS B 62 7.279 12.764 6.184 1.00 0.00 C ATOM 1715 NZ LYS B 62 7.884 11.412 6.241 1.00 0.00 N ATOM 0 H LYS B 62 2.677 13.186 7.221 1.00 0.00 H new ATOM 0 HA LYS B 62 1.876 13.566 4.493 1.00 0.00 H new ATOM 0 HB2 LYS B 62 3.735 12.109 3.598 1.00 0.00 H new ATOM 0 HB3 LYS B 62 4.202 13.746 4.015 1.00 0.00 H new ATOM 0 HG2 LYS B 62 4.719 12.421 6.376 1.00 0.00 H new ATOM 0 HG3 LYS B 62 5.064 11.172 5.197 1.00 0.00 H new ATOM 0 HD2 LYS B 62 6.745 12.457 4.132 1.00 0.00 H new ATOM 0 HD3 LYS B 62 6.158 13.964 4.808 1.00 0.00 H new ATOM 0 HE2 LYS B 62 8.068 13.510 6.092 1.00 0.00 H new ATOM 0 HE3 LYS B 62 6.756 12.967 7.119 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 8.271 11.245 7.192 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 7.158 10.698 6.032 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 8.648 11.344 5.539 1.00 0.00 H new ATOM 1729 N ILE B 63 0.943 11.290 4.567 1.00 0.00 N ATOM 1730 CA ILE B 63 0.231 10.027 4.668 1.00 0.00 C ATOM 1731 C ILE B 63 1.117 8.935 4.074 1.00 0.00 C ATOM 1732 O ILE B 63 1.606 9.080 2.951 1.00 0.00 O ATOM 1733 CB ILE B 63 -1.124 10.101 3.923 1.00 0.00 C ATOM 1734 CG1 ILE B 63 -2.019 11.188 4.533 1.00 0.00 C ATOM 1735 CG2 ILE B 63 -1.833 8.762 3.966 1.00 0.00 C ATOM 1736 CD1 ILE B 63 -1.723 12.593 4.038 1.00 0.00 C ATOM 0 H ILE B 63 0.650 11.868 3.779 1.00 0.00 H new ATOM 0 HA ILE B 63 0.014 9.803 5.713 1.00 0.00 H new ATOM 0 HB ILE B 63 -0.922 10.357 2.883 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -3.060 10.950 4.314 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -1.909 11.167 5.617 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -2.783 8.836 3.437 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -1.210 8.005 3.489 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -2.016 8.481 5.003 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -2.400 13.299 4.519 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -0.693 12.855 4.281 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -1.863 12.635 2.958 1.00 0.00 H new ATOM 1748 N GLN B 64 1.338 7.847 4.806 1.00 0.00 N ATOM 1749 CA GLN B 64 2.260 6.814 4.316 1.00 0.00 C ATOM 1750 C GLN B 64 1.769 5.376 4.520 1.00 0.00 C ATOM 1751 O GLN B 64 0.753 5.131 5.169 1.00 0.00 O ATOM 1752 CB GLN B 64 3.623 6.972 4.985 1.00 0.00 C ATOM 1753 CG GLN B 64 4.180 8.386 4.989 1.00 0.00 C ATOM 1754 CD GLN B 64 5.579 8.429 5.557 1.00 0.00 C ATOM 1755 OE1 GLN B 64 5.978 9.391 6.220 1.00 0.00 O ATOM 1756 NE2 GLN B 64 6.341 7.382 5.297 1.00 0.00 N ATOM 0 H GLN B 64 0.910 7.656 5.712 1.00 0.00 H new ATOM 0 HA GLN B 64 2.326 6.970 3.239 1.00 0.00 H new ATOM 0 HB2 GLN B 64 3.547 6.625 6.016 1.00 0.00 H new ATOM 0 HB3 GLN B 64 4.336 6.319 4.481 1.00 0.00 H new ATOM 0 HG2 GLN B 64 4.187 8.778 3.972 1.00 0.00 H new ATOM 0 HG3 GLN B 64 3.528 9.033 5.576 1.00 0.00 H new ATOM 0 HE21 GLN B 64 5.972 6.607 4.745 1.00 0.00 H new ATOM 0 HE22 GLN B 64 7.298 7.348 5.648 1.00 0.00 H new ATOM 1765 N LEU B 65 2.521 4.440 3.924 1.00 0.00 N ATOM 1766 CA LEU B 65 2.249 3.004 3.986 1.00 0.00 C ATOM 1767 C LEU B 65 3.552 2.208 4.194 1.00 0.00 C ATOM 1768 O LEU B 65 4.473 2.326 3.390 1.00 0.00 O ATOM 1769 CB LEU B 65 1.632 2.587 2.662 1.00 0.00 C ATOM 1770 CG LEU B 65 1.212 1.126 2.564 1.00 0.00 C ATOM 1771 CD1 LEU B 65 -0.227 0.949 3.003 1.00 0.00 C ATOM 1772 CD2 LEU B 65 1.416 0.613 1.148 1.00 0.00 C ATOM 0 H LEU B 65 3.350 4.668 3.376 1.00 0.00 H new ATOM 0 HA LEU B 65 1.579 2.800 4.821 1.00 0.00 H new ATOM 0 HB2 LEU B 65 0.758 3.211 2.476 1.00 0.00 H new ATOM 0 HB3 LEU B 65 2.347 2.795 1.866 1.00 0.00 H new ATOM 0 HG LEU B 65 1.839 0.540 3.235 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -0.505 -0.102 2.925 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -0.335 1.277 4.037 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -0.878 1.545 2.364 1.00 0.00 H new ATOM 0 HD21 LEU B 65 1.112 -0.432 1.092 1.00 0.00 H new ATOM 0 HD22 LEU B 65 0.814 1.203 0.457 1.00 0.00 H new ATOM 0 HD23 LEU B 65 2.468 0.700 0.878 1.00 0.00 H new ATOM 1784 N GLN B 66 3.652 1.421 5.270 1.00 0.00 N ATOM 1785 CA GLN B 66 4.855 0.619 5.506 1.00 0.00 C ATOM 1786 C GLN B 66 4.541 -0.874 5.340 1.00 0.00 C ATOM 1787 O GLN B 66 3.539 -1.370 5.851 1.00 0.00 O ATOM 1788 CB GLN B 66 5.463 0.888 6.893 1.00 0.00 C ATOM 1789 CG GLN B 66 4.957 -0.017 8.008 1.00 0.00 C ATOM 1790 CD GLN B 66 5.874 -0.027 9.221 1.00 0.00 C ATOM 1791 OE1 GLN B 66 5.446 -0.332 10.332 1.00 0.00 O ATOM 1792 NE2 GLN B 66 7.138 0.316 9.023 1.00 0.00 N ATOM 0 H GLN B 66 2.927 1.323 5.981 1.00 0.00 H new ATOM 0 HA GLN B 66 5.596 0.913 4.763 1.00 0.00 H new ATOM 0 HB2 GLN B 66 6.546 0.783 6.824 1.00 0.00 H new ATOM 0 HB3 GLN B 66 5.260 1.923 7.167 1.00 0.00 H new ATOM 0 HG2 GLN B 66 3.963 0.310 8.312 1.00 0.00 H new ATOM 0 HG3 GLN B 66 4.855 -1.033 7.627 1.00 0.00 H new ATOM 0 HE21 GLN B 66 7.459 0.563 8.087 1.00 0.00 H new ATOM 0 HE22 GLN B 66 7.791 0.333 9.807 1.00 0.00 H new ATOM 1801 N LEU B 67 5.384 -1.578 4.605 1.00 0.00 N ATOM 1802 CA LEU B 67 5.204 -3.010 4.381 1.00 0.00 C ATOM 1803 C LEU B 67 6.200 -3.803 5.217 1.00 0.00 C ATOM 1804 O LEU B 67 7.386 -3.834 4.910 1.00 0.00 O ATOM 1805 CB LEU B 67 5.413 -3.355 2.903 1.00 0.00 C ATOM 1806 CG LEU B 67 4.604 -2.525 1.907 1.00 0.00 C ATOM 1807 CD1 LEU B 67 4.935 -2.940 0.483 1.00 0.00 C ATOM 1808 CD2 LEU B 67 3.116 -2.672 2.173 1.00 0.00 C ATOM 0 H LEU B 67 6.206 -1.182 4.149 1.00 0.00 H new ATOM 0 HA LEU B 67 4.187 -3.271 4.673 