USER MOD reduce.3.24.130724 H: found=0, std=0, add=889, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 215 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 78 SER OG : rot 180:sc= 0.0185 USER MOD Set 1.2: A 79 ASN : amide:sc= 0 X(o=0.019,f=0.019) USER MOD Set 2.1: A 56 MET CE :methyl -140:sc= -3.89! (180deg=-8.35!) USER MOD Set 2.2: A 57 ASN : amide:sc= -2.5! C(o=-14!,f=-19!) USER MOD Set 2.3: A 60 ASN :FLIP amide:sc= -5.04! C(o=-29!,f=-14!) USER MOD Set 2.4: A 62 CYS SG : rot -90:sc= -2.74! USER MOD Set 2.5: A 69 TYR OH : rot -110:sc=-0.00799 USER MOD Set 3.1: A 44 SER OG : rot -109:sc= -0.593! USER MOD Set 3.2: A 48 THR OG1 : rot 59:sc= 0.47 USER MOD Set 4.1: A 1 GLY N :NH3+ -118:sc= 0.645 (180deg=0) USER MOD Set 4.2: A 7 ASN :FLIP amide:sc= -2.01! F(o=-2.9,f=-1.4!) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0395 USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot -160:sc=0.000234 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 ASN : amide:sc= -0.374 X(o=-0.37,f=-0.75!) USER MOD Single : A 15 THR OG1 : rot 68:sc= 0.931 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 HIS :FLIP no HD1:sc= -4.12! C(o=-7.7!,f=-4.1!) USER MOD Single : A 20 HIS : no HD1:sc= -0.0716 X(o=-0.072,f=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=-0.031) USER MOD Single : A 28 LYS NZ :NH3+ -110:sc= 0 (180deg=-0.353) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= -0.81 USER MOD Single : A 40 HIS : no HD1:sc= -0.143 X(o=-0.14,f=-0.38) USER MOD Single : A 43 GLN :FLIP amide:sc= -0.627 F(o=-6.6!,f=-0.63) USER MOD Single : A 47 HIS : no HD1:sc= -0.364 K(o=-0.36,f=-1.3!) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot -12:sc= 0.789! USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -1.37! X(o=-1.4!,f=-1.2) USER MOD Single : A 64 THR OG1 : rot 180:sc= -0.719 USER MOD Single : A 65 ASN :FLIP amide:sc= -0.162 F(o=-1.9!,f=-0.16) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 TYR OH : rot -70:sc= -3.98! USER MOD Single : A 77 TYR OH : rot -89:sc= -5.03! USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ -159:sc= -0.113 (180deg=-0.678) USER MOD Single : A 84 ASN :FLIP amide:sc= 0.0749 F(o=-1.3,f=0.075) USER MOD Single : A 85 ASN : amide:sc= -0.0883 K(o=-0.088,f=-1.1!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 HIS : no HD1:sc= -0.118 X(o=-0.12,f=-0.34) USER MOD Single : A 91 LYS NZ :NH3+ -152:sc= -2.43! (180deg=-3.4!) USER MOD Single : A 94 ASN :FLIP amide:sc= -2.96! C(o=-11!,f=-3!) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 180:sc= -0.0467 USER MOD Single : A 105 CYS SG : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.167) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.779 5.800 -1.405 1.00 0.00 N ATOM 2 CA GLY A 1 11.258 7.143 -0.974 1.00 0.00 C ATOM 3 C GLY A 1 12.336 7.643 -1.939 1.00 0.00 C ATOM 4 O GLY A 1 12.101 8.538 -2.728 1.00 0.00 O ATOM 0 H1 GLY A 1 9.766 5.850 -1.637 1.00 0.00 H new ATOM 0 H2 GLY A 1 11.311 5.494 -2.244 1.00 0.00 H new ATOM 0 H3 GLY A 1 10.924 5.116 -0.635 1.00 0.00 H new ATOM 0 HA2 GLY A 1 10.425 7.846 -0.949 1.00 0.00 H new ATOM 0 HA3 GLY A 1 11.660 7.089 0.038 1.00 0.00 H new ATOM 8 N SER A 2 13.498 7.056 -1.854 1.00 0.00 N ATOM 9 CA SER A 2 14.598 7.481 -2.754 1.00 0.00 C ATOM 10 C SER A 2 15.708 6.440 -2.783 1.00 0.00 C ATOM 11 O SER A 2 16.522 6.418 -3.683 1.00 0.00 O ATOM 12 CB SER A 2 15.177 8.801 -2.222 1.00 0.00 C ATOM 13 OG SER A 2 16.451 8.896 -2.842 1.00 0.00 O ATOM 0 H SER A 2 13.729 6.305 -1.203 1.00 0.00 H new ATOM 0 HA SER A 2 14.204 7.601 -3.763 1.00 0.00 H new ATOM 0 HB2 SER A 2 14.543 9.648 -2.483 1.00 0.00 H new ATOM 0 HB3 SER A 2 15.262 8.789 -1.135 1.00 0.00 H new ATOM 0 HG SER A 2 16.894 9.721 -2.554 1.00 0.00 H new ATOM 16 N HIS A 3 15.718 5.593 -1.792 1.00 0.00 N ATOM 17 CA HIS A 3 16.764 4.543 -1.737 1.00 0.00 C ATOM 18 C HIS A 3 16.335 3.304 -2.516 1.00 0.00 C ATOM 19 O HIS A 3 17.027 2.862 -3.414 1.00 0.00 O ATOM 20 CB HIS A 3 16.970 4.151 -0.266 1.00 0.00 C ATOM 21 CG HIS A 3 18.440 3.793 -0.034 1.00 0.00 C ATOM 22 ND1 HIS A 3 19.367 4.622 0.085 1.00 0.00 N ATOM 23 CD2 HIS A 3 19.037 2.554 0.092 1.00 0.00 C ATOM 24 CE1 HIS A 3 20.481 4.048 0.272 1.00 0.00 C ATOM 25 NE2 HIS A 3 20.372 2.720 0.292 1.00 0.00 N ATOM 0 H HIS A 3 15.049 5.585 -1.022 1.00 0.00 H new ATOM 0 HA HIS A 3 17.682 4.930 -2.178 1.00 0.00 H new ATOM 0 HB2 HIS A 3 16.678 4.975 0.385 1.00 0.00 H new ATOM 0 HB3 HIS A 3 16.334 3.303 -0.012 1.00 0.00 H new ATOM 0 HD2 HIS A 3 18.525 1.604 0.040 1.00 0.00 H new ATOM 0 HE1 HIS A 3 21.414 4.576 0.401 1.00 0.00 H new ATOM 0 HE2 HIS A 3 21.097 2.015 0.423 1.00 0.00 H new ATOM 29 N MET A 4 15.202 2.767 -2.158 1.00 0.00 N ATOM 30 CA MET A 4 14.708 1.558 -2.863 1.00 0.00 C ATOM 31 C MET A 4 14.569 1.824 -4.380 1.00 0.00 C ATOM 32 O MET A 4 13.920 2.770 -4.780 1.00 0.00 O ATOM 33 CB MET A 4 13.320 1.217 -2.295 1.00 0.00 C ATOM 34 CG MET A 4 13.010 -0.256 -2.572 1.00 0.00 C ATOM 35 SD MET A 4 11.695 -1.024 -1.591 1.00 0.00 S ATOM 36 CE MET A 4 12.424 -2.677 -1.492 1.00 0.00 C ATOM 0 H MET A 4 14.601 3.113 -1.410 1.00 0.00 H new ATOM 0 HA MET A 4 15.413 0.740 -2.717 1.00 0.00 H new ATOM 0 HB2 MET A 4 13.295 1.411 -1.223 1.00 0.00 H new ATOM 0 HB3 MET A 4 12.561 1.853 -2.751 1.00 0.00 H new ATOM 0 HG2 MET A 4 12.747 -0.353 -3.625 1.00 0.00 H new ATOM 0 HG3 MET A 4 13.925 -0.828 -2.418 1.00 0.00 H new ATOM 0 HE1 MET A 4 11.767 -3.331 -0.918 1.00 0.00 H new ATOM 0 HE2 MET A 4 12.550 -3.080 -2.497 1.00 0.00 H new ATOM 0 HE3 MET A 4 13.395 -2.617 -1.001 1.00 0.00 H new ATOM 38 N PRO A 5 15.184 0.972 -5.208 1.00 0.00 N ATOM 39 CA PRO A 5 15.111 1.139 -6.660 1.00 0.00 C ATOM 40 C PRO A 5 13.670 1.079 -7.165 1.00 0.00 C ATOM 41 O PRO A 5 13.051 0.035 -7.160 1.00 0.00 O ATOM 42 CB PRO A 5 15.911 -0.049 -7.240 1.00 0.00 C ATOM 43 CG PRO A 5 16.445 -0.883 -6.038 1.00 0.00 C ATOM 44 CD PRO A 5 15.974 -0.185 -4.752 1.00 0.00 C ATOM 0 HA PRO A 5 15.506 2.109 -6.961 1.00 0.00 H new ATOM 0 HB2 PRO A 5 15.277 -0.662 -7.881 1.00 0.00 H new ATOM 0 HB3 PRO A 5 16.736 0.308 -7.856 1.00 0.00 H new ATOM 0 HG2 PRO A 5 16.067 -1.905 -6.081 1.00 0.00 H new ATOM 0 HG3 PRO A 5 17.533 -0.944 -6.066 1.00 0.00 H new ATOM 0 HD2 PRO A 5 15.372 -0.855 -4.138 1.00 0.00 H new ATOM 0 HD3 PRO A 5 16.821 0.132 -4.143 1.00 0.00 H new ATOM 45 N ARG A 6 13.167 2.209 -7.592 1.00 0.00 N ATOM 46 CA ARG A 6 11.770 2.251 -8.105 1.00 0.00 C ATOM 47 C ARG A 6 10.787 1.659 -7.098 1.00 0.00 C ATOM 48 O ARG A 6 10.568 0.463 -7.069 1.00 0.00 O ATOM 49 CB ARG A 6 11.703 1.427 -9.403 1.00 0.00 C ATOM 50 CG ARG A 6 12.021 2.336 -10.594 1.00 0.00 C ATOM 51 CD ARG A 6 10.908 3.375 -10.743 1.00 0.00 C ATOM 52 NE ARG A 6 11.439 4.715 -10.360 1.00 0.00 N ATOM 53 CZ ARG A 6 11.391 5.695 -11.223 1.00 0.00 C ATOM 54 NH1 ARG A 6 11.965 5.540 -12.386 1.00 0.00 N ATOM 55 NH2 ARG A 6 10.777 6.796 -10.891 1.00 0.00 N ATOM 0 H ARG A 6 13.663 3.100 -7.607 1.00 0.00 H new ATOM 0 HA ARG A 6 11.496 3.291 -8.281 1.00 0.00 H new ATOM 0 HB2 ARG A 6 12.413 0.601 -9.361 1.00 0.00 H new ATOM 0 HB3 ARG A 6 10.712 0.989 -9.519 1.00 0.00 H new ATOM 0 HG2 ARG A 6 12.980 2.832 -10.443 1.00 0.00 H new ATOM 0 HG3 ARG A 6 12.108 1.745 -11.506 1.00 0.00 H new ATOM 0 HD2 ARG A 6 10.546 3.394 -11.771 1.00 0.00 H new ATOM 0 HD3 ARG A 6 10.060 3.111 -10.111 1.00 0.00 H new ATOM 0 HE ARG A 6 11.836 4.865 -9.433 1.00 0.00 H new ATOM 0 HH11 ARG A 6 12.440 4.665 -12.608 1.00 0.00 H new ATOM 0 HH12 ARG A 6 11.938 6.294 -13.073 1.00 0.00 H new ATOM 0 HH21 ARG A 6 10.345 6.881 -9.971 1.00 0.00 H new ATOM 0 HH22 ARG A 6 10.729 7.572 -11.551 1.00 0.00 H new ATOM 62 N ASN A 7 10.209 2.507 -6.292 1.00 0.00 N ATOM 63 CA ASN A 7 9.240 2.009 -5.287 1.00 0.00 C ATOM 64 C ASN A 7 7.852 1.894 -5.905 1.00 0.00 C ATOM 65 O ASN A 7 7.440 2.744 -6.669 1.00 0.00 O ATOM 66 CB ASN A 7 9.181 3.009 -4.119 1.00 0.00 C ATOM 67 CG ASN A 7 10.317 4.025 -4.260 1.00 0.00 C ATOM 68 OD1 ASN A 7 11.332 3.956 -3.442 1.00 0.00 O flip ATOM 69 ND2 ASN A 7 10.289 4.892 -5.110 1.00 0.00 N flip ATOM 0 H ASN A 7 10.367 3.515 -6.288 1.00 0.00 H new ATOM 0 HA ASN A 7 9.559 1.027 -4.937 1.00 0.00 H new ATOM 0 HB2 ASN A 7 8.219 3.521 -4.113 1.00 0.00 H new ATOM 0 HB3 ASN A 7 9.267 2.481 -3.169 1.00 0.00 H new ATOM 0 HD21 ASN A 7 9.499 4.951 -5.752 1.00 0.00 H new ATOM 0 HD22 ASN A 7 11.056 5.561 -5.182 1.00 0.00 H new ATOM 73 N SER A 8 7.151 0.847 -5.565 1.00 0.00 N ATOM 74 CA SER A 8 5.790 0.671 -6.130 1.00 0.00 C ATOM 75 C SER A 8 4.751 1.391 -5.280 1.00 0.00 C ATOM 76 O SER A 8 3.621 0.955 -5.174 1.00 0.00 O ATOM 77 CB SER A 8 5.460 -0.831 -6.150 1.00 0.00 C ATOM 78 OG SER A 8 5.467 -1.208 -4.781 1.00 0.00 O ATOM 0 H SER A 8 7.461 0.114 -4.927 1.00 0.00 H new ATOM 0 HA SER A 8 5.768 1.090 -7.136 1.00 0.00 H new ATOM 0 HB2 SER A 8 4.490 -1.019 -6.610 1.00 0.00 H new ATOM 0 HB3 SER A 8 6.198 -1.393 -6.722 1.00 0.00 H new ATOM 0 HG SER A 8 5.582 -2.179 -4.710 1.00 0.00 H new ATOM 81 N LYS A 9 5.150 2.482 -4.690 1.00 0.00 N ATOM 82 CA LYS A 9 4.200 3.242 -3.845 1.00 0.00 C ATOM 83 C LYS A 9 3.430 4.254 -4.682 1.00 0.00 C ATOM 84 O LYS A 9 2.305 4.592 -4.370 1.00 0.00 O ATOM 85 CB LYS A 9 5.001 3.990 -2.770 1.00 0.00 C ATOM 86 CG LYS A 9 5.105 3.110 -1.525 1.00 0.00 C ATOM 87 CD LYS A 9 5.690 3.933 -0.376 1.00 0.00 C ATOM 88 CE LYS A 9 5.952 3.011 0.816 1.00 0.00 C ATOM 89 NZ LYS A 9 5.977 3.793 2.085 1.00 0.00 N ATOM 0 H LYS A 9 6.088 2.876 -4.758 1.00 0.00 H new ATOM 0 HA LYS A 9 3.489 2.551 -3.391 1.00 0.00 H new ATOM 0 HB2 LYS A 9 5.996 4.234 -3.143 1.00 0.00 H new ATOM 0 HB3 LYS A 9 4.513 4.933 -2.525 1.00 0.00 H new ATOM 0 HG2 LYS A 9 4.121 2.729 -1.251 1.00 0.00 H new ATOM 0 HG3 LYS A 9 5.737 2.245 -1.728 1.00 0.00 H new ATOM 0 HD2 LYS A 9 6.616 4.413 -0.691 1.00 0.00 H new ATOM 0 HD3 LYS A 9 5.000 4.727 -0.093 1.00 0.00 H new ATOM 0 HE2 LYS A 9 5.178 2.246 0.869 1.00 0.00 H new ATOM 0 HE3 LYS A 9 6.902 2.494 0.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 6.156 3.152 2.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 6.732 4.507 2.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 5.061 4.266 2.219 1.00 0.00 H new ATOM 94 N ASN A 10 4.050 4.721 -5.730 1.00 0.00 N ATOM 95 CA ASN A 10 3.369 5.711 -6.597 1.00 0.00 C ATOM 96 C ASN A 10 2.018 5.180 -7.058 1.00 0.00 C ATOM 97 O ASN A 10 0.996 5.804 -6.848 1.00 0.00 O ATOM 98 CB ASN A 10 4.252 5.959 -7.830 1.00 0.00 C ATOM 99 CG ASN A 10 5.376 4.922 -7.862 1.00 0.00 C ATOM 100 OD1 ASN A 10 6.358 5.031 -7.153 1.00 0.00 O ATOM 101 ND2 ASN A 10 5.270 3.901 -8.667 1.00 0.00 N ATOM 0 H ASN A 10 4.993 4.460 -6.019 1.00 0.00 H new ATOM 0 HA ASN A 10 3.210 6.633 -6.037 1.00 0.00 H new ATOM 0 HB2 ASN A 10 3.654 5.893 -8.739 1.00 0.00 H new ATOM 0 HB3 ASN A 10 4.670 6.965 -7.796 1.00 0.00 H new ATOM 0 HD21 ASN A 10 6.009 3.199 -8.700 1.00 0.00 H new ATOM 0 HD22 ASN A 10 4.448 3.805 -9.264 1.00 0.00 H new ATOM 105 N ASP A 11 2.034 4.032 -7.681 1.00 0.00 N ATOM 106 CA ASP A 11 0.761 3.444 -8.162 1.00 0.00 C ATOM 107 C ASP A 11 -0.204 3.232 -7.003 1.00 0.00 C ATOM 108 O ASP A 11 -1.247 3.855 -6.938 1.00 0.00 O ATOM 109 CB ASP A 11 1.068 2.080 -8.802 1.00 0.00 C ATOM 110 CG ASP A 11 0.312 1.961 -10.127 1.00 0.00 C ATOM 111 OD1 ASP A 11 -0.906 1.977 -10.058 1.00 0.00 O ATOM 112 OD2 ASP A 11 0.995 1.859 -11.133 1.00 0.00 O ATOM 0 H ASP A 11 2.871 3.482 -7.875 1.00 0.00 H new ATOM 0 HA ASP A 11 0.304 4.122 -8.883 1.00 0.00 H new ATOM 0 HB2 ASP A 11 2.140 1.978 -8.971 1.00 0.00 H new ATOM 0 HB3 ASP A 11 0.774 1.275 -8.129 1.00 0.00 H new ATOM 114 N GLY A 12 0.168 2.353 -6.110 1.00 0.00 N ATOM 115 CA GLY A 12 -0.704 2.068 -4.934 1.00 0.00 C ATOM 116 C GLY A 12 -0.835 0.561 -4.753 1.00 0.00 C ATOM 117 O GLY A 12 -1.312 0.089 -3.740 1.00 0.00 O ATOM 0 H GLY A 12 1.037 1.821 -6.145 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -0.280 2.518 -4.036 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -1.688 2.514 -5.080 1.00 0.00 H new ATOM 119 N VAL A 13 -0.407 -0.165 -5.750 1.00 0.00 N ATOM 120 CA VAL A 13 -0.491 -1.640 -5.672 1.00 0.00 C ATOM 121 C VAL A 13 0.626 -2.292 -6.478 1.00 0.00 C ATOM 122 O VAL A 13 0.865 -1.937 -7.615 1.00 0.00 O ATOM 123 CB VAL A 13 -1.847 -2.069 -6.258 1.00 0.00 C ATOM 124 CG1 VAL A 13 -1.919 -1.647 -7.728 1.00 0.00 C ATOM 125 CG2 VAL A 13 -1.990 -3.594 -6.165 1.00 0.00 C ATOM 0 H VAL A 13 -0.004 0.204 -6.611 1.00 0.00 H new ATOM 0 HA VAL A 13 -0.392 -1.953 -4.633 1.00 0.00 H new ATOM 0 HB VAL A 13 -2.650 -1.593 -5.696 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -2.879 -1.949 -8.147 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -1.816 -0.564 -7.801 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -1.113 -2.126 -8.284 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -2.951 -3.895 -6.581 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -1.186 -4.070 -6.727 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -1.934 -3.902 -5.121 1.00 0.00 H new ATOM 127 N ASP A 14 1.290 -3.237 -5.870 1.00 0.00 N ATOM 128 CA ASP A 14 2.390 -3.924 -6.582 1.00 0.00 C ATOM 129 C ASP A 14 1.835 -5.116 -7.335 1.00 0.00 C ATOM 130 O ASP A 14 1.338 -6.052 -6.742 1.00 0.00 O ATOM 131 CB ASP A 14 3.411 -4.416 -5.546 1.00 0.00 C ATOM 132 CG ASP A 14 2.708 -5.335 -4.546 1.00 0.00 C ATOM 133 OD1 ASP A 14 1.505 -5.181 -4.422 1.00 0.00 O ATOM 134 OD2 ASP A 14 3.415 -6.142 -3.963 1.00 0.00 O ATOM 0 H ASP A 14 1.116 -3.557 -4.917 1.00 0.00 H new ATOM 0 HA ASP A 14 2.864 -3.239 -7.285 1.00 0.00 H new ATOM 0 HB2 ASP A 14 4.222 -4.950 -6.042 1.00 0.00 H new ATOM 0 HB3 ASP A 14 3.858 -3.568 -5.027 1.00 0.00 H new ATOM 136 N THR A 15 1.932 -5.067 -8.629 1.00 0.00 N ATOM 137 CA THR A 15 1.415 -6.180 -9.433 1.00 0.00 C ATOM 138 C THR A 15 2.240 -6.345 -10.708 1.00 0.00 C ATOM 139 O THR A 15 2.032 -5.655 -11.684 1.00 0.00 O ATOM 140 CB THR A 15 -0.046 -5.863 -9.796 1.00 0.00 C ATOM 141 OG1 THR A 15 0.011 -4.806 -10.731 1.00 0.00 O ATOM 142 CG2 THR A 15 -0.788 -5.262 -8.587 1.00 0.00 C ATOM 0 H THR A 15 2.349 -4.300 -9.157 1.00 0.00 H new ATOM 0 HA THR A 15 1.477 -7.109 -8.866 