USER MOD reduce.3.24.130724 H: found=0, std=0, add=1462, rem=0, adj=51 USER MOD reduce.3.24.130724 removed 1460 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: C 79 TYR OH : rot -59:sc= 0.307! USER MOD Set 1.2: C 83 TYR OH : rot 30:sc= 0 USER MOD Set 2.1: C 18 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: C 20 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.0308) USER MOD Set 3.1: B 6 MET CE :methyl -160:sc= -0.26 (180deg=-1.07) USER MOD Set 3.2: B 74 THR OG1 : rot -72:sc= -0.184 USER MOD Set 4.1: B 28 LYS NZ :NH3+ -172:sc= -0.753 (180deg=-0.784) USER MOD Set 4.2: B 42 GLN :FLIP amide:sc= -1.96 F(o=-3.9,f=-2.7) USER MOD Set 5.1: A 5 GLN :FLIP amide:sc= -1.82 F(o=-3.3!,f=-2.5) USER MOD Set 5.2: A 6 HIS : no HD1:sc= -0.639 K(o=-2.5,f=-4.5) USER MOD Single : A 1 VAL N :NH3+ 141:sc= -0.113 (180deg=-0.906) USER MOD Single : A 3 THR OG1 : rot -88:sc= 0.153 USER MOD Single : A 8 CYS SG : rot -49:sc= -2.89! USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot -50:sc= -8.27! USER MOD Single : A 13 ASN :FLIP amide:sc= -0.0873 F(o=-0.8,f=-0.087) USER MOD Single : A 15 HIS : no HD1:sc= 0 X(o=0,f=-0.0023) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 HIS : no HE2:sc= -6.64! C(o=-6.6!,f=-12!) USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 THR OG1 : rot 66:sc= 0.19! USER MOD Single : B 13 THR OG1 : rot 86:sc= 0.142 USER MOD Single : B 16 THR OG1 : rot 157:sc= -6.26! USER MOD Single : B 19 LYS NZ :NH3+ 169:sc= 0.105 (180deg=0.0781) USER MOD Single : B 21 SER OG : rot -26:sc= 0.849 USER MOD Single : B 22 SER OG : rot -179:sc= -0.53 USER MOD Single : B 23 THR OG1 : rot 180:sc= -0.73 USER MOD Single : B 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 45 TYR OH : rot 180:sc= -0.121 USER MOD Single : B 46 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0123) USER MOD Single : B 49 GLN : amide:sc= -0.52 X(o=-0.52,f=-0.52) USER MOD Single : B 55 LYS NZ :NH3+ 146:sc= 0.129 (180deg=0) USER MOD Single : B 56 THR OG1 : rot 180:sc= 0.0986 USER MOD Single : B 60 CYS SG : rot 180:sc= -5.27! USER MOD Single : B 63 THR OG1 : rot -169:sc= -3.91! USER MOD Single : B 64 SER OG : rot 73:sc= 0.603 USER MOD Single : B 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 66 THR OG1 : rot -60:sc= -0.46 USER MOD Single : B 70 GLN : amide:sc= -0.0817 X(o=-0.082,f=0) USER MOD Single : B 89 CYS SG : rot 61:sc= 0.24 USER MOD Single : C 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 23 SER OG : rot 30:sc= 0.777 USER MOD Single : C 24 SER OG : rot 180:sc= 0 USER MOD Single : C 27 HIS :FLIP no HD1:sc= -1.27 F(o=-1.9!,f=-1.3) USER MOD Single : C 32 LYS NZ :NH3+ -144:sc= -2.97! (180deg=-7.1!) USER MOD Single : C 35 HIS : no HE2:sc= -7.53! C(o=-7.5!,f=-7.6!) USER MOD Single : C 38 THR OG1 : rot 69:sc= -7.35! USER MOD Single : C 39 SER OG : rot -97:sc= -6.17! USER MOD Single : C 41 THR OG1 : rot 180:sc= 0 USER MOD Single : C 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 45 MET CE :methyl -116:sc= -3.57! (180deg=-3.98!) USER MOD Single : C 58 ASN :FLIP amide:sc= -0.76 F(o=-4!,f=-0.76) USER MOD Single : C 61 ASN : amide:sc= -1.32 X(o=-1.3,f=-0.85) USER MOD Single : C 67 SER OG : rot 180:sc= 0.0324 USER MOD Single : C 68 HIS : no HD1:sc= -0.486 X(o=-0.49,f=-0.44) USER MOD Single : C 71 SER OG : rot 180:sc= 0 USER MOD Single : C 72 LYS NZ :NH3+ 170:sc= -2.42! (180deg=-2.94!) USER MOD Single : C 74 CYS SG : rot 129:sc= -4.69! USER MOD Single : C 75 MET CE :methyl -138:sc= -0.266 (180deg=-2.13!) USER MOD Single : C 76 TYR OH : rot 180:sc= 0 USER MOD Single : C 78 THR OG1 : rot -51:sc= 0.683 USER MOD Single : C 80 LYS NZ :NH3+ -163:sc=-0.00482 (180deg=-0.177) USER MOD Single : C 105 MET CE :methyl -147:sc= -0.324 (180deg=-2.04!) USER MOD Single : C 108 ASN : amide:sc= -1.42 K(o=-1.4,f=-3.3!) USER MOD Single : C 112 CYS SG : rot 54:sc= -0.0718 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 15.225 4.361 17.556 1.00 0.00 N ATOM 2 CA VAL A 1 14.740 4.746 16.200 1.00 0.00 C ATOM 3 C VAL A 1 13.700 5.834 16.274 1.00 0.00 C ATOM 4 O VAL A 1 12.852 5.884 17.143 1.00 0.00 O ATOM 5 CB VAL A 1 14.146 3.529 15.546 1.00 0.00 C ATOM 6 CG1 VAL A 1 12.960 3.052 16.368 1.00 0.00 C ATOM 7 CG2 VAL A 1 13.672 3.912 14.142 1.00 0.00 C ATOM 0 H1 VAL A 1 15.362 3.331 17.596 1.00 0.00 H new ATOM 0 H2 VAL A 1 16.129 4.838 17.750 1.00 0.00 H new ATOM 0 H3 VAL A 1 14.524 4.645 18.269 1.00 0.00 H new ATOM 0 HA VAL A 1 15.580 5.128 15.621 1.00 0.00 H new ATOM 0 HB VAL A 1 14.888 2.733 15.484 1.00 0.00 H new ATOM 0 HG11 VAL A 1 12.524 2.170 15.900 1.00 0.00 H new ATOM 0 HG12 VAL A 1 13.293 2.801 17.375 1.00 0.00 H new ATOM 0 HG13 VAL A 1 12.211 3.843 16.419 1.00 0.00 H new ATOM 0 HG21 VAL A 1 13.238 3.039 13.654 1.00 0.00 H new ATOM 0 HG22 VAL A 1 12.921 4.699 14.214 1.00 0.00 H new ATOM 0 HG23 VAL A 1 14.519 4.271 13.557 1.00 0.00 H new ATOM 19 N ALA A 2 13.804 6.706 15.354 1.00 0.00 N ATOM 20 CA ALA A 2 12.881 7.867 15.275 1.00 0.00 C ATOM 21 C ALA A 2 12.036 7.799 14.002 1.00 0.00 C ATOM 22 O ALA A 2 12.394 7.146 13.044 1.00 0.00 O ATOM 23 CB ALA A 2 13.815 9.065 15.220 1.00 0.00 C ATOM 0 H ALA A 2 14.510 6.677 14.618 1.00 0.00 H new ATOM 0 HA ALA A 2 12.181 7.906 16.110 1.00 0.00 H new ATOM 0 HB1 ALA A 2 13.228 9.981 15.160 1.00 0.00 H new ATOM 0 HB2 ALA A 2 14.431 9.087 16.119 1.00 0.00 H new ATOM 0 HB3 ALA A 2 14.456 8.986 14.342 1.00 0.00 H new ATOM 29 N THR A 3 10.924 8.480 13.978 1.00 0.00 N ATOM 30 CA THR A 3 10.072 8.462 12.757 1.00 0.00 C ATOM 31 C THR A 3 10.845 9.076 11.587 1.00 0.00 C ATOM 32 O THR A 3 12.042 9.272 11.660 1.00 0.00 O ATOM 33 CB THR A 3 8.852 9.318 13.106 1.00 0.00 C ATOM 34 OG1 THR A 3 9.068 9.963 14.353 1.00 0.00 O ATOM 35 CG2 THR A 3 7.612 8.429 13.195 1.00 0.00 C ATOM 0 H THR A 3 10.570 9.046 14.749 1.00 0.00 H new ATOM 0 HA THR A 3 9.781 7.453 12.463 1.00 0.00 H new ATOM 0 HB THR A 3 8.701 10.070 12.331 1.00 0.00 H new ATOM 0 HG1 THR A 3 8.766 9.379 15.080 1.00 0.00 H new ATOM 0 HG21 THR A 3 6.744 9.039 13.444 1.00 0.00 H new ATOM 0 HG22 THR A 3 7.447 7.937 12.236 1.00 0.00 H new ATOM 0 HG23 THR A 3 7.759 7.676 13.969 1.00 0.00 H new ATOM 43 N LEU A 4 10.178 9.384 10.510 1.00 0.00 N ATOM 44 CA LEU A 4 10.892 9.985 9.348 1.00 0.00 C ATOM 45 C LEU A 4 11.072 11.493 9.556 1.00 0.00 C ATOM 46 O LEU A 4 11.811 12.143 8.845 1.00 0.00 O ATOM 47 CB LEU A 4 10.001 9.711 8.135 1.00 0.00 C ATOM 48 CG LEU A 4 10.882 9.566 6.893 1.00 0.00 C ATOM 49 CD1 LEU A 4 10.014 9.232 5.682 1.00 0.00 C ATOM 50 CD2 LEU A 4 11.617 10.883 6.641 1.00 0.00 C ATOM 0 H LEU A 4 9.175 9.247 10.384 1.00 0.00 H new ATOM 0 HA LEU A 4 11.888 9.562 9.219 1.00 0.00 H new ATOM 0 HB2 LEU A 4 9.420 8.803 8.292 1.00 0.00 H new ATOM 0 HB3 LEU A 4 9.289 10.525 7.999 1.00 0.00 H new ATOM 0 HG LEU A 4 11.604 8.765 7.052 1.00 0.00 H new ATOM 0 HD11 LEU A 4 10.645 9.130 4.799 1.00 0.00 H new ATOM 0 HD12 LEU A 4 9.485 8.296 5.861 1.00 0.00 H new ATOM 0 HD13 LEU A 4 9.291 10.032 5.521 1.00 0.00 H new ATOM 0 HD21 LEU A 4 12.247 10.785 5.757 1.00 0.00 H new ATOM 0 HD22 LEU A 4 10.891 11.680 6.483 1.00 0.00 H new ATOM 0 HD23 LEU A 4 12.238 11.124 7.504 1.00 0.00 H new ATOM 62 N GLN A 5 10.397 12.055 10.522 1.00 0.00 N ATOM 63 CA GLN A 5 10.528 13.521 10.768 1.00 0.00 C ATOM 64 C GLN A 5 11.986 13.876 11.081 1.00 0.00 C ATOM 65 O GLN A 5 12.494 14.891 10.648 1.00 0.00 O ATOM 66 CB GLN A 5 9.638 13.798 11.981 1.00 0.00 C ATOM 67 CG GLN A 5 9.983 15.168 12.575 1.00 0.00 C ATOM 68 CD GLN A 5 10.048 15.065 14.100 1.00 0.00 C ATOM 69 OE1 GLN A 5 9.082 14.466 14.743 1.00 0.00 O flip ATOM 70 NE2 GLN A 5 10.987 15.533 14.712 1.00 0.00 N flip ATOM 0 H GLN A 5 9.761 11.564 11.151 1.00 0.00 H new ATOM 0 HA GLN A 5 10.235 14.114 9.902 1.00 0.00 H new ATOM 0 HB2 GLN A 5 8.589 13.772 11.687 1.00 0.00 H new ATOM 0 HB3 GLN A 5 9.778 13.020 12.732 1.00 0.00 H new ATOM 0 HG2 GLN A 5 10.939 15.515 12.183 1.00 0.00 H new ATOM 0 HG3 GLN A 5 9.233 15.902 12.282 1.00 0.00 H new ATOM 0 HE21 GLN A 5 11.741 16.001 14.209 1.00 0.00 H new