1.00 0.00 H new ATOM 0 HB2 LEU B 67 6.471 -3.240 2.668 1.00 0.00 H new ATOM 0 HB3 LEU B 67 5.166 -4.407 2.756 1.00 0.00 H new ATOM 0 HG LEU B 67 4.871 -1.476 2.034 1.00 0.00 H new ATOM 0 HD11 LEU B 67 4.351 -2.340 -0.216 1.00 0.00 H new ATOM 0 HD12 LEU B 67 5.997 -2.784 0.296 1.00 0.00 H new ATOM 0 HD13 LEU B 67 4.694 -3.994 0.346 1.00 0.00 H new ATOM 0 HD21 LEU B 67 2.557 -2.074 1.454 1.00 0.00 H new ATOM 0 HD22 LEU B 67 2.830 -3.719 2.074 1.00 0.00 H new ATOM 0 HD23 LEU B 67 2.891 -2.329 3.183 1.00 0.00 H new ATOM 1820 N VAL B 68 5.723 -4.420 6.282 1.00 0.00 N ATOM 1821 CA VAL B 68 6.577 -5.228 7.139 1.00 0.00 C ATOM 1822 C VAL B 68 6.587 -6.651 6.609 1.00 0.00 C ATOM 1823 O VAL B 68 5.539 -7.288 6.516 1.00 0.00 O ATOM 1824 CB VAL B 68 6.083 -5.227 8.603 1.00 0.00 C ATOM 1825 CG1 VAL B 68 6.969 -6.103 9.481 1.00 0.00 C ATOM 1826 CG2 VAL B 68 6.022 -3.810 9.147 1.00 0.00 C ATOM 0 H VAL B 68 4.747 -4.378 6.576 1.00 0.00 H new ATOM 0 HA VAL B 68 7.581 -4.803 7.128 1.00 0.00 H new ATOM 0 HB VAL B 68 5.076 -5.645 8.619 1.00 0.00 H new ATOM 0 HG11 VAL B 68 6.598 -6.084 10.506 1.00 0.00 H new ATOM 0 HG12 VAL B 68 6.952 -7.127 9.108 1.00 0.00 H new ATOM 0 HG13 VAL B 68 7.991 -5.725 9.458 1.00 0.00 H new ATOM 0 HG21 VAL B 68 5.672 -3.831 10.179 1.00 0.00 H new ATOM 0 HG22 VAL B 68 7.015 -3.363 9.110 1.00 0.00 H new ATOM 0 HG23 VAL B 68 5.335 -3.218 8.543 1.00 0.00 H new ATOM 1836 N LEU B 69 7.753 -7.146 6.239 1.00 0.00 N ATOM 1837 CA LEU B 69 7.856 -8.488 5.692 1.00 0.00 C ATOM 1838 C LEU B 69 8.431 -9.456 6.714 1.00 0.00 C ATOM 1839 O LEU B 69 9.238 -9.072 7.561 1.00 0.00 O ATOM 1840 CB LEU B 69 8.712 -8.480 4.426 1.00 0.00 C ATOM 1841 CG LEU B 69 8.410 -7.334 3.459 1.00 0.00 C ATOM 1842 CD1 LEU B 69 9.109 -7.551 2.138 1.00 0.00 C ATOM 1843 CD2 LEU B 69 6.921 -7.187 3.231 1.00 0.00 C ATOM 0 H LEU B 69 8.638 -6.643 6.306 1.00 0.00 H new ATOM 0 HA LEU B 69 6.852 -8.826 5.437 1.00 0.00 H new ATOM 0 HB2 LEU B 69 9.762 -8.428 4.714 1.00 0.00 H new ATOM 0 HB3 LEU B 69 8.572 -9.426 3.903 1.00 0.00 H new ATOM 0 HG LEU B 69 8.783 -6.416 3.913 1.00 0.00 H new ATOM 0 HD11 LEU B 69 8.880 -6.724 1.465 1.00 0.00 H new ATOM 0 HD12 LEU B 69 10.186 -7.600 2.300 1.00 0.00 H new ATOM 0 HD13 LEU B 69 8.766 -8.485 1.694 1.00 0.00 H new ATOM 0 HD21 LEU B 69 6.738 -6.365 2.539 1.00 0.00 H new ATOM 0 HD22 LEU B 69 6.525 -8.111 2.809 1.00 0.00 H new ATOM 0 HD23 LEU B 69 6.426 -6.980 4.180 1.00 0.00 H new ATOM 1855 N HIS B 70 8.025 -10.718 6.622 1.00 0.00 N ATOM 1856 CA HIS B 70 8.504 -11.745 7.547 1.00 0.00 C ATOM 1857 C HIS B 70 9.919 -12.181 7.189 1.00 0.00 C ATOM 1858 O HIS B 70 10.505 -13.029 7.855 1.00 0.00 O ATOM 1859 CB HIS B 70 7.565 -12.964 7.588 1.00 0.00 C ATOM 1860 CG HIS B 70 6.828 -13.242 6.310 1.00 0.00 C ATOM 1861 ND1 HIS B 70 5.476 -13.024 6.143 1.00 0.00 N ATOM 1862 CD2 HIS B 70 7.272 -13.733 5.125 1.00 0.00 C ATOM 1863 CE1 HIS B 70 5.160 -13.376 4.893 1.00 0.00 C ATOM 1864 NE2 HIS B 70 6.210 -13.821 4.247 1.00 0.00 N ATOM 0 H HIS B 70 7.367 -11.056 5.919 1.00 0.00 H new ATOM 0 HA HIS B 70 8.514 -11.300 8.542 1.00 0.00 H new ATOM 0 HB2 HIS B 70 8.150 -13.845 7.851 1.00 0.00 H new ATOM 0 HB3 HIS B 70 6.836 -12.815 8.385 1.00 0.00 H new ATOM 0 HD1 HIS B 70 4.833 -12.660 6.847 1.00 0.00 H new ATOM 0 HD2 HIS B 70 8.292 -14.010 4.904 1.00 0.00 H new ATOM 0 HE1 HIS B 70 4.169 -13.303 4.470 1.00 0.00 H new ATOM 1872 N ALA B 71 10.459 -11.586 6.135 1.00 0.00 N ATOM 1873 CA ALA B 71 11.809 -11.891 5.693 1.00 0.00 C ATOM 1874 C ALA B 71 12.813 -10.984 6.395 1.00 0.00 C ATOM 1875 O ALA B 71 14.017 -11.092 6.184 1.00 0.00 O ATOM 1876 CB ALA B 71 11.917 -11.740 4.183 1.00 0.00 C ATOM 0 H ALA B 71 9.979 -10.886 5.569 1.00 0.00 H new ATOM 0 HA ALA B 71 12.037 -12.925 5.953 1.00 0.00 H new ATOM 0 HB1 ALA B 71 12.934 -11.972 3.866 1.00 0.00 H new ATOM 0 HB2 ALA B 71 11.221 -12.425 3.698 1.00 0.00 H new ATOM 0 HB3 ALA B 71 11.674 -10.715 3.901 1.00 0.00 H new ATOM 1882 N GLY B 72 12.300 -10.088 7.234 1.00 0.00 N ATOM 1883 CA GLY B 72 13.157 -9.170 7.959 1.00 0.00 C ATOM 1884 C GLY B 72 13.373 -7.876 7.205 1.00 0.00 C ATOM 1885 O GLY B 72 14.407 -7.227 7.355 1.00 0.00 O ATOM 0 H GLY B 72 11.303 -9.982 7.424 1.00 0.00 H new ATOM 0 HA2 GLY B 72 12.714 -8.953 8.931 1.00 0.00 H new ATOM 0 HA3 GLY B 72 14.120 -9.645 8.146 1.00 0.00 H new ATOM 1889 N ASP B 73 12.389 -7.499 6.402 1.00 0.00 N ATOM 1890 CA ASP B 73 12.467 -6.278 5.609 1.00 0.00 C ATOM 1891 C ASP B 73 11.222 -5.423 5.827 1.00 0.00 C ATOM 1892 O ASP B 73 10.178 -5.930 6.244 1.00 0.00 O ATOM 1893 CB ASP B 73 12.623 -6.624 4.122 1.00 0.00 C ATOM 1894 CG ASP B 73 12.647 -5.395 3.230 1.00 0.00 C ATOM 1895 OD1 ASP B 73 13.320 -4.408 3.596 1.00 0.00 O ATOM 1896 OD2 ASP B 73 11.987 -5.416 2.171 1.00 0.00 O ATOM 0 H ASP B 73 11.522 -8.023 6.281 1.00 0.00 H new ATOM 0 HA ASP B 73 13.339 -5.707 5.929 1.00 0.00 H new ATOM 0 HB2 ASP B 73 13.545 -7.188 3.980 1.00 0.00 H new ATOM 0 HB3 ASP B 73 11.802 -7.273 3.817 1.00 0.00 H new ATOM 1901 N THR B 74 11.341 -4.132 5.555 1.00 0.00 N ATOM 1902 CA THR B 74 10.240 -3.201 5.708 1.00 0.00 C ATOM 1903 C THR B 74 10.283 -2.154 4.599 1.00 0.00 C ATOM 1904 O THR B 74 11.321 -1.542 4.355 1.00 0.00 O ATOM 1905 CB THR B 74 10.295 -2.491 7.075 1.00 0.00 C ATOM 1906 OG1 THR B 74 11.659 -2.242 7.441 1.00 0.00 O ATOM 1907 CG2 THR B 74 9.623 -3.326 8.153 1.00 0.00 C ATOM 0 H THR B 74 12.205 -3.703 5.222 1.00 0.00 H new ATOM 0 HA THR B 74 9.312 -3.770 5.647 