1.00 0.00 H new ATOM 0 HB THR A 15 -0.540 -6.770 -10.145 1.00 0.00 H new ATOM 0 HG1 THR A 15 0.411 -5.128 -11.565 1.00 0.00 H new ATOM 0 HG21 THR A 15 -1.819 -5.045 -8.864 1.00 0.00 H new ATOM 0 HG22 THR A 15 -0.776 -5.974 -7.762 1.00 0.00 H new ATOM 0 HG23 THR A 15 -0.294 -4.341 -8.278 1.00 0.00 H new ATOM 145 N ALA A 16 3.174 -7.260 -10.658 1.00 0.00 N ATOM 146 CA ALA A 16 4.038 -7.510 -11.838 1.00 0.00 C ATOM 147 C ALA A 16 3.964 -8.969 -12.234 1.00 0.00 C ATOM 148 O ALA A 16 4.740 -9.782 -11.774 1.00 0.00 O ATOM 149 CB ALA A 16 5.488 -7.178 -11.452 1.00 0.00 C ATOM 0 H ALA A 16 3.372 -7.844 -9.845 1.00 0.00 H new ATOM 0 HA ALA A 16 3.706 -6.893 -12.673 1.00 0.00 H new ATOM 0 HB1 ALA A 16 6.142 -7.355 -12.306 1.00 0.00 H new ATOM 0 HB2 ALA A 16 5.555 -6.131 -11.155 1.00 0.00 H new ATOM 0 HB3 ALA A 16 5.798 -7.812 -10.621 1.00 0.00 H new ATOM 151 N ILE A 17 3.029 -9.277 -13.081 1.00 0.00 N ATOM 152 CA ILE A 17 2.882 -10.657 -13.518 1.00 0.00 C ATOM 153 C ILE A 17 2.138 -10.713 -14.870 1.00 0.00 C ATOM 154 O ILE A 17 2.736 -10.529 -15.911 1.00 0.00 O ATOM 155 CB ILE A 17 2.094 -11.385 -12.429 1.00 0.00 C ATOM 156 CG1 ILE A 17 1.865 -12.807 -12.842 1.00 0.00 C ATOM 157 CG2 ILE A 17 0.738 -10.679 -12.212 1.00 0.00 C ATOM 158 CD1 ILE A 17 3.226 -13.471 -12.995 1.00 0.00 C ATOM 0 H ILE A 17 2.363 -8.617 -13.484 1.00 0.00 H new ATOM 0 HA ILE A 17 3.853 -11.129 -13.667 1.00 0.00 H new ATOM 0 HB ILE A 17 2.660 -11.368 -11.498 1.00 0.00 H new ATOM 0 HG12 ILE A 17 1.266 -13.330 -12.096 1.00 0.00 H new ATOM 0 HG13 ILE A 17 1.312 -12.848 -13.780 1.00 0.00 H new ATOM 0 HG21 ILE A 17 0.177 -11.199 -11.435 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.910 -9.647 -11.906 1.00 0.00 H new ATOM 0 HG23 ILE A 17 0.168 -10.692 -13.141 1.00 0.00 H new ATOM 0 HD11 ILE A 17 3.092 -14.510 -13.296 1.00 0.00 H new ATOM 0 HD12 ILE A 17 3.804 -12.945 -13.755 1.00 0.00 H new ATOM 0 HD13 ILE A 17 3.758 -13.434 -12.044 1.00 0.00 H new ATOM 160 N TYR A 18 0.857 -10.964 -14.827 1.00 0.00 N ATOM 161 CA TYR A 18 0.074 -11.030 -16.082 1.00 0.00 C ATOM 162 C TYR A 18 0.275 -9.763 -16.904 1.00 0.00 C ATOM 163 O TYR A 18 -0.261 -9.635 -17.988 1.00 0.00 O ATOM 164 CB TYR A 18 -1.402 -11.152 -15.720 1.00 0.00 C ATOM 165 CG TYR A 18 -1.574 -12.227 -14.651 1.00 0.00 C ATOM 166 CD1 TYR A 18 -0.964 -13.456 -14.777 1.00 0.00 C ATOM 167 CD2 TYR A 18 -2.345 -11.975 -13.549 1.00 0.00 C ATOM 168 CE1 TYR A 18 -1.133 -14.419 -13.805 1.00 0.00 C ATOM 169 CE2 TYR A 18 -2.517 -12.934 -12.575 1.00 0.00 C ATOM 170 CZ TYR A 18 -1.912 -14.166 -12.695 1.00 0.00 C ATOM 171 OH TYR A 18 -2.086 -15.131 -11.727 1.00 0.00 O ATOM 0 H TYR A 18 0.323 -11.126 -13.973 1.00 0.00 H new ATOM 0 HA TYR A 18 0.405 -11.887 -16.669 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -1.778 -10.197 -15.355 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -1.985 -11.407 -16.605 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -0.351 -13.666 -15.641 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -2.824 -11.013 -13.442 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -0.651 -15.380 -13.914 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -3.130 -12.719 -11.712 1.00 0.00 H new ATOM 0 HH TYR A 18 -2.663 -14.781 -11.016 1.00 0.00 H new ATOM 174 N HIS A 19 0.993 -8.822 -16.326 1.00 0.00 N ATOM 175 CA HIS A 19 1.270 -7.526 -17.025 1.00 0.00 C ATOM 176 C HIS A 19 1.592 -7.731 -18.506 1.00 0.00 C ATOM 177 O HIS A 19 1.722 -6.772 -19.239 1.00 0.00 O ATOM 178 CB HIS A 19 2.485 -6.868 -16.336 1.00 0.00 C ATOM 179 CG HIS A 19 2.635 -5.413 -16.804 1.00 0.00 C ATOM 180 ND1 HIS A 19 1.802 -4.641 -17.594 1.00 0.00 N flip ATOM 181 CD2 HIS A 19 3.599 -4.669 -16.513 1.00 0.00 C flip ATOM 182 CE1 HIS A 19 2.348 -3.401 -17.740 1.00 0.00 C flip ATOM 183 NE2 HIS A 19 3.470 -3.516 -17.028 1.00 0.00 N flip ATOM 0 H HIS A 19 1.400 -8.900 -15.394 1.00 0.00 H new ATOM 0 HA HIS A 19 0.381 -6.899 -16.964 1.00 0.00 H new ATOM 0 HB2 HIS A 19 2.359 -6.899 -15.254 1.00 0.00 H new ATOM 0 HB3 HIS A 19 3.391 -7.428 -16.568 1.00 0.00 H new ATOM 0 HD2 HIS A 19 4.436 -4.971 -15.900 1.00 0.00 H new ATOM 0 HE1 HIS A 19 1.972 -2.550 -18.288 1.00 0.00 H new ATOM 0 HE2 HIS A 19 4.148 -2.763 -16.911 1.00 0.00 H new ATOM 187 N HIS A 20 1.736 -8.977 -18.907 1.00 0.00 N ATOM 188 CA HIS A 20 2.049 -9.275 -20.333 1.00 0.00 C ATOM 189 C HIS A 20 1.404 -8.248 -21.265 1.00 0.00 C ATOM 190 O HIS A 20 2.087 -7.421 -21.836 1.00 0.00 O ATOM 191 CB HIS A 20 1.461 -10.666 -20.653 1.00 0.00 C ATOM 192 CG HIS A 20 2.565 -11.579 -21.184 1.00 0.00 C ATOM 193 ND1 HIS A 20 2.768 -12.751 -20.802 1.00 0.00 N ATOM 194 CD2 HIS A 20 3.525 -11.334 -22.145 1.00 0.00 C ATOM 195 CE1 HIS A 20 3.747 -13.277 -21.412 1.00 0.00 C ATOM 196 NE2 HIS A 20 4.299 -12.444 -22.296 1.00 0.00 N ATOM 0 H HIS A 20 1.649 -9.795 -18.303 1.00 0.00 H new ATOM 0 HA HIS A 20 3.128 -9.243 -20.483 1.00 0.00 H new ATOM 0 HB2 HIS A 20 1.017 -11.099 -19.757 1.00 0.00 H new ATOM 0 HB3 HIS A 20 0.664 -10.574 -21.391 1.00 0.00 H new ATOM 0 HD2 HIS A 20 3.643 -10.409 -22.690 1.00 0.00 H new ATOM 0 HE1 HIS A 20 4.094 -14.284 -21.236 1.00 0.00 H new ATOM 0 HE2 HIS A 20 5.091 -12.598 -22.920 1.00 0.00 H new ATOM 200 N LYS A 21 0.100 -8.313 -21.401 1.00 0.00 N ATOM 201 CA LYS A 21 -0.585 -7.338 -22.292 1.00 0.00 C ATOM 202 C LYS A 21 -1.149 -6.164 -21.488 1.00 0.00 C ATOM 203 O LYS A 21 -0.621 -5.069 -21.526 1.00 0.00 O ATOM 204 CB LYS A 21 -1.752 -8.058 -22.982 1.00 0.00 C ATOM 205 CG LYS A 21 -1.283 -9.423 -23.480 1.00 0.00 C ATOM 206 CD LYS A 21 0.008 -9.255 -24.277 1.00 0.00 C ATOM 207 CE LYS A 21 0.336 -10.579 -24.973 1.00 0.00 C ATOM 208 NZ LYS A 21 1.391 -10.380 -26.006 1.00 0.00 N ATOM 0 H LYS A 21 -0.507 -8.990 -20.939 1.00 0.00 H new ATOM 0 HA LYS A 21 0.133 -6.954 -23.017 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -2.582 -8.178 -22.286 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -2.120 -7.461 -23.816 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -1.118 -10.093 -22.636 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -2.052 -9.879 -24.104 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -0.104 -8.459 -25.014 1.00 0.00 H new ATOM 0 HD3 LYS A 21 0.824 -8.964 -23.616 1.00 0.00 H new ATOM 0 HE2 LYS A 21 0.673 -11.309 -24.237 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -0.563 -10.985 -25.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 1.601 -11.288 -26.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 1.056 -9.699 -26.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 2.254 -10.014 -25.555 1.00 0.00 H new ATOM 213 N LEU A 22 -2.216 -6.423 -20.772 1.00 0.00 N ATOM 214 CA LEU A 22 -2.842 -5.346 -19.950 1.00 0.00 C ATOM 215 C LEU A 22 -3.580 -5.941 -18.763 1.00 0.00 C ATOM 216 O LEU A 22 -4.255 -5.244 -18.033 1.00 0.00 O ATOM 217 CB LEU A 22 -3.855 -4.579 -20.829 1.00 0.00 C ATOM 218 CG LEU A 22 -5.075 -5.467 -21.113 1.00 0.00 C ATOM 219 CD1 LEU A 22 -6.104 -4.663 -21.910 1.00 0.00 C ATOM 220 CD2 LEU A 22 -4.634 -6.674 -21.936 1.00 0.00 C ATOM 0 H LEU A 22 -2.678 -7.331 -20.723 1.00 0.00 H new ATOM 0 HA LEU A 22 -2.061 -4.679 -19.584 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -4.169 -3.665 -20.325 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -3.385 -4.281 -21.766 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.516 -5.803 -20.174 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -6.974 -5.287 -22.116 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -6.411 -3.791 -21.332 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -5.661 -4.337 -22.851 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -5.496 -7.309 -22.141 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -4.201 -6.334 -22.877 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -3.889 -7.242 -21.378 1.00 0.00 H new ATOM 222 N ARG A 23 -3.423 -7.218 -18.578 1.00 0.00 N ATOM 223 CA ARG A 23 -4.102 -7.879 -17.456 1.00 0.00 C ATOM 224 C ARG A 23 -3.774 -7.210 -16.139 1.00 0.00 C ATOM 225 O ARG A 23 -4.538 -7.289 -15.199 1.00 0.00 O ATOM 226 CB ARG A 23 -3.653 -9.341 -17.418 1.00 0.00 C ATOM 227 CG ARG A 23 -4.718 -10.200 -18.103 1.00 0.00 C ATOM 228 CD ARG A 23 -4.379 -11.675 -17.900 1.00 0.00 C ATOM 229 NE ARG A 23 -5.479 -12.504 -18.467 1.00 0.00 N ATOM 230 CZ ARG A 23 -5.296 -13.786 -18.637 1.00 0.00 C ATOM 231 NH1 ARG A 23 -4.297 -14.368 -18.031 1.00 0.00 N ATOM 232 NH2 ARG A 23 -6.121 -14.445 -19.404 1.00 0.00 N ATOM 0 H ARG A 23 -2.850 -7.827 -19.162 1.00 0.00 H new ATOM 0 HA ARG A 23 -5.180 -7.809 -17.601 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -2.694 -9.455 -17.923 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -3.511 -9.666 -16.387 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -5.702 -9.980 -17.688 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -4.761 -9.967 -19.167 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -3.435 -11.916 -18.389 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -4.253 -11.890 -16.839 1.00 0.00 H new ATOM 0 HE ARG A 23 -6.368 -12.074 -18.721 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -3.674 -13.822 -17.436 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -4.140 -15.368 -18.153 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -6.893 -13.958 -19.859 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -5.993 -15.447 -19.548 1.00 0.00 H new ATOM 239 N ASP A 24 -2.649 -6.562 -16.079 1.00 0.00 N ATOM 240 CA ASP A 24 -2.292 -5.895 -14.818 1.00 0.00 C ATOM 241 C ASP A 24 -3.146 -4.655 -14.635 1.00 0.00 C ATOM 242 O ASP A 24 -3.465 -4.264 -13.529 1.00 0.00 O ATOM 243 CB ASP A 24 -0.824 -5.475 -14.872 1.00 0.00 C ATOM 244 CG ASP A 24 -0.605 -4.606 -16.107 1.00 0.00 C ATOM 245 OD1 ASP A 24 -1.198 -4.948 -17.118 1.00 0.00 O ATOM 246 OD2 ASP A 24 0.137 -3.646 -15.971 1.00 0.00 O ATOM 0 H ASP A 24 -1.975 -6.470 -16.839 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.459 -6.582 -13.988 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -0.556 -4.924 -13.971 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -0.181 -6.354 -14.911 1.00 0.00 H new ATOM 248 N GLN A 25 -3.504 -4.059 -15.737 1.00 0.00 N ATOM 249 CA GLN A 25 -4.336 -2.844 -15.676 1.00 0.00 C ATOM 250 C GLN A 25 -5.696 -3.201 -15.175 1.00 0.00 C ATOM 251 O GLN A 25 -6.357 -2.407 -14.538 1.00 0.00 O ATOM 252 CB GLN A 25 -4.447 -2.269 -17.094 1.00 0.00 C ATOM 253 CG GLN A 25 -3.076 -2.315 -17.747 1.00 0.00 C ATOM 254 CD GLN A 25 -2.848 -1.031 -18.544 1.00 0.00 C ATOM 255 OE1 GLN A 25 -3.693 -0.597 -19.301 1.00 0.00 O ATOM 256 NE2 GLN A 25 -1.721 -0.393 -18.401 1.00 0.00 N ATOM 0 H GLN A 25 -3.252 -4.368 -16.676 1.00 0.00 H new ATOM 0 HA GLN A 25 -3.890 -2.110 -15.005 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -5.164 -2.844 -17.680 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -4.814 -1.243 -17.058 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -2.303 -2.426 -16.987 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -3.003 -3.181 -18.404 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -1.008 -0.753 -17.767 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -1.552 0.467 -18.923 1.00 0.00 H new ATOM 260 N VAL A 26 -6.108 -4.388 -15.476 1.00 0.00 N ATOM 261 CA VAL A 26 -7.425 -4.805 -15.014 1.00 0.00 C ATOM 262 C VAL A 26 -7.339 -5.183 -13.552 1.00 0.00 C ATOM 263 O VAL A 26 -8.065 -4.666 -12.734 1.00 0.00 O ATOM 264 CB VAL A 26 -7.885 -6.011 -15.835 1.00 0.00 C ATOM 265 CG1 VAL A 26 -9.400 -6.123 -15.741 1.00 0.00 C ATOM 266 CG2 VAL A 26 -7.492 -5.811 -17.296 1.00 0.00 C ATOM 0 H VAL A 26 -5.587 -5.077 -16.019 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.140 -3.991 -15.136 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.417 -6.917 -15.451 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -9.738 -6.980 -16.323 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -9.691 -6.255 -14.699 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -9.857 -5.215 -16.134 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -7.819 -6.670 -17.882 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.966 -4.908 -17.680 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -6.409 -5.712 -17.371 1.00 0.00 H new ATOM 268 N LEU A 27 -6.437 -6.072 -13.242 1.00 0.00 N ATOM 269 CA LEU A 27 -6.292 -6.488 -11.827 1.00 0.00 C ATOM 270 C LEU A 27 -6.045 -5.269 -10.972 1.00 0.00 C ATOM 271 O LEU A 27 -6.278 -5.279 -9.780 1.00 0.00 O ATOM 272 CB LEU A 27 -5.064 -7.420 -11.706 1.00 0.00 C ATOM 273 CG LEU A 27 -5.520 -8.887 -11.548 1.00 0.00 C ATOM 274 CD1 LEU A 27 -4.609 -9.802 -12.362 1.00 0.00 C ATOM 275 CD2 LEU A 27 -5.400 -9.291 -10.079 1.00 0.00 C ATOM 0 H LEU A 27 -5.802 -6.522 -13.902 1.00 0.00 H new ATOM 0 HA LEU A 27 -7.198 -6.999 -11.501 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -4.435 -7.321 -12.590 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -4.458 -7.126 -10.849 1.00 0.00 H new ATOM 0 HG LEU A 27 -6.550 -8.978 -11.893 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -4.935 -10.836 -12.247 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -4.657 -9.521 -13.414 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -3.583 -9.703 -12.007 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -5.720 -10.326 -9.959 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -4.363 -9.192 -9.758 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -6.031 -8.643 -9.471 1.00 0.00 H new ATOM 277 N LYS A 28 -5.584 -4.230 -11.602 1.00 0.00 N ATOM 278 CA LYS A 28 -5.313 -2.997 -10.849 1.00 0.00 C ATOM 279 C LYS A 28 -6.557 -2.150 -10.800 1.00 0.00 C ATOM 280 O LYS A 28 -6.946 -1.681 -9.754 1.00 0.00 O ATOM 281 CB LYS A 28 -4.195 -2.226 -11.564 1.00 0.00 C ATOM 282 CG LYS A 28 -3.960 -0.895 -10.850 1.00 0.00 C ATOM 283 CD LYS A 28 -4.303 0.251 -11.802 1.00 0.00 C ATOM 284 CE LYS A 28 -4.210 1.575 -11.048 1.00 0.00 C ATOM 285 NZ LYS A 28 -5.516 1.904 -10.414 1.00 0.00 N ATOM 0 H LYS A 28 -5.386 -4.188 -12.602 1.00 0.00 H new ATOM 0 HA LYS A 28 -5.009 -3.240 -9.831 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -3.278 -2.815 -11.570 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -4.467 -2.050 -12.605 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -4.576 -0.836 -9.953 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -2.921 -0.819 -10.529 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -3.618 0.253 -12.650 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -5.307 0.117 -12.204 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -3.434 1.513 -10.285 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -3.920 2.372 -11.