ATOM 0 HE22 GLN A 5 11.021 15.458 15.729 1.00 0.00 H new ATOM 79 N HIS A 6 12.659 13.050 11.834 1.00 0.00 N ATOM 80 CA HIS A 6 14.081 13.343 12.180 1.00 0.00 C ATOM 81 C HIS A 6 14.994 13.051 10.985 1.00 0.00 C ATOM 82 O HIS A 6 15.919 13.787 10.705 1.00 0.00 O ATOM 83 CB HIS A 6 14.405 12.407 13.344 1.00 0.00 C ATOM 84 CG HIS A 6 14.308 13.165 14.639 1.00 0.00 C ATOM 85 ND1 HIS A 6 13.098 13.614 15.145 1.00 0.00 N ATOM 86 CD2 HIS A 6 15.263 13.560 15.544 1.00 0.00 C ATOM 87 CE1 HIS A 6 13.353 14.247 16.305 1.00 0.00 C ATOM 88 NE2 HIS A 6 14.658 14.243 16.595 1.00 0.00 N ATOM 0 H HIS A 6 12.287 12.185 12.225 1.00 0.00 H new ATOM 0 HA HIS A 6 14.233 14.390 12.442 1.00 0.00 H new ATOM 0 HB2 HIS A 6 13.713 11.565 13.351 1.00 0.00 H new ATOM 0 HB3 HIS A 6 15.407 11.995 13.225 1.00 0.00 H new ATOM 0 HD2 HIS A 6 16.322 13.370 15.454 1.00 0.00 H new ATOM 0 HE1 HIS A 6 12.596 14.703 16.926 1.00 0.00 H new ATOM 0 HE2 HIS A 6 15.113 14.652 17.411 1.00 0.00 H new ATOM 96 N LEU A 7 14.748 11.979 10.285 1.00 0.00 N ATOM 97 CA LEU A 7 15.608 11.640 9.114 1.00 0.00 C ATOM 98 C LEU A 7 15.505 12.726 8.039 1.00 0.00 C ATOM 99 O LEU A 7 16.500 13.205 7.532 1.00 0.00 O ATOM 100 CB LEU A 7 15.057 10.314 8.592 1.00 0.00 C ATOM 101 CG LEU A 7 15.889 9.161 9.154 1.00 0.00 C ATOM 102 CD1 LEU A 7 17.291 9.198 8.544 1.00 0.00 C ATOM 103 CD2 LEU A 7 15.992 9.303 10.674 1.00 0.00 C ATOM 0 H LEU A 7 13.990 11.323 10.472 1.00 0.00 H new ATOM 0 HA LEU A 7 16.661 11.568 9.385 1.00 0.00 H new ATOM 0 HB2 LEU A 7 14.013 10.201 8.886 1.00 0.00 H new ATOM 0 HB3 LEU A 7 15.085 10.300 7.502 1.00 0.00 H new ATOM 0 HG LEU A 7 15.411 8.213 8.907 1.00 0.00 H new ATOM 0 HD11 LEU A 7 17.884 8.376 8.945 1.00 0.00 H new ATOM 0 HD12 LEU A 7 17.219 9.099 7.461 1.00 0.00 H new ATOM 0 HD13 LEU A 7 17.770 10.145 8.791 1.00 0.00 H new ATOM 0 HD21 LEU A 7 16.585 8.482 11.077 1.00 0.00 H new ATOM 0 HD22 LEU A 7 16.471 10.251 10.919 1.00 0.00 H new ATOM 0 HD23 LEU A 7 14.993 9.278 11.110 1.00 0.00 H new ATOM 115 N CYS A 8 14.312 13.113 7.682 1.00 0.00 N ATOM 116 CA CYS A 8 14.146 14.156 6.638 1.00 0.00 C ATOM 117 C CYS A 8 14.670 15.509 7.134 1.00 0.00 C ATOM 118 O CYS A 8 15.265 16.264 6.389 1.00 0.00 O ATOM 119 CB CYS A 8 12.639 14.207 6.390 1.00 0.00 C ATOM 120 SG CYS A 8 11.820 15.106 7.732 1.00 0.00 S ATOM 0 H CYS A 8 13.443 12.749 8.072 1.00 0.00 H new ATOM 0 HA CYS A 8 14.706 13.932 5.730 1.00 0.00 H new ATOM 0 HB2 CYS A 8 12.435 14.695 5.437 1.00 0.00 H new ATOM 0 HB3 CYS A 8 12.239 13.195 6.322 1.00 0.00 H new ATOM 0 HG CYS A 8 12.223 14.639 8.876 1.00 0.00 H new ATOM 126 N ARG A 9 14.454 15.825 8.382 1.00 0.00 N ATOM 127 CA ARG A 9 14.941 17.132 8.914 1.00 0.00 C ATOM 128 C ARG A 9 16.460 17.093 9.112 1.00 0.00 C ATOM 129 O ARG A 9 17.128 18.106 9.053 1.00 0.00 O ATOM 130 CB ARG A 9 14.218 17.310 10.254 1.00 0.00 C ATOM 131 CG ARG A 9 15.030 16.656 11.376 1.00 0.00 C ATOM 132 CD ARG A 9 16.041 17.664 11.931 1.00 0.00 C ATOM 133 NE ARG A 9 15.285 18.444 12.950 1.00 0.00 N ATOM 134 CZ ARG A 9 15.053 17.930 14.128 1.00 0.00 C ATOM 135 NH1 ARG A 9 15.482 16.731 14.415 1.00 0.00 N ATOM 136 NH2 ARG A 9 14.391 18.615 15.019 1.00 0.00 N ATOM 0 H ARG A 9 13.963 15.237 9.055 1.00 0.00 H new ATOM 0 HA ARG A 9 14.737 17.958 8.233 1.00 0.00 H new ATOM 0 HB2 ARG A 9 14.080 18.371 10.464 1.00 0.00 H new ATOM 0 HB3 ARG A 9 13.225 16.863 10.204 1.00 0.00 H new ATOM 0 HG2 ARG A 9 14.365 16.317 12.170 1.00 0.00 H new ATOM 0 HG3 ARG A 9 15.549 15.775 10.998 1.00 0.00 H new ATOM 0 HD2 ARG A 9 16.898 17.159 12.376 1.00 0.00 H new ATOM 0 HD3 ARG A 9 16.426 18.312 11.143 1.00 0.00 H new ATOM 0 HE ARG A 9 14.948 19.381 12.728 1.00 0.00 H new ATOM 0 HH11 ARG A 9 15.999 16.194 13.719 1.00 0.00 H new ATOM 0 HH12 ARG A 9 15.300 16.331 15.335 1.00 0.00 H new ATOM 0 HH21 ARG A 9 14.055 19.552 14.796 1.00 0.00 H new ATOM 0 HH22 ARG A 9 14.210 18.214 15.939 1.00 0.00 H new ATOM 150 N LYS A 10 17.007 15.933 9.349 1.00 0.00 N ATOM 151 CA LYS A 10 18.481 15.832 9.554 1.00 0.00 C ATOM 152 C LYS A 10 19.227 16.247 8.282 1.00 0.00 C ATOM 153 O LYS A 10 20.202 16.969 8.332 1.00 0.00 O ATOM 154 CB LYS A 10 18.735 14.357 9.867 1.00 0.00 C ATOM 155 CG LYS A 10 18.735 14.148 11.381 1.00 0.00 C ATOM 156 CD LYS A 10 19.176 12.717 11.700 1.00 0.00 C ATOM 157 CE LYS A 10 18.819 12.384 13.151 1.00 0.00 C ATOM 158 NZ LYS A 10 18.892 10.899 13.233 1.00 0.00 N ATOM 0 H LYS A 10 16.498 15.051 9.410 1.00 0.00 H new ATOM 0 HA LYS A 10 18.831 16.487 10.352 1.00 0.00 H new ATOM 0 HB2 LYS A 10 17.966 13.739 9.404 1.00 0.00 H new ATOM 0 HB3 LYS A 10 19.691 14.045 9.446 1.00 0.00 H new ATOM 0 HG2 LYS A 10 19.407 14.862 11.857 1.00 0.00 H new ATOM 0 HG3 LYS A 10 17.739 14.331 11.784 1.00 0.00 H new ATOM 0 HD2 LYS A 10 18.687 12.015 11.024 1.00 0.00 H new ATOM 0 HD3 LYS A 10 20.250 12.613 11.546 1.00 0.00 H new ATOM 0 HE2 LYS A 10 19.515 12.853 13.847 1.00 0.00 H new ATOM 0 HE3 LYS A 10 17.823 12.745 13.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 18.660 10.593 14.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 18.214 10.481 12.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 19.854 10.585 12.992 1.00 0.00 H new ATOM 172 N THR A 11 18.778 15.794 7.144 1.00 0.00 N ATOM 173 CA THR A 11 19.466 16.163 5.872 1.00 0.00 C ATOM 174 C THR A 11 19.415 17.679 5.661 1.00 0.00 C ATOM 175 O THR A 11 20.423 18.318 5.436 1.00 0.00 O ATOM 176 CB THR A 11 18.684 15.440 4.776 1.00 0.00 C ATOM 177 OG1 THR A 11 18.735 14.041 5.008 1.00 0.00 O ATOM 178 CG2 THR A 11 19.303 15.758 3.413 1.00 0.00 C ATOM 0 H THR A 11 17.966 15.185 7.039 1.00 0.00 H new ATOM 0 HA THR A 11 20.519 15.881 5.875 1.00 0.00 H new ATOM 0 HB THR A 11 17.646 15.773 4.787 1.00 0.00 H new ATOM 0 HG1 THR A 11 19.665 13.767 5.154 1.00 0.00 H new ATOM 0 HG21 THR A 11 18.746 15.242 2.631 1.00 0.00 H new ATOM 0 HG22 THR A 11 19.264 16.833 3.238 1.00 0.00 H new ATOM 0 HG23 THR A 11 20.341 15.425 3.398 1.00 0.00 H new ATOM 186 N VAL A 12 18.248 18.260 5.732 1.00 0.00 N ATOM 187 CA VAL A 12 18.139 19.735 5.535 1.00 0.00 C ATOM 188 C VAL A 12 18.933 20.471 6.618 1.00 0.00 C ATOM 189 O VAL A 12 19.632 21.428 6.346 1.00 0.00 O ATOM 190 CB VAL A 12 16.647 20.042 5.659 1.00 0.00 C ATOM 191 CG1 VAL A 12 16.431 21.556 5.595 1.00 0.00 C ATOM 192 CG2 VAL A 12 15.892 19.372 4.509 1.00 0.00 C ATOM 0 H VAL A 12 17.368 17.779 5.917 1.00 0.00 H new ATOM 0 HA VAL A 12 18.541 20.056 4.574 1.00 0.00 H new ATOM 0 HB VAL A 12 16.275 19.661 6.610 1.00 0.00 H new ATOM 0 HG11 VAL A 12 15.367 21.776 5.683 1.00 0.00 H new ATOM 0 HG12 VAL A 12 16.970 22.035 6.412 1.00 0.00 H new ATOM 0 HG13 VAL A 12 16.802 21.937 4.643 1.00 0.00 H new ATOM 0 HG21 VAL A 12 14.828 19.590 4.596 1.00 0.00 H new ATOM 0 HG22 VAL A 12 16.264 19.754 3.558 1.00 0.00 H new ATOM 0 HG23 VAL A 12 16.046 18.294 4.552 1.00 0.00 H new ATOM 202 N ASN A 13 18.830 20.034 7.843 1.00 0.00 N ATOM 203 CA ASN A 13 19.579 20.709 8.942 1.00 0.00 C ATOM 204 C ASN A 13 21.067 20.361 8.862 1.00 0.00 C ATOM 205 O ASN A 13 21.923 21.187 9.111 1.00 0.00 O ATOM 206 CB ASN A 13 18.969 20.161 10.232 1.00 0.00 C ATOM 207 CG ASN A 13 19.521 20.937 11.429 1.00 0.00 C ATOM 208 OD1 ASN A 13 20.749 20.726 11.817 1.00 0.00 O flip ATOM 209 ND2 ASN A 13 18.828 21.744 12.017 1.00 0.00 N flip ATOM 0 H ASN A 13 18.260 19.239 8.131 1.00 0.00 H new ATOM 0 HA ASN A 13 19.505 21.795 8.885 1.00 0.00 H new ATOM 0 HB2 ASN A 13 17.883 20.248 10.199 1.00 0.00 H new ATOM 0 HB3 ASN A 13 19.201 19.101 10.334 1.00 0.00 H new ATOM 0 HD21 ASN A 13 17.868 21.909 11.714 1.00 0.00 H new ATOM 0 HD22 ASN A 13 19.206 22.256 12.814 1.00 0.00 H new ATOM 216 N GLY A 14 21.384 19.143 8.515 1.00 0.00 N ATOM 217 CA GLY A 14 22.817 18.742 8.421 1.00 0.00 C ATOM 218 C GLY A 14 23.457 19.400 7.195 1.00 0.00 C ATOM 219 O GLY A 14 24.639 19.262 6.953 1.00 0.00 O ATOM 0 H GLY A 14 20.712 18.408 8.293 1.00 0.00 H new ATOM 0 HA2 GLY A 14 23.348 19.040 9.325 1.00 0.00 H new ATOM 0 HA3 GLY A 14 22.897 17.657 8.347 1.00 0.00 H new ATOM 223 N HIS A 15 22.685 