1.00 0.00 H new ATOM 0 HB THR B 74 9.760 -1.546 6.987 1.00 0.00 H new ATOM 0 HG1 THR B 74 11.687 -1.789 8.310 1.00 0.00 H new ATOM 0 HG21 THR B 74 9.677 -2.801 9.107 1.00 0.00 H new ATOM 0 HG22 THR B 74 8.579 -3.490 7.888 1.00 0.00 H new ATOM 0 HG23 THR B 74 10.131 -4.287 8.239 1.00 0.00 H new ATOM 1915 N THR B 75 9.154 -1.937 3.949 1.00 0.00 N ATOM 1916 CA THR B 75 9.076 -0.969 2.869 1.00 0.00 C ATOM 1917 C THR B 75 8.200 0.216 3.268 1.00 0.00 C ATOM 1918 O THR B 75 6.976 0.116 3.277 1.00 0.00 O ATOM 1919 CB THR B 75 8.505 -1.627 1.604 1.00 0.00 C ATOM 1920 OG1 THR B 75 8.839 -3.022 1.587 1.00 0.00 O ATOM 1921 CG2 THR B 75 9.057 -0.961 0.356 1.00 0.00 C ATOM 0 H THR B 75 8.277 -2.418 4.150 1.00 0.00 H new ATOM 0 HA THR B 75 10.084 -0.609 2.664 1.00 0.00 H new ATOM 0 HB THR B 75 7.421 -1.509 1.615 1.00 0.00 H new ATOM 0 HG1 THR B 75 9.147 -3.274 0.691 1.00 0.00 H new ATOM 0 HG21 THR B 75 8.640 -1.443 -0.528 1.00 0.00 H new ATOM 0 HG22 THR B 75 8.786 0.095 0.357 1.00 0.00 H new ATOM 0 HG23 THR B 75 10.143 -1.056 0.343 1.00 0.00 H new ATOM 1929 N ASN B 76 8.827 1.329 3.607 1.00 0.00 N ATOM 1930 CA ASN B 76 8.099 2.526 4.024 1.00 0.00 C ATOM 1931 C ASN B 76 7.866 3.462 2.843 1.00 0.00 C ATOM 1932 O ASN B 76 8.803 4.066 2.329 1.00 0.00 O ATOM 1933 CB ASN B 76 8.870 3.252 5.123 1.00 0.00 C ATOM 1934 CG ASN B 76 8.774 2.541 6.458 1.00 0.00 C ATOM 1935 OD1 ASN B 76 8.693 1.315 6.526 1.00 0.00 O ATOM 1936 ND2 ASN B 76 8.760 3.304 7.527 1.00 0.00 N ATOM 0 H ASN B 76 9.842 1.434 3.603 1.00 0.00 H new ATOM 0 HA ASN B 76 7.128 2.217 4.412 1.00 0.00 H new ATOM 0 HB2 ASN B 76 9.917 3.337 4.834 1.00 0.00 H new ATOM 0 HB3 ASN B 76 8.484 4.266 5.225 1.00 0.00 H new ATOM 0 HD21 ASN B 76 8.680 2.883 8.453 1.00 0.00 H new ATOM 0 HD22 ASN B 76 8.829 4.317 7.431 1.00 0.00 H new ATOM 1943 N PHE B 77 6.613 3.588 2.424 1.00 0.00 N ATOM 1944 CA PHE B 77 6.267 4.436 1.292 1.00 0.00 C ATOM 1945 C PHE B 77 5.498 5.686 1.714 1.00 0.00 C ATOM 1946 O PHE B 77 4.410 5.601 2.282 1.00 0.00 O ATOM 1947 CB PHE B 77 5.442 3.647 0.276 1.00 0.00 C ATOM 1948 CG PHE B 77 6.262 2.713 -0.565 1.00 0.00 C ATOM 1949 CD1 PHE B 77 7.528 3.080 -0.992 1.00 0.00 C ATOM 1950 CD2 PHE B 77 5.768 1.472 -0.931 1.00 0.00 C ATOM 1951 CE1 PHE B 77 8.287 2.227 -1.766 1.00 0.00 C ATOM 1952 CE2 PHE B 77 6.522 0.615 -1.707 1.00 0.00 C ATOM 1953 CZ PHE B 77 7.784 0.993 -2.124 1.00 0.00 C ATOM 0 H PHE B 77 5.819 3.113 2.852 1.00 0.00 H new ATOM 0 HA PHE B 77 7.204 4.762 0.840 1.00 0.00 H new ATOM 0 HB2 PHE B 77 4.681 3.073 0.805 1.00 0.00 H new ATOM 0 HB3 PHE B 77 4.919 4.346 -0.376 1.00 0.00 H new ATOM 0 HD1 PHE B 77 7.925 4.045 -0.716 1.00 0.00 H new ATOM 0 HD2 PHE B 77 4.783 1.172 -0.606 1.00 0.00 H new ATOM 0 HE1 PHE B 77 9.273 2.524 -2.091 1.00 0.00 H new ATOM 0 HE2 PHE B 77 6.126 -0.350 -1.988 1.00 0.00 H new ATOM 0 HZ PHE B 77 8.376 0.323 -2.730 1.00 0.00 H new ATOM 1963 N HIS B 78 6.091 6.836 1.444 1.00 0.00 N ATOM 1964 CA HIS B 78 5.502 8.132 1.734 1.00 0.00 C ATOM 1965 C HIS B 78 4.795 8.661 0.485 1.00 0.00 C ATOM 1966 O HIS B 78 5.425 8.882 -0.550 1.00 0.00 O ATOM 1967 CB HIS B 78 6.631 9.066 2.202 1.00 0.00 C ATOM 1968 CG HIS B 78 6.457 10.539 1.940 1.00 0.00 C ATOM 1969 ND1 HIS B 78 7.521 11.389 1.735 1.00 0.00 N ATOM 1970 CD2 HIS B 78 5.343 11.309 1.849 1.00 0.00 C ATOM 1971 CE1 HIS B 78 7.036 12.618 1.528 1.00 0.00 C ATOM 1972 NE2 HIS B 78 5.719 12.624 1.586 1.00 0.00 N ATOM 0 H HIS B 78 7.012 6.896 1.009 1.00 0.00 H new ATOM 0 HA HIS B 78 4.752 8.064 2.522 1.00 0.00 H new ATOM 0 HB2 HIS B 78 6.762 8.927 3.275 1.00 0.00 H new ATOM 0 HB3 HIS B 78 7.556 8.744 1.723 1.00 0.00 H new ATOM 0 HD1 HIS B 78 8.507 11.127 1.740 1.00 0.00 H new ATOM 0 HD2 HIS B 78 4.328 10.958 1.962 1.00 0.00 H new ATOM 0 HE1 HIS B 78 7.643 13.491 1.338 1.00 0.00 H new ATOM 1980 N PHE B 79 3.491 8.852 0.578 1.00 0.00 N ATOM 1981 CA PHE B 79 2.716 9.355 -0.548 1.00 0.00 C ATOM 1982 C PHE B 79 2.826 10.875 -0.615 1.00 0.00 C ATOM 1983 O PHE B 79 2.056 11.592 0.023 1.00 0.00 O ATOM 1984 CB PHE B 79 1.252 8.922 -0.426 1.00 0.00 C ATOM 1985 CG PHE B 79 1.061 7.433 -0.510 1.00 0.00 C ATOM 1986 CD1 PHE B 79 1.263 6.627 0.601 1.00 0.00 C ATOM 1987 CD2 PHE B 79 0.687 6.836 -1.702 1.00 0.00 C ATOM 1988 CE1 PHE B 79 1.094 5.259 0.523 1.00 0.00 C ATOM 1989 CE2 PHE B 79 0.516 5.467 -1.786 1.00 0.00 C ATOM 1990 CZ PHE B 79 0.721 4.678 -0.673 1.00 0.00 C ATOM 0 H PHE B 79 2.945 8.667 1.419 1.00 0.00 H new ATOM 0 HA PHE B 79 3.117 8.935 -1.470 1.00 0.00 H new ATOM 0 HB2 PHE B 79 0.853 9.279 0.523 1.00 0.00 H new ATOM 0 HB3 PHE B 79 0.672 9.400 -1.215 1.00 0.00 H new ATOM 0 HD1 PHE B 79 1.556 7.075 1.539 1.00 0.00 H new ATOM 0 HD2 PHE B 79 0.527 7.448 -2.577 1.00 0.00 H new ATOM 0 HE1 PHE B 79 1.253 4.644 1.396 1.00 0.00 H new ATOM 0 HE2 PHE B 79 0.222 5.015 -2.722 1.00 0.00 H new ATOM 0 HZ PHE B 79 0.590 3.608 -0.737 1.00 0.00 H new ATOM 2000 N SER B 80 3.799 11.357 -1.380 1.00 0.00 N ATOM 2001 CA SER B 80 4.031 12.793 -1.517 1.00 0.00 C ATOM 2002 C SER B 80 3.108 13.420 -2.557 1.00 0.00 C ATOM 2003 O SER B 80 3.103 14.637 -2.739 1.00 0.00 O ATOM 2004 CB SER B 80 5.492 13.058 -1.881 1.00 0.00 C ATOM 2005 OG SER B 80 5.978 12.094 -2.804 1.00 0.00 O ATOM 0 H SER B 80 4.442 10.774 -1.916 1.00 0.00 H new ATOM 0 HA SER B 80 3.808 13.256 -0.556 1.00 0.00 H new ATOM 0 HB2 SER B 80 5.587 14.055 -2.310 1.00 0.00 H new ATOM 0 HB3 SER B 80 6.103 13.040 -0.978 1.00 0.00 H new ATOM 0 HG SER B 80 5.223 11.611 -3.200 1.00 0.00 H new ATOM 2011 N ASN B 81 2.340 12.588 -3.244 1.00 0.00 N ATOM 2012 CA ASN B 81 1.409 13.073 -4.251 1.00 0.00 C ATOM 2013 C ASN B 81 0.181 13.630 -3.548 1.00 0.00 C ATOM 2014 O ASN B 81 -0.768 12.907 -3.281 1.00 0.00 O ATOM 2015 CB ASN B 81 1.025 11.931 -5.198 1.00 0.00 C ATOM 2016 CG ASN B 81 0.165 12.386 -6.358 1.00 0.00 C ATOM 2017 OD1 ASN B 81 0.371 13.460 -6.917 1.00 0.00 O ATOM 2018 ND2 ASN B 81 -0.805 11.567 -6.726 1.00 0.00 N ATOM 0 H ASN B 81 2.343 11.575 -3.123 1.00 0.00 H new ATOM 0 HA ASN B 81 1.872 13.861 -4.845 1.00 0.00 H new ATOM 0 HB2 ASN B 81 1.932 11.468 -5.586 1.00 0.00 H new ATOM 0 HB3 ASN B 81 0.491 11.165 -4.636 1.00 0.00 H new ATOM 0 HD21 ASN B 81 -1.417 11.818 -7.502 1.00 0.00 H new ATOM 0 HD22 ASN B 81 -0.941 10.684 -6.234 1.00 0.00 H new ATOM 2025 N GLU B 82 0.212 14.924 -3.259 1.00 0.00 N ATOM 2026 CA GLU B 82 -0.866 15.600 -2.533 1.00 0.00 C ATOM 2027 C GLU B 82 -2.246 15.381 -3.156 1.00 0.00 C ATOM 2028 O GLU B 82 -3.230 15.170 -2.438 1.00 0.00 O ATOM 2029 CB GLU B 82 -0.570 17.102 -2.420 1.00 0.00 C ATOM 2030 CG GLU B 82 0.351 17.645 -3.509 1.00 0.00 C ATOM 2031 CD GLU B 82 -0.348 17.813 -4.845 1.00 0.00 C ATOM 2032 OE1 GLU B 82 -0.386 16.835 -5.624 1.00 0.00 O ATOM 2033 OE2 GLU B 82 -0.865 18.915 -5.108 1.00 0.00 O ATOM 0 H GLU B 82 0.983 15.539 -3.519 1.00 0.00 H new ATOM 0 HA GLU B 82 -0.898 15.152 -1.540 1.00 0.00 H new ATOM 0 HB2 GLU B 82 -1.512 17.649 -2.451 1.00 0.00 H new ATOM 0 HB3 GLU B 82 -0.119 17.299 -1.448 1.00 0.00 H new ATOM 0 HG2 GLU B 82 0.753 18.607 -3.191 1.00 0.00 H new ATOM 0 HG3 GLU B 82 1.198 16.970 -3.631 1.00 0.00 H new ATOM 2040 N SER B 83 -2.304 15.422 -4.478 1.00 0.00 N ATOM 2041 CA SER B 83 -3.544 15.251 -5.224 1.00 0.00 C ATOM 2042 C SER B 83 -4.370 14.047 -4.748 1.00 0.00 C ATOM 2043 O SER B 83 -5.580 14.167 -4.510 1.00 0.00 O ATOM 2044 CB SER B 83 -3.226 15.115 -6.714 1.00 0.00 C ATOM 2045 OG SER B 83 -2.605 16.289 -7.214 1.00 0.00 O ATOM 0 H SER B 83 -1.487 15.576 -5.069 1.00 0.00 H new ATOM 0 HA SER B 83 -4.154 16.136 -5.046 1.00 0.00 H new ATOM 0 HB2 SER B 83 -2.571 14.258 -6.872 1.00 0.00 H new ATOM 0 HB3 SER B 83 -4.144 14.921 -7.269 1.00 0.00 H new ATOM 0 HG SER B 83 -1.777 16.457 -6.718 1.00 0.00 H new ATOM 2051 N THR B 84 -3.736 12.893 -4.601 1.00 0.00 N ATOM 2052 CA THR B 84 -4.452 11.698 -4.183 1.00 0.00 C ATOM 2053 C THR B 84 -3.730 10.920 -3.082 1.00 0.00 C ATOM 2054 O THR B 84 -4.014 9.748 -2.887 1.00 0.00 O ATOM 2055 CB THR B 84 -4.683 10.774 -5.395 1.00 0.00 C ATOM 2056 OG1 THR B 84 -3.623 10.950 -6.338 1.00 0.00 O ATOM 2057 CG2 THR B 84 -6.014 11.070 -6.072 1.00 0.00 C ATOM 0 H THR B 84 -2.738 12.759 -4.763 1.00 0.00 H new ATOM 0 HA THR B 84 -5.403 12.033 -3.770 1.00 0.00 H new ATOM 0 HB THR B 84 -4.702 9.744 -5.038 1.00 0.00 H new ATOM 0 HG1 THR B 84 -2.810 10.518 -6.001 1.00 0.00 H new ATOM 0 HG21 THR B 84 -6.146 10.401 -6.923 1.00 0.00 H new ATOM 0 HG22 THR B 84 -6.826 10.917 -5.361 1.00 0.00 H new ATOM 0 HG23 THR B 84 -6.024 12.104 -6.418 1.00 0.00 H new ATOM 2065 N ALA B 85 -2.849 11.588 -2.341 1.00 0.00 N ATOM 2066 CA ALA B 85 -2.060 10.954 -1.270 1.00 0.00 C ATOM 2067 C ALA B 85 -2.877 10.007 -0.394 1.00 0.00 C ATOM 2068 O ALA B 85 -2.649 8.796 -0.391 1.00 0.00 O ATOM 2069 CB ALA B 85 -1.411 12.019 -0.400 1.00 0.00 C ATOM 0 H ALA B 85 -2.657 12.583 -2.460 1.00 0.00 H new ATOM 0 HA ALA B 85 -1.299 10.351 -1.765 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -0.830 11.540 0.389 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -0.753 12.637 -1.011 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -2.184 12.644 0.047 1.00 0.00 H new ATOM 2075 N VAL B 86 -3.822 10.565 0.349 1.00 0.00 N ATOM 2076 CA VAL B 86 -4.665 9.781 1.244 1.00 0.00 C ATOM 2077 C VAL B 86 -5.455 8.717 0.485 1.00 0.00 C ATOM 2078 O VAL B 86 -5.551 7.568 0.916 1.00 0.00 O ATOM 2079 CB VAL B 86 -5.659 10.685 2.001 1.00 0.00 C ATOM 2080 CG1 VAL B 86 -6.294 9.930 3.153 1.00 0.00 C ATOM 2081 CG2 VAL B 86 -4.976 11.950 2.498 1.00 0.00 C ATOM 0 H VAL B 86 -4.026 11.564 0.350 1.00 0.00 H new ATOM 0 HA VAL B 86 -3.997 9.292 1.953 1.00 0.00 H new ATOM 0 HB VAL B 86 -6.446 10.979 1.307 1.00 0.00 H new ATOM 0 HG11 VAL B 86 -6.992 10.584 3.676 1.00 0.00 H new ATOM 0 HG12 VAL B 86 -6.829 9.062 2.768 1.00 0.00 H new ATOM 0 HG13 VAL B 86 -5.518 9.601 3.844 1.00 0.00 H new ATOM 0 HG21 VAL B 86 -5.699 12.570 3.028 1.00 0.00 H new ATOM 0 HG22 VAL B 86 -4.163 11.683 3.173 1.00 0.00 H new ATOM 0 HG23 VAL B 86 -4.576 12.505 1.649 1.00 0.00 H new ATOM 2091 N LYS B 87 -5.987 9.104 -0.665 1.00 0.00 N ATOM 2092 CA LYS B 87 -6.798 8.210 -1.486 1.00 0.00 C ATOM 2093 C LYS B 87 -5.984 7.022 -2.005 1.00 0.00 C ATOM 2094 O LYS B 87 -6.416 5.875 -1.900 1.00 0.00 O ATOM 2095 CB LYS B 87 -7.408 8.994 -2.650 1.00 0.00 C ATOM 2096 CG LYS B 87 -8.097 10.283 -2.216 1.00 0.00 C ATOM 2097 CD LYS B 87 -7.962 11.370 -3.270 1.00 0.00 C ATOM 2098 CE LYS B 87 -8.401 12.730 -2.745 1.00 0.00 C ATOM 2099 NZ LYS B 87 -8.157 13.816 -3.736 1.00 0.00 N ATOM 0 H LYS B 87 -5.871 10.039 -1.055 1.00 0.00 H new ATOM 0 HA LYS B 87 -7.596 7.806 -0.863 1.00 0.00 H new ATOM 0 HB2 LYS B 87 -6.623 9.234 -3.368 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -8.130 8.361 -3.166 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -9.153 10.087 -2.028 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -7.665 10.629 -1.277 1.00 0.00 H new ATOM 0 HD2 LYS B 87 -6.925 11.427 -3.602 