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -5.945 2.715 -10.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -6.151 1.083 -10.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -5.365 2.144 -9.413 1.00 0.00 H new ATOM 290 N ALA A 29 -7.175 -1.977 -11.927 1.00 0.00 N ATOM 291 CA ALA A 29 -8.400 -1.159 -11.942 1.00 0.00 C ATOM 292 C ALA A 29 -9.496 -1.873 -11.174 1.00 0.00 C ATOM 293 O ALA A 29 -10.443 -1.271 -10.739 1.00 0.00 O ATOM 294 CB ALA A 29 -8.855 -0.965 -13.396 1.00 0.00 C ATOM 0 H ALA A 29 -6.887 -2.363 -12.826 1.00 0.00 H new ATOM 0 HA ALA A 29 -8.199 -0.193 -11.480 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -9.762 -0.360 -13.416 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -8.070 -0.460 -13.959 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -9.057 -1.937 -13.847 1.00 0.00 H new ATOM 296 N LEU A 30 -9.331 -3.158 -11.006 1.00 0.00 N ATOM 297 CA LEU A 30 -10.350 -3.930 -10.271 1.00 0.00 C ATOM 298 C LEU A 30 -10.147 -3.793 -8.785 1.00 0.00 C ATOM 299 O LEU A 30 -11.061 -3.470 -8.051 1.00 0.00 O ATOM 300 CB LEU A 30 -10.191 -5.412 -10.636 1.00 0.00 C ATOM 301 CG LEU A 30 -10.695 -5.654 -12.056 1.00 0.00 C ATOM 302 CD1 LEU A 30 -10.079 -6.951 -12.591 1.00 0.00 C ATOM 303 CD2 LEU A 30 -12.214 -5.798 -12.027 1.00 0.00 C ATOM 0 H LEU A 30 -8.535 -3.697 -11.348 1.00 0.00 H new ATOM 0 HA LEU A 30 -11.339 -3.556 -10.537 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.144 -5.705 -10.558 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -10.748 -6.031 -9.933 1.00 0.00 H new ATOM 0 HG LEU A 30 -10.414 -4.819 -12.697 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -10.434 -7.131 -13.606 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.993 -6.862 -12.597 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -10.371 -7.784 -11.951 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -12.582 -5.971 -13.038 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -12.488 -6.640 -11.392 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.658 -4.885 -11.630 1.00 0.00 H new ATOM 305 N TYR A 31 -8.946 -4.021 -8.367 1.00 0.00 N ATOM 306 CA TYR A 31 -8.652 -3.917 -6.936 1.00 0.00 C ATOM 307 C TYR A 31 -8.656 -2.476 -6.431 1.00 0.00 C ATOM 308 O TYR A 31 -9.090 -2.212 -5.327 1.00 0.00 O ATOM 309 CB TYR A 31 -7.269 -4.523 -6.688 1.00 0.00 C ATOM 310 CG TYR A 31 -6.770 -4.064 -5.329 1.00 0.00 C ATOM 311 CD1 TYR A 31 -6.273 -2.792 -5.165 1.00 0.00 C ATOM 312 CD2 TYR A 31 -6.819 -4.910 -4.245 1.00 0.00 C ATOM 313 CE1 TYR A 31 -5.832 -2.368 -3.936 1.00 0.00 C ATOM 314 CE2 TYR A 31 -6.379 -4.490 -3.012 1.00 0.00 C ATOM 315 CZ TYR A 31 -5.880 -3.214 -2.846 1.00 0.00 C ATOM 316 OH TYR A 31 -5.437 -2.790 -1.610 1.00 0.00 O ATOM 0 H TYR A 31 -8.156 -4.275 -8.960 1.00 0.00 H new ATOM 0 HA TYR A 31 -9.434 -4.449 -6.395 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -7.322 -5.611 -6.723 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -6.575 -4.213 -7.469 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -6.229 -2.121 -6.010 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -7.206 -5.911 -4.364 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -5.445 -1.366 -3.821 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -6.424 -5.163 -2.168 1.00 0.00 H new ATOM 0 HH TYR A 31 -5.545 -3.513 -0.958 1.00 0.00 H new ATOM 319 N ASP A 32 -8.183 -1.571 -7.231 1.00 0.00 N ATOM 320 CA ASP A 32 -8.165 -0.154 -6.777 1.00 0.00 C ATOM 321 C ASP A 32 -9.529 0.531 -6.907 1.00 0.00 C ATOM 322 O ASP A 32 -9.823 1.444 -6.162 1.00 0.00 O ATOM 323 CB ASP A 32 -7.133 0.619 -7.615 1.00 0.00 C ATOM 324 CG ASP A 32 -5.725 0.268 -7.130 1.00 0.00 C ATOM 325 OD1 ASP A 32 -5.327 0.868 -6.145 1.00 0.00 O ATOM 326 OD2 ASP A 32 -5.127 -0.581 -7.772 1.00 0.00 O ATOM 0 H ASP A 32 -7.813 -1.743 -8.166 1.00 0.00 H new ATOM 0 HA ASP A 32 -7.903 -0.151 -5.719 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.241 0.366 -8.670 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -7.304 1.692 -7.525 1.00 0.00 H new ATOM 328 N VAL A 33 -10.342 0.101 -7.834 1.00 0.00 N ATOM 329 CA VAL A 33 -11.666 0.763 -7.963 1.00 0.00 C ATOM 330 C VAL A 33 -12.642 0.210 -6.944 1.00 0.00 C ATOM 331 O VAL A 33 -13.605 0.861 -6.588 1.00 0.00 O ATOM 332 CB VAL A 33 -12.221 0.519 -9.370 1.00 0.00 C ATOM 333 CG1 VAL A 33 -13.604 1.161 -9.479 1.00 0.00 C ATOM 334 CG2 VAL A 33 -11.284 1.167 -10.395 1.00 0.00 C ATOM 0 H VAL A 33 -10.153 -0.658 -8.489 1.00 0.00 H new ATOM 0 HA VAL A 33 -11.539 1.831 -7.788 1.00 0.00 H new ATOM 0 HB VAL A 33 -12.295 -0.552 -9.560 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -14.006 0.992 -10.478 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -14.271 0.717 -8.740 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -13.523 2.233 -9.297 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -11.671 0.998 -11.400 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -11.222 2.239 -10.205 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -10.291 0.726 -10.310 1.00 0.00 H new ATOM 336 N LEU A 34 -12.380 -0.985 -6.484 1.00 0.00 N ATOM 337 CA LEU A 34 -13.289 -1.587 -5.484 1.00 0.00 C ATOM 338 C LEU A 34 -12.798 -1.318 -4.069 1.00 0.00 C ATOM 339 O LEU A 34 -13.568 -0.988 -3.192 1.00 0.00 O ATOM 340 CB LEU A 34 -13.318 -3.098 -5.700 1.00 0.00 C ATOM 341 CG LEU A 34 -14.442 -3.448 -6.675 1.00 0.00 C ATOM 342 CD1 LEU A 34 -14.088 -4.745 -7.408 1.00 0.00 C ATOM 343 CD2 LEU A 34 -15.740 -3.650 -5.891 1.00 0.00 C ATOM 0 H LEU A 34 -11.583 -1.560 -6.758 1.00 0.00 H new ATOM 0 HA LEU A 34 -14.280 -1.149 -5.605 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -12.360 -3.439 -6.094 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -13.473 -3.610 -4.750 1.00 0.00 H new ATOM 0 HG LEU A 34 -14.569 -2.641 -7.397 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -14.887 -4.999 -8.105 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -13.157 -4.610 -7.958 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -13.968 -5.551 -6.684 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -16.546 -3.900 -6.580 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -15.610 -4.462 -5.175 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -15.990 -2.733 -5.358 1.00 0.00 H new ATOM 345 N ALA A 35 -11.523 -1.471 -3.870 1.00 0.00 N ATOM 346 CA ALA A 35 -10.963 -1.230 -2.520 1.00 0.00 C ATOM 347 C ALA A 35 -11.284 0.174 -2.032 1.00 0.00 C ATOM 348 O ALA A 35 -11.929 0.349 -1.017 1.00 0.00 O ATOM 349 CB ALA A 35 -9.439 -1.384 -2.597 1.00 0.00 C ATOM 0 H ALA A 35 -10.848 -1.751 -4.581 1.00 0.00 H new ATOM 0 HA ALA A 35 -11.402 -1.946 -1.825 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -9.006 -1.210 -1.612 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -9.192 -2.392 -2.930 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -9.035 -0.659 -3.304 1.00 0.00 H new ATOM 351 N LYS A 36 -10.825 1.150 -2.763 1.00 0.00 N ATOM 352 CA LYS A 36 -11.089 2.556 -2.363 1.00 0.00 C ATOM 353 C LYS A 36 -12.511 2.734 -1.853 1.00 0.00 C ATOM 354 O LYS A 36 -12.749 3.485 -0.929 1.00 0.00 O ATOM 355 CB LYS A 36 -10.889 3.458 -3.594 1.00 0.00 C ATOM 356 CG LYS A 36 -9.945 4.604 -3.225 1.00 0.00 C ATOM 357 CD LYS A 36 -10.647 5.528 -2.228 1.00 0.00 C ATOM 358 CE LYS A 36 -11.892 6.128 -2.888 1.00 0.00 C ATOM 359 NZ LYS A 36 -12.120 7.520 -2.407 1.00 0.00 N ATOM 0 H LYS A 36 -10.280 1.034 -3.617 1.00 0.00 H new ATOM 0 HA LYS A 36 -10.402 2.823 -1.560 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -10.475 2.880 -4.420 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.847 3.853 -3.930 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -9.027 4.210 -2.790 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -9.661 5.160 -4.118 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -10.927 4.972 -1.333 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -9.971 6.322 -1.911 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -11.773 6.127 -3.971 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -12.763 5.512 -2.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -12.968 7.911 -2.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -12.255 7.513 -1.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -11.296 8.109 -2.644 1.00 0.00 H new ATOM 364 N GLU A 37 -13.433 2.037 -2.455 1.00 0.00 N ATOM 365 CA GLU A 37 -14.841 2.165 -2.006 1.00 0.00 C ATOM 366 C GLU A 37 -14.930 2.125 -0.492 1.00 0.00 C ATOM 367 O GLU A 37 -15.184 3.129 0.144 1.00 0.00 O ATOM 368 CB GLU A 37 -15.649 0.989 -2.574 1.00 0.00 C ATOM 369 CG GLU A 37 -15.393 0.883 -4.082 1.00 0.00 C ATOM 370 CD GLU A 37 -16.102 2.032 -4.795 1.00 0.00 C ATOM 371 OE1 GLU A 37 -17.295 1.884 -5.006 1.00 0.00 O ATOM 372 OE2 GLU A 37 -15.411 2.994 -5.090 1.00 0.00 O ATOM 0 H GLU A 37 -13.273 1.392 -3.229 1.00 0.00 H new ATOM 0 HA GLU A 37 -15.236 3.118 -2.359 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -15.362 0.062 -2.078 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -16.712 1.137 -2.383 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -14.323 0.919 -4.284 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -15.756 -0.073 -4.458 1.00 0.00 H new ATOM 374 N SER A 38 -14.712 0.970 0.064 1.00 0.00 N ATOM 375 CA SER A 38 -14.783 0.857 1.537 1.00 0.00 C ATOM 376 C SER A 38 -13.887 -0.250 2.059 1.00 0.00 C ATOM 377 O SER A 38 -13.279 -0.984 1.304 1.00 0.00 O ATOM 378 CB SER A 38 -16.241 0.557 1.930 1.00 0.00 C ATOM 379 OG SER A 38 -16.996 1.518 1.211 1.00 0.00 O ATOM 0 H SER A 38 -14.490 0.108 -0.435 1.00 0.00 H new ATOM 0 HA SER A 38 -14.442 1.795 1.975 1.00 0.00 H new ATOM 0 HB2 SER A 38 -16.526 -0.459 1.658 1.00 0.00 H new ATOM 0 HB3 SER A 38 -16.392 0.654 3.005 1.00 0.00 H new ATOM 0 HG SER A 38 -17.949 1.397 1.404 1.00 0.00 H new ATOM 382 N GLU A 39 -13.814 -0.328 3.349 1.00 0.00 N ATOM 383 CA GLU A 39 -12.981 -1.362 3.992 1.00 0.00 C ATOM 384 C GLU A 39 -13.831 -2.594 4.246 1.00 0.00 C ATOM 385 O GLU A 39 -13.353 -3.616 4.694 1.00 0.00 O ATOM 386 CB GLU A 39 -12.474 -0.809 5.337 1.00 0.00 C ATOM 387 CG GLU A 39 -12.179 0.686 5.186 1.00 0.00 C ATOM 388 CD GLU A 39 -10.885 1.021 5.929 1.00 0.00 C ATOM 389 OE1 GLU A 39 -9.848 0.657 5.400 1.00 0.00 O ATOM 390 OE2 GLU A 39 -11.006 1.622 6.984 1.00 0.00 O ATOM 0 H GLU A 39 -14.305 0.291 3.994 1.00 0.00 H new ATOM 0 HA GLU A 39 -12.139 -1.625 3.352 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -13.221 -0.968 6.114 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -11.574 -1.340 5.647 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -12.085 0.945 4.132 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -13.005 1.274 5.586 1.00 0.00 H new ATOM 392 N HIS A 40 -15.104 -2.452 3.942 1.00 0.00 N ATOM 393 CA HIS A 40 -16.071 -3.587 4.146 1.00 0.00 C ATOM 394 C HIS A 40 -16.401 -4.480 2.887 1.00 0.00 C ATOM 395 O HIS A 40 -17.106 -5.458 3.039 1.00 0.00 O ATOM 396 CB HIS A 40 -17.389 -2.987 4.658 1.00 0.00 C ATOM 397 CG HIS A 40 -17.960 -3.900 5.746 1.00 0.00 C ATOM 398 ND1 HIS A 40 -17.282 -4.465 6.631 1.00 0.00 N ATOM 399 CD2 HIS A 40 -19.267 -4.287 5.982 1.00 0.00 C ATOM 400 CE1 HIS A 40 -18.009 -5.166 7.398 1.00 0.00 C ATOM 401 NE2 HIS A 40 -19.299 -5.114 7.063 1.00 0.00 N ATOM 0 H HIS A 40 -15.516 -1.600 3.562 1.00 0.00 H new ATOM 0 HA HIS A 40 -15.576 -4.262 4.845 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -17.218 -1.987 5.057 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -18.101 -2.886 3.839 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -20.125 -3.982 5.401 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -17.627 -5.740 8.229 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -20.098 -5.573 7.501 1.00 0.00 H new ATOM 405 N PRO A 41 -15.890 -4.158 1.680 1.00 0.00 N ATOM 406 CA PRO A 41 -16.192 -4.970 0.479 1.00 0.00 C ATOM 407 C PRO A 41 -16.317 -6.475 0.803 1.00 0.00 C ATOM 408 O PRO A 41 -15.331 -7.170 0.961 1.00 0.00 O ATOM 409 CB PRO A 41 -15.008 -4.701 -0.460 1.00 0.00 C ATOM 410 CG PRO A 41 -14.380 -3.361 0.020 1.00 0.00 C ATOM 411 CD PRO A 41 -14.871 -3.137 1.468 1.00 0.00 C ATOM 0 HA PRO A 41 -17.153 -4.701 0.040 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -14.281 -5.512 -0.414 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -15.339 -4.628 -1.496 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -13.292 -3.408 -0.017 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -14.686 -2.537 -0.625 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -14.054 -3.239 2.183 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -15.282 -2.136 1.595 1.00 0.00 H new ATOM 412 N PRO A 42 -17.566 -6.943 0.895 1.00 0.00 N ATOM 413 CA PRO A 42 -17.855 -8.347 1.200 1.00 0.00 C ATOM 414 C PRO A 42 -17.542 -9.307 0.048 1.00 0.00 C ATOM 415 O PRO A 42 -17.038 -10.389 0.277 1.00 0.00 O ATOM 416 CB PRO A 42 -19.376 -8.383 1.464 1.00 0.00 C ATOM 417 CG PRO A 42 -19.942 -6.967 1.154 1.00 0.00 C ATOM 418 CD PRO A 42 -18.761 -6.090 0.731 1.00 0.00 C ATOM 0 HA PRO A 42 -17.237 -8.673 2.036 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -19.856 -9.133 0.835 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -19.578 -8.658 2.499 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -20.688 -7.016 0.361 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -20.436 -6.550 2.031 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -18.868 -5.757 -0.301 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -18.694 -5.195 1.350 1.00 0.00 H new ATOM 419 N GLN A 43 -17.850 -8.909 -1.169 1.00 0.00 N ATOM 420 CA GLN A 43 -17.569 -9.810 -2.311 1.00 0.00 C ATOM 421 C GLN A 43 -16.222 -10.508 -2.168 1.00 0.00 C ATOM 422 O GLN A 43 -16.179 -11.674 -1.850 1.00 0.00 O ATOM 423 CB GLN A 43 -17.549 -8.961 -3.581 1.00 0.00 C ATOM 424 CG GLN A 43 -18.525 -7.797 -3.413 1.00 0.00 C ATOM 425 CD GLN A 43 -18.757 -7.144 -4.773 1.00 0.00 C ATOM 426 OE1 GLN A 43 -17.759 -7.061 -5.610 1.00 0.00 O flip ATOM 427 NE2 GLN A 43 -19.846 -6.706 -5.088 1.00 0.00 N flip ATOM 0 H GLN A 43 -18.276 -8.013 -1.407 1.00 0.00 H new ATOM 0 HA GLN A 43 -18.340 -10.579 -2.347 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -16.543 -8.585 -3.768 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -17.829 -9.566 -4.443 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -19.469 -8.153 -3.000 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -18.124 -7.068 -2.709 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -20.629 -6.769 -4.437 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -19.977 -6.276 -6.003 1.00 0.00 H new ATOM 431 N SER A 44 -15.161 -9.745 -2.364 1.00 0.00 N ATOM 432 CA SER A 44 -13.755 -10.286 -2.262 1.00 0.00 C ATOM 433 C SER A 44 -12.902 -9.630 -3.310 1.00 0.00 C ATOM 434 O SER A 44 -12.586 -10.228 -4.288 1.00 0.00 O ATOM 435 CB SER A 44 -13.719 -11.804 -2.542 1.00 0.00 C ATOM 436 OG SER A 44 -14.637 -11.996 -3.611 1.00 0.00 O ATOM 0 H SER A 44 -15.212 -8.753 -2.594 1.00 0.00 H new ATOM 0 HA SER A 44 -13.393 -10.086 -1.254 1.00 0.00 H new ATOM 0 HB2 SER A 44 -12.717 -12.132 -2.817 1.00 0.00 H new ATOM 0 HB3 SER A 44 -14.011 -12.376 -1.661 1.00 0.00 H new ATOM 0 HG SER A 44 -15.434 -12.460 -3.279 1.00 0.00 H new ATOM 439 N ILE A 45 -12.548 -8.413 -3.097 1.00 0.00 N ATOM 440 CA ILE A 45 -11.713 -7.739 -4.108 1.00 0.00 C ATOM 441 C ILE A 45 -10.542 -8.601 -4.527 1.00 0.00 C ATOM 442 O ILE A 45 -10.191 -8.649 -5.689 1.00 0.00 O ATOM 443 CB ILE A 45 -11.173 -6.446 -3.521 1.00 0.00 C ATOM 444 CG1 ILE A 45 -12.294 -5.640 -2.870 1.00 0.00 C ATOM 445 CG2 ILE A 45 -10.571 -5.629 -4.664 1.00 0.00 C ATOM 446 CD1 ILE A 45 -13.590 -5.818 -3.666 1.00 0.00 C ATOM 0 H ILE A 45 -12.794 -7.857 -2.278 1.00 0.00 H new ATOM 0 HA ILE A 45 -12.333 -7.546 -4.984 1.00 0.00 H new ATOM 0 HB ILE A 45 -10.425 -6.673 -2.761 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -12.440 -5.968 -1.841 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -12.021 -4.585 -2.832 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -10.174 -4.692 -4.272 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -9.767 -6.196 -5.132 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -11.342 -5.415 -5.404 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -14.387 -5.241 -3.197 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -13.441 -5.468 -4.687 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -13.866 -6.872 -3.681 1.00 0.00 H new ATOM 448 N LEU A 46 -9.956 -9.267 -3.593 1.00 0.00 N ATOM 449 CA LEU A 46 -8.810 -10.121 -3.948 1.00 0.00 C ATOM 450 C LEU A 46 -9.271 -11.366 -4.695 1.00 0.00 C ATOM 451 O LEU A 46 -8.790 -11.665 -5.767 1.00 0.00 O ATOM 452 CB LEU A 46 -8.108 -10.547 -2.652 1.00 0.00 C ATOM 453 CG LEU A 46 -6.596 -10.607 -2.891 1.00 0.00 C ATOM 454 CD1 LEU A 46 -6.308 -11.530 -4.073 1.00 0.00 C ATOM 455 CD2 LEU A 46 -6.074 -9.205 -3.207 1.00 0.00 C ATOM 0 H LEU A 46 -10.216 -9.259 -2.607 1.00 0.00 H new ATOM 0 HA LEU A 46 -8.133 -9.562 -4.594 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -8.334 -9.840 -1.853 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -8.476 -11.521 -2.329 1.00 0.00 H new ATOM 0 HG LEU A 46 -6.101 -10.988 -1.998 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -5.233 -11.575 -4.246 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -6.682 -12.530 -3.854 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -6.803 -11.145 -4.964 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -4.998 -9.247 -3.377 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -6.568 -8.826 -4.101 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.283 -8.541 -2.368 1.00 0.00 H new ATOM 457 N HIS A 47 -10.216 -12.048 -4.126 1.00 0.00 N ATOM 458 CA HIS A 47 -10.733 -13.280 -4.772 1.00 0.00 C ATOM 459 C HIS A 47 -11.694 -12.978 -5.915 1.00 0.00 C ATOM 460 O HIS A 47 -12.081 -13.865 -6.650 1.00 0.00 O ATOM 461 CB HIS A 47 -11.477 -14.089 -3.698 1.00 0.00 C ATOM 462 CG HIS A 47 -11.034 -15.555 -3.754 1.00 0.00 C ATOM 463 ND1 HIS A 47 -10.060 -15.986 -4.409 1.00 0.00 N ATOM 464 CD2 HIS A 47 -11.573 -16.663 -3.127 1.00 0.00 C ATOM 465 CE1 HIS A 47 -9.922 -17.237 -4.266 1.00 0.00 C ATOM 466 NE2 HIS A 47 -10.845 -17.763 -3.461 1.00 0.00 N ATOM 0 H HIS A 47 -10.655 -11.806 -3.238 1.00 0.00 H new ATOM 0 HA HIS A 47 -9.892 -13.831 -5.193 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -11.272 -13.675 -2.711 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -12.553 -14.018 -3.856 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -12.435 -16.657 -2.476 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -9.143 -17.813 -4.743 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -10.972 -18.733 -3.172 1.00 0.00 H new ATOM 470 N THR A 48 -12.058 -11.745 -6.049 1.00 0.00 N ATOM 471 CA THR A 48 -12.988 -11.378 -7.136 1.00 0.00 C ATOM 472 C THR A 48 -12.200 -10.941 -8.338 1.00 0.00 C ATOM 473 O THR A 48 -12.213 -11.590 -9.365 1.00 0.00 O ATOM 474 CB THR A 48 -13.862 -10.216 -6.662 1.00 0.00 C ATOM 475 OG1 THR A 48 -14.598 -10.728 -5.570 1.00 0.00 O ATOM 476 CG2 THR A 48 -14.923 -9.869 -7.715 1.00 0.00 C ATOM 0 H THR A 48 -11.753 -10.975 -5.454 1.00 0.00 H new ATOM 0 HA THR A 48 -13.610 -12.234 -7.398 1.00 0.00 H new ATOM 0 HB THR A 48 -13.241 -9.347 -6.446 1.00 0.00 H new ATOM 0 HG1 THR A 48 -13.980 -11.040 -4.876 1.00 0.00 H new ATOM 0 HG21 THR A 48 -15.533 -9.040 -7.357 1.00 0.00 H new ATOM 0 HG22 THR A 48 -14.432 -9.583 -8.645 1.00 0.00 H new ATOM 0 HG23 THR A 48 -15.558 -10.737 -7.892 1.00 0.00 H new ATOM 479 N ALA A 49 -11.513 -9.848 -8.197 1.00 0.00 N ATOM 480 CA ALA A 49 -10.721 -9.367 -9.328 1.00 0.00 C ATOM 481 C ALA A 49 -9.807 -10.483 -9.811 1.00 0.00 C ATOM 482 O ALA A 49 -9.436 -10.523 -10.961 1.00 0.00 O ATOM 483 CB ALA A 49 -9.871 -8.173 -8.863 1.00 0.00 C ATOM 0 H ALA A 49 -11.472 -9.279 -7.352 1.00 0.00 H new ATOM 0 HA ALA A 49 -11.378 -9.060 -10.142 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -9.275 -7.804 -9.697 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -10.525 -7.378 -8.505 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -9.210 -8.489 -8.056 1.00 0.00 H new ATOM 485 N LYS A 50 -9.462 -11.385 -8.916 1.00 0.00 N ATOM 486 CA LYS A 50 -8.573 -12.499 -9.333 1.00 0.00 C ATOM 487 C LYS A 50 -9.219 -13.331 -10.432 1.00 0.00 C ATOM 488 O LYS A 50 -8.553 -13.793 -11.337 1.00 0.00 O ATOM 489 CB LYS A 50 -8.341 -13.418 -8.128 1.00 0.00 C ATOM 490 CG LYS A 50 -6.995 -13.080 -7.487 1.00 0.00 C ATOM 491 CD LYS A 50 -6.800 -13.951 -6.243 1.00 0.00 C ATOM 492 CE LYS A 50 -6.449 -15.376 -6.679 1.00 0.00 C ATOM 493 NZ LYS A 50 -5.884 -16.144 -5.536 1.00 0.00 N ATOM 0 H LYS A 50 -9.755 -11.392 -7.939 1.00 0.00 H new ATOM 0 HA LYS A 50 -7.639 -12.075 -9.702 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -9.144 -13.294 -7.402 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -8.355 -14.461 -8.444 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -6.186 -13.252 -8.197 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -6.962 -12.025 -7.216 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -6.005 -13.542 -5.619 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -7.708 -13.955 -5.641 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -7.340 -15.877 -7.057 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -5.729 -15.346 -7.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -5.651 -17.109 -5.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -5.022 -15.673 -5.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -6.583 -16.188 -4.768 1.00 0.00 H new ATOM 498 N ALA A 51 -10.511 -13.504 -10.333 1.00 0.00 N ATOM 499 CA ALA A 51 -11.224 -14.308 -11.361 1.00 0.00 C ATOM 500 C ALA A 51 -11.840 -13.447 -12.467 1.00 0.00 C ATOM 501 O ALA A 51 -11.646 -13.707 -13.637 1.00 0.00 O ATOM 502 CB ALA A 51 -12.360 -15.071 -10.663 1.00 0.00 C ATOM 0 H ALA A 51 -11.097 -13.125 -9.589 1.00 0.00 H new ATOM 0 HA ALA A 51 -10.497 -14.974 -11.826 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -12.900 -15.670 -11.396 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -11.942 -15.725 -9.897 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -13.045 -14.360 -10.200 1.00 0.00 H new ATOM 504 N ILE A 52 -12.573 -12.441 -12.076 1.00 0.00 N ATOM 505 CA ILE A 52 -13.211 -11.557 -13.092 1.00 0.00 C ATOM 506 C ILE A 52 -12.199 -11.017 -14.099 1.00 0.00 C ATOM 507 O ILE A 52 -12.452 -10.998 -15.286 1.00 0.00 O ATOM 508 CB ILE A 52 -13.856 -10.376 -12.356 1.00 0.00 C ATOM 509 CG1 ILE A 52 -15.240 -10.773 -11.865 1.00 0.00 C ATOM 510 CG2 ILE A 52 -14.008 -9.200 -13.339 1.00 0.00 C ATOM 511 CD1 ILE A 52 -15.104 -11.885 -10.823 1.00 0.00 C ATOM 0 H ILE A 52 -12.757 -12.194 -11.104 1.00 0.00 H new ATOM 0 HA ILE A 52 -13.948 -12.140 -13.644 1.00 0.00 H new ATOM 0 HB ILE A 52 -13.231 -10.091 -11.510 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -15.746 -9.911 -11.430 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -15.852 -11.114 -12.700 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -14.466 -8.354 -12.826 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -13.026 -8.909 -13.713 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -14.639 -9.503 -14.174 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -16.093 -12.173 -10.468 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -14.614 -12.748 -11.274 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -14.507 -11.527 -9.984 1.00 0.00 H new ATOM 513 N GLU A 53 -11.077 -10.589 -13.611 1.00 0.00 N ATOM 514 CA GLU A 53 -10.045 -10.046 -14.527 1.00 0.00 C ATOM 515 C GLU A 53 -9.859 -10.915 -15.774 1.00 0.00 C ATOM 516 O GLU A 53 -10.150 -10.493 -16.874 1.00 0.00 O ATOM 517 CB GLU A 53 -8.710 -9.988 -13.774 1.00 0.00 C ATOM 518 CG GLU A 53 -7.645 -9.391 -14.696 1.00 0.00 C ATOM 519 CD GLU A 53 -6.682 -10.488 -15.146 1.00 0.00 C ATOM 520 OE1 GLU A 53 -7.170 -11.415 -15.768 1.00 0.00 O ATOM 521 OE2 GLU A 53 -5.511 -10.336 -14.844 1.00 0.00 O ATOM 0 H GLU A 53 -10.829 -10.591 -12.622 1.00 0.00 H new ATOM 0 HA GLU A 53 -10.371 -9.058 -14.852 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -8.811 -9.382 -12.874 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -8.414 -10.987 -13.454 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -8.118 -8.930 -15.563 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -7.098 -8.605 -14.175 1.00 0.00 H new ATOM 523 N SER A 54 -9.378 -12.107 -15.574 1.00 0.00 N ATOM 524 CA SER A 54 -9.160 -13.021 -16.731 1.00 0.00 C ATOM 525 C SER A 54 -10.458 -13.390 -17.447 1.00 0.00 C ATOM 526 O SER A 54 -10.425 -13.994 -18.496 1.00 0.00 O ATOM 527 CB SER A 54 -8.516 -14.314 -16.204 1.00 0.00 C ATOM 528 OG SER A 54 -8.337 -15.113 -17.366 1.00 0.00 O ATOM 0 H SER A 54 -9.126 -12.490 -14.663 1.00 0.00 H new ATOM 0 HA SER A 54 -8.523 -12.503 -17.448 1.00 0.00 H new ATOM 0 HB2 SER A 54 -7.566 -14.113 -15.709 1.00 0.00 H new ATOM 0 HB3 SER A 54 -9.157 -14.810 -15.475 1.00 0.00 H new ATOM 0 HG SER A 54 -8.829 -14.716 -18.115 1.00 0.00 H new ATOM 531 N GLU A 55 -11.578 -13.031 -16.886 1.00 0.00 N ATOM 532 CA GLU A 55 -12.851 -13.385 -17.566 1.00 0.00 C ATOM 533 C GLU A 55 -13.224 -12.391 -18.651 1.00 0.00 C ATOM 534 O GLU A 55 -13.150 -12.700 -19.824 1.00 0.00 O ATOM 535 CB GLU A 55 -13.970 -13.412 -16.517 1.00 0.00 C ATOM 536 CG GLU A 55 -15.216 -14.065 -17.125 1.00 0.00 C ATOM 537 CD GLU A 55 -14.892 -15.504 -17.534 1.00 0.00 C ATOM 538 OE1 GLU A 55 -14.930 -16.341 -16.647 1.00 0.00 O ATOM 539 OE2 GLU A 55 -14.628 -15.685 -18.710 1.00 0.00 O ATOM 0 H GLU A 55 -11.667 -12.520 -16.008 1.00 0.00 H new ATOM 0 HA GLU A 55 -12.719 -14.358 -18.040 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -13.646 -13.968 -15.637 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -14.200 -12.399 -16.187 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -16.033 -14.056 -16.403 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -15.551 -13.496 -17.992 1.00 0.00 H new ATOM 541 N MET A 56 -13.617 -11.225 -18.256 1.00 0.00 N ATOM 542 CA MET A 56 -13.996 -10.216 -19.270 1.00 0.00 C ATOM 543 C MET A 56 -12.811 -9.869 -20.159 1.00 0.00 C ATOM 544 O MET A 56 -12.963 -9.192 -21.158 1.00 0.00 O ATOM 545 CB MET A 56 -14.467 -8.943 -18.545 1.00 0.00 C ATOM 546 CG MET A 56 -13.675 -8.773 -17.248 1.00 0.00 C ATOM 547 SD MET A 56 -13.829 -7.184 -16.386 1.00 0.00 S ATOM 548 CE MET A 56 -12.267 -6.456 -16.944 1.00 0.00 C ATOM 0 H MET A 56 -13.693 -10.926 -17.284 1.00 0.00 H new ATOM 0 HA MET A 56 -14.791 -10.624 -19.894 1.00 0.00 H new ATOM 0 HB2 MET A 56 -14.326 -8.073 -19.186 1.00 0.00 H new ATOM 0 HB3 MET A 56 -15.533 -9.009 -18.327 1.00 0.00 H new ATOM 0 HG2 MET A 56 -13.980 -9.562 -16.560 1.00 0.00 H new ATOM 0 HG3 MET A 56 -12.621 -8.935 -17.472 1.00 0.00 H new ATOM 0 HE1 MET A 56 -11.804 -5.912 -16.120 1.00 0.00 H new ATOM 0 HE2 MET A 56 -11.596 -7.247 -17.279 1.00 0.00 H new ATOM 0 HE3 MET A 56 -12.459 -5.770 -17.769 1.00 0.00 H new ATOM 550 N ASN A 57 -11.651 -10.344 -19.784 1.00 0.00 N ATOM 551 CA ASN A 57 -10.439 -10.044 -20.602 1.00 0.00 C ATOM 552 C ASN A 57 -10.102 -11.183 -21.565 1.00 0.00 C ATOM 553 O ASN A 57 -9.668 -10.948 -22.674 1.00 0.00 O ATOM 554 CB ASN A 57 -9.256 -9.831 -19.649 1.00 0.00 C ATOM 555 CG ASN A 57 -8.066 -9.272 -20.434 1.00 0.00 C ATOM 556 OD1 ASN A 57 -7.785 -9.693 -21.539 1.00 0.00 O ATOM 557 ND2 ASN A 57 -7.342 -8.326 -19.900 1.00 0.00 N ATOM 0 H ASN A 57 -11.492 -10.920 -18.957 1.00 0.00 H new ATOM 0 HA ASN A 57 -10.637 -9.153 -21.198 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -9.536 -9.142 -18.852 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -8.983 -10.773 -19.174 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -6.545 -7.944 -20.410 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -7.573 -7.969 -18.973 1.00 0.00 H new ATOM 561 N LYS A 58 -10.304 -12.395 -21.130 1.00 0.00 N ATOM 562 CA LYS A 58 -9.992 -13.541 -22.022 1.00 0.00 C ATOM 563 C LYS A 58 -10.596 -13.337 -23.405 1.00 0.00 C ATOM 564 O LYS A 58 -9.895 -13.382 -24.399 1.00 0.00 O ATOM 565 CB LYS A 58 -10.584 -14.820 -21.410 1.00 0.00 C ATOM 566 CG LYS A 58 -10.503 -15.952 -22.438 1.00 0.00 C ATOM 567 CD LYS A 58 -10.444 -17.295 -21.703 1.00 0.00 C ATOM 568 CE LYS A 58 -10.787 -18.423 -22.683 1.00 0.00 C ATOM 569 NZ LYS A 58 -11.158 -19.662 -21.944 1.00 0.00 N ATOM 0 H LYS A 58 -10.667 -12.638 -20.208 1.00 0.00 H new ATOM 0 HA LYS A 58 -8.909 -13.621 -22.121 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -10.038 -15.092 -20.507 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -11.620 -14.652 -21.117 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -11.370 -15.923 -23.098 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -9.620 -15.828 -23.065 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -9.450 -17.451 -21.285 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -11.145 -17.297 -20.868 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -11.612 -18.116 -23.326 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -9.934 -18.621 -23.