20.113 6.420 1.00 0.00 N ATOM 224 CA HIS A 15 23.253 20.777 5.212 1.00 0.00 C ATOM 225 C HIS A 15 24.206 21.903 5.622 1.00 0.00 C ATOM 226 O HIS A 15 23.953 22.632 6.560 1.00 0.00 O ATOM 227 CB HIS A 15 22.045 21.344 4.467 1.00 0.00 C ATOM 228 CG HIS A 15 22.334 21.378 2.992 1.00 0.00 C ATOM 229 ND1 HIS A 15 23.176 22.321 2.425 1.00 0.00 N ATOM 230 CD2 HIS A 15 21.900 20.592 1.953 1.00 0.00 C ATOM 231 CE1 HIS A 15 23.222 22.082 1.102 1.00 0.00 C ATOM 232 NE2 HIS A 15 22.461 21.038 0.761 1.00 0.00 N ATOM 0 H HIS A 15 21.688 20.264 6.571 1.00 0.00 H new ATOM 0 HA HIS A 15 23.827 20.086 4.595 1.00 0.00 H new ATOM 0 HB2 HIS A 15 21.165 20.732 4.661 1.00 0.00 H new ATOM 0 HB3 HIS A 15 21.821 22.348 4.827 1.00 0.00 H new ATOM 0 HD2 HIS A 15 21.225 19.754 2.047 1.00 0.00 H new ATOM 0 HE1 HIS A 15 23.803 22.663 0.401 1.00 0.00 H new ATOM 0 HE2 HIS A 15 22.322 20.651 -0.173 1.00 0.00 H new ATOM 241 N MET B 1 11.807 -18.008 12.652 1.00 0.00 N ATOM 242 CA MET B 1 10.793 -17.747 13.715 1.00 0.00 C ATOM 243 C MET B 1 9.704 -16.810 13.187 1.00 0.00 C ATOM 244 O MET B 1 8.594 -17.224 12.912 1.00 0.00 O ATOM 245 CB MET B 1 11.570 -17.078 14.848 1.00 0.00 C ATOM 246 CG MET B 1 11.593 -18.001 16.067 1.00 0.00 C ATOM 247 SD MET B 1 11.813 -17.014 17.568 1.00 0.00 S ATOM 248 CE MET B 1 10.286 -17.521 18.398 1.00 0.00 C ATOM 0 H1 MET B 1 12.541 -18.645 13.022 1.00 0.00 H new ATOM 0 H2 MET B 1 11.345 -18.451 11.832 1.00 0.00 H new ATOM 0 H3 MET B 1 12.243 -17.110 12.360 1.00 0.00 H new ATOM 0 HA MET B 1 10.296 -18.659 14.044 1.00 0.00 H new ATOM 0 HB2 MET B 1 12.588 -16.859 14.525 1.00 0.00 H new ATOM 0 HB3 MET B 1 11.107 -16.126 15.108 1.00 0.00 H new ATOM 0 HG2 MET B 1 10.664 -18.568 16.125 1.00 0.00 H new ATOM 0 HG3 MET B 1 12.403 -18.725 15.973 1.00 0.00 H new ATOM 0 HE1 MET B 1 10.214 -17.022 19.364 1.00 0.00 H new ATOM 0 HE2 MET B 1 9.429 -17.246 17.783 1.00 0.00 H new ATOM 0 HE3 MET B 1 10.294 -18.601 18.547 1.00 0.00 H new ATOM 260 N ASP B 2 10.011 -15.550 13.044 1.00 0.00 N ATOM 261 CA ASP B 2 8.993 -14.588 12.535 1.00 0.00 C ATOM 262 C ASP B 2 9.507 -13.894 11.271 1.00 0.00 C ATOM 263 O ASP B 2 10.656 -13.513 11.182 1.00 0.00 O ATOM 264 CB ASP B 2 8.807 -13.573 13.665 1.00 0.00 C ATOM 265 CG ASP B 2 8.068 -14.237 14.830 1.00 0.00 C ATOM 266 OD1 ASP B 2 7.190 -15.042 14.565 1.00 0.00 O ATOM 267 OD2 ASP B 2 8.393 -13.929 15.964 1.00 0.00 O ATOM 0 H ASP B 2 10.923 -15.145 13.258 1.00 0.00 H new ATOM 0 HA ASP B 2 8.057 -15.079 12.270 1.00 0.00 H new ATOM 0 HB2 ASP B 2 9.776 -13.203 13.999 1.00 0.00 H new ATOM 0 HB3 ASP B 2 8.243 -12.712 13.306 1.00 0.00 H new ATOM 272 N VAL B 3 8.661 -13.728 10.291 1.00 0.00 N ATOM 273 CA VAL B 3 9.099 -13.061 9.032 1.00 0.00 C ATOM 274 C VAL B 3 8.038 -12.058 8.571 1.00 0.00 C ATOM 275 O VAL B 3 6.902 -12.104 8.998 1.00 0.00 O ATOM 276 CB VAL B 3 9.247 -14.193 8.015 1.00 0.00 C ATOM 277 CG1 VAL B 3 7.914 -14.930 7.873 1.00 0.00 C ATOM 278 CG2 VAL B 3 9.655 -13.613 6.660 1.00 0.00 C ATOM 0 H VAL B 3 7.685 -14.025 10.308 1.00 0.00 H new ATOM 0 HA VAL B 3 10.028 -12.505 9.159 1.00 0.00 H new ATOM 0 HB VAL B 3 10.013 -14.889 8.357 1.00 0.00 H new ATOM 0 HG11 VAL B 3 8.020 -15.737 7.148 1.00 0.00 H new ATOM 0 HG12 VAL B 3 7.623 -15.345 8.838 1.00 0.00 H new ATOM 0 HG13 VAL B 3 7.148 -14.234 7.532 1.00 0.00 H new ATOM 0 HG21 VAL B 3 9.760 -14.420 5.935 1.00 0.00 H new ATOM 0 HG22 VAL B 3 8.890 -12.916 6.318 1.00 0.00 H new ATOM 0 HG23 VAL B 3 10.605 -13.089 6.760 1.00 0.00 H new ATOM 288 N PHE B 4 8.397 -11.152 7.705 1.00 0.00 N ATOM 289 CA PHE B 4 7.403 -10.152 7.222 1.00 0.00 C ATOM 290 C PHE B 4 7.026 -10.445 5.767 1.00 0.00 C ATOM 291 O PHE B 4 7.749 -11.104 5.050 1.00 0.00 O ATOM 292 CB PHE B 4 8.113 -8.802 7.334 1.00 0.00 C ATOM 293 CG PHE B 4 7.781 -8.169 8.665 1.00 0.00 C ATOM 294 CD1 PHE B 4 6.649 -7.356 8.791 1.00 0.00 C ATOM 295 CD2 PHE B 4 8.606 -8.399 9.774 1.00 0.00 C ATOM 296 CE1 PHE B 4 6.340 -6.772 10.024 1.00 0.00 C ATOM 297 CE2 PHE B 4 8.297 -7.813 11.007 1.00 0.00 C ATOM 298 CZ PHE B 4 7.164 -7.000 11.133 1.00 0.00 C ATOM 0 H PHE B 4 9.333 -11.060 7.311 1.00 0.00 H new ATOM 0 HA PHE B 4 6.479 -10.173 7.799 1.00 0.00 H new ATOM 0 HB2 PHE B 4 9.191 -8.937 7.242 1.00 0.00 H new ATOM 0 HB3 PHE B 4 7.803 -8.147 6.520 1.00 0.00 H new ATOM 0 HD1 PHE B 4 6.014 -7.179 7.936 1.00 0.00 H new ATOM 0 HD2 PHE B 4 9.479 -9.027 9.678 1.00 0.00 H new ATOM 0 HE1 PHE B 4 5.466 -6.145 10.121 1.00 0.00 H new ATOM 0 HE2 PHE B 4 8.933 -7.988 11.862 1.00 0.00 H new ATOM 0 HZ PHE B 4 6.926 -6.549 12.085 1.00 0.00 H new ATOM 308 N LEU B 5 5.897 -9.965 5.327 1.00 0.00 N ATOM 309 CA LEU B 5 5.475 -10.220 3.920 1.00 0.00 C ATOM 310 C LEU B 5 4.746 -8.998 3.359 1.00 0.00 C ATOM 311 O LEU B 5 4.046 -8.300 4.064 1.00 0.00 O ATOM 312 CB LEU B 5 4.528 -11.418 4.000 1.00 0.00 C ATOM 313 CG LEU B 5 4.927 -12.455 2.949 1.00 0.00 C ATOM 314 CD1 LEU B 5 6.387 -12.860 3.158 1.00 0.00 C ATOM 315 CD2 LEU B 5 4.032 -13.688 3.087 1.00 0.00 C ATOM 0 H LEU B 5 5.247 -9.407 5.880 1.00 0.00 H new ATOM 0 HA LEU B 5 6.323 -10.415 3.263 1.00 0.00 H new ATOM 0 HB2 LEU B 5 4.567 -11.860 4.996 1.00 0.00 H new ATOM 0 HB3 LEU B 5 3.500 -11.094 3.835 1.00 0.00 H new ATOM 0 HG LEU B 5 4.809 -12.027 1.953 1.00 0.00 H new ATOM 0 HD11 LEU B 5 6.670 -13.599 2.409 1.00 0.00 H new ATOM 0 HD12 LEU B 5 7.026 -11.982 3.061 1.00 0.00 H new ATOM 0 HD13 LEU B 5 6.507 -13.288 4.153 1.00 0.00 H new ATOM 0 HD21 LEU B 5 4.315 -14.428 2.339 1.00 0.00 H new ATOM 0 HD22 LEU B 5 4.151 -14.115 4.083 1.00 0.00 H new ATOM 0 HD23 LEU B 5 2.991 -13.401 2.938 1.00 0.00 H new ATOM 327 N MET B 6 4.899 -8.739 2.093 1.00 0.00 N ATOM 328 CA MET B 6 4.207 -7.569 1.487 1.00 0.00 C ATOM 329 C MET B 6 3.252 -8.056 0.398 1.00 0.00 C ATOM 330 O MET B 6 3.576 -8.935 -0.372 1.00 0.00 O ATOM 331 CB MET B 6 5.324 -6.714 0.883 1.00 0.00 C ATOM 332 CG MET B 6 4.837 -5.272 0.729 1.00 0.00 C ATOM 333 SD MET B 6 5.712 -4.485 -0.647 1.00 0.00 S ATOM 334 CE MET B 6 7.393 -4.766 -0.038 1.00 0.00 C ATOM 0 H MET B 6 5.473 -9.286 1.451 1.00 0.00 H new ATOM 0 HA MET B 6 3.618 -7.005 2.210 1.00 0.00 H new ATOM 0 HB2 MET B 6 6.206 -6.745 1.523 1.00 0.00 H new ATOM 0 HB3 MET B 6 5.619 -7.115 -0.087 1.00 0.00 H new ATOM 0 HG2 MET B 6 3.762 -5.257 0.547 1.00 0.00 H new ATOM 0 HG3 MET B 6 5.012 -4.717 1.651 1.00 0.00 H new ATOM 0 HE1 MET B 6 8.078 -4.073 -0.527 1.00 0.00 H new ATOM 0 HE2 MET B 6 7.421 -4.605 1.040 1.00 0.00 H new ATOM 0 HE3 MET B 6 7.694 -5.790 -0.260 1.00 0.00 H new ATOM 344 N ILE B 7 2.078 -7.494 0.325 1.00 0.00 N ATOM 345 CA ILE B 7 1.115 -7.934 -0.714 1.00 0.00 C ATOM 346 C ILE B 7 0.987 -6.827 -1.753 1.00 0.00 C ATOM 347 O ILE B 7 0.793 -5.675 -1.419 1.00 0.00 O ATOM 348 CB ILE B 7 -0.191 -8.162 0.048 1.00 0.00 C ATOM 349 CG1 ILE B 7 -0.418 -9.673 0.208 1.00 0.00 C ATOM 350 CG2 ILE B 7 -1.362 -7.523 -0.705 1.00 0.00 C ATOM 351 CD1 ILE B 7 -1.624 -10.119 -0.622 1.00 0.00 C ATOM 0 H ILE B 7 1.747 -6.751 0.940 1.00 0.00 H new ATOM 0 HA ILE B 7 1.413 -8.836 -1.248 1.00 0.00 H new ATOM 0 HB ILE B 7 -0.126 -7.698 1.032 1.00 0.00 H new ATOM 0 HG12 ILE B 7 0.472 -10.217 -0.109 1.00 0.00 H new ATOM 0 HG13 ILE B 7 -0.581 -9.914 1.258 1.00 0.00 H new ATOM 0 HG21 ILE B 7 -2.286 -7.692 -0.152 1.00 0.00 H new ATOM 0 HG22 ILE B 7 -1.190 -6.451 -0.804 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -1.445 -7.970 -1.696 1.00 0.00 H new ATOM 0 HD11 ILE B 7 -1.773 -11.192 -0.499 1.00 0.00 H new ATOM 0 HD12 ILE B 7 -2.514 -9.588 -0.285 1.00 0.00 H new ATOM 0 HD13 ILE B 7 -1.445 -9.896 -1.674 1.00 0.00 H new ATOM 363 N ARG B 8 1.118 -7.149 -3.009 1.00 0.00 N ATOM 364 CA ARG B 8 1.031 -6.076 -4.028 1.00 0.00 C ATOM 365 C ARG B 8 -0.201 -6.230 -4.918 1.00 0.00 C ATOM 366 O ARG B 8 -0.557 -7.306 -5.374 1.00 0.00 O ATOM 367 CB ARG B 8 2.318 -6.205 -4.842 1.00 0.00 C ATOM 368 CG ARG B 8 3.459 -5.533 -4.074 1.00 0.00 C ATOM 369 CD ARG B 8 4.641 -5.280 -5.014 1.00 0.00 C ATOM 370 NE ARG B 8 4.486 -3.863 -5.447 1.00 0.00 N ATOM 371 CZ ARG B 8 4.802 -2.891 -4.633 