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -8.562 11.107 -4.141 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -9.462 12.698 -2.496 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -7.864 12.953 -1.823 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -8.226 14.740 -3.263 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 -7.207 13.706 -4.144 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 -8.868 13.761 -4.493 1.00 0.00 H new ATOM 2113 N GLU B 88 -4.808 7.302 -2.555 1.00 0.00 N ATOM 2114 CA GLU B 88 -3.936 6.261 -3.085 1.00 0.00 C ATOM 2115 C GLU B 88 -3.467 5.348 -1.960 1.00 0.00 C ATOM 2116 O GLU B 88 -3.424 4.131 -2.113 1.00 0.00 O ATOM 2117 CB GLU B 88 -2.726 6.880 -3.802 1.00 0.00 C ATOM 2118 CG GLU B 88 -3.060 7.492 -5.156 1.00 0.00 C ATOM 2119 CD GLU B 88 -1.925 8.327 -5.732 1.00 0.00 C ATOM 2120 OE1 GLU B 88 -1.737 9.474 -5.270 1.00 0.00 O ATOM 2121 OE2 GLU B 88 -1.235 7.853 -6.658 1.00 0.00 O ATOM 0 H GLU B 88 -4.435 8.247 -2.646 1.00 0.00 H new ATOM 0 HA GLU B 88 -4.501 5.673 -3.808 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -2.292 7.649 -3.163 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -1.965 6.112 -3.939 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -3.308 6.695 -5.857 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -3.948 8.116 -5.056 1.00 0.00 H new ATOM 2128 N ARG B 89 -3.150 5.950 -0.818 1.00 0.00 N ATOM 2129 CA ARG B 89 -2.681 5.211 0.351 1.00 0.00 C ATOM 2130 C ARG B 89 -3.655 4.107 0.754 1.00 0.00 C ATOM 2131 O ARG B 89 -3.269 2.945 0.877 1.00 0.00 O ATOM 2132 CB ARG B 89 -2.465 6.171 1.526 1.00 0.00 C ATOM 2133 CG ARG B 89 -2.156 5.484 2.852 1.00 0.00 C ATOM 2134 CD ARG B 89 -3.340 5.562 3.807 1.00 0.00 C ATOM 2135 NE ARG B 89 -2.928 5.884 5.173 1.00 0.00 N ATOM 2136 CZ ARG B 89 -3.730 5.799 6.240 1.00 0.00 C ATOM 2137 NH1 ARG B 89 -5.013 5.486 6.102 1.00 0.00 N ATOM 2138 NH2 ARG B 89 -3.251 6.067 7.446 1.00 0.00 N ATOM 0 H ARG B 89 -3.210 6.958 -0.676 1.00 0.00 H new ATOM 0 HA ARG B 89 -1.736 4.738 0.085 1.00 0.00 H new ATOM 0 HB2 ARG B 89 -1.646 6.847 1.281 1.00 0.00 H new ATOM 0 HB3 ARG B 89 -3.358 6.784 1.648 1.00 0.00 H new ATOM 0 HG2 ARG B 89 -1.900 4.440 2.672 1.00 0.00 H new ATOM 0 HG3 ARG B 89 -1.285 5.951 3.311 1.00 0.00 H new ATOM 0 HD2 ARG B 89 -4.041 6.318 3.453 1.00 0.00 H new ATOM 0 HD3 ARG B 89 -3.870 4.610 3.804 1.00 0.00 H new ATOM 0 HE ARG B 89 -1.967 6.193 5.321 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -5.397 5.307 5.174 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -5.614 5.424 6.924 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -2.274 6.337 7.558 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -3.859 6.003 8.262 1.00 0.00 H new ATOM 2152 N ASP B 90 -4.916 4.468 0.949 1.00 0.00 N ATOM 2153 CA ASP B 90 -5.923 3.496 1.364 1.00 0.00 C ATOM 2154 C ASP B 90 -6.320 2.556 0.241 1.00 0.00 C ATOM 2155 O ASP B 90 -6.704 1.419 0.499 1.00 0.00 O ATOM 2156 CB ASP B 90 -7.152 4.187 1.947 1.00 0.00 C ATOM 2157 CG ASP B 90 -7.027 4.368 3.443 1.00 0.00 C ATOM 2158 OD1 ASP B 90 -6.418 5.365 3.876 1.00 0.00 O ATOM 2159 OD2 ASP B 90 -7.513 3.494 4.191 1.00 0.00 O ATOM 0 H ASP B 90 -5.266 5.418 0.828 1.00 0.00 H new ATOM 0 HA ASP B 90 -5.464 2.889 2.145 1.00 0.00 H new ATOM 0 HB2 ASP B 90 -7.284 5.159 1.471 1.00 0.00 H new ATOM 0 HB3 ASP B 90 -8.042 3.599 1.723 1.00 0.00 H new ATOM 2164 N ALA B 91 -6.201 3.004 -1.002 1.00 0.00 N ATOM 2165 CA ALA B 91 -6.552 2.156 -2.130 1.00 0.00 C ATOM 2166 C ALA B 91 -5.506 1.071 -2.256 1.00 0.00 C ATOM 2167 O ALA B 91 -5.804 -0.082 -2.570 1.00 0.00 O ATOM 2168 CB ALA B 91 -6.657 2.963 -3.412 1.00 0.00 C ATOM 0 H ALA B 91 -5.869 3.936 -1.251 1.00 0.00 H new ATOM 0 HA ALA B 91 -7.530 1.706 -1.958 1.00 0.00 H new ATOM 0 HB1 ALA B 91 -6.921 2.302 -4.238 1.00 0.00 H new ATOM 0 HB2 ALA B 91 -7.426 3.727 -3.299 1.00 0.00 H new ATOM 0 HB3 ALA B 91 -5.700 3.440 -3.621 1.00 0.00 H new ATOM 2174 N VAL B 92 -4.267 1.464 -1.996 1.00 0.00 N ATOM 2175 CA VAL B 92 -3.154 0.545 -2.020 1.00 0.00 C ATOM 2176 C VAL B 92 -3.285 -0.405 -0.842 1.00 0.00 C ATOM 2177 O VAL B 92 -3.110 -1.609 -0.982 1.00 0.00 O ATOM 2178 CB VAL B 92 -1.808 1.294 -1.941 1.00 0.00 C ATOM 2179 CG1 VAL B 92 -0.672 0.344 -1.632 1.00 0.00 C ATOM 2180 CG2 VAL B 92 -1.531 2.031 -3.234 1.00 0.00 C ATOM 0 H VAL B 92 -4.013 2.424 -1.765 1.00 0.00 H new ATOM 0 HA VAL B 92 -3.171 -0.008 -2.959 1.00 0.00 H new ATOM 0 HB VAL B 92 -1.879 2.019 -1.130 1.00 0.00 H new ATOM 0 HG11 VAL B 92 0.264 0.900 -1.582 1.00 0.00 H new ATOM 0 HG12 VAL B 92 -0.856 -0.143 -0.675 1.00 0.00 H new ATOM 0 HG13 VAL B 92 -0.605 -0.410 -2.416 1.00 0.00 H new ATOM 0 HG21 VAL B 92 -0.577 2.553 -3.158 1.00 0.00 H new ATOM 0 HG22 VAL B 92 -1.490 1.318 -4.058 1.00 0.00 H new ATOM 0 HG23 VAL B 92 -2.326 2.753 -3.419 1.00 0.00 H new ATOM 2190 N LYS B 93 -3.618 0.164 0.313 1.00 0.00 N ATOM 2191 CA LYS B 93 -3.803 -0.602 1.536 1.00 0.00 C ATOM 2192 C LYS B 93 -4.838 -1.695 1.323 1.00 0.00 C ATOM 2193 O LYS B 93 -4.556 -2.875 1.510 1.00 0.00 O ATOM 2194 CB LYS B 93 -4.262 0.318 2.670 1.00 0.00 C ATOM 2195 CG LYS B 93 -4.392 -0.382 4.014 1.00 0.00 C ATOM 2196 CD LYS B 93 -5.845 -0.677 4.369 1.00 0.00 C ATOM 2197 CE LYS B 93 -6.523 0.530 4.999 1.00 0.00 C ATOM 2198 NZ LYS B 93 -7.792 0.897 4.312 1.00 0.00 N ATOM 0 H LYS B 93 -3.766 1.167 0.425 1.00 0.00 H new ATOM 0 HA LYS B 93 -2.850 -1.058 1.804 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -3.554 