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -11.387 -20.416 -22.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -10.360 -19.963 -21.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -11.986 -19.473 -21.344 1.00 0.00 H new ATOM 574 N VAL A 59 -11.886 -13.114 -23.444 1.00 0.00 N ATOM 575 CA VAL A 59 -12.559 -12.903 -24.751 1.00 0.00 C ATOM 576 C VAL A 59 -12.893 -11.430 -24.962 1.00 0.00 C ATOM 577 O VAL A 59 -13.915 -10.954 -24.512 1.00 0.00 O ATOM 578 CB VAL A 59 -13.869 -13.710 -24.750 1.00 0.00 C ATOM 579 CG1 VAL A 59 -13.598 -15.111 -25.305 1.00 0.00 C ATOM 580 CG2 VAL A 59 -14.386 -13.833 -23.315 1.00 0.00 C ATOM 0 H VAL A 59 -12.496 -13.070 -22.628 1.00 0.00 H new ATOM 0 HA VAL A 59 -11.893 -13.226 -25.552 1.00 0.00 H new ATOM 0 HB VAL A 59 -14.611 -13.204 -25.368 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -14.523 -15.687 -25.306 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -13.218 -15.032 -26.324 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -12.859 -15.613 -24.681 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -15.314 -14.404 -23.310 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -13.643 -14.344 -22.703 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -14.570 -12.839 -22.908 1.00 0.00 H new ATOM 582 N ASN A 60 -12.019 -10.729 -25.643 1.00 0.00 N ATOM 583 CA ASN A 60 -12.279 -9.286 -25.888 1.00 0.00 C ATOM 584 C ASN A 60 -11.647 -8.814 -27.192 1.00 0.00 C ATOM 585 O ASN A 60 -11.153 -9.602 -27.976 1.00 0.00 O ATOM 586 CB ASN A 60 -11.674 -8.467 -24.736 1.00 0.00 C ATOM 587 CG ASN A 60 -10.299 -9.031 -24.370 1.00 0.00 C ATOM 588 OD1 ASN A 60 -9.813 -10.028 -25.060 1.00 0.00 O flip ATOM 589 ND2 ASN A 60 -9.652 -8.563 -23.455 1.00 0.00 N flip ATOM 0 H ASN A 60 -11.149 -11.092 -26.033 1.00 0.00 H new ATOM 0 HA ASN A 60 -13.358 -9.145 -25.952 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -11.583 -7.421 -25.029 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -12.334 -8.499 -23.869 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -10.026 -7.784 -22.912 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -8.735 -8.948 -23.229 1.00 0.00 H new ATOM 593 N ASN A 61 -11.679 -7.525 -27.390 1.00 0.00 N ATOM 594 CA ASN A 61 -11.096 -6.941 -28.622 1.00 0.00 C ATOM 595 C ASN A 61 -9.611 -6.653 -28.435 1.00 0.00 C ATOM 596 O ASN A 61 -8.936 -6.272 -29.360 1.00 0.00 O ATOM 597 CB ASN A 61 -11.823 -5.617 -28.909 1.00 0.00 C ATOM 598 CG ASN A 61 -11.739 -5.303 -30.404 1.00 0.00 C ATOM 599 OD1 ASN A 61 -11.557 -4.169 -30.801 1.00 0.00 O ATOM 600 ND2 ASN A 61 -11.870 -6.274 -31.262 1.00 0.00 N ATOM 0 H ASN A 61 -12.088 -6.850 -26.744 1.00 0.00 H new ATOM 0 HA ASN A 61 -11.212 -7.646 -29.445 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -12.866 -5.688 -28.599 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -11.373 -4.810 -28.331 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -11.820 -6.081 -32.262 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -12.023 -7.228 -30.934 1.00 0.00 H new ATOM 604 N CYS A 62 -9.150 -6.818 -27.220 1.00 0.00 N ATOM 605 CA CYS A 62 -7.707 -6.566 -26.907 1.00 0.00 C ATOM 606 C CYS A 62 -6.757 -7.006 -28.030 1.00 0.00 C ATOM 607 O CYS A 62 -5.622 -6.572 -28.076 1.00 0.00 O ATOM 608 CB CYS A 62 -7.352 -7.362 -25.643 1.00 0.00 C ATOM 609 SG CYS A 62 -7.471 -9.166 -25.738 1.00 0.00 S ATOM 0 H CYS A 62 -9.714 -7.119 -26.425 1.00 0.00 H new ATOM 0 HA CYS A 62 -7.582 -5.491 -26.778 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -6.332 -7.106 -25.358 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -8.003 -7.023 -24.837 1.00 0.00 H new ATOM 0 HG CYS A 62 -8.665 -9.541 -25.386 1.00 0.00 H new ATOM 611 N ASP A 63 -7.218 -7.846 -28.911 1.00 0.00 N ATOM 612 CA ASP A 63 -6.322 -8.292 -30.012 1.00 0.00 C ATOM 613 C ASP A 63 -6.409 -7.345 -31.205 1.00 0.00 C ATOM 614 O ASP A 63 -5.950 -7.656 -32.284 1.00 0.00 O ATOM 615 CB ASP A 63 -6.761 -9.697 -30.460 1.00 0.00 C ATOM 616 CG ASP A 63 -5.547 -10.459 -30.998 1.00 0.00 C ATOM 617 OD1 ASP A 63 -4.894 -9.898 -31.861 1.00 0.00 O ATOM 618 OD2 ASP A 63 -5.341 -11.560 -30.514 1.00 0.00 O ATOM 0 H ASP A 63 -8.160 -8.238 -28.919 1.00 0.00 H new ATOM 0 HA ASP A 63 -5.294 -8.300 -29.649 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -7.202 -10.237 -29.622 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -7.529 -9.622 -31.230 1.00 0.00 H new ATOM 620 N THR A 64 -7.002 -6.202 -30.986 1.00 0.00 N ATOM 621 CA THR A 64 -7.131 -5.223 -32.090 1.00 0.00 C ATOM 622 C THR A 64 -7.192 -3.799 -31.556 1.00 0.00 C ATOM 623 O THR A 64 -6.267 -3.030 -31.728 1.00 0.00 O ATOM 624 CB THR A 64 -8.406 -5.524 -32.853 1.00 0.00 C ATOM 625 OG1 THR A 64 -8.390 -6.920 -33.073 1.00 0.00 O ATOM 626 CG2 THR A 64 -8.359 -4.906 -34.258 1.00 0.00 C ATOM 0 H THR A 64 -7.399 -5.910 -30.093 1.00 0.00 H new ATOM 0 HA THR A 64 -6.260 -5.306 -32.740 1.00 0.00 H new ATOM 0 HB THR A 64 -9.266 -5.147 -32.300 1.00 0.00 H new ATOM 0 HG1 THR A 64 -9.196 -7.183 -33.565 1.00 0.00 H new ATOM 0 HG21 THR A 64 -9.284 -5.135 -34.787 1.00 0.00 H new ATOM 0 HG22 THR A 64 -8.245 -3.825 -34.176 1.00 0.00 H new ATOM 0 HG23 THR A 64 -7.514 -5.319 -34.809 1.00 0.00 H new ATOM 629 N ASN A 65 -8.293 -3.480 -30.918 1.00 0.00 N ATOM 630 CA ASN A 65 -8.461 -2.115 -30.353 1.00 0.00 C ATOM 631 C ASN A 65 -8.818 -2.200 -28.881 1.00 0.00 C ATOM 632 O ASN A 65 -9.960 -2.037 -28.500 1.00 0.00 O ATOM 633 CB ASN A 65 -9.605 -1.416 -31.102 1.00 0.00 C ATOM 634 CG ASN A 65 -9.103 -0.944 -32.470 1.00 0.00 C ATOM 635 OD1 ASN A 65 -7.834 -1.058 -32.757 1.00 0.00 O flip ATOM 636 ND2 ASN A 65 -9.861 -0.467 -33.290 1.00 0.00 N flip ATOM 0 H ASN A 65 -9.080 -4.111 -30.767 1.00 0.00 H new ATOM 0 HA ASN A 65 -7.530 -1.558 -30.463 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -10.445 -2.100 -31.226 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -9.969 -0.567 -30.523 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -10.854 -0.374 -33.074 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -9.505 -0.159 -34.195 1.00 0.00 H new ATOM 640 N GLU A 66 -7.829 -2.458 -28.082 1.00 0.00 N ATOM 641 CA GLU A 66 -8.071 -2.563 -26.625 1.00 0.00 C ATOM 642 C GLU A 66 -8.737 -1.300 -26.122 1.00 0.00 C ATOM 643 O GLU A 66 -9.163 -1.220 -24.987 1.00 0.00 O ATOM 644 CB GLU A 66 -6.720 -2.734 -25.919 1.00 0.00 C ATOM 645 CG GLU A 66 -5.639 -2.042 -26.743 1.00 0.00 C ATOM 646 CD GLU A 66 -6.123 -0.643 -27.128 1.00 0.00 C ATOM 647 OE1 GLU A 66 -6.069 0.209 -26.256 1.00 0.00 O ATOM 648 OE2 GLU A 66 -6.521 -0.506 -28.274 1.00 0.00 O ATOM 0 H GLU A 66 -6.863 -2.601 -28.375 1.00 0.00 H new ATOM 0 HA GLU A 66 -8.719 -3.415 -26.420 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -6.762 -2.306 -24.917 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -6.486 -3.792 -25.804 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -4.714 -1.976 -26.170 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -5.418 -2.623 -27.638 1.00 0.00 H new ATOM 650 N ALA A 67 -8.811 -0.337 -26.986 1.00 0.00 N ATOM 651 CA ALA A 67 -9.437 0.939 -26.611 1.00 0.00 C ATOM 652 C ALA A 67 -10.901 0.727 -26.281 1.00 0.00 C ATOM 653 O ALA A 67 -11.476 1.438 -25.481 1.00 0.00 O ATOM 654 CB ALA A 67 -9.328 1.874 -27.816 1.00 0.00 C ATOM 0 H ALA A 67 -8.460 -0.384 -27.943 1.00 0.00 H new ATOM 0 HA ALA A 67 -8.940 1.359 -25.736 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -9.784 2.834 -27.574 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -8.278 2.024 -28.067 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -9.845 1.432 -28.668 1.00 0.00 H new ATOM 656 N ALA A 68 -11.474 -0.256 -26.908 1.00 0.00 N ATOM 657 CA ALA A 68 -12.897 -0.553 -26.661 1.00 0.00 C ATOM 658 C ALA A 68 -13.056 -1.375 -25.386 1.00 0.00 C ATOM 659 O ALA A 68 -13.694 -0.949 -24.443 1.00 0.00 O ATOM 660 CB ALA A 68 -13.414 -1.366 -27.853 1.00 0.00 C ATOM 0 H ALA A 68 -11.012 -0.866 -27.583 1.00 0.00 H new ATOM 0 HA ALA A 68 -13.457 0.375 -26.544 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -14.467 -1.603 -27.702 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -13.301 -0.783 -28.767 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -12.842 -2.290 -27.938 1.00 0.00 H new ATOM 662 N TYR A 69 -12.470 -2.541 -25.382 1.00 0.00 N ATOM 663 CA TYR A 69 -12.570 -3.412 -24.181 1.00 0.00 C ATOM 664 C TYR A 69 -12.289 -2.612 -22.909 1.00 0.00 C ATOM 665 O TYR A 69 -12.872 -2.863 -21.872 1.00 0.00 O ATOM 666 CB TYR A 69 -11.516 -4.522 -24.311 1.00 0.00 C ATOM 667 CG TYR A 69 -11.125 -5.035 -22.918 1.00 0.00 C ATOM 668 CD1 TYR A 69 -12.045 -5.699 -22.132 1.00 0.00 C ATOM 669 CD2 TYR A 69 -9.847 -4.839 -22.431 1.00 0.00 C ATOM 670 CE1 TYR A 69 -11.693 -6.157 -20.879 1.00 0.00 C ATOM 671 CE2 TYR A 69 -9.497 -5.298 -21.177 1.00 0.00 C ATOM 672 CZ TYR A 69 -10.419 -5.961 -20.392 1.00 0.00 C ATOM 673 OH TYR A 69 -10.070 -6.422 -19.139 1.00 0.00 O ATOM 0 H TYR A 69 -11.929 -2.926 -26.156 1.00 0.00 H new ATOM 0 HA TYR A 69 -13.576 -3.827 -24.116 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -11.910 -5.341 -24.913 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -10.636 -4.141 -24.828 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -13.047 -5.861 -22.500 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -9.116 -4.323 -23.036 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -12.423 -6.674 -20.274 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -8.495 -5.137 -20.808 1.00 0.00 H new ATOM 0 HH TYR A 69 -9.943 -5.661 -18.534 1.00 0.00 H new ATOM 676 N LYS A 70 -11.395 -1.660 -23.013 1.00 0.00 N ATOM 677 CA LYS A 70 -11.061 -0.836 -21.819 1.00 0.00 C ATOM 678 C LYS A 70 -12.137 0.213 -21.550 1.00 0.00 C ATOM 679 O LYS A 70 -12.519 0.440 -20.419 1.00 0.00 O ATOM 680 CB LYS A 70 -9.731 -0.108 -22.080 1.00 0.00 C ATOM 681 CG LYS A 70 -9.559 1.000 -21.034 1.00 0.00 C ATOM 682 CD LYS A 70 -8.112 1.503 -21.058 1.00 0.00 C ATOM 683 CE LYS A 70 -8.035 2.853 -20.334 1.00 0.00 C ATOM 684 NZ LYS A 70 -7.536 3.913 -21.255 1.00 0.00 N ATOM 0 H LYS A 70 -10.888 -1.422 -23.866 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.991 -1.496 -20.954 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -8.899 -0.811 -22.025 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -9.724 0.317 -23.084 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -10.245 1.821 -21.242 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -9.807 0.621 -20.043 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -7.455 0.780 -20.575 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -7.768 1.609 -22.087 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -9.020 3.126 -19.956 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -7.374 2.772 -19.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -7.490 4.820 -20.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -6.587 3.658 -21.