1.00 0.00 C ATOM 372 NH1 ARG B 8 5.251 -3.160 -3.437 1.00 0.00 N ATOM 373 NH2 ARG B 8 4.666 -1.651 -5.015 1.00 0.00 N ATOM 0 H ARG B 8 1.278 -8.091 -3.366 1.00 0.00 H new ATOM 0 HA ARG B 8 0.929 -5.094 -3.566 1.00 0.00 H new ATOM 0 HB2 ARG B 8 2.549 -7.256 -5.018 1.00 0.00 H new ATOM 0 HB3 ARG B 8 2.195 -5.738 -5.819 1.00 0.00 H new ATOM 0 HG2 ARG B 8 3.116 -4.591 -3.646 1.00 0.00 H new ATOM 0 HG3 ARG B 8 3.772 -6.166 -3.244 1.00 0.00 H new ATOM 0 HD2 ARG B 8 5.592 -5.436 -4.505 1.00 0.00 H new ATOM 0 HD3 ARG B 8 4.621 -5.959 -5.867 1.00 0.00 H new ATOM 0 HE ARG B 8 4.133 -3.651 -6.380 1.00 0.00 H new ATOM 0 HH11 ARG B 8 5.355 -4.129 -3.138 1.00 0.00 H new ATOM 0 HH12 ARG B 8 5.498 -2.401 -2.802 1.00 0.00 H new ATOM 0 HH21 ARG B 8 4.313 -1.441 -5.949 1.00 0.00 H new ATOM 0 HH22 ARG B 8 4.912 -0.892 -4.380 1.00 0.00 H new ATOM 387 N ARG B 9 -0.836 -5.122 -5.155 1.00 0.00 N ATOM 388 CA ARG B 9 -2.049 -5.070 -6.003 1.00 0.00 C ATOM 389 C ARG B 9 -2.097 -3.689 -6.651 1.00 0.00 C ATOM 390 O ARG B 9 -1.596 -2.730 -6.096 1.00 0.00 O ATOM 391 CB ARG B 9 -3.227 -5.274 -5.052 1.00 0.00 C ATOM 392 CG ARG B 9 -4.223 -6.250 -5.681 1.00 0.00 C ATOM 393 CD ARG B 9 -5.047 -6.919 -4.581 1.00 0.00 C ATOM 394 NE ARG B 9 -5.927 -7.889 -5.292 1.00 0.00 N ATOM 395 CZ ARG B 9 -6.935 -7.459 -6.002 1.00 0.00 C ATOM 396 NH1 ARG B 9 -7.176 -6.178 -6.089 1.00 0.00 N ATOM 397 NH2 ARG B 9 -7.701 -8.311 -6.626 1.00 0.00 N ATOM 0 H ARG B 9 -0.551 -4.217 -4.780 1.00 0.00 H new ATOM 0 HA ARG B 9 -2.066 -5.823 -6.791 1.00 0.00 H new ATOM 0 HB2 ARG B 9 -2.874 -5.662 -4.096 1.00 0.00 H new ATOM 0 HB3 ARG B 9 -3.714 -4.320 -4.849 1.00 0.00 H new ATOM 0 HG2 ARG B 9 -4.880 -5.721 -6.371 1.00 0.00 H new ATOM 0 HG3 ARG B 9 -3.692 -7.004 -6.262 1.00 0.00 H new ATOM 0 HD2 ARG B 9 -4.405 -7.424 -3.859 1.00 0.00 H new ATOM 0 HD3 ARG B 9 -5.634 -6.186 -4.027 1.00 0.00 H new ATOM 0 HE ARG B 9 -5.742 -8.890 -5.224 1.00 0.00 H new ATOM 0 HH11 ARG B 9 -6.576 -5.512 -5.602 1.00 0.00 H new ATOM 0 HH12 ARG B 9 -7.964 -5.844 -6.644 1.00 0.00 H new ATOM 0 HH21 ARG B 9 -7.512 -9.311 -6.559 1.00 0.00 H new ATOM 0 HH22 ARG B 9 -8.489 -7.977 -7.181 1.00 0.00 H new ATOM 411 N HIS B 10 -2.667 -3.550 -7.806 1.00 0.00 N ATOM 412 CA HIS B 10 -2.679 -2.200 -8.423 1.00 0.00 C ATOM 413 C HIS B 10 -3.248 -1.207 -7.459 1.00 0.00 C ATOM 414 O HIS B 10 -4.151 -1.498 -6.707 1.00 0.00 O ATOM 415 CB HIS B 10 -3.665 -2.226 -9.529 1.00 0.00 C ATOM 416 CG HIS B 10 -3.148 -2.985 -10.719 1.00 0.00 C ATOM 417 ND1 HIS B 10 -2.458 -2.364 -11.747 1.00 0.00 N ATOM 418 CD2 HIS B 10 -3.230 -4.310 -11.068 1.00 0.00 C ATOM 419 CE1 HIS B 10 -2.154 -3.307 -12.659 1.00 0.00 C ATOM 420 NE2 HIS B 10 -2.603 -4.510 -12.294 1.00 0.00 N ATOM 0 H HIS B 10 -3.117 -4.292 -8.342 1.00 0.00 H new ATOM 0 HA HIS B 10 -1.665 -1.943 -8.729 1.00 0.00 H new ATOM 0 HB2 HIS B 10 -4.591 -2.684 -9.180 1.00 0.00 H new ATOM 0 HB3 HIS B 10 -3.906 -1.205 -9.825 1.00 0.00 H new ATOM 0 HD1 HIS B 10 -2.223 -1.373 -11.803 1.00 0.00 H new ATOM 0 HD2 HIS B 10 -3.708 -5.080 -10.481 1.00 0.00 H new ATOM 0 HE1 HIS B 10 -1.613 -3.114 -13.574 1.00 0.00 H new ATOM 428 N LYS B 11 -2.735 -0.040 -7.496 1.00 0.00 N ATOM 429 CA LYS B 11 -3.223 1.027 -6.585 1.00 0.00 C ATOM 430 C LYS B 11 -3.416 0.450 -5.184 1.00 0.00 C ATOM 431 O LYS B 11 -3.400 1.162 -4.200 1.00 0.00 O ATOM 432 CB LYS B 11 -4.561 1.474 -7.174 1.00 0.00 C ATOM 433 CG LYS B 11 -4.347 2.713 -8.045 1.00 0.00 C ATOM 434 CD LYS B 11 -5.653 3.506 -8.135 1.00 0.00 C ATOM 435 CE LYS B 11 -6.483 2.993 -9.313 1.00 0.00 C ATOM 436 NZ LYS B 11 -7.728 3.809 -9.289 1.00 0.00 N ATOM 0 H LYS B 11 -1.983 0.242 -8.125 1.00 0.00 H new ATOM 0 HA LYS B 11 -2.525 1.860 -6.501 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -4.996 0.670 -7.768 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -5.267 1.697 -6.374 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -3.559 3.336 -7.622 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -4.019 2.418 -9.042 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -6.217 3.404 -7.208 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -5.438 4.567 -8.263 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -5.949 3.115 -10.255 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -6.705 1.931 -9.207 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -8.350 3.516 -10.069 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -8.218 3.668 -8.383 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -7.486 4.815 -9.398 1.00 0.00 H new ATOM 450 N THR B 12 -3.613 -0.841 -5.084 1.00 0.00 N ATOM 451 CA THR B 12 -3.823 -1.443 -3.727 1.00 0.00 C ATOM 452 C THR B 12 -2.603 -2.246 -3.247 1.00 0.00 C ATOM 453 O THR B 12 -2.243 -3.260 -3.813 1.00 0.00 O ATOM 454 CB THR B 12 -5.027 -2.370 -3.872 1.00 0.00 C ATOM 455 OG1 THR B 12 -5.618 -2.194 -5.150 1.00 0.00 O ATOM 456 CG2 THR B 12 -6.048 -2.045 -2.784 1.00 0.00 C ATOM 0 H THR B 12 -3.638 -1.496 -5.866 1.00 0.00 H new ATOM 0 HA THR B 12 -3.979 -0.659 -2.986 1.00 0.00 H new ATOM 0 HB THR B 12 -4.702 -3.405 -3.770 1.00 0.00 H new ATOM 0 HG1 THR B 12 -4.997 -2.501 -5.843 1.00 0.00 H new ATOM 0 HG21 THR B 12 -6.909 -2.705 -2.885 1.00 0.00 H new ATOM 0 HG22 THR B 12 -5.593 -2.188 -1.804 1.00 0.00 H new ATOM 0 HG23 THR B 12 -6.371 -1.009 -2.886 1.00 0.00 H new ATOM 464 N THR B 13 -1.994 -1.804 -2.178 1.00 0.00 N ATOM 465 CA THR B 13 -0.819 -2.527 -1.594 1.00 0.00 C ATOM 466 C THR B 13 -1.029 -2.686 -0.085 1.00 0.00 C ATOM 467 O THR B 13 -1.119 -1.714 0.637 1.00 0.00 O ATOM 468 CB THR B 13 0.387 -1.630 -1.879 1.00 0.00 C ATOM 469 OG1 THR B 13 0.175 -0.929 -3.097 1.00 0.00 O ATOM 470 CG2 THR B 13 1.647 -2.489 -1.994 1.00 0.00 C ATOM 0 H THR B 13 -2.264 -0.959 -1.675 1.00 0.00 H new ATOM 0 HA THR B 13 -0.682 -3.523 -2.016 1.00 0.00 H new ATOM 0 HB THR B 13 0.511 -0.916 -1.065 1.00 0.00 H new ATOM 0 HG1 THR B 13 -0.327 -0.107 -2.918 1.00 0.00 H new ATOM 0 HG21 THR B 13 2.506 -1.850 -2.197 1.00 0.00 H new ATOM 0 HG22 THR B 13 1.808 -3.026 -1.059 1.00 0.00 H new ATOM 0 HG23 THR B 13 1.527 -3.204 -2.808 1.00 0.00 H new ATOM 478 N ILE B 14 -1.109 -3.893 0.403 1.00 0.00 N ATOM 479 CA ILE B 14 -1.319 -4.076 1.870 1.00 0.00 C ATOM 480 C ILE B 14 -0.081 -4.688 2.514 1.00 0.00 C ATOM 481 O ILE B 14 0.446 -5.680 2.052 1.00 0.00 O ATOM 482 CB ILE B 14 -2.516 -5.033 2.001 1.00 0.00 C ATOM 483 CG1 ILE B 14 -3.435 -4.564 3.129 1.00 0.00 C ATOM 484 CG2 ILE B 14 -2.024 -6.446 2.332 1.00 0.00 C ATOM 485 CD1 ILE B 14 -2.711 -4.716 4.468 1.00 0.00 C ATOM 0 H ILE B 14 -1.039 -4.753 -0.142 1.00 0.00 H new ATOM 0 HA ILE B 14 -1.503 -3.125 2.371 1.00 0.00 H new ATOM 0 HB ILE B 14 -3.058 -5.041 1.055 1.00 0.00 H new ATOM 0 HG12 ILE B 14 -3.720 -3.524 2.973 1.00 0.00 H new ATOM 0 HG13 ILE B 14 -4.355 -5.149 3.131 1.00 0.00 H new ATOM 0 HG21 ILE B 14 -2.878 -7.117 2.423 1.00 0.00 H new ATOM 0 HG22 ILE B 14 -1.369 -6.799 1.536 1.00 0.00 H new ATOM 0 HG23 ILE B 14 -1.475 -6.429 3.273 1.00 0.00 H new ATOM 0 HD11 ILE B 14 -3.364 -4.382 5.275 1.00 0.00 H new ATOM 0 HD12 ILE B 14 -2.449 -5.763 4.623 1.00 0.00 H new ATOM 0 HD13 ILE B 14 -1.804 -4.112 4.462 1.00 0.00 H new ATOM 497 N PHE B 15 0.371 -4.129 3.600 1.00 0.00 N ATOM 498 CA PHE B 15 1.550 -4.723 4.277 1.00 0.00 C ATOM 499 C PHE B 15 1.049 -5.839 5.188 1.00 0.00 C ATOM 500 O PHE B 15 0.332 -5.604 6.141 1.00 0.00 O ATOM 501 CB PHE B 15 2.169 -3.585 5.092 1.00 0.00 C ATOM 502 CG PHE B 15 3.623 -3.429 4.717 1.00 0.00 C ATOM 503 CD1 PHE B 15 3.970 -2.978 3.438 1.00 0.00 C ATOM 504 CD2 PHE B 15 4.622 -3.735 5.648 1.00 0.00 C ATOM 505 CE1 PHE B 15 5.319 -2.832 3.091 1.00 0.00 C ATOM 506 CE2 PHE B 15 5.971 -3.589 5.300 1.00 0.00 C ATOM 507 CZ PHE B 15 6.319 -3.138 4.022 1.00 0.00 C ATOM 0 H PHE B 15 -0.020 -3.297 4.042 1.00 0.00 H new ATOM 0 HA PHE B 15 2.284 -5.144 3.589 1.00 0.00 H new ATOM 0 HB2 PHE B 15 1.632 -2.655 4.904 1.00 0.00 H new ATOM 0 HB3 PHE B 15 2.078 -3.795 6.158 1.00 0.00 H new ATOM 0 HD1 PHE B 15 3.198 -2.743 2.720 1.00 0.00 H new ATOM 0 HD2 PHE B 15 4.353 -4.084 6.634 1.00 0.00 H new ATOM 0 HE1 PHE B 15 5.588 -2.483 2.105 1.00 0.00 H new ATOM 0 HE2 PHE B 15 6.742 -3.825 6.018 1.00 0.00 H new ATOM 0 HZ PHE B 15 7.359 -3.026 3.754 1.00 0.00 H new ATOM 517 N THR B 16 1.393 -7.055 4.883 1.00 0.00 N ATOM 518 CA THR B 16 0.909 -8.193 5.707 1.00 0.00 C ATOM 519 C THR B 16 2.057 -8.797 6.517 1.00 0.00 C ATOM 520 O THR B 16 3.180 -8.874 6.061 1.00 0.00 O ATOM 521 CB THR B 16 0.377 -9.204 4.693 1.00 0.00 C ATOM 522 OG1 THR B 16 -0.382 -10.196 5.367 1.00 0.00 O ATOM 523 CG2 THR B 16 1.552 -9.863 3.979 1.00 0.00 C ATOM 0 H THR B 16 1.990 -7.311 4.097 1.00 0.00 H new ATOM 0 HA THR B 16 0.149 -7.889 6.426 1.00 0.00 H new ATOM 0 HB THR B 16 -0.256 -8.695 3.966 1.00 0.00 H new ATOM 0 HG1 THR B 16 -1.009 -10.611 4.739 1.00 0.00 H new ATOM 0 HG21 THR B 16 1.178 -10.586 3.254 1.00 0.00 H new ATOM 0 HG22 THR B 16 2.138 -9.102 3.464 1.00 0.00 H new ATOM 0 HG23 THR B 16 2.181 -10.373 4.708 1.00 0.00 H new ATOM 531 N ASP B 17 1.787 -9.232 7.714 1.00 0.00 N ATOM 532 CA ASP B 17 2.867 -9.837 8.544 1.00 0.00 C ATOM 533 C ASP B 17 2.476 -11.256 8.960 1.00 0.00 C ATOM 534 O ASP B 17 1.326 -11.540 9.233 1.00 0.00 O ATOM 535 CB ASP B 17 2.978 -8.929 9.770 1.00 0.00 C ATOM 536 CG ASP B 17 4.162 -9.375 10.629 1.00 0.00 C ATOM 537 OD1 ASP B 17 5.284 -9.248 10.168 1.00 0.00 O ATOM 538 OD2 ASP B 17 3.926 -9.835 11.734 1.00 0.00 O ATOM 0 H ASP B 17 0.868 -9.196 8.154 1.00 0.00 H new ATOM 0 HA ASP B 17 3.812 -9.912 8.006 1.00 0.00 H new ATOM 0 HB2 ASP B 17 3.111 -7.893 9.458 1.00 0.00 H new ATOM 0 HB3 ASP B 17 2.057 -8.971 10.351 1.00 0.00 H new ATOM 543 N ALA B 18 3.425 -12.149 9.012 1.00 0.00 N ATOM 544 CA ALA B 18 3.112 -13.551 9.411 1.00 0.00 C ATOM 545 C ALA B 18 4.390 -14.269 9.849 1.00 0.00 C ATOM 546 O ALA B 18 5.481 -13.758 9.701 1.00 0.00 O ATOM 547 CB ALA B 18 2.535 -14.201 8.154 1.00 0.00 C ATOM 0 H ALA B 18 4.405 -11.969 8.795 1.00 0.00 H new ATOM 0 HA ALA B 18 2.416 -13.599 10.249 1.00 0.00 H new ATOM 0 HB1 ALA B 18 2.278 -15.239 8.366 1.00 0.00 H new ATOM 0 HB2 ALA B 18 1.640 -13.662 7.844 1.00 0.00 H new ATOM 0 HB3 ALA B 18 3.275 -14.166 7.354 1.00 0.00 H new ATOM 553 N LYS B 19 4.267 -15.454 10.379 1.00 0.00 N ATOM 554 CA LYS B 19 5.480 -16.200 10.814 1.00 0.00 C ATOM 555 C LYS B 19 5.989 -17.077 9.666 1.00 0.00 C ATOM 556 O LYS B 19 5.217 -17.597 8.884 1.00 0.00 O ATOM 557 CB LYS B 19 5.017 -17.066 11.985 1.00 0.00 C ATOM 558 CG LYS B 19 4.598 -16.167 13.150 1.00 0.00 C ATOM 559 CD LYS B 19 3.072 -16.092 13.214 1.00 0.00 C ATOM 560 CE LYS B 19 2.524 -17.358 13.878 1.00 0.00 C ATOM 561 NZ LYS B 19 1.043 -17.206 13.830 1.00 0.00 N ATOM 0 H LYS B 19 3.381 -15.937 10.529 1.00 0.00 H new ATOM 0 HA LYS B 19 6.296 -15.537 11.100 1.00 0.00 H new ATOM 0 HB2 LYS B 19 4.181 -17.695 11.678 1.00 0.00 H new ATOM 0 HB3 LYS B 19 5.820 -17.734 12.297 1.00 0.00 H new ATOM 0 HG2 LYS B 19 4.993 -16.560 14.087 1.00 0.00 H new ATOM 0 HG3 LYS B 19 5.017 -15.169 13.022 1.00 0.00 H new ATOM 0 HD2 LYS B 19 2.764 -15.211 13.777 1.00 0.00 H new ATOM 0 HD3 LYS B 19 2.660 -15.988 12.210 1.00 0.00 H new ATOM 0 HE2 LYS B 19 2.847 -18.254 13.347 1.00 0.00 H new ATOM 0 HE3 LYS B 19 2.879 -17.451 14.905 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 0.593 -18.106 14.093 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 0.748 -16.464 14.496 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 0.752 -16.942 12.867 1.00 0.00 H new ATOM 575 N GLU B 20 7.277 -17.249 9.557 1.00 0.00 N ATOM 576 CA GLU B 20 7.820 -18.095 8.458 1.00 0.00 C ATOM 577 C GLU B 20 7.223 -19.500 8.542 1.00 0.00 C ATOM 578 O GLU B 20 7.099 -20.194 7.553 1.00 0.00 O ATOM 579 CB GLU B 20 9.329 -18.139 8.695 1.00 0.00 C ATOM 580 CG GLU B 20 9.995 -18.960 7.589 1.00 0.00 C ATOM 581 CD GLU B 20 10.986 -19.947 8.210 1.00 0.00 C ATOM 582 OE1 GLU B 20 10.702 -20.438 9.291 1.00 0.00 O ATOM 583 OE2 GLU B 20 12.012 -20.192 7.597 1.00 0.00 O ATOM 0 H GLU B 20 7.975 -16.842 10.179 1.00 0.00 H new ATOM 0 HA GLU B 20 7.578 -17.700 7.471 1.00 0.00 H new ATOM 0 HB2 GLU B 20 9.736 -17.128 8.707 1.00 0.00 H new ATOM 0 HB3 GLU B 20 9.542 -18.580 9.669 1.00 0.00 H new ATOM 0 HG2 GLU B 20 9.240 -19.499 7.017 1.00 0.00 H new ATOM 0 HG3 GLU B 20 10.512 -18.300 6.893 1.00 0.00 H new ATOM 590 N SER B 21 6.848 -19.921 9.719 1.00 0.00 N ATOM 591 CA SER B 21 6.254 -21.279 9.871 1.00 0.00 C ATOM 592 C SER B 21 4.736 -21.170 10.036 1.00 0.00 C ATOM 593 O SER B 21 4.065 -22.136 10.344 1.00 0.00 O ATOM 594 CB SER B 21 6.893 -21.852 11.135 1.00 0.00 C ATOM 595 OG SER B 21 6.180 -23.015 11.535 1.00 0.00 O ATOM 0 H SER B 21 6.927 -19.383 10.582 1.00 0.00 H new ATOM 0 HA SER B 21 6.436 -21.912 9.003 1.00 0.00 H new ATOM 0 HB2 SER B 21 7.938 -22.098 10.949 1.00 0.00 H new ATOM 0 HB3 SER B 21 6.878 -21.110 11.933 1.00 0.00 H new ATOM 0 HG SER B 21 5.256 -22.958 11.215 1.00 0.00 H new ATOM 601 N SER B 22 4.189 -20.003 9.827 1.00 0.00 N ATOM 602 CA SER B 22 2.715 -19.838 9.964 1.00 0.00 C ATOM 603 C SER B 22 2.005 -20.689 8.916 1.00 0.00 C ATOM 604 O SER B 22 1.804 -21.874 9.094 1.00 0.00 O ATOM 605 CB SER B 22 2.459 -18.350 9.722 1.00 0.00 C ATOM 606 OG SER B 22 1.109 -18.168 9.316 1.00 0.00 O ATOM 0 H SER B 22 4.699 -19.158 9.568 1.00 0.00 H new ATOM 0 HA SER B 22 2.344 -20.155 10.939 1.00 0.00 H new ATOM 0 HB2 SER B 22 2.658 -17.782 10.631 1.00 0.00 H new ATOM 0 HB3 SER B 22 3.136 -17.972 8.956 1.00 0.00 H new ATOM 0 HG SER B 22 0.944 -17.217 9.146 1.00 0.00 H new ATOM 612 N THR B 23 1.630 -20.096 7.821 1.00 0.00 N ATOM 613 CA THR B 23 0.938 -20.875 6.756 1.00 0.00 C ATOM 614 C THR B 23 0.424 -19.935 5.666 1.00 0.00 C ATOM 615 O THR B 23 -0.378 -19.058 5.920 1.00 0.00 O ATOM 616 CB THR B 23 -0.231 -21.571 7.458 1.00 0.00 C ATOM 617 OG1 THR B 23 -1.183 -21.985 6.487 1.00 0.00 O ATOM 618 CG2 THR B 23 -0.894 -20.603 8.442 1.00 0.00 C ATOM 0 H THR B 23 1.771 -19.107 7.615 1.00 0.00 H new ATOM 0 HA THR B 23 1.604 -21.591 6.274 1.00 0.00 H new ATOM 0 HB THR B 23 0.139 -22.439 8.003 1.00 0.00 H new ATOM 0 HG1 THR B 23 -1.932 -22.432 6.933 1.00 0.00 H new ATOM 0 HG21 THR B 23 -1.725 -21.102 8.939 1.00 0.00 H new ATOM 0 HG22 THR B 23 -0.164 -20.284 9.186 1.00 0.00 H new ATOM 0 HG23 THR B 23 -1.265 -19.732 7.902 1.00 0.00 H new ATOM 626 N VAL B 24 0.871 -20.114 4.453 1.00 0.00 N ATOM 627 CA VAL B 24 0.394 -19.230 3.353 1.00 0.00 C ATOM 628 C VAL B 24 -1.112 -19.007 3.498 1.00 0.00 C ATOM 629 O VAL B 24 -1.648 -18.002 3.075 1.00 0.00 O ATOM 630 CB VAL B 24 0.709 -19.988 2.062 1.00 0.00 C ATOM 631 CG1 VAL B 24 0.433 -19.085 0.859 1.00 0.00 C ATOM 632 CG2 VAL B 24 2.183 -20.399 2.061 1.00 0.00 C ATOM 0 H VAL B 24 1.543 -20.831 4.177 1.00 0.00 H new ATOM 0 HA VAL B 24 0.871 -18.250 3.364 1.00 0.00 H new ATOM 0 HB VAL B 24 0.081 -20.877 2.000 1.00 0.00 H new ATOM 0 HG11 VAL B 24 0.658 -19.625 -0.061 1.00 0.00 H new ATOM 0 HG12 VAL B 24 -0.616 -18.789 0.859 1.00 0.00 H new ATOM 0 HG13 VAL B 24 1.061 -18.196 0.920 1.00 0.00 H new ATOM 0 HG21 VAL B 24 2.409 -20.939 1.142 1.00 0.00 H new ATOM 0 HG22 VAL B 24 2.809 -19.509 2.122 1.00 0.00 H new ATOM 0 HG23 VAL B 24 2.382 -21.042 2.918 1.00 0.00 H new ATOM 642 N PHE B 25 -1.796 -19.940 4.107 1.00 0.00 N ATOM 643 CA PHE B 25 -3.264 -19.785 4.295 1.00 0.00 C ATOM 644 C PHE B 25 -3.542 -18.647 5.281 1.00 0.00 C ATOM 645 O PHE B 25 -4.400 -17.817 5.057 1.00 0.00 O ATOM 646 CB PHE B 25 -3.733 -21.121 4.871 1.00 0.00 C ATOM 647 CG PHE B 25 -4.767 -21.729 3.954 1.00 0.00 C ATOM 648 CD1 PHE B 25 -5.697 -20.907 3.306 1.00 0.00 C ATOM 649 CD2 PHE B 25 -4.796 -23.114 3.752 1.00 0.00 C ATOM 650 CE1 PHE B 25 -6.655 -21.471 2.455 1.00 0.00 C ATOM 651 CE2 PHE B 25 -5.754 -23.677 2.901 1.00 0.00 C ATOM 652 CZ PHE B 25 -6.684 -22.856 2.253 1.00 0.00 C ATOM 0 H PHE B 25 -1.399 -20.802 4.481 1.00 0.00 H new ATOM 0 HA PHE B 25 -3.781 -19.541 3.367 1.00 0.00 H new ATOM 0 HB2 PHE B 25 -2.886 -21.799 4.982 1.00 0.00 H new ATOM 0 HB3 PHE B 25 -4.155 -20.973 5.865 1.00 0.00 H new ATOM 0 HD1 PHE B 25 -5.675 -19.839 3.463 1.00 0.00 H new