1.141 2.767 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -5.224 0.755 2.404 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -3.828 -1.315 3.993 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -3.949 0.241 4.791 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -6.387 -0.972 3.471 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -5.888 -1.520 5.058 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -6.730 0.319 6.048 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -5.841 1.380 4.973 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -7.889 1.932 4.291 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -7.778 0.531 3.339 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -8.597 0.484 4.826 1.00 0.00 H new ATOM 2212 N ASP B 94 -6.029 -1.279 0.938 1.00 0.00 N ATOM 2213 CA ASP B 94 -7.138 -2.197 0.685 1.00 0.00 C ATOM 2214 C ASP B 94 -6.731 -3.295 -0.284 1.00 0.00 C ATOM 2215 O ASP B 94 -6.842 -4.478 0.033 1.00 0.00 O ATOM 2216 CB ASP B 94 -8.340 -1.420 0.138 1.00 0.00 C ATOM 2217 CG ASP B 94 -9.171 -0.796 1.242 1.00 0.00 C ATOM 2218 OD1 ASP B 94 -8.588 -0.424 2.286 1.00 0.00 O ATOM 2219 OD2 ASP B 94 -10.399 -0.670 1.071 1.00 0.00 O ATOM 0 H ASP B 94 -6.262 -0.297 0.790 1.00 0.00 H new ATOM 0 HA ASP B 94 -7.415 -2.670 1.627 1.00 0.00 H new ATOM 0 HB2 ASP B 94 -7.989 -0.638 -0.536 1.00 0.00 H new ATOM 0 HB3 ASP B 94 -8.966 -2.090 -0.451 1.00 0.00 H new ATOM 2224 N LEU B 95 -6.224 -2.902 -1.448 1.00 0.00 N ATOM 2225 CA LEU B 95 -5.796 -3.864 -2.456 1.00 0.00 C ATOM 2226 C LEU B 95 -4.723 -4.797 -1.898 1.00 0.00 C ATOM 2227 O LEU B 95 -4.791 -6.014 -2.076 1.00 0.00 O ATOM 2228 CB LEU B 95 -5.268 -3.136 -3.695 1.00 0.00 C ATOM 2229 CG LEU B 95 -5.056 -4.020 -4.926 1.00 0.00 C ATOM 2230 CD1 LEU B 95 -6.366 -4.661 -5.357 1.00 0.00 C ATOM 2231 CD2 LEU B 95 -4.460 -3.208 -6.065 1.00 0.00 C ATOM 0 H LEU B 95 -6.100 -1.926 -1.716 1.00 0.00 H new ATOM 0 HA LEU B 95 -6.660 -4.465 -2.740 1.00 0.00 H new ATOM 0 HB2 LEU B 95 -5.966 -2.340 -3.954 1.00 0.00 H new ATOM 0 HB3 LEU B 95 -4.321 -2.660 -3.441 1.00 0.00 H new ATOM 0 HG LEU B 95 -4.357 -4.814 -4.664 1.00 0.00 H new ATOM 0 HD11 LEU B 95 -6.194 -5.286 -6.234 1.00 0.00 H new ATOM 0 HD12 LEU B 95 -6.755 -5.275 -4.545 1.00 0.00 H new ATOM 0 HD13 LEU B 95 -7.089 -3.883 -5.602 1.00 0.00 H new ATOM 0 HD21 LEU B 95 -4.315 -3.851 -6.933 1.00 0.00 H new ATOM 0 HD22 LEU B 95 -5.137 -2.394 -6.325 1.00 0.00 H new ATOM 0 HD23 LEU B 95 -3.500 -2.796 -5.755 1.00 0.00 H new ATOM 2243 N LEU B 96 -3.752 -4.219 -1.199 1.00 0.00 N ATOM 2244 CA LEU B 96 -2.666 -4.990 -0.611 1.00 0.00 C ATOM 2245 C LEU B 96 -3.180 -5.998 0.402 1.00 0.00 C ATOM 2246 O LEU B 96 -2.873 -7.183 0.305 1.00 0.00 O ATOM 2247 CB LEU B 96 -1.647 -4.074 0.064 1.00 0.00 C ATOM 2248 CG LEU B 96 -0.508 -3.597 -0.833 1.00 0.00 C ATOM 2249 CD1 LEU B 96 0.372 -2.610 -0.089 1.00 0.00 C ATOM 2250 CD2 LEU B 96 0.318 -4.776 -1.317 1.00 0.00 C ATOM 0 H LEU B 96 -3.696 -3.215 -1.026 1.00 0.00 H new ATOM 0 HA LEU B 96 -2.183 -5.529 -1.427 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -2.170 -3.201 0.455 1.00 0.00 H new ATOM 0 HB3 LEU B 96 -1.220 -4.599 0.918 1.00 0.00 H new ATOM 0 HG LEU B 96 -0.939 -3.097 -1.700 1.00 0.00 H new ATOM 0 HD11 LEU B 96 1.180 -2.279 -0.742 1.00 0.00 H new ATOM 0 HD12 LEU B 96 -0.224 -1.750 0.216 1.00 0.00 H new ATOM 0 HD13 LEU B 96 0.793 -3.091 0.794 1.00 0.00 H new ATOM 0 HD21 LEU B 96 1.125 -4.417 -1.955 1.00 0.00 H new ATOM 0 HD22 LEU B 96 0.739 -5.301 -0.460 1.00 0.00 H new ATOM 0 HD23 LEU B 96 -0.317 -5.457 -1.884 1.00 0.00 H new ATOM 2262 N GLN B 97 -3.982 -5.541 1.360 1.00 0.00 N ATOM 2263 CA GLN B 97 -4.492 -6.437 2.387 1.00 0.00 C ATOM 2264 C GLN B 97 -5.462 -7.443 1.802 1.00 0.00 C ATOM 2265 O GLN B 97 -5.604 -8.528 2.335 1.00 0.00 O ATOM 2266 CB GLN B 97 -5.091 -5.681 3.583 1.00 0.00 C ATOM 2267 CG GLN B 97 -6.400 -4.960 3.335 1.00 0.00 C ATOM 2268 CD GLN B 97 -6.982 -4.395 4.623 1.00 0.00 C ATOM 2269 OE1 GLN B 97 -6.643 -5.009 5.758 1.00 0.00 O flip ATOM 2270 NE2 GLN B 97 -7.708 -3.406 4.606 1.00 0.00 N flip ATOM 0 H GLN B 97 -4.287 -4.571 1.445 1.00 0.00 H new ATOM 0 HA GLN B 97 -3.641 -6.993 2.780 1.00 0.00 H new ATOM 0 HB2 GLN B 97 -5.241 -6.391 4.396 1.00 0.00 H new ATOM 0 HB3 GLN B 97 -4.359 -4.951 3.928 1.00 0.00 H new ATOM 0 HG2 GLN B 97 -6.241 -4.151 2.622 1.00 0.00 H new ATOM 0 HG3 GLN B 97 -7.115 -5.648 2.883 1.00 0.00 H new ATOM 0 HE21 GLN B 97 -7.946 -2.963 3.718 1.00 0.00 H new ATOM 0 HE22 GLN B 97 -8.074 -3.027 5.479 1.00 0.00 H new ATOM 2279 N GLN B 98 -6.102 -7.098 0.699 1.00 0.00 N ATOM 2280 CA GLN B 98 -7.023 -8.014 0.044 1.00 0.00 C ATOM 2281 C GLN B 98 -6.257 -9.176 -0.580 1.00 0.00 C ATOM 2282 O GLN B 98 -6.654 -10.338 -0.473 1.00 0.00 O ATOM 2283 CB GLN B 98 -7.817 -7.295 -1.044 1.00 0.00 C ATOM 2284 CG GLN B 98 -9.113 -6.686 -0.553 1.00 0.00 C ATOM 2285 CD GLN B 98 -9.883 -6.004 -1.664 1.00 0.00 C ATOM 2286 OE1 GLN B 98 -9.753 -4.803 -1.885 1.00 0.00 O ATOM 2287 NE2 GLN B 98 -10.674 -6.774 -2.389 1.00 0.00 N ATOM 0 H GLN B 98 -6.003 -6.194 0.238 1.00 0.00 H new ATOM 0 HA GLN B 98 -7.713 -8.394 0.797 1.00 0.00 H new ATOM 0 HB2 GLN B 98 -7.197 -6.508 -1.474 1.00 0.00 H new ATOM 0 HB3 GLN B 98 -8.038 -8.000 -1.845 1.00 0.00 H new ATOM 0 HG2 GLN B 98 -9.733 -7.465 -0.109 1.00 0.00 H new ATOM 0 HG3 GLN B 98 -8.897 -5.963 0.234 1.00 0.00 H new ATOM 0 HE21 GLN B 98 -10.755 -7.768 -2.174 1.00 0.00 H new ATOM 0 HE22 GLN