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -8.182 4.001 -22.065 1.00 0.00 H new ATOM 689 N ALA A 71 -12.600 0.837 -22.596 1.00 0.00 N ATOM 690 CA ALA A 71 -13.651 1.878 -22.424 1.00 0.00 C ATOM 691 C ALA A 71 -14.869 1.322 -21.694 1.00 0.00 C ATOM 692 O ALA A 71 -15.305 1.875 -20.705 1.00 0.00 O ATOM 693 CB ALA A 71 -14.088 2.357 -23.818 1.00 0.00 C ATOM 0 H ALA A 71 -12.299 0.673 -23.557 1.00 0.00 H new ATOM 0 HA ALA A 71 -13.241 2.696 -21.833 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -14.859 3.121 -23.715 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -13.230 2.775 -24.344 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -14.486 1.515 -24.384 1.00 0.00 H new ATOM 695 N ARG A 72 -15.397 0.240 -22.191 1.00 0.00 N ATOM 696 CA ARG A 72 -16.587 -0.355 -21.531 1.00 0.00 C ATOM 697 C ARG A 72 -16.219 -0.981 -20.186 1.00 0.00 C ATOM 698 O ARG A 72 -16.999 -0.967 -19.265 1.00 0.00 O ATOM 699 CB ARG A 72 -17.154 -1.447 -22.453 1.00 0.00 C ATOM 700 CG ARG A 72 -16.178 -2.624 -22.506 1.00 0.00 C ATOM 701 CD ARG A 72 -16.698 -3.742 -21.599 1.00 0.00 C ATOM 702 NE ARG A 72 -15.813 -4.931 -21.729 1.00 0.00 N ATOM 703 CZ ARG A 72 -15.935 -5.911 -20.879 1.00 0.00 C ATOM 704 NH1 ARG A 72 -16.785 -6.867 -21.136 1.00 0.00 N ATOM 705 NH2 ARG A 72 -15.209 -5.900 -19.796 1.00 0.00 N ATOM 0 H ARG A 72 -15.059 -0.253 -23.018 1.00 0.00 H new ATOM 0 HA ARG A 72 -17.322 0.430 -21.352 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -18.124 -1.781 -22.085 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -17.313 -1.047 -23.454 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -16.078 -2.985 -23.530 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -15.187 -2.306 -22.182 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -16.723 -3.404 -20.563 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -17.720 -4.003 -21.873 1.00 0.00 H new ATOM 0 HE ARG A 72 -15.119 -4.978 -22.475 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -17.341 -6.839 -21.991 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -16.894 -7.642 -20.482 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -14.559 -5.133 -19.626 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -15.291 -6.659 -19.119 1.00 0.00 H new ATOM 712 N TYR A 73 -15.033 -1.504 -20.096 1.00 0.00 N ATOM 713 CA TYR A 73 -14.604 -2.133 -18.821 1.00 0.00 C ATOM 714 C TYR A 73 -14.786 -1.186 -17.636 1.00 0.00 C ATOM 715 O TYR A 73 -15.491 -1.491 -16.693 1.00 0.00 O ATOM 716 CB TYR A 73 -13.113 -2.493 -18.942 1.00 0.00 C ATOM 717 CG TYR A 73 -12.495 -2.577 -17.548 1.00 0.00 C ATOM 718 CD1 TYR A 73 -13.110 -3.306 -16.558 1.00 0.00 C ATOM 719 CD2 TYR A 73 -11.314 -1.921 -17.263 1.00 0.00 C ATOM 720 CE1 TYR A 73 -12.558 -3.384 -15.300 1.00 0.00 C ATOM 721 CE2 TYR A 73 -10.760 -1.996 -16.002 1.00 0.00 C ATOM 722 CZ TYR A 73 -11.379 -2.730 -15.009 1.00 0.00 C ATOM 723 OH TYR A 73 -10.830 -2.806 -13.745 1.00 0.00 O ATOM 0 H TYR A 73 -14.343 -1.524 -20.847 1.00 0.00 H new ATOM 0 HA TYR A 73 -15.217 -3.017 -18.645 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -12.999 -3.445 -19.460 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -12.594 -1.742 -19.537 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -14.035 -3.822 -16.770 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -10.821 -1.345 -18.032 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -13.052 -3.962 -14.534 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -9.837 -1.478 -15.790 1.00 0.00 H new ATOM 0 HH TYR A 73 -11.388 -2.304 -13.115 1.00 0.00 H new ATOM 726 N ARG A 74 -14.148 -0.055 -17.708 1.00 0.00 N ATOM 727 CA ARG A 74 -14.264 0.928 -16.598 1.00 0.00 C ATOM 728 C ARG A 74 -15.653 1.566 -16.531 1.00 0.00 C ATOM 729 O ARG A 74 -16.283 1.580 -15.493 1.00 0.00 O ATOM 730 CB ARG A 74 -13.235 2.044 -16.836 1.00 0.00 C ATOM 731 CG ARG A 74 -13.226 2.972 -15.622 1.00 0.00 C ATOM 732 CD ARG A 74 -11.930 3.785 -15.611 1.00 0.00 C ATOM 733 NE ARG A 74 -11.570 4.156 -17.009 1.00 0.00 N ATOM 734 CZ ARG A 74 -10.653 5.064 -17.212 1.00 0.00 C ATOM 735 NH1 ARG A 74 -10.965 6.321 -17.051 1.00 0.00 N ATOM 736 NH2 ARG A 74 -9.457 4.684 -17.566 1.00 0.00 N ATOM 0 H ARG A 74 -13.552 0.232 -18.485 1.00 0.00 H new ATOM 0 HA ARG A 74 -14.089 0.401 -15.660 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -12.244 1.617 -16.992 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -13.487 2.604 -17.737 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -14.087 3.640 -15.655 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -13.310 2.389 -14.705 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -12.055 4.682 -15.005 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -11.126 3.204 -15.158 1.00 0.00 H new ATOM 0 HE ARG A 74 -12.034 3.706 -17.798 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -11.911 6.580 -16.771 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -10.263 7.045 -17.205 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -9.250 3.692 -17.680 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -8.728 5.379 -17.729 1.00 0.00 H new ATOM 743 N ILE A 75 -16.099 2.074 -17.639 1.00 0.00 N ATOM 744 CA ILE A 75 -17.442 2.721 -17.669 1.00 0.00 C ATOM 745 C ILE A 75 -18.550 1.788 -17.167 1.00 0.00 C ATOM 746 O ILE A 75 -19.342 2.162 -16.325 1.00 0.00 O ATOM 747 CB ILE A 75 -17.745 3.113 -19.114 1.00 0.00 C ATOM 748 CG1 ILE A 75 -16.699 4.110 -19.608 1.00 0.00 C ATOM 749 CG2 ILE A 75 -19.127 3.786 -19.156 1.00 0.00 C ATOM 750 CD1 ILE A 75 -16.813 4.250 -21.129 1.00 0.00 C ATOM 0 H ILE A 75 -15.596 2.072 -18.526 1.00 0.00 H new ATOM 0 HA ILE A 75 -17.420 3.588 -17.009 1.00 0.00 H new ATOM 0 HB ILE A 75 -17.729 2.226 -19.747 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -16.848 5.078 -19.130 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -15.699 3.771 -19.336 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -19.361 4.073 -20.181 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -19.882 3.089 -18.793 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -19.119 4.674 -18.523 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -16.068 4.961 -21.486 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -16.643 3.281 -21.597 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -17.809 4.608 -21.388 1.00 0.00 H new ATOM 752 N ILE A 76 -18.586 0.601 -17.693 1.00 0.00 N ATOM 753 CA ILE A 76 -19.634 -0.370 -17.263 1.00 0.00 C ATOM 754 C ILE A 76 -19.219 -1.127 -16.001 1.00 0.00 C ATOM 755 O ILE A 76 -20.016 -1.833 -15.417 1.00 0.00 O ATOM 756 CB ILE A 76 -19.856 -1.363 -18.400 1.00 0.00 C ATOM 757 CG1 ILE A 76 -20.164 -0.584 -19.670 1.00 0.00 C ATOM 758 CG2 ILE A 76 -21.070 -2.250 -18.053 1.00 0.00 C ATOM 759 CD1 ILE A 76 -20.517 -1.551 -20.785 1.00 0.00 C ATOM 0 H ILE A 76 -17.938 0.257 -18.402 1.00 0.00 H new ATOM 0 HA ILE A 76 -20.549 0.177 -17.033 1.00 0.00 H new ATOM 0 HB ILE A 76 -18.969 -1.981 -18.542 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -20.991 0.104 -19.496 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -19.303 0.019 -19.957 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -21.240 -2.965 -18.858 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -20.874 -2.788 -17.125 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -21.954 -1.625 -17.930 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -20.738 -0.993 -21.695 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -19.676 -2.221 -20.965 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -21.391 -2.135 -20.497 1.00 0.00 H new ATOM 761 N TYR A 77 -17.983 -0.933 -15.591 1.00 0.00 N ATOM 762 CA TYR A 77 -17.467 -1.630 -14.361 1.00 0.00 C ATOM 763 C TYR A 77 -18.557 -1.863 -13.335 1.00 0.00 C ATOM 764 O TYR A 77 -18.691 -2.941 -12.809 1.00 0.00 O ATOM 765 CB TYR A 77 -16.404 -0.731 -13.720 1.00 0.00 C ATOM 766 CG TYR A 77 -15.704 -1.474 -12.567 1.00 0.00 C ATOM 767 CD1 TYR A 77 -16.186 -1.395 -11.268 1.00 0.00 C ATOM 768 CD2 TYR A 77 -14.544 -2.177 -12.799 1.00 0.00 C ATOM 769 CE1 TYR A 77 -15.507 -2.005 -10.232 1.00 0.00 C ATOM 770 CE2 TYR A 77 -13.869 -2.784 -11.763 1.00 0.00 C ATOM 771 CZ TYR A 77 -14.343 -2.702 -10.473 1.00 0.00 C ATOM 772 OH TYR A 77 -13.653 -3.290 -9.436 1.00 0.00 O ATOM 0 H TYR A 77 -17.309 -0.323 -16.054 1.00 0.00 H new ATOM 0 HA TYR A 77 -17.068 -2.599 -14.662 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -15.670 -0.433 -14.469 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -16.867 0.182 -13.346 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -17.098 -0.853 -11.066 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -14.158 -2.254 -13.805 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -15.891 -1.935 -9.225 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -12.959 -3.330 -11.965 1.00 0.00 H new ATOM 0 HH TYR A 77 -13.011 -2.649 -9.065 1.00 0.00 H new ATOM 775 N SER A 78 -19.321 -0.866 -13.071 1.00 0.00 N ATOM 776 CA SER A 78 -20.392 -1.052 -12.077 1.00 0.00 C ATOM 777 C SER A 78 -21.200 -2.295 -12.393 1.00 0.00 C ATOM 778 O SER A 78 -21.399 -3.138 -11.543 1.00 0.00 O ATOM 779 CB SER A 78 -21.315 0.173 -12.109 1.00 0.00 C ATOM 780 OG SER A 78 -21.409 0.501 -13.488 1.00 0.00 O ATOM 0 H SER A 78 -19.257 0.061 -13.492 1.00 0.00 H new ATOM 0 HA SER A 78 -19.947 -1.167 -11.089 1.00 0.00 H new ATOM 0 HB2 SER A 78 -22.293 -0.054 -11.686 1.00 0.00 H new ATOM 0 HB3 SER A 78 -20.901 0.999 -11.530 1.00 0.00 H new ATOM 0 HG SER A 78 -21.990 1.282 -13.600 1.00 0.00 H new ATOM 783 N ASN A 79 -21.652 -2.396 -13.604 1.00 0.00 N ATOM 784 CA ASN A 79 -22.445 -3.589 -13.969 1.00 0.00 C ATOM 785 C ASN A 79 -21.543 -4.809 -14.124 1.00 0.00 C ATOM 786 O ASN A 79 -22.018 -5.918 -14.220 1.00 0.00 O ATOM 787 CB ASN A 79 -23.158 -3.318 -15.301 1.00 0.00 C ATOM 788 CG ASN A 79 -24.389 -2.448 -15.046 1.00 0.00 C ATOM 789 OD1 ASN A 79 -25.488 -2.939 -14.889 1.00 0.00 O ATOM 790 ND2 ASN A 79 -24.245 -1.153 -14.997 1.00 0.00 N ATOM 0 H ASN A 79 -21.509 -1.713 -14.348 1.00 0.00 H new ATOM 0 HA ASN A 79 -23.170 -3.790 -13.180 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -22.482 -2.817 -15.994 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -23.453 -4.258 -15.767 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -25.054 -0.556 -14.827 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -23.323 -0.737 -15.128 1.00 0.00 H new ATOM 794 N VAL A 80 -20.252 -4.589 -14.153 1.00 0.00 N ATOM 795 CA VAL A 80 -19.332 -5.748 -14.299 1.00 0.00 C ATOM 796 C VAL A 80 -19.180 -6.461 -12.965 1.00 0.00 C ATOM 797 O VAL A 80 -19.196 -7.675 -12.905 1.00 0.00 O ATOM 798 CB VAL A 80 -17.949 -5.256 -14.749 1.00 0.00 C ATOM 799 CG1 VAL A 80 -17.027 -6.462 -14.917 1.00 0.00 C ATOM 800 CG2 VAL A 80 -18.072 -4.532 -16.090 1.00 0.00 C ATOM 0 H VAL A 80 -19.806 -3.674 -14.083 1.00 0.00 H new ATOM 0 HA VAL A 80 -19.746 -6.432 -15.039 1.00 0.00 H new ATOM 0 HB VAL A 80 -17.543 -4.572 -14.003 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -16.041 -6.125 -15.237 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -16.940 -6.989 -13.967 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -17.441 -7.135 -15.668 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -17.089 -4.184 -16.407 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -18.473 -5.216 -16.838 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -18.742 -3.679 -15.983 1.00 0.00 H new ATOM 802 N ILE A 81 -19.030 -5.695 -11.907 1.00 0.00 N ATOM 803 CA ILE A 81 -18.879 -6.336 -10.580 1.00 0.00 C ATOM 804 C ILE A 81 -20.230 -6.872 -10.135 1.00 0.00 C ATOM 805 O ILE A 81 -20.327 -7.636 -9.194 1.00 0.00 O ATOM 806 CB ILE A 81 -18.364 -5.287 -9.580 1.00 0.00 C ATOM 807 CG1 ILE A 81 -16.862 -5.102 -9.764 1.00 0.00 C ATOM 808 CG2 ILE A 81 -18.600 -5.792 -8.144 1.00 0.00 C ATOM 809 CD1 ILE A 81 -16.528 -5.046 -11.256 1.00 0.00 C ATOM 0 H ILE A 81 -19.007 -4.675 -11.913 1.00 0.00 H new ATOM 0 HA ILE A 81 -18.169 -7.161 -10.631 1.00 0.00 H new ATOM 0 HB ILE A 81 -18.890 -4.348 -9.751 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -16.536 -4.185 -9.274 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -16.324 -5.924 -9.292 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -18.236 -5.050 -7.433 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -19.666 -5.953 -7.986 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -18.065 -6.730 -7.996 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -15.454 -4.914 -11.384 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -16.838 -5.975 -11.733 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -17.054 -4.209 -11.715 1.00 0.00 H new ATOM 811 N SER A 82 -21.256 -6.449 -10.834 1.00 0.00 N ATOM 812 CA SER A 82 -22.622 -6.908 -10.496 1.00 0.00 C ATOM 813 C SER A 82 -23.003 -8.091 -11.385 1.00 0.00 C ATOM 814 O SER A 82 -23.213 -9.190 -10.911 1.00 0.00 O ATOM 815 CB SER A 82 -23.606 -5.752 -10.753 1.00 0.00 C ATOM 816 OG SER A 82 -24.820 -6.189 -10.159 1.00 0.00 O ATOM 0 H SER A 82 -21.197 -5.805 -11.623 1.00 0.00 H new ATOM 0 HA SER A 82 -22.659 -7.215 -9.451 1.00 0.00 H new ATOM 0 HB2 SER A 82 -23.255 -4.823 -10.304 1.00 0.00 H new ATOM 0 HB3 SER A 82 -23.730 -5.564 -11.820 1.00 0.00 H new ATOM 0 HG SER A 82 -25.508 -5.501 -10.278 1.00 0.00 H new ATOM 819 N LYS A 83 -23.079 -7.832 -12.667 1.00 0.00 N ATOM 820 CA LYS A 83 -23.440 -8.910 -13.630 1.00 0.00 C ATOM 821 C LYS A 83 -22.613 -8.782 -14.912 1.00 0.00 C ATOM 822 O LYS A 83 -22.771 -7.840 -15.661 1.00 0.00 O ATOM 823 CB LYS A 83 -24.928 -8.764 -13.988 1.00 0.00 C ATOM 824 CG LYS A 83 -25.711 -9.917 -13.360 1.00 0.00 C ATOM 825 CD LYS A 83 -27.101 -9.979 -13.994 1.00 0.00 C ATOM 826 CE LYS A 83 -27.969 -10.968 -13.211 1.00 0.00 C ATOM 827 NZ LYS A 83 -27.187 -12.190 -12.862 1.00 0.00 N ATOM 0 H LYS A 83 -22.906 -6.918 -13.086 1.00 0.00 H new ATOM 0 HA LYS A 83 -23.241 -9.880 -13.174 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -25.310 -7.809 -13.626 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -25.056 -8.768 -15.070 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -25.184 -10.858 -13.515 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -25.795 -9.773 -12.283 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -27.560 -8.991 -13.989 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -27.025 -10.290 -15.036 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -28.339 -10.495 -12.302 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -28.841 -11.244 -13.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -27.840 -12.975 -12.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -26.570 -12.447 -13.