ATOM 0 HD2 PHE B 25 -4.079 -23.748 4.253 1.00 0.00 H new ATOM 0 HE1 PHE B 25 -7.372 -20.837 1.954 1.00 0.00 H new ATOM 0 HE2 PHE B 25 -5.776 -24.745 2.744 1.00 0.00 H new ATOM 0 HZ PHE B 25 -7.424 -23.291 1.597 1.00 0.00 H new ATOM 662 N GLU B 26 -2.819 -18.598 6.369 1.00 0.00 N ATOM 663 CA GLU B 26 -3.045 -17.506 7.358 1.00 0.00 C ATOM 664 C GLU B 26 -2.889 -16.151 6.667 1.00 0.00 C ATOM 665 O GLU B 26 -3.724 -15.277 6.798 1.00 0.00 O ATOM 666 CB GLU B 26 -1.966 -17.697 8.423 1.00 0.00 C ATOM 667 CG GLU B 26 -1.906 -16.456 9.316 1.00 0.00 C ATOM 668 CD GLU B 26 -1.286 -16.826 10.665 1.00 0.00 C ATOM 669 OE1 GLU B 26 -1.913 -17.575 11.397 1.00 0.00 O ATOM 670 OE2 GLU B 26 -0.197 -16.355 10.943 1.00 0.00 O ATOM 0 H GLU B 26 -2.086 -19.264 6.614 1.00 0.00 H new ATOM 0 HA GLU B 26 -4.044 -17.536 7.793 1.00 0.00 H new ATOM 0 HB2 GLU B 26 -2.185 -18.580 9.023 1.00 0.00 H new ATOM 0 HB3 GLU B 26 -0.999 -17.865 7.950 1.00 0.00 H new ATOM 0 HG2 GLU B 26 -1.316 -15.677 8.834 1.00 0.00 H new ATOM 0 HG3 GLU B 26 -2.908 -16.052 9.463 1.00 0.00 H new ATOM 677 N LEU B 27 -1.839 -15.975 5.912 1.00 0.00 N ATOM 678 CA LEU B 27 -1.655 -14.679 5.196 1.00 0.00 C ATOM 679 C LEU B 27 -2.813 -14.485 4.215 1.00 0.00 C ATOM 680 O LEU B 27 -3.259 -13.383 3.965 1.00 0.00 O ATOM 681 CB LEU B 27 -0.328 -14.818 4.448 1.00 0.00 C ATOM 682 CG LEU B 27 0.823 -14.410 5.369 1.00 0.00 C ATOM 683 CD1 LEU B 27 2.118 -15.068 4.893 1.00 0.00 C ATOM 684 CD2 LEU B 27 0.983 -12.888 5.338 1.00 0.00 C ATOM 0 H LEU B 27 -1.105 -16.667 5.760 1.00 0.00 H new ATOM 0 HA LEU B 27 -1.642 -13.820 5.867 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -0.193 -15.847 4.114 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -0.334 -14.191 3.556 1.00 0.00 H new ATOM 0 HG LEU B 27 0.606 -14.734 6.387 1.00 0.00 H new ATOM 0 HD11 LEU B 27 2.937 -14.776 5.550 1.00 0.00 H new ATOM 0 HD12 LEU B 27 2.004 -16.152 4.914 1.00 0.00 H new ATOM 0 HD13 LEU B 27 2.337 -14.746 3.875 1.00 0.00 H new ATOM 0 HD21 LEU B 27 1.803 -12.595 5.994 1.00 0.00 H new ATOM 0 HD22 LEU B 27 1.200 -12.566 4.320 1.00 0.00 H new ATOM 0 HD23 LEU B 27 0.060 -12.418 5.679 1.00 0.00 H new ATOM 696 N LYS B 28 -3.304 -15.562 3.670 1.00 0.00 N ATOM 697 CA LYS B 28 -4.443 -15.483 2.711 1.00 0.00 C ATOM 698 C LYS B 28 -5.643 -14.793 3.365 1.00 0.00 C ATOM 699 O LYS B 28 -6.395 -14.089 2.721 1.00 0.00 O ATOM 700 CB LYS B 28 -4.777 -16.937 2.375 1.00 0.00 C ATOM 701 CG LYS B 28 -5.516 -16.995 1.036 1.00 0.00 C ATOM 702 CD LYS B 28 -6.993 -16.657 1.253 1.00 0.00 C ATOM 703 CE LYS B 28 -7.786 -17.004 -0.008 1.00 0.00 C ATOM 704 NZ LYS B 28 -7.429 -15.943 -0.990 1.00 0.00 N ATOM 0 H LYS B 28 -2.961 -16.506 3.850 1.00 0.00 H new ATOM 0 HA LYS B 28 -4.194 -14.905 1.821 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -3.863 -17.529 2.324 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -5.394 -17.371 3.162 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -5.071 -16.292 0.332 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -5.420 -17.989 0.598 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -7.383 -17.213 2.105 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -7.104 -15.598 1.486 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -7.521 -17.993 -0.381 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -8.858 -17.015 0.190 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -8.033 -16.032 -1.832 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -7.572 -15.008 -0.558 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -6.432 -16.047 -1.267 1.00 0.00 H new ATOM 718 N ARG B 29 -5.840 -15.008 4.638 1.00 0.00 N ATOM 719 CA ARG B 29 -7.006 -14.385 5.327 1.00 0.00 C ATOM 720 C ARG B 29 -6.940 -12.859 5.222 1.00 0.00 C ATOM 721 O ARG B 29 -7.949 -12.202 5.050 1.00 0.00 O ATOM 722 CB ARG B 29 -6.881 -14.825 6.786 1.00 0.00 C ATOM 723 CG ARG B 29 -8.229 -15.357 7.276 1.00 0.00 C ATOM 724 CD ARG B 29 -8.926 -14.285 8.116 1.00 0.00 C ATOM 725 NE ARG B 29 -10.260 -14.103 7.477 1.00 0.00 N ATOM 726 CZ ARG B 29 -11.218 -13.500 8.126 1.00 0.00 C ATOM 727 NH1 ARG B 29 -11.008 -13.052 9.334 1.00 0.00 N ATOM 728 NH2 ARG B 29 -12.386 -13.341 7.566 1.00 0.00 N ATOM 0 H ARG B 29 -5.245 -15.587 5.230 1.00 0.00 H new ATOM 0 HA ARG B 29 -7.954 -14.689 4.884 1.00 0.00 H new ATOM 0 HB2 ARG B 29 -6.117 -15.597 6.880 1.00 0.00 H new ATOM 0 HB3 ARG B 29 -6.563 -13.985 7.404 1.00 0.00 H new ATOM 0 HG2 ARG B 29 -8.854 -15.632 6.426 1.00 0.00 H new ATOM 0 HG3 ARG B 29 -8.082 -16.260 7.869 1.00 0.00 H new ATOM 0 HD2 ARG B 29 -9.025 -14.600 9.155 1.00 0.00 H new ATOM 0 HD3 ARG B 29 -8.359 -13.354 8.118 1.00 0.00 H new ATOM 0 HE ARG B 29 -10.424 -14.450 6.532 1.00 0.00 H new ATOM 0 HH11 ARG B 29 -10.094 -13.173 9.771 1.00 0.00 H new ATOM 0 HH12 ARG B 29 -11.757 -12.581 9.841 1.00 0.00 H new ATOM 0 HH21 ARG B 29 -12.550 -13.688 6.621 1.00 0.00 H new ATOM 0 HH22 ARG B 29 -13.135 -12.870 8.073 1.00 0.00 H new ATOM 742 N ILE B 30 -5.774 -12.283 5.312 1.00 0.00 N ATOM 743 CA ILE B 30 -5.679 -10.804 5.203 1.00 0.00 C ATOM 744 C ILE B 30 -6.228 -10.353 3.850 1.00 0.00 C ATOM 745 O ILE B 30 -6.931 -9.368 3.751 1.00 0.00 O ATOM 746 CB ILE B 30 -4.188 -10.502 5.317 1.00 0.00 C ATOM 747 CG1 ILE B 30 -3.846 -10.215 6.777 1.00 0.00 C ATOM 748 CG2 ILE B 30 -3.837 -9.283 4.462 1.00 0.00 C ATOM 749 CD1 ILE B 30 -2.337 -10.036 6.911 1.00 0.00 C ATOM 0 H ILE B 30 -4.889 -12.770 5.455 1.00 0.00 H new ATOM 0 HA ILE B 30 -6.254 -10.283 5.968 1.00 0.00 H new ATOM 0 HB ILE B 30 -3.616 -11.361 4.965 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -4.363 -9.316 7.114 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -4.185 -11.035 7.411 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -2.771 -9.073 4.548 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -4.084 -9.486 3.420 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -4.406 -8.420 4.808 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -2.086 -9.831 7.952 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -1.833 -10.947 6.589 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -2.013 -9.202 6.288 1.00 0.00 H new ATOM 761 N VAL B 31 -5.926 -11.076 2.807 1.00 0.00 N ATOM 762 CA VAL B 31 -6.446 -10.693 1.471 1.00 0.00 C ATOM 763 C VAL B 31 -7.978 -10.622 1.542 1.00 0.00 C ATOM 764 O VAL B 31 -8.589 -9.664 1.115 1.00 0.00 O ATOM 765 CB VAL B 31 -5.978 -11.815 0.547 1.00 0.00 C ATOM 766 CG1 VAL B 31 -7.000 -12.029 -0.563 1.00 0.00 C ATOM 767 CG2 VAL B 31 -4.631 -11.435 -0.071 1.00 0.00 C ATOM 0 H VAL B 31 -5.343 -11.913 2.825 1.00 0.00 H new ATOM 0 HA VAL B 31 -6.096 -9.722 1.121 1.00 0.00 H new ATOM 0 HB VAL B 31 -5.872 -12.735 1.122 1.00 0.00 H new ATOM 0 HG11 VAL B 31 -6.662 -12.830 -1.220 1.00 0.00 H new ATOM 0 HG12 VAL B 31 -7.961 -12.300 -0.126 1.00 0.00 H new ATOM 0 HG13 VAL B 31 -7.109 -11.110 -1.139 1.00 0.00 H new ATOM 0 HG21 VAL B 31 -4.295 -12.235 -0.731 1.00 0.00 H new ATOM 0 HG22 VAL B 31 -4.740 -10.514 -0.643 1.00 0.00 H new ATOM 0 HG23 VAL B 31 -3.897 -11.285 0.721 1.00 0.00 H new ATOM 777 N GLU B 32 -8.594 -11.627 2.109 1.00 0.00 N ATOM 778 CA GLU B 32 -10.080 -11.630 2.250 1.00 0.00 C ATOM 779 C GLU B 32 -10.487 -10.730 3.419 1.00 0.00 C ATOM 780 O GLU B 32 -11.654 -10.542 3.697 1.00 0.00 O ATOM 781 CB GLU B 32 -10.449 -13.085 2.539 1.00 0.00 C ATOM 782 CG GLU B 32 -11.946 -13.182 2.839 1.00 0.00 C ATOM 783 CD GLU B 32 -12.379 -14.650 2.813 1.00 0.00 C ATOM 784 OE1 GLU B 32 -11.868 -15.383 1.984 1.00 0.00 O ATOM 785 OE2 GLU B 32 -13.215 -15.014 3.623 1.00 0.00 O ATOM 0 H GLU B 32 -8.126 -12.453 2.483 1.00 0.00 H new ATOM 0 HA GLU B 32 -10.586 -11.255 1.360 1.00 0.00 H new ATOM 0 HB2 GLU B 32 -10.197 -13.712 1.684 1.00 0.00 H new ATOM 0 HB3 GLU B 32 -9.873 -13.456 3.387 1.00 0.00 H new ATOM 0 HG2 GLU B 32 -12.161 -12.746 3.815 1.00 0.00 H new ATOM 0 HG3 GLU B 32 -12.513 -12.612 2.103 1.00 0.00 H new ATOM 792 N GLY B 33 -9.526 -10.170 4.099 1.00 0.00 N ATOM 793 CA GLY B 33 -9.839 -9.276 5.246 1.00 0.00 C ATOM 794 C GLY