B 98 -11.204 -6.375 -3.164 1.00 0.00 H new ATOM 2296 N LEU B 99 -5.151 -8.856 -1.233 1.00 0.00 N ATOM 2297 CA LEU B 99 -4.331 -9.860 -1.898 1.00 0.00 C ATOM 2298 C LEU B 99 -3.393 -10.572 -0.925 1.00 0.00 C ATOM 2299 O LEU B 99 -2.950 -11.687 -1.191 1.00 0.00 O ATOM 2300 CB LEU B 99 -3.530 -9.207 -3.020 1.00 0.00 C ATOM 2301 CG LEU B 99 -4.387 -8.568 -4.109 1.00 0.00 C ATOM 2302 CD1 LEU B 99 -3.606 -7.494 -4.851 1.00 0.00 C ATOM 2303 CD2 LEU B 99 -4.897 -9.624 -5.075 1.00 0.00 C ATOM 0 H LEU B 99 -4.798 -7.903 -1.318 1.00 0.00 H new ATOM 0 HA LEU B 99 -4.999 -10.615 -2.313 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -2.879 -8.445 -2.591 1.00 0.00 H new ATOM 0 HB3 LEU B 99 -2.884 -9.958 -3.475 1.00 0.00 H new ATOM 0 HG LEU B 99 -5.246 -8.094 -3.633 1.00 0.00 H new ATOM 0 HD11 LEU B 99 -4.237 -7.053 -5.622 1.00 0.00 H new ATOM 0 HD12 LEU B 99 -3.295 -6.720 -4.149 1.00 0.00 H new ATOM 0 HD13 LEU B 99 -2.725 -7.939 -5.314 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -5.506 -9.150 -5.844 1.00 0.00 H new ATOM 0 HD22 LEU B 99 -4.051 -10.129 -5.542 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -5.500 -10.352 -4.533 1.00 0.00 H new ATOM 2315 N LEU B 100 -3.113 -9.928 0.203 1.00 0.00 N ATOM 2316 CA LEU B 100 -2.211 -10.480 1.216 1.00 0.00 C ATOM 2317 C LEU B 100 -2.523 -11.929 1.612 1.00 0.00 C ATOM 2318 O LEU B 100 -1.690 -12.806 1.392 1.00 0.00 O ATOM 2319 CB LEU B 100 -2.156 -9.575 2.458 1.00 0.00 C ATOM 2320 CG LEU B 100 -1.049 -8.529 2.400 1.00 0.00 C ATOM 2321 CD1 LEU B 100 -1.011 -7.656 3.652 1.00 0.00 C ATOM 2322 CD2 LEU B 100 0.268 -9.242 2.209 1.00 0.00 C ATOM 0 H LEU B 100 -3.500 -9.015 0.443 1.00 0.00 H new ATOM 0 HA LEU B 100 -1.228 -10.506 0.747 1.00 0.00 H new ATOM 0 HB2 LEU B 100 -3.116 -9.071 2.573 1.00 0.00 H new ATOM 0 HB3 LEU B 100 -2.013 -10.195 3.343 1.00 0.00 H new ATOM 0 HG LEU B 100 -1.244 -7.858 1.563 1.00 0.00 H new ATOM 0 HD11 LEU B 100 -0.206 -6.927 3.563 1.00 0.00 H new ATOM 0 HD12 LEU B 100 -1.962 -7.135 3.761 1.00 0.00 H new ATOM 0 HD13 LEU B 100 -0.838 -8.282 4.527 1.00 0.00 H new ATOM 0 HD21 LEU B 100 1.075 -8.510 2.165 1.00 0.00 H new ATOM 0 HD22 LEU B 100 0.439 -9.921 3.045 1.00 0.00 H new ATOM 0 HD23 LEU B 100 0.242 -9.811 1.279 1.00 0.00 H new ATOM 2334 N PRO B 101 -3.719 -12.230 2.145 1.00 0.00 N ATOM 2335 CA PRO B 101 -4.044 -13.589 2.576 1.00 0.00 C ATOM 2336 C PRO B 101 -4.294 -14.529 1.405 1.00 0.00 C ATOM 2337 O PRO B 101 -4.378 -15.746 1.573 1.00 0.00 O ATOM 2338 CB PRO B 101 -5.303 -13.400 3.415 1.00 0.00 C ATOM 2339 CG PRO B 101 -5.955 -12.176 2.870 1.00 0.00 C ATOM 2340 CD PRO B 101 -4.851 -11.306 2.335 1.00 0.00 C ATOM 0 HA PRO B 101 -3.225 -14.054 3.124 1.00 0.00 H new ATOM 0 HB2 PRO B 101 -5.962 -14.265 3.337 1.00 0.00 H new ATOM 0 HB3 PRO B 101 -5.059 -13.279 4.470 1.00 0.00 H new ATOM 0 HG2 PRO B 101 -6.663 -12.432 2.082 1.00 0.00 H new ATOM 0 HG3 PRO B 101 -6.516 -11.657 3.647 1.00 0.00 H new ATOM 0 HD2 PRO B 101 -5.138 -10.831 1.397 1.00 0.00 H new ATOM 0 HD3 PRO B 101 -4.600 -10.508 3.033 1.00 0.00 H new ATOM 2348 N LYS B 102 -4.406 -13.963 0.216 1.00 0.00 N ATOM 2349 CA LYS B 102 -4.632 -14.752 -0.978 1.00 0.00 C ATOM 2350 C LYS B 102 -3.312 -15.276 -1.530 1.00 0.00 C ATOM 2351 O LYS B 102 -3.276 -16.309 -2.198 1.00 0.00 O ATOM 2352 CB LYS B 102 -5.363 -13.929 -2.041 1.00 0.00 C ATOM 2353 CG LYS B 102 -6.832 -13.694 -1.718 1.00 0.00 C ATOM 2354 CD LYS B 102 -7.654 -13.447 -2.975 1.00 0.00 C ATOM 2355 CE LYS B 102 -7.512 -12.018 -3.477 1.00 0.00 C ATOM 2356 NZ LYS B 102 -8.156 -11.042 -2.559 1.00 0.00 N ATOM 0 H LYS B 102 -4.344 -12.958 0.054 1.00 0.00 H new ATOM 0 HA LYS B 102 -5.259 -15.602 -0.710 1.00 0.00 H new ATOM 0 HB2 LYS B 102 -4.864 -12.966 -2.151 1.00 0.00 H new ATOM 0 HB3 LYS B 102 -5.287 -14.439 -3.001 1.00 0.00 H new ATOM 0 HG2 LYS B 102 -7.230 -14.559 -1.187 1.00 0.00 H new ATOM 0 HG3 LYS B 102 -6.925 -12.839 -1.049 1.00 0.00 H new ATOM 0 HD2 LYS B 102 -7.339 -14.139 -3.756 1.00 0.00 H new ATOM 0 HD3 LYS B 102 -8.704 -13.656 -2.769 1.00 0.00 H new ATOM 0 HE2 LYS B 102 -6.455 -11.774 -3.583 1.00 0.00 H new ATOM 0 HE3 LYS B 102 -7.959 -11.935 -4.467 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 -8.698 -10.349 -3.114 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 -8.797 -11.544 -1.912 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 -7.425 -10.549 -2.008 1.00 0.00 H new ATOM 2370 N PHE B 103 -2.223 -14.578 -1.226 1.00 0.00 N ATOM 2371 CA PHE B 103 -0.911 -14.976 -1.715 1.00 0.00 C ATOM 2372 C PHE B 103 -0.007 -15.502 -0.607 1.00 0.00 C ATOM 2373 O PHE B 103 0.733 -16.463 -0.824 1.00 0.00 O ATOM 2374 CB PHE B 103 -0.239 -13.809 -2.434 1.00 0.00 C ATOM 2375 CG PHE B 103 -0.828 -13.547 -3.789 1.00 0.00 C ATOM 2376 CD1 PHE B 103 -0.406 -14.272 -4.891 1.00 0.00 C ATOM 2377 CD2 PHE B 103 -1.813 -12.590 -3.957 1.00 0.00 C ATOM 2378 CE1 PHE B 103 -0.956 -14.044 -6.136 1.00 0.00 C ATOM 2379 CE2 PHE B 103 -2.368 -12.359 -5.199 1.00 0.00 C ATOM 2380 CZ PHE B 103 -1.939 -13.087 -6.290 1.00 0.00 C ATOM 0 H PHE B 103 -2.224 -13.739 -0.646 1.00 0.00 H new ATOM 0 HA PHE B 103 -1.067 -15.796 -2.416 1.00 0.00 H new ATOM 0 HB2 PHE B 103 -0.329 -12.911 -1.823 1.00 0.00 H new ATOM 0 HB3 PHE B 103 0.826 -14.017 -2.539 1.00 0.00 H new ATOM 0 HD1 PHE B 103 0.361 -15.023 -4.775 1.00 0.00 H new ATOM 0 HD2 PHE B 103 -2.151 -12.017 -3.106 1.00 0.00 H new ATOM 0 HE1 PHE B 103 -0.618 -14.614 -6.989 1.00 0.00 H new ATOM 0 HE2 PHE B 