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -26.605 -12.001 -12.021 1.00 0.00 H new ATOM 832 N ASN A 84 -21.753 -9.737 -15.145 1.00 0.00 N ATOM 833 CA ASN A 84 -20.913 -9.681 -16.371 1.00 0.00 C ATOM 834 C ASN A 84 -21.769 -9.681 -17.634 1.00 0.00 C ATOM 835 O ASN A 84 -22.957 -9.932 -17.585 1.00 0.00 O ATOM 836 CB ASN A 84 -20.009 -10.921 -16.395 1.00 0.00 C ATOM 837 CG ASN A 84 -20.876 -12.175 -16.302 1.00 0.00 C ATOM 838 OD1 ASN A 84 -21.232 -12.610 -15.126 1.00 0.00 O flip ATOM 839 ND2 ASN A 84 -21.240 -12.768 -17.298 1.00 0.00 N flip ATOM 0 H ASN A 84 -21.598 -10.546 -14.544 1.00 0.00 H new ATOM 0 HA ASN A 84 -20.329 -8.761 -16.350 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -19.420 -10.939 -17.312 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -19.305 -10.889 -15.564 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -20.964 -12.432 -18.221 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -21.821 -13.602 -17.211 1.00 0.00 H new ATOM 843 N ASN A 85 -21.144 -9.391 -18.745 1.00 0.00 N ATOM 844 CA ASN A 85 -21.895 -9.366 -20.025 1.00 0.00 C ATOM 845 C ASN A 85 -23.058 -8.393 -19.961 1.00 0.00 C ATOM 846 O ASN A 85 -24.212 -8.776 -19.986 1.00 0.00 O ATOM 847 CB ASN A 85 -22.433 -10.782 -20.289 1.00 0.00 C ATOM 848 CG ASN A 85 -22.738 -10.947 -21.778 1.00 0.00 C ATOM 849 OD1 ASN A 85 -23.399 -10.127 -22.385 1.00 0.00 O ATOM 850 ND2 ASN A 85 -22.276 -11.995 -22.404 1.00 0.00 N ATOM 0 H ASN A 85 -20.150 -9.172 -18.817 1.00 0.00 H new ATOM 0 HA ASN A 85 -21.229 -9.042 -20.825 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -21.700 -11.525 -19.973 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -23.335 -10.954 -19.702 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -22.470 -12.123 -23.397 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -21.721 -12.686 -21.900 1.00 0.00 H new ATOM 854 N PRO A 86 -22.714 -7.139 -19.873 1.00 0.00 N ATOM 855 CA PRO A 86 -23.697 -6.075 -19.806 1.00 0.00 C ATOM 856 C PRO A 86 -24.440 -5.945 -21.125 1.00 0.00 C ATOM 857 O PRO A 86 -25.650 -5.981 -21.159 1.00 0.00 O ATOM 858 CB PRO A 86 -22.871 -4.794 -19.554 1.00 0.00 C ATOM 859 CG PRO A 86 -21.365 -5.200 -19.589 1.00 0.00 C ATOM 860 CD PRO A 86 -21.311 -6.713 -19.812 1.00 0.00 C ATOM 0 HA PRO A 86 -24.442 -6.261 -19.033 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -23.085 -4.043 -20.315 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -23.128 -4.354 -18.591 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -20.843 -4.674 -20.388 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -20.872 -4.931 -18.655 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -20.784 -6.957 -20.734 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -20.782 -7.213 -19.001 1.00 0.00 H new ATOM 861 N ASP A 87 -23.673 -5.828 -22.190 1.00 0.00 N ATOM 862 CA ASP A 87 -24.268 -5.689 -23.566 1.00 0.00 C ATOM 863 C ASP A 87 -23.282 -4.982 -24.498 1.00 0.00 C ATOM 864 O ASP A 87 -23.663 -4.456 -25.524 1.00 0.00 O ATOM 865 CB ASP A 87 -25.555 -4.829 -23.494 1.00 0.00 C ATOM 866 CG ASP A 87 -25.386 -3.745 -22.429 1.00 0.00 C ATOM 867 OD1 ASP A 87 -24.293 -3.207 -22.375 1.00 0.00 O ATOM 868 OD2 ASP A 87 -26.359 -3.516 -21.730 1.00 0.00 O ATOM 0 H ASP A 87 -22.653 -5.823 -22.165 1.00 0.00 H new ATOM 0 HA ASP A 87 -24.493 -6.686 -23.945 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -25.755 -4.373 -24.464 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -26.412 -5.458 -23.255 1.00 0.00 H new ATOM 870 N LEU A 88 -22.029 -4.985 -24.114 1.00 0.00 N ATOM 871 CA LEU A 88 -20.984 -4.316 -24.957 1.00 0.00 C ATOM 872 C LEU A 88 -21.253 -4.494 -26.454 1.00 0.00 C ATOM 873 O LEU A 88 -20.859 -3.668 -27.255 1.00 0.00 O ATOM 874 CB LEU A 88 -19.612 -4.936 -24.626 1.00 0.00 C ATOM 875 CG LEU A 88 -18.544 -4.286 -25.508 1.00 0.00 C ATOM 876 CD1 LEU A 88 -18.585 -2.767 -25.313 1.00 0.00 C ATOM 877 CD2 LEU A 88 -17.166 -4.811 -25.096 1.00 0.00 C ATOM 0 H LEU A 88 -21.684 -5.419 -23.258 1.00 0.00 H new ATOM 0 HA LEU A 88 -21.004 -3.249 -24.735 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -19.374 -4.783 -23.573 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -19.635 -6.013 -24.795 1.00 0.00 H new ATOM 0 HG LEU A 88 -18.732 -4.527 -26.554 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -17.826 -2.299 -25.940 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -19.569 -2.391 -25.593 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -18.390 -2.529 -24.267 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -16.400 -4.352 -25.721 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -16.979 -4.562 -24.051 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -17.136 -5.893 -25.222 1.00 0.00 H new ATOM 879 N LYS A 89 -21.919 -5.560 -26.807 1.00 0.00 N ATOM 880 CA LYS A 89 -22.210 -5.786 -28.250 1.00 0.00 C ATOM 881 C LYS A 89 -22.744 -4.514 -28.903 1.00 0.00 C ATOM 882 O LYS A 89 -22.771 -4.398 -30.112 1.00 0.00 O ATOM 883 CB LYS A 89 -23.280 -6.886 -28.372 1.00 0.00 C ATOM 884 CG LYS A 89 -22.720 -8.199 -27.825 1.00 0.00 C ATOM 885 CD LYS A 89 -23.620 -9.355 -28.277 1.00 0.00 C ATOM 886 CE LYS A 89 -25.084 -8.945 -28.123 1.00 0.00 C ATOM 887 NZ LYS A 89 -25.977 -10.120 -28.332 1.00 0.00 N ATOM 0 H LYS A 89 -22.269 -6.274 -26.169 1.00 0.00 H new ATOM 0 HA LYS A 89 -21.288 -6.080 -28.751 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -24.175 -6.601 -27.820 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -23.574 -7.009 -29.414 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -21.702 -8.352 -28.184 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -22.672 -8.163 -26.737 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -23.409 -9.611 -29.315 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -23.415 -10.245 -27.682 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -25.249 -8.527 -27.130 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -25.327 -8.163 -28.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -26.969 -9.826 -28.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -25.831 -10.501 -29.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -25.755 -10.854 -27.629 1.00 0.00 H new ATOM 892 N HIS A 90 -23.159 -3.586 -28.089 1.00 0.00 N ATOM 893 CA HIS A 90 -23.698 -2.314 -28.636 1.00 0.00 C ATOM 894 C HIS A 90 -22.801 -1.753 -29.735 1.00 0.00 C ATOM 895 O HIS A 90 -23.279 -1.296 -30.754 1.00 0.00 O ATOM 896 CB HIS A 90 -23.770 -1.295 -27.488 1.00 0.00 C ATOM 897 CG HIS A 90 -24.718 -0.157 -27.873 1.00 0.00 C ATOM 898 ND1 HIS A 90 -25.789 -0.297 -28.501 1.00 0.00 N ATOM 899 CD2 HIS A 90 -24.614 1.198 -27.622 1.00 0.00 C ATOM 900 CE1 HIS A 90 -26.376 0.815 -28.675 1.00 0.00 C ATOM 901 NE2 HIS A 90 -25.698 1.834 -28.147 1.00 0.00 N ATOM 0 H HIS A 90 -23.148 -3.654 -27.071 1.00 0.00 H new ATOM 0 HA HIS A 90 -24.682 -2.504 -29.066 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -24.120 -1.781 -26.577 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -22.777 -0.899 -27.276 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -23.803 1.676 -27.094 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -27.318 0.923 -29.192 1.00 0.00 H new ATOM 0 HE2 HIS A 90 -25.930 2.827 -28.138 1.00 0.00 H new ATOM 905 N LYS A 91 -21.518 -1.797 -29.512 1.00 0.00 N ATOM 906 CA LYS A 91 -20.585 -1.267 -30.540 1.00 0.00 C ATOM 907 C LYS A 91 -20.763 -1.986 -31.872 1.00 0.00 C ATOM 908 O LYS A 91 -20.591 -1.398 -32.923 1.00 0.00 O ATOM 909 CB LYS A 91 -19.142 -1.472 -30.049 1.00 0.00 C ATOM 910 CG LYS A 91 -18.882 -2.965 -29.843 1.00 0.00 C ATOM 911 CD LYS A 91 -17.832 -3.143 -28.743 1.00 0.00 C ATOM 912 CE LYS A 91 -16.560 -2.395 -29.141 1.00 0.00 C ATOM 913 NZ LYS A 91 -16.367 -2.447 -30.617 1.00 0.00 N ATOM 0 H LYS A 91 -21.080 -2.173 -28.671 1.00 0.00 H new ATOM 0 HA LYS A 91 -20.798 -0.209 -30.691 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -18.438 -1.066 -30.775 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -18.984 -0.932 -29.115 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -19.806 -3.473 -29.567 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -18.534 -3.418 -30.772 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -18.212 -2.761 -27.795 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -17.616 -4.201 -28.597 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -16.623 -1.358 -28.812 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -15.699 -2.837 -28.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -15.352 -2.384 -30.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -16.746 -3.342 -30.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -16.867 -1.650 -31.061 1.00 0.00 H new ATOM 918 N ILE A 92 -21.104 -3.241 -31.810 1.00 0.00 N ATOM 919 CA ILE A 92 -21.295 -4.006 -33.068 1.00 0.00 C ATOM 920 C ILE A 92 -22.422 -3.404 -33.900 1.00 0.00 C ATOM 921 O ILE A 92 -22.458 -3.559 -35.107 1.00 0.00 O ATOM 922 CB ILE A 92 -21.666 -5.442 -32.707 1.00 0.00 C ATOM 923 CG1 ILE A 92 -20.632 -6.012 -31.751 1.00 0.00 C ATOM 924 CG2 ILE A 92 -21.667 -6.288 -33.993 1.00 0.00 C ATOM 925 CD1 ILE A 92 -21.103 -7.382 -31.266 1.00 0.00 C ATOM 0 H ILE A 92 -21.257 -3.766 -30.949 1.00 0.00 H new ATOM 0 HA ILE A 92 -20.373 -3.973 -33.649 1.00 0.00 H new ATOM 0 HB ILE A 92 -22.649 -5.459 -32.236 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -19.667 -6.101 -32.250 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -20.492 -5.341 -30.904 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -21.931 -7.318 -33.751 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -22.396 -5.882 -34.695 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -20.675 -6.264 -34.445 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -20.366 -7.798 -30.579 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -22.059 -7.277 -30.753 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -21.221 -8.049 -32.120 1.00 0.00 H new ATOM 927 N ALA A 93 -23.322 -2.724 -33.242 1.00 0.00 N ATOM 928 CA ALA A 93 -24.449 -2.109 -33.980 1.00 0.00 C ATOM 929 C ALA A 93 -23.989 -0.865 -34.727 1.00 0.00 C ATOM 930 O ALA A 93 -24.276 -0.698 -35.894 1.00 0.00 O ATOM 931 CB ALA A 93 -25.530 -1.705 -32.963 1.00 0.00 C ATOM 0 H ALA A 93 -23.322 -2.572 -32.233 1.00 0.00 H new ATOM 0 HA ALA A 93 -24.838 -2.827 -34.702 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -26.370 -1.249 -33.487 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -25.873 -2.589 -32.426 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -25.113 -0.990 -32.254 1.00 0.00 H new ATOM 933 N ASN A 94 -23.280 -0.016 -34.041 1.00 0.00 N ATOM 934 CA ASN A 94 -22.791 1.222 -34.696 1.00 0.00 C ATOM 935 C ASN A 94 -21.818 1.966 -33.786 1.00 0.00 C ATOM 936 O ASN A 94 -22.188 2.902 -33.106 1.00 0.00 O ATOM 937 CB ASN A 94 -23.999 2.126 -34.986 1.00 0.00 C ATOM 938 CG ASN A 94 -24.828 2.289 -33.712 1.00 0.00 C ATOM 939 OD1 ASN A 94 -25.158 1.225 -33.027 1.00 0.00 O flip ATOM 940 ND2 ASN A 94 -25.190 3.384 -33.329 1.00 0.00 N flip ATOM 0 H ASN A 94 -23.020 -0.126 -33.061 1.00 0.00 H new ATOM 0 HA ASN A 94 -22.272 0.960 -35.618 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -23.662 3.100 -35.341 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -24.610 1.692 -35.778 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -24.937 4.219 -33.858 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -25.747 3.468 -32.479 1.00 0.00 H new ATOM 944 N GLY A 95 -20.589 1.529 -33.796 1.00 0.00 N ATOM 945 CA GLY A 95 -19.558 2.188 -32.940 1.00 0.00 C ATOM 946 C GLY A 95 -18.773 3.236 -33.742 1.00 0.00 C ATOM 947 O GLY A 95 -17.970 3.960 -33.196 1.00 0.00 O ATOM 0 H GLY A 95 -20.253 0.747 -34.357 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -20.038 2.663 -32.085 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -18.873 1.438 -32.545 1.00 0.00 H new ATOM 949 N ASP A 96 -19.003 3.271 -35.023 1.00 0.00 N ATOM 950 CA ASP A 96 -18.281 4.258 -35.873 1.00 0.00 C ATOM 951 C ASP A 96 -18.457 5.693 -35.359 1.00 0.00 C ATOM 952 O ASP A 96 -17.790 6.598 -35.824 1.00 0.00 O ATOM 953 CB ASP A 96 -18.859 4.171 -37.295 1.00 0.00 C ATOM 954 CG ASP A 96 -19.287 2.729 -37.575 1.00 0.00 C ATOM 955 OD1 ASP A 96 -18.596 1.854 -37.079 1.00 0.00 O ATOM 956 OD2 ASP A 96 -20.280 2.583 -38.269 1.00 0.00 O ATOM 0 H ASP A 96 -19.656 2.663 -35.517 1.00 0.00 H new ATOM 0 HA ASP A 96 -17.217 4.022 -35.852 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -19.712 4.842 -37.396 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -18.114 4.490 -38.024 1.00 0.00 H new ATOM 958 N ILE A 97 -19.347 5.870 -34.407 1.00 0.00 N ATOM 959 CA ILE A 97 -19.584 7.243 -33.846 1.00 0.00 C ATOM 960 C ILE A 97 -19.183 7.322 -32.367 1.00 0.00 C ATOM 961 O ILE A 97 -19.365 8.340 -31.730 1.00 0.00 O ATOM 962 CB ILE A 97 -21.087 7.542 -33.946 1.00 0.00 C ATOM 963 CG1 ILE A 97 -21.531 7.553 -35.406 1.00 0.00 C ATOM 964 CG2 ILE A 97 -21.352 8.934 -33.344 1.00 0.00 C ATOM 965 CD1 ILE A 97 -23.049 7.769 -35.469 1.00 0.00 C ATOM 0 H ILE A 97 -19.916 5.129 -33.997 1.00 0.00 H new ATOM 0 HA ILE A 97 -18.985 7.959 -34.409 1.00 0.00 H new ATOM 0 HB ILE A 97 -21.641 6.772 -33.408 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -21.016 8.345 -35.949 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -21.265 6.612 -35.887 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -22.416 9.161 -33.408 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -21.041 8.944 -32.299 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -20.787 9.684 -33.898 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -23.372 7.778 -36.510 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -23.554 6.961 -34.939 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -23.301 8.722 -35.003 1.00 0.00 H new ATOM 967 N THR A 98 -18.637 6.255 -31.851 1.00 0.00 N ATOM 968 CA THR A 98 -18.227 6.264 -30.417 1.00 0.00 C ATOM 969 C THR A 98 -16.962 7.104 -30.156 1.00 0.00 C ATOM 970 O THR A 98 -16.911 7.868 -29.214 1.00 0.00 O ATOM 971 CB THR A 98 -17.975 4.812 -29.967 1.00 0.00 C ATOM 972 OG1 THR A 98 -19.025 4.518 -29.065 1.00 0.00 O ATOM 973 CG2 THR A 98 -16.693 4.701 -29.109 1.00 0.00 C ATOM 0 H THR A 98 -18.458 5.386 -32.354 1.00 0.00 H new ATOM 0 HA THR A 98 -19.035 6.723 -29.848 1.00 0.00 H new ATOM 0 HB THR A 98 -17.900 4.167 -30.843 1.00 0.00 H new ATOM 0 HG1 THR A 98 -18.927 3.600 -28.737 1.00 0.00 H new ATOM 0 HG21 THR A 98 -16.545 3.664 -28.808 1.00 0.00 H new ATOM 0 HG22 THR A 98 -15.835 5.036 -29.692 1.00 0.00 H new ATOM 0 HG23 THR A 98 -16.794 5.325 -28.221 1.00 0.00 H new ATOM 976 N PRO A 99 -15.962 6.939 -30.995 1.00 0.00 N ATOM 977 CA PRO A 99 -14.706 7.680 -30.845 1.00 0.00 C ATOM 978 C PRO A 99 -14.850 9.160 -31.216 1.00 0.00 C ATOM 979 O PRO A 99 -14.065 9.982 -30.786 1.00 0.00 O ATOM 980 CB PRO A 99 -13.732 6.997 -31.831 1.00 0.00 C ATOM 981 CG PRO A 99 -14.549 5.929 -32.626 1.00 0.00 C ATOM 982 CD PRO A 99 -16.005 6.011 -32.129 1.00 0.00 C ATOM 0 HA PRO A 99 -14.368 