B 33 -9.854 -7.828 4.757 1.00 0.00 C ATOM 795 O GLY B 33 -10.679 -7.032 5.157 1.00 0.00 O ATOM 0 H GLY B 33 -8.532 -10.295 3.908 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -10.806 -9.539 5.675 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -9.096 -9.400 6.034 1.00 0.00 H new ATOM 799 N ILE B 34 -8.953 -7.492 3.876 1.00 0.00 N ATOM 800 CA ILE B 34 -8.913 -6.103 3.334 1.00 0.00 C ATOM 801 C ILE B 34 -9.376 -6.127 1.878 1.00 0.00 C ATOM 802 O ILE B 34 -10.268 -5.405 1.482 1.00 0.00 O ATOM 803 CB ILE B 34 -7.450 -5.646 3.453 1.00 0.00 C ATOM 804 CG1 ILE B 34 -7.104 -4.681 2.305 1.00 0.00 C ATOM 805 CG2 ILE B 34 -6.499 -6.849 3.432 1.00 0.00 C ATOM 806 CD1 ILE B 34 -6.274 -5.403 1.240 1.00 0.00 C ATOM 0 H ILE B 34 -8.240 -8.121 3.506 1.00 0.00 H new ATOM 0 HA ILE B 34 -9.568 -5.419 3.873 1.00 0.00 H new ATOM 0 HB ILE B 34 -7.329 -5.129 4.405 1.00 0.00 H new ATOM 0 HG12 ILE B 34 -8.019 -4.290 1.860 1.00 0.00 H new ATOM 0 HG13 ILE B 34 -6.548 -3.827 2.693 1.00 0.00 H new ATOM 0 HG21 ILE B 34 -5.470 -6.501 3.517 1.00 0.00 H new ATOM 0 HG22 ILE B 34 -6.729 -7.509 4.268 1.00 0.00 H new ATOM 0 HG23 ILE B 34 -6.621 -7.393 2.495 1.00 0.00 H new ATOM 0 HD11 ILE B 34 -6.035 -4.710 0.433 1.00 0.00 H new ATOM 0 HD12 ILE B 34 -5.351 -5.772 1.687 1.00 0.00 H new ATOM 0 HD13 ILE B 34 -6.844 -6.242 0.841 1.00 0.00 H new ATOM 818 N LEU B 35 -8.783 -6.972 1.089 1.00 0.00 N ATOM 819 CA LEU B 35 -9.194 -7.075 -0.340 1.00 0.00 C ATOM 820 C LEU B 35 -10.412 -7.996 -0.448 1.00 0.00 C ATOM 821 O LEU B 35 -11.067 -8.066 -1.469 1.00 0.00 O ATOM 822 CB LEU B 35 -7.991 -7.685 -1.059 1.00 0.00 C ATOM 823 CG LEU B 35 -7.163 -6.571 -1.701 1.00 0.00 C ATOM 824 CD1 LEU B 35 -5.718 -7.041 -1.868 1.00 0.00 C ATOM 825 CD2 LEU B 35 -7.750 -6.228 -3.072 1.00 0.00 C ATOM 0 H LEU B 35 -8.029 -7.599 1.370 1.00 0.00 H new ATOM 0 HA LEU B 35 -9.470 -6.113 -0.771 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -7.379 -8.247 -0.354 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -8.327 -8.388 -1.821 1.00 0.00 H new ATOM 0 HG LEU B 35 -7.185 -5.687 -1.064 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -5.128 -6.247 -2.326 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -5.300 -7.287 -0.892 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -5.694 -7.924 -2.506 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -7.161 -5.434 -3.532 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -7.727 -7.112 -3.709 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -8.780 -5.893 -2.953 1.00 0.00 H new ATOM 837 N LYS B 36 -10.725 -8.690 0.613 1.00 0.00 N ATOM 838 CA LYS B 36 -11.907 -9.598 0.601 1.00 0.00 C ATOM 839 C LYS B 36 -11.854 -10.567 -0.586 1.00 0.00 C ATOM 840 O LYS B 36 -12.836 -10.751 -1.277 1.00 0.00 O ATOM 841 CB LYS B 36 -13.114 -8.669 0.475 1.00 0.00 C ATOM 842 CG LYS B 36 -14.346 -9.351 1.072 1.00 0.00 C ATOM 843 CD LYS B 36 -15.612 -8.693 0.522 1.00 0.00 C ATOM 844 CE LYS B 36 -16.561 -8.362 1.676 1.00 0.00 C ATOM 845 NZ LYS B 36 -17.927 -8.589 1.128 1.00 0.00 N ATOM 0 H LYS B 36 -10.209 -8.666 1.493 1.00 0.00 H new ATOM 0 HA LYS B 36 -11.947 -10.216 1.498 1.00 0.00 H new ATOM 0 HB2 LYS B 36 -12.919 -7.729 0.992 1.00 0.00 H new ATOM 0 HB3 LYS B 36 -13.291 -8.426 -0.573 1.00 0.00 H new ATOM 0 HG2 LYS B 36 -14.340 -10.413 0.828 1.00 0.00 H new ATOM 0 HG3 LYS B 36 -14.326 -9.274 2.159 1.00 0.00 H new ATOM 0 HD2 LYS B 36 -15.355 -7.785 -0.023 1.00 0.00 H new ATOM 0 HD3 LYS B 36 -16.103 -9.361 -0.186 1.00 0.00 H new ATOM 0 HE2 LYS B 36 -16.371 -9.000 2.539 1.00 0.00 H new ATOM 0 HE3 LYS B 36 -16.435 -7.331 2.008 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 -18.634 -8.382 1.862 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 -18.082 -7.963 0.312 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 -18.020 -9.580 0.827 1.00 0.00 H new ATOM 859 N ARG B 37 -10.734 -11.197 -0.834 1.00 0.00 N ATOM 860 CA ARG B 37 -10.684 -12.148 -1.983 1.00 0.00 C ATOM 861 C ARG B 37 -10.966 -13.573 -1.495 1.00 0.00 C ATOM 862 O ARG B 37 -10.360 -14.036 -0.548 1.00 0.00 O ATOM 863 CB ARG B 37 -9.264 -12.045 -2.541 1.00 0.00 C ATOM 864 CG ARG B 37 -8.852 -10.574 -2.648 1.00 0.00 C ATOM 865 CD ARG B 37 -9.320 -10.009 -3.991 1.00 0.00 C ATOM 866 NE ARG B 37 -10.218 -8.874 -3.638 1.00 0.00 N ATOM 867 CZ ARG B 37 -11.014 -8.366 -4.538 1.00 0.00 C ATOM 868 NH1 ARG B 37 -11.027 -8.851 -5.750 1.00 0.00 N ATOM 869 NH2 ARG B 37 -11.800 -7.371 -4.227 1.00 0.00 N ATOM 0 H ARG B 37 -9.869 -11.097 -0.303 1.00 0.00 H new ATOM 0 HA ARG B 37 -11.430 -11.912 -2.742 1.00 0.00 H new ATOM 0 HB2 ARG B 37 -8.570 -12.580 -1.893 1.00 0.00 H new ATOM 0 HB3 ARG B 37 -9.214 -12.518 -3.522 1.00 0.00 H new ATOM 0 HG2 ARG B 37 -9.289 -10.003 -1.829 1.00 0.00 H new ATOM 0 HG3 ARG B 37 -7.770 -10.481 -2.560 1.00 0.00 H new ATOM 0 HD2 ARG B 37 -8.476 -9.672 -4.593 1.00 0.00 H new ATOM 0 HD3 ARG B 37 -9.848 -10.763 -4.575 1.00 0.00 H new ATOM 0 HE ARG B 37 -10.210 -8.494 -2.692 1.00 0.00 H new ATOM 0 HH11 ARG B 37 -10.414 -9.629 -5.995 1.00 0.00 H new ATOM 0 HH12 ARG B 37 -11.650 -8.452 -6.452 1.00 0.00 H new ATOM 0 HH21 ARG B 37 -11.792 -6.991 -3.280 1.00 0.00 H new ATOM 0 HH22 ARG B 37 -12.422 -6.974 -4.931 1.00 0.00 H new ATOM 883 N PRO B 38 -11.882 -14.221 -2.164 1.00 0.00 N ATOM 884 CA PRO B 38 -12.256 -15.610 -1.798 1.00 0.00 C ATOM 885 C PRO B 38 -11.164 -16.595 -2.226 1.00 0.00 C ATOM 886 O PRO B 38 -10.533 -16.417 -3.249 1.00 0.00 O ATOM 887 CB PRO B 38 -13.541 -15.853 -2.585 1.00 0.00 C ATOM 888 CG PRO B 38 -13.471 -14.912 -3.746 1.00 0.00 C ATOM 889 CD PRO B 38 -12.654 -13.724 -3.309 1.00 0.00 C ATOM 0 HA PRO B 38 -12.383 -15.748 -0.724 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -13.608 -16.888 -2.920 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -14.421 -15.658 -1.972 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -13.013 -15.398 -4.608 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -14.471 -14.601 -4.050 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -12.001 -13.374 -4.108 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -13.290 -12.885 -3.027 1.00 0.00 H new ATOM 897 N PRO B 39 -10.981 -17.606 -1.421 1.00 0.00 N ATOM 898 CA PRO B 39 -9.958 -18.638 -1.712 1.00 0.00 C ATOM 899 C PRO B 39 -10.446 -19.577 -2.821 1.00 0.00 C ATOM 900 O PRO B 39 -11.039 -20.605 -2.560 1.00 0.00 O ATOM 901 CB PRO B 39 -9.820 -19.387 -0.390 1.00 0.00 C ATOM 902 CG PRO B 39 -11.124 -19.181 0.317 1.00 0.00 C ATOM 903 CD PRO B 39 -11.704 -17.878 -0.175 1.00 0.00 C ATOM 0 HA PRO B 39 -9.014 -18.219 -2.061 1.00 0.00 H new ATOM 0 HB2 PRO B 39 -9.626 -20.447 -0.556 1.00 0.00 H new ATOM 0 HB3 PRO B 39 -8.988 -18.999 0.197 1.00 0.00 H new ATOM 0 HG2 PRO B 39 -11.806 -20.006 0.112 1.00 0.00 H new ATOM 0 HG3 PRO B 39 -10.975 -19.151 1.396 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -12.777 -17.961 -0.348 1.00 0.00 H new ATOM 0 HD3 PRO B 39 -11.559 -17.079 0.552 1.00 0.00 H new ATOM 911 N ASP B 40 -10.203 -19.232 -4.056 1.00 0.00 N ATOM 912 CA ASP B 40 -10.653 -20.106 -5.177 1.00 0.00 C ATOM 913 C ASP B 40 -10.111 -19.580 -6.509 1.00 0.00 C ATOM 914 O ASP B 40 -9.105 -20.044 -7.008 1.00 0.00 O ATOM 915 CB ASP B 40 -12.180 -20.028 -5.152 1.00 0.00 C ATOM 916 CG ASP B 40 -12.754 -21.380 -4.728 1.00 0.00 C ATOM 917 OD1 ASP B 40 -12.001 -22.182 -4.199 1.00 0.00 O ATOM 918 OD2 ASP B 40 -13.936 -21.593 -4.939 1.00 0.00 O ATOM 0 H ASP B 40 -9.713 -18.383 -4.337 1.00 0.00 H new ATOM 0 HA ASP B 40 -10.295 -21.130 -5.071 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -12.504 -19.251 -4.460 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -12.557 -19.754 -6.137 1.00 0.00 H new ATOM 923 N GLU B 41 -10.769 -18.612 -7.087 1.00 0.00 N ATOM 924 CA GLU B 41 -10.290 -18.055 -8.385 1.00 0.00 C ATOM 925 C GLU B 41 -9.249 -16.960 -8.137 1.00 0.00 C ATOM 926 O GLU B 41 -9.210 -15.961 -8.827 1.00 0.00 O ATOM 927 CB GLU B 41 -11.537 -17.468 -9.048 1.00 0.00 C ATOM 928 CG GLU B 41 -11.727 -18.096 -10.430 1.00 0.00 C ATOM 