103 -3.137 -11.610 -5.317 1.00 0.00 H new ATOM 0 HZ PHE B 103 -2.372 -12.908 -7.263 1.00 0.00 H new ATOM 2390 N LYS B 104 -0.071 -14.909 0.579 1.00 0.00 N ATOM 2391 CA LYS B 104 0.786 -15.354 1.668 1.00 0.00 C ATOM 2392 C LYS B 104 0.363 -16.734 2.165 1.00 0.00 C ATOM 2393 O LYS B 104 -0.755 -16.944 2.636 1.00 0.00 O ATOM 2394 CB LYS B 104 0.841 -14.320 2.810 1.00 0.00 C ATOM 2395 CG LYS B 104 -0.366 -14.307 3.734 1.00 0.00 C ATOM 2396 CD LYS B 104 -0.294 -13.160 4.736 1.00 0.00 C ATOM 2397 CE LYS B 104 0.908 -13.293 5.661 1.00 0.00 C ATOM 2398 NZ LYS B 104 0.877 -12.305 6.775 1.00 0.00 N ATOM 0 H LYS B 104 -0.694 -14.135 0.808 1.00 0.00 H new ATOM 0 HA LYS B 104 1.800 -15.443 1.279 1.00 0.00 H new ATOM 0 HB2 LYS B 104 1.733 -14.510 3.407 1.00 0.00 H new ATOM 0 HB3 LYS B 104 0.955 -13.327 2.374 1.00 0.00 H new ATOM 0 HG2 LYS B 104 -1.277 -14.217 3.142 1.00 0.00 H new ATOM 0 HG3 LYS B 104 -0.426 -15.255 4.269 1.00 0.00 H new ATOM 0 HD2 LYS B 104 -0.238 -12.212 4.200 1.00 0.00 H new ATOM 0 HD3 LYS B 104 -1.208 -13.137 5.329 1.00 0.00 H new ATOM 0 HE2 LYS B 104 0.936 -14.301 6.074 1.00 0.00 H new ATOM 0 HE3 LYS B 104 1.823 -13.159 5.085 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 1.788 -12.318 7.276 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 0.707 -11.354 6.391 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 0.114 -12.552 7.437 1.00 0.00 H new ATOM 2412 N ARG B 105 1.261 -17.691 1.997 1.00 0.00 N ATOM 2413 CA ARG B 105 1.011 -19.056 2.429 1.00 0.00 C ATOM 2414 C ARG B 105 1.521 -19.246 3.846 1.00 0.00 C ATOM 2415 O ARG B 105 1.153 -20.194 4.534 1.00 0.00 O ATOM 2416 CB ARG B 105 1.677 -20.053 1.477 1.00 0.00 C ATOM 2417 CG ARG B 105 0.713 -21.079 0.894 1.00 0.00 C ATOM 2418 CD ARG B 105 -0.277 -20.447 -0.079 1.00 0.00 C ATOM 2419 NE ARG B 105 -1.300 -19.650 0.604 1.00 0.00 N ATOM 2420 CZ ARG B 105 -2.056 -18.730 0.004 1.00 0.00 C ATOM 2421 NH1 ARG B 105 -1.920 -18.496 -1.296 1.00 0.00 N ATOM 2422 NH2 ARG B 105 -2.944 -18.040 0.709 1.00 0.00 N ATOM 0 H ARG B 105 2.173 -17.547 1.563 1.00 0.00 H new ATOM 0 HA ARG B 105 -0.063 -19.241 2.413 1.00 0.00 H new ATOM 0 HB2 ARG B 105 2.147 -19.504 0.661 1.00 0.00 H new ATOM 0 HB3 ARG B 105 2.472 -20.575 2.010 1.00 0.00 H new ATOM 0 HG2 ARG B 105 1.279 -21.857 0.381 1.00 0.00 H new ATOM 0 HG3 ARG B 105 0.167 -21.563 1.703 1.00 0.00 H new ATOM 0 HD2 ARG B 105 0.263 -19.814 -0.783 1.00 0.00 H new ATOM 0 HD3 ARG B 105 -0.760 -21.231 -0.662 1.00 0.00 H new ATOM 0 HE ARG B 105 -1.443 -19.809 1.601 1.00 0.00 H new ATOM 0 HH11 ARG B 105 -1.235 -19.021 -1.840 1.00 0.00 H new ATOM 0 HH12 ARG B 105 -2.500 -17.791 -1.751 1.00 0.00 H new ATOM 0 HH21 ARG B 105 -3.048 -18.214 1.709 1.00 0.00 H new ATOM 0 HH22 ARG B 105 -3.523 -17.336 0.251 1.00 0.00 H new ATOM 2436 N LYS B 106 2.374 -18.327 4.270 1.00 0.00 N ATOM 2437 CA LYS B 106 2.925 -18.357 5.609 1.00 0.00 C ATOM 2438 C LYS B 106 2.149 -17.375 6.474 1.00 0.00 C ATOM 2439 O LYS B 106 2.233 -16.163 6.273 1.00 0.00 O ATOM 2440 CB LYS B 106 4.429 -18.023 5.605 1.00 0.00 C ATOM 2441 CG LYS B 106 4.865 -17.032 4.526 1.00 0.00 C ATOM 2442 CD LYS B 106 5.356 -17.745 3.270 1.00 0.00 C ATOM 2443 CE LYS B 106 6.704 -17.208 2.796 1.00 0.00 C ATOM 2444 NZ LYS B 106 6.626 -15.788 2.364 1.00 0.00 N ATOM 0 H LYS B 106 2.700 -17.547 3.699 1.00 0.00 H new ATOM 0 HA LYS B 106 2.827 -19.363 6.018 1.00 0.00 H new ATOM 0 HB2 LYS B 106 4.699 -17.618 6.580 1.00 0.00 H new ATOM 0 HB3 LYS B 106 4.991 -18.948 5.477 1.00 0.00 H new ATOM 0 HG2 LYS B 106 4.029 -16.380 4.271 1.00 0.00 H new ATOM 0 HG3 LYS B 106 5.658 -16.395 4.916 1.00 0.00 H new ATOM 0 HD2 LYS B 106 5.442 -18.813 3.470 1.00 0.00 H new ATOM 0 HD3 LYS B 106 4.619 -17.627 2.475 1.00 0.00 H new ATOM 0 HE2 LYS B 106 7.433 -17.301 3.601 1.00 0.00 H new ATOM 0 HE3 LYS B 106 7.065 -17.818 1.968 1.00 0.00 H new ATOM 0 HZ1 LYS B 106 7.446 -15.562 1.765 1.00 0.00 H new ATOM 0 HZ2 LYS B 106 5.750 -15.637 1.824 1.00 0.00 H new ATOM 0 HZ3 LYS B 106 6.628 -15.170 3.201 1.00 0.00 H new ATOM 2458 N ALA B 107 1.365 -17.907 7.404 1.00 0.00 N ATOM 2459 CA ALA B 107 0.545 -17.086 8.290 1.00 0.00 C ATOM 2460 C ALA B 107 1.388 -16.385 9.352 1.00 0.00 C ATOM 2461 O ALA B 107 1.326 -16.727 10.536 1.00 0.00 O ATOM 2462 CB ALA B 107 -0.538 -17.934 8.941 1.00 0.00 C ATOM 0 H ALA B 107 1.279 -18.910 7.566 1.00 0.00 H new ATOM 0 HA ALA B 107 0.073 -16.312 7.684 1.00 0.00 H new ATOM 0 HB1 ALA B 107 -1.142 -17.310 9.599 1.00 0.00 H new ATOM 0 HB2 ALA B 107 -1.173 -18.369 8.169 1.00 0.00 H new ATOM 0 HB3 ALA B 107 -0.075 -18.732 9.522 1.00 0.00 H new ATOM 2468 N ASN B 108 2.180 -15.417 8.909 1.00 0.00 N ATOM 2469 CA ASN B 108 3.040 -14.642 9.787 1.00 0.00 C ATOM 2470 C ASN B 108 3.790 -13.605 8.970 1.00 0.00 C ATOM 2471 O ASN B 108 4.961 -13.328 9.289 1.00 0.00 O ATOM 2472 CB ASN B 108 4.037 -15.545 10.524 1.00 0.00 C ATOM 2473 CG ASN B 108 4.060 -15.276 12.016 1.00 0.00 C ATOM 2474 OD1 ASN B 108 4.882 -14.503 12.514 1.00 0.00 O ATOM 2475 ND2 ASN B 108 3.146 -15.902 12.738 1.00 0.00 N ATOM 2476 OXT ASN B 108 3.207 -13.085 7.995 1.00 0.00 O ATOM 0 H ASN B 108 2.242 -15.148 7.927 1.00 0.00 H new ATOM 0 HA ASN B 108 2.418 -14.147 10.533 1.00 0.00 H new ATOM 0 HB2 ASN B 108 3.777 -16.589 10.349 1.00 0.00 H new ATOM 0 HB3 ASN B 108 5.035 -15.392 10.114 1.00 0.00 H new ATOM 0 HD21 ASN B 108 3.103 -15.753 13.746 1.00 0.00 H new ATOM 0 HD22 ASN B 108 2.484 -16.534 12.287 1.00 0.00 H new TER 2483 ASN B 108