7.661 -29.809 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -13.295 7.730 -32.509 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -12.907 6.528 -31.294 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -14.496 6.123 -33.697 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -14.141 4.931 -32.462 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -16.670 6.374 -32.912 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -16.375 5.032 -31.825 1.00 0.00 H new ATOM 983 N GLU A 100 -15.846 9.475 -32.000 1.00 0.00 N ATOM 984 CA GLU A 100 -16.035 10.900 -32.396 1.00 0.00 C ATOM 985 C GLU A 100 -16.978 11.638 -31.445 1.00 0.00 C ATOM 986 O GLU A 100 -17.113 12.840 -31.517 1.00 0.00 O ATOM 987 CB GLU A 100 -16.641 10.931 -33.806 1.00 0.00 C ATOM 988 CG GLU A 100 -15.793 10.060 -34.734 1.00 0.00 C ATOM 989 CD GLU A 100 -15.758 10.687 -36.128 1.00 0.00 C ATOM 990 OE1 GLU A 100 -15.464 11.871 -36.183 1.00 0.00 O ATOM 991 OE2 GLU A 100 -16.029 9.950 -37.061 1.00 0.00 O ATOM 0 H GLU A 100 -16.528 8.818 -32.379 1.00 0.00 H new ATOM 0 HA GLU A 100 -15.065 11.396 -32.362 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -17.668 10.566 -33.782 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -16.675 11.955 -34.178 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -14.781 9.967 -34.340 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -16.208 9.054 -34.786 1.00 0.00 H new ATOM 993 N PHE A 101 -17.614 10.915 -30.576 1.00 0.00 N ATOM 994 CA PHE A 101 -18.546 11.580 -29.627 1.00 0.00 C ATOM 995 C PHE A 101 -17.847 12.668 -28.812 1.00 0.00 C ATOM 996 O PHE A 101 -18.258 13.811 -28.816 1.00 0.00 O ATOM 997 CB PHE A 101 -19.092 10.514 -28.662 1.00 0.00 C ATOM 998 CG PHE A 101 -20.595 10.359 -28.889 1.00 0.00 C ATOM 999 CD1 PHE A 101 -21.439 11.449 -28.764 1.00 0.00 C ATOM 1000 CD2 PHE A 101 -21.132 9.131 -29.232 1.00 0.00 C ATOM 1001 CE1 PHE A 101 -22.794 11.311 -28.977 1.00 0.00 C ATOM 1002 CE2 PHE A 101 -22.487 8.996 -29.446 1.00 0.00 C ATOM 1003 CZ PHE A 101 -23.318 10.086 -29.319 1.00 0.00 C ATOM 0 H PHE A 101 -17.533 9.903 -30.479 1.00 0.00 H new ATOM 0 HA PHE A 101 -19.345 12.050 -30.200 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -18.586 9.563 -28.827 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -18.895 10.805 -27.630 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -21.033 12.414 -28.498 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -20.485 8.272 -29.333 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -23.445 12.166 -28.875 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -22.897 8.034 -29.714 1.00 0.00 H new ATOM 0 HZ PHE A 101 -24.379 9.980 -29.488 1.00 0.00 H new ATOM 1005 N LEU A 102 -16.807 12.292 -28.132 1.00 0.00 N ATOM 1006 CA LEU A 102 -16.068 13.285 -27.311 1.00 0.00 C ATOM 1007 C LEU A 102 -15.655 14.507 -28.130 1.00 0.00 C ATOM 1008 O LEU A 102 -15.204 15.494 -27.584 1.00 0.00 O ATOM 1009 CB LEU A 102 -14.818 12.617 -26.770 1.00 0.00 C ATOM 1010 CG LEU A 102 -15.207 11.323 -26.035 1.00 0.00 C ATOM 1011 CD1 LEU A 102 -16.577 11.474 -25.358 1.00 0.00 C ATOM 1012 CD2 LEU A 102 -15.267 10.153 -27.030 1.00 0.00 C ATOM 0 H LEU A 102 -16.436 11.342 -28.108 1.00 0.00 H new ATOM 0 HA LEU A 102 -16.722 13.624 -26.508 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -14.131 12.392 -27.586 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -14.297 13.292 -26.091 1.00 0.00 H new ATOM 0 HG LEU A 102 -14.452 11.125 -25.274 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -16.833 10.548 -24.844 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -16.538 12.290 -24.637 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -17.333 11.691 -26.112 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -15.543 9.240 -26.502 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -16.010 10.367 -27.798 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -14.291 10.021 -27.496 1.00 0.00 H new ATOM 1014 N ALA A 103 -15.816 14.423 -29.421 1.00 0.00 N ATOM 1015 CA ALA A 103 -15.433 15.580 -30.277 1.00 0.00 C ATOM 1016 C ALA A 103 -16.168 16.851 -29.851 1.00 0.00 C ATOM 1017 O ALA A 103 -15.850 17.933 -30.304 1.00 0.00 O ATOM 1018 CB ALA A 103 -15.813 15.255 -31.729 1.00 0.00 C ATOM 0 H ALA A 103 -16.191 13.614 -29.916 1.00 0.00 H new ATOM 0 HA ALA A 103 -14.361 15.751 -30.177 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -15.540 16.091 -32.372 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -15.282 14.360 -32.053 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -16.887 15.083 -31.794 1.00 0.00 H new ATOM 1020 N THR A 104 -17.132 16.697 -28.981 1.00 0.00 N ATOM 1021 CA THR A 104 -17.897 17.880 -28.515 1.00 0.00 C ATOM 1022 C THR A 104 -18.251 17.737 -27.049 1.00 0.00 C ATOM 1023 O THR A 104 -17.960 18.602 -26.250 1.00 0.00 O ATOM 1024 CB THR A 104 -19.194 17.968 -29.322 1.00 0.00 C ATOM 1025 OG1 THR A 104 -18.790 18.122 -30.667 1.00 0.00 O ATOM 1026 CG2 THR A 104 -19.952 19.263 -28.994 1.00 0.00 C ATOM 0 H THR A 104 -17.418 15.805 -28.577 1.00 0.00 H new ATOM 0 HA THR A 104 -17.290 18.775 -28.650 1.00 0.00 H new ATOM 0 HB THR A 104 -19.817 17.097 -29.117 1.00 0.00 H new ATOM 0 HG1 THR A 104 -19.582 18.183 -31.241 1.00 0.00 H new ATOM 0 HG21 THR A 104 -20.871 19.305 -29.579 1.00 0.00 H new ATOM 0 HG22 THR A 104 -20.197 19.282 -27.932 1.00 0.00 H new ATOM 0 HG23 THR A 104 -19.327 20.122 -29.238 1.00 0.00 H new ATOM 1029 N CYS A 105 -18.877 16.644 -26.724 1.00 0.00 N ATOM 1030 CA CYS A 105 -19.266 16.415 -25.312 1.00 0.00 C ATOM 1031 C CYS A 105 -18.137 16.810 -24.372 1.00 0.00 C ATOM 1032 O CYS A 105 -18.372 17.308 -23.289 1.00 0.00 O ATOM 1033 CB CYS A 105 -19.559 14.917 -25.133 1.00 0.00 C ATOM 1034 SG CYS A 105 -19.972 14.344 -23.468 1.00 0.00 S ATOM 0 H CYS A 105 -19.135 15.902 -27.375 1.00 0.00 H new ATOM 0 HA CYS A 105 -20.143 17.019 -25.077 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -20.384 14.654 -25.794 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -18.687 14.360 -25.474 1.00 0.00 H new ATOM 0 HG CYS A 105 -20.191 13.063 -23.492 1.00 0.00 H new ATOM 1036 N ASP A 106 -16.929 16.580 -24.806 1.00 0.00 N ATOM 1037 CA ASP A 106 -15.765 16.933 -23.957 1.00 0.00 C ATOM 1038 C ASP A 106 -15.222 18.302 -24.325 1.00 0.00 C ATOM 1039 O ASP A 106 -15.115 19.176 -23.488 1.00 0.00 O ATOM 1040 CB ASP A 106 -14.665 15.886 -24.186 1.00 0.00 C ATOM 1041 CG ASP A 106 -13.375 16.346 -23.503 1.00 0.00 C ATOM 1042 OD1 ASP A 106 -13.234 16.022 -22.335 1.00 0.00 O ATOM 1043 OD2 ASP A 106 -12.603 16.996 -24.189 1.00 0.00 O ATOM 0 H ASP A 106 -16.701 16.164 -25.709 1.00 0.00 H new ATOM 0 HA ASP A 106 -16.078 16.952 -22.913 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -14.977 14.921 -23.786 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -14.495 15.749 -25.254 1.00 0.00 H new ATOM 1045 N ALA A 107 -14.890 18.469 -25.570 1.00 0.00 N ATOM 1046 CA ALA A 107 -14.353 19.778 -26.002 1.00 0.00 C ATOM 1047 C ALA A 107 -15.326 20.891 -25.661 1.00 0.00 C ATOM 1048 O ALA A 107 -14.991 22.056 -25.733 1.00 0.00 O ATOM 1049 CB ALA A 107 -14.146 19.746 -27.525 1.00 0.00 C ATOM 0 H ALA A 107 -14.967 17.761 -26.300 1.00 0.00 H new ATOM 0 HA ALA A 107 -13.410 19.965 -25.488 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -13.750 20.705 -27.859 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -13.442 18.954 -27.780 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -15.099 19.556 -28.018 1.00 0.00 H new ATOM 1051 N LYS A 108 -16.516 20.514 -25.295 1.00 0.00 N ATOM 1052 CA LYS A 108 -17.521 21.538 -24.945 1.00 0.00 C ATOM 1053 C LYS A 108 -17.055 22.326 -23.740 1.00 0.00 C ATOM 1054 O LYS A 108 -17.416 23.474 -23.567 1.00 0.00 O ATOM 1055 CB LYS A 108 -18.843 20.822 -24.622 1.00 0.00 C ATOM 1056 CG LYS A 108 -19.817 21.812 -23.990 1.00 0.00 C ATOM 1057 CD LYS A 108 -19.736 21.683 -22.468 1.00 0.00 C ATOM 1058 CE LYS A 108 -20.172 22.999 -21.827 1.00 0.00 C ATOM 1059 NZ LYS A 108 -21.578 23.316 -22.197 1.00 0.00 N ATOM 0 H LYS A 108 -16.831 19.546 -25.225 1.00 0.00 H new ATOM 0 HA LYS A 108 -17.660 22.228 -25.777 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -19.273 20.403 -25.531 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -18.661 19.990 -23.942 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -19.572 22.829 -24.296 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -20.833 21.612 -24.332 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -20.375 20.869 -22.126 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -18.718 21.438 -22.166 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -20.081 22.930 -20.743 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -19.513 23.805 -22.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -21.921 24.105 -21.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -21.621 23.584 -23.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -22.176 22.481 -22.036 1.00 0.00 H new ATOM 1064 N ASP A 109 -16.254 21.701 -22.917 1.00 0.00 N ATOM 1065 CA ASP A 109 -15.766 22.421 -21.730 1.00 0.00 C ATOM 1066 C ASP A 109 -15.023 23.627 -22.221 1.00 0.00 C ATOM 1067 O ASP A 109 -14.959 24.651 -21.572 1.00 0.00 O ATOM 1068 CB ASP A 109 -14.811 21.509 -20.948 1.00 0.00 C ATOM 1069 CG ASP A 109 -15.625 20.489 -20.148 1.00 0.00 C ATOM 1070 OD1 ASP A 109 -16.790 20.345 -20.482 1.00 0.00 O ATOM 1071 OD2 ASP A 109 -15.036 19.913 -19.249 1.00 0.00 O ATOM 0 H ASP A 109 -15.928 20.740 -23.021 1.00 0.00 H new ATOM 0 HA ASP A 109 -16.588 22.713 -21.077 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -14.137 20.996 -21.634 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -14.191 22.103 -20.277 1.00 0.00 H new ATOM 1073 N LEU A 110 -14.472 23.465 -23.385 1.00 0.00 N ATOM 1074 CA LEU A 110 -13.718 24.551 -24.005 1.00 0.00 C ATOM 1075 C LEU A 110 -13.859 24.438 -25.511 1.00 0.00 C ATOM 1076 O LEU A 110 -13.012 23.889 -26.187 1.00 0.00 O ATOM 1077 CB LEU A 110 -12.236 24.405 -23.626 1.00 0.00 C ATOM 1078 CG LEU A 110 -11.865 22.924 -23.642 1.00 0.00 C ATOM 1079 CD1 LEU A 110 -10.571 22.736 -24.438 1.00 0.00 C ATOM 1080 CD2 LEU A 110 -11.650 22.440 -22.206 1.00 0.00 C ATOM 0 H LEU A 110 -14.520 22.606 -23.933 1.00 0.00 H new ATOM 0 HA LEU A 110 -14.093 25.516 -23.665 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -11.611 24.958 -24.328 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -12.056 24.828 -22.638 1.00 0.00 H new ATOM 0 HG LEU A 110 -12.668 22.350 -24.105 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -10.303 21.680 -24.452 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -10.718 23.086 -25.460 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -9.770 23.308 -23.970 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -11.385 21.383 -22.214 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -10.845 23.012 -21.746 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -12.567 22.580 -21.634 1.00 0.00 H new ATOM 1082 N ALA A 111 -14.938 24.972 -26.003 1.00 0.00 N ATOM 1083 CA ALA A 111 -15.188 24.926 -27.459 1.00 0.00 C ATOM 1084 C ALA A 111 -14.261 25.862 -28.265 1.00 0.00 C ATOM 1085 O ALA A 111 -13.863 25.526 -29.363 1.00 0.00 O ATOM 1086 CB ALA A 111 -16.641 25.349 -27.704 1.00 0.00 C ATOM 0 H ALA A 111 -15.659 25.440 -25.453 1.00 0.00 H new ATOM 0 HA ALA A 111 -14.989 23.909 -27.797 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -16.852 25.324 -28.773 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -17.312 24.664 -27.185 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -16.794 26.361 -27.328 1.00 0.00 H new ATOM 1088 N PRO A 112 -13.932 27.025 -27.714 1.00 0.00 N ATOM 1089 CA PRO A 112 -13.059 27.963 -28.420 1.00 0.00 C ATOM 1090 C PRO A 112 -11.702 27.335 -28.741 1.00 0.00 C ATOM 1091 O PRO A 112 -10.996 26.888 -27.860 1.00 0.00 O ATOM 1092 CB PRO A 112 -12.884 29.151 -27.448 1.00 0.00 C ATOM 1093 CG PRO A 112 -13.846 28.906 -26.244 1.00 0.00 C ATOM 1094 CD PRO A 112 -14.385 27.470 -26.384 1.00 0.00 C ATOM 0 HA PRO A 112 -13.487 28.263 -29.376 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -11.851 29.221 -27.107 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -13.120 30.092 -27.944 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -13.319 29.030 -25.298 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -14.663 29.627 -26.250 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -13.997 26.823 -25.597 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -15.472 27.447 -26.308 1.00 0.00 H new ATOM 1095 N ALA A 113 -11.370 27.311 -30.008 1.00 0.00 N ATOM 1096 CA ALA A 113 -10.072 26.720 -30.419 1.00 0.00 C ATOM 1097 C ALA A 113 -8.880 27.555 -29.926 1.00 0.00 C ATOM 1098 O ALA A 113 -7.951 27.027 -29.349 1.00 0.00 O ATOM 1099 CB ALA A 113 -10.030 26.646 -31.956 1.00 0.00 C ATOM 0 H ALA A 113 -11.944 27.675 -30.769 1.00 0.00 H new ATOM 0 HA ALA A 113 -9.993 25.728 -29.974 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -9.081 26.213 -32.274 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -10.850 26.023 -32.313 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -10.129 27.649 -32.371 1.00 0.00 H new ATOM 1101 N PRO A 114 -8.930 28.855 -30.170 1.00 0.00 N ATOM 1102 CA PRO A 114 -7.854 29.746 -29.749 1.00 0.00 C ATOM 1103 C PRO A 114 -7.723 29.771 -28.232 1.00 0.00 C ATOM 1104 CB PRO A 114 -8.271 31.143 -30.256 1.00 0.00 C ATOM 1105 CG PRO A 114 -9.641 30.984 -30.982 1.00 0.00 C ATOM 1106 CD PRO A 114 -10.051 29.507 -30.864 1.00 0.00 C ATOM 0 HA PRO A 114 -6.892 29.421 -30.145 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -8.356 31.844 -29.425 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -7.520 31.545 -30.936 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -10.393 31.629 -30.529 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -9.558 31.278 -32.028 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -10.979 29.399 -30.303 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -10.219 29.064 -31.846 1.00 0.00 H new TER 1107 PRO A 114