929 CD GLU B 41 -13.161 -18.610 -10.566 1.00 0.00 C ATOM 930 OE1 GLU B 41 -13.806 -18.785 -9.545 1.00 0.00 O ATOM 931 OE2 GLU B 41 -13.591 -18.819 -11.688 1.00 0.00 O ATOM 0 H GLU B 41 -11.617 -18.183 -6.717 1.00 0.00 H new ATOM 0 HA GLU B 41 -9.814 -18.811 -9.009 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -12.414 -17.656 -8.428 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -11.438 -16.386 -9.139 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -11.518 -17.360 -11.207 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -11.021 -18.915 -10.569 1.00 0.00 H new ATOM 938 N GLN B 42 -8.406 -17.142 -7.158 1.00 0.00 N ATOM 939 CA GLN B 42 -7.369 -16.112 -6.864 1.00 0.00 C ATOM 940 C GLN B 42 -5.984 -16.761 -6.794 1.00 0.00 C ATOM 941 O GLN B 42 -5.844 -17.912 -6.430 1.00 0.00 O ATOM 942 CB GLN B 42 -7.758 -15.540 -5.500 1.00 0.00 C ATOM 943 CG GLN B 42 -7.641 -16.633 -4.436 1.00 0.00 C ATOM 944 CD GLN B 42 -6.252 -16.579 -3.799 1.00 0.00 C ATOM 945 OE1 GLN B 42 -5.761 -15.427 -3.429 1.00 0.00 O flip ATOM 946 NE2 GLN B 42 -5.606 -17.594 -3.634 1.00 0.00 N flip ATOM 0 H GLN B 42 -8.390 -17.960 -6.548 1.00 0.00 H new ATOM 0 HA GLN B 42 -7.322 -15.342 -7.634 1.00 0.00 H new ATOM 0 HB2 GLN B 42 -7.110 -14.701 -5.247 1.00 0.00 H new ATOM 0 HB3 GLN B 42 -8.778 -15.157 -5.532 1.00 0.00 H new ATOM 0 HG2 GLN B 42 -8.408 -16.496 -3.673 1.00 0.00 H new ATOM 0 HG3 GLN B 42 -7.809 -17.612 -4.885 1.00 0.00 H new ATOM 0 HE21 GLN B 42 -5.988 -18.494 -3.923 1.00 0.00 H new ATOM 0 HE22 GLN B 42 -4.681 -17.546 -3.207 1.00 0.00 H new ATOM 955 N ARG B 43 -4.960 -16.031 -7.140 1.00 0.00 N ATOM 956 CA ARG B 43 -3.585 -16.605 -7.094 1.00 0.00 C ATOM 957 C ARG B 43 -2.597 -15.565 -6.559 1.00 0.00 C ATOM 958 O ARG B 43 -2.785 -14.376 -6.723 1.00 0.00 O ATOM 959 CB ARG B 43 -3.252 -16.967 -8.542 1.00 0.00 C ATOM 960 CG ARG B 43 -2.685 -18.386 -8.594 1.00 0.00 C ATOM 961 CD ARG B 43 -2.429 -18.785 -10.048 1.00 0.00 C ATOM 962 NE ARG B 43 -3.485 -19.788 -10.362 1.00 0.00 N ATOM 963 CZ ARG B 43 -3.310 -20.641 -11.335 1.00 0.00 C ATOM 964 NH1 ARG B 43 -2.212 -20.614 -12.041 1.00 0.00 N ATOM 965 NH2 ARG B 43 -4.235 -21.520 -11.604 1.00 0.00 N ATOM 0 H ARG B 43 -5.015 -15.062 -7.453 1.00 0.00 H new ATOM 0 HA ARG B 43 -3.523 -17.472 -6.436 1.00 0.00 H new ATOM 0 HB2 ARG B 43 -4.147 -16.898 -9.160 1.00 0.00 H new ATOM 0 HB3 ARG B 43 -2.529 -16.260 -8.948 1.00 0.00 H new ATOM 0 HG2 ARG B 43 -1.758 -18.439 -8.024 1.00 0.00 H new ATOM 0 HG3 ARG B 43 -3.383 -19.084 -8.133 1.00 0.00 H new ATOM 0 HD2 ARG B 43 -2.493 -17.923 -10.712 1.00 0.00 H new ATOM 0 HD3 ARG B 43 -1.432 -19.209 -10.172 1.00 0.00 H new ATOM 0 HE ARG B 43 -4.346 -19.808 -9.816 1.00 0.00 H new ATOM 0 HH11 ARG B 43 -1.489 -19.926 -11.833 1.00 0.00 H new ATOM 0 HH12 ARG B 43 -2.078 -21.281 -12.801 1.00 0.00 H new ATOM 0 HH21 ARG B 43 -5.094 -21.541 -11.055 1.00 0.00 H new ATOM 0 HH22 ARG B 43 -4.099 -22.187 -12.364 1.00 0.00 H new ATOM 979 N LEU B 44 -1.548 -16.003 -5.921 1.00 0.00 N ATOM 980 CA LEU B 44 -0.553 -15.036 -5.375 1.00 0.00 C ATOM 981 C LEU B 44 0.809 -15.253 -6.038 1.00 0.00 C ATOM 982 O LEU B 44 1.163 -16.358 -6.401 1.00 0.00 O ATOM 983 CB LEU B 44 -0.477 -15.346 -3.881 1.00 0.00 C ATOM 984 CG LEU B 44 -1.842 -15.096 -3.240 1.00 0.00 C ATOM 985 CD1 LEU B 44 -1.924 -15.844 -1.910 1.00 0.00 C ATOM 986 CD2 LEU B 44 -2.021 -13.596 -2.992 1.00 0.00 C ATOM 0 H LEU B 44 -1.336 -16.987 -5.754 1.00 0.00 H new ATOM 0 HA LEU B 44 -0.837 -14.000 -5.561 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -0.176 -16.382 -3.728 1.00 0.00 H new ATOM 0 HB3 LEU B 44 0.280 -14.721 -3.407 1.00 0.00 H new ATOM 0 HG LEU B 44 -2.628 -15.451 -3.907 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -2.897 -15.666 -1.452 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -1.795 -16.912 -2.085 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -1.139 -15.488 -1.243 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -2.994 -13.416 -2.535 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -1.236 -13.241 -2.325 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -1.961 -13.061 -3.940 1.00 0.00 H new ATOM 998 N TYR B 45 1.576 -14.210 -6.199 1.00 0.00 N ATOM 999 CA TYR B 45 2.910 -14.363 -6.838 1.00 0.00 C ATOM 1000 C TYR B 45 3.975 -13.659 -5.999 1.00 0.00 C ATOM 1001 O TYR B 45 3.811 -12.529 -5.585 1.00 0.00 O ATOM 1002 CB TYR B 45 2.772 -13.696 -8.206 1.00 0.00 C ATOM 1003 CG TYR B 45 2.124 -14.659 -9.172 1.00 0.00 C ATOM 1004 CD1 TYR B 45 0.762 -14.962 -9.049 1.00 0.00 C ATOM 1005 CD2 TYR B 45 2.884 -15.250 -10.188 1.00 0.00 C ATOM 1006 CE1 TYR B 45 0.161 -15.856 -9.943 1.00 0.00 C ATOM 1007 CE2 TYR B 45 2.283 -16.144 -11.081 1.00 0.00 C ATOM 1008 CZ TYR B 45 0.921 -16.447 -10.959 1.00 0.00 C ATOM 1009 OH TYR B 45 0.330 -17.329 -11.841 1.00 0.00 O ATOM 0 H TYR B 45 1.336 -13.260 -5.916 1.00 0.00 H new ATOM 0 HA TYR B 45 3.213 -15.406 -6.925 1.00 0.00 H new ATOM 0 HB2 TYR B 45 2.172 -12.790 -8.122 1.00 0.00 H new ATOM 0 HB3 TYR B 45 3.752 -13.396 -8.577 1.00 0.00 H new ATOM 0 HD1 TYR B 45 0.176 -14.506 -8.265 1.00 0.00 H new ATOM 0 HD2 TYR B 45 3.934 -15.016 -10.283 1.00 0.00 H new ATOM 0 HE1 TYR B 45 -0.889 -16.090 -9.849 1.00 0.00 H new ATOM 0 HE2 TYR B 45 2.870 -16.601 -11.865 1.00 0.00 H new ATOM 0 HH TYR B 45 0.998 -17.646 -12.484 1.00 0.00 H new ATOM 1019 N LYS B 46 5.066 -14.321 -5.748 1.00 0.00 N ATOM 1020 CA LYS B 46 6.151 -13.700 -4.935 1.00 0.00 C ATOM 1021 C LYS B 46 7.400 -13.487 -5.794 1.00 0.00 C ATOM 1022 O LYS B 46 7.840 -14.375 -6.498 1.00 0.00 O ATOM 1023 CB LYS B 46 6.432 -14.705 -3.819 1.00 0.00 C ATOM 1024 CG LYS B 46 6.934 -16.017 -4.425 1.00 0.00 C ATOM 1025 CD LYS B 46 8.432 -16.164 -4.157 1.00 0.00 C ATOM 1026 CE LYS B 46 8.863 -17.606 -4.439 1.00 0.00 C ATOM 1027 NZ LYS B 46 9.984 -17.489 -5.412 1.00 0.00 N ATOM 0 H LYS B 46 5.257 -15.270 -6.071 1.00 0.00 H new ATOM 0 HA LYS B 46 5.867 -12.724 -4.542 1.00 0.00 H new ATOM 0 HB2 LYS B 46 7.176 -14.302 -3.132 1.00 0.00 H new ATOM 0 HB3 LYS B 46 5.526 -14.883 -3.240 1.00 0.00 H new ATOM 0 HG2 LYS B 46 6.393 -16.859 -3.994 1.00 0.00 H new ATOM 0 HG3 LYS B 46 6.743 -16.031 -5.498 1.00 0.00 H new ATOM 0 HD2 LYS B 46 8.994 -15.475 -4.788 1.00 0.00 H new ATOM 0 HD3 LYS B 46 8.654 -15.903 -3.122 1.00 0.00 H new ATOM 0 HE2 LYS B 46 9.183 -18.108 -3.526 1.00 0.00 H new ATOM 0 HE3 LYS B 46 8.041 -18.190 -4.852 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 10.266 -18.437 -5.732 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 9.676 -16.925 -6.230 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 10.793 -17.023 -4.955 1.00 0.00 H new ATOM 1041 N ASP B 47 7.974 -12.316 -5.743 1.00 0.00 N ATOM 1042 CA ASP B 47 9.195 -12.049 -6.557 1.00 0.00 C ATOM 1043 C ASP B 47 8.994 -12.546 -7.991 1.00 0.00 C ATOM 1044 O ASP B 47 9.531 -13.562 -8.387 1.00 0.00 O ATOM 1045 CB ASP B 47 10.311 -12.835 -5.867 1.00 0.00 C ATOM 1046 CG ASP B 47 10.289 -12.538 -4.366 1.00 0.00 C ATOM 1047 OD1 ASP B 47 10.784 -11.492 -3.982 1.00 0.00 O ATOM 1048 OD2 ASP B 47 9.779 -13.364 -3.626 1.00 0.00 O ATOM 0 H ASP B 47 7.651 -11.533 -5.174 1.00 0.00 H new ATOM 0 HA ASP B 47 9.425 -10.985 -6.620 1.00 0.00 H new ATOM 0 HB2 ASP B 47 10.179 -13.903 -6.039 1.00 0.00 H new ATOM 0 HB3 ASP B 47 11.278 -12.561 -6.289 1.00 0.00 H new ATOM 1053 N ASP B 48 8.224 -11.838 -8.772 1.00 0.00 N ATOM 1054 CA ASP B 48 7.989 -12.270 -10.181 1.00 0.00 C ATOM 1055 C ASP B 48 7.770 -13.784 -10.242 1.00 0.00 C ATOM 1056 O ASP B 48 8.118 -14.431 -11.210 1.00 0.00 O ATOM 1057 CB ASP B 48 9.262 -11.881 -10.933 1.00 0.00 C ATOM 1058 CG ASP B 48 9.167 -12.366 -12.381 1.00 0.00 C ATOM 1059 OD1 ASP B 48 8.128 -12.160 -12.987 1.00 0.00 O ATOM 1060 OD2 ASP B 48 10.134 -12.934 -12.859 1.00 0.00 O ATOM 0 H ASP B 48 7.747 -10.979 -8.496 1.00 0.00 H new ATOM 0 HA ASP B 48 7.103 -11.804 -10.612 1.00 0.00 H new ATOM 0 HB2 ASP B 48 9.396 -10.799 -10.908 1.00 0.00 H new ATOM 0 HB3 ASP B 48 10.133 -12.321 -10.447 1.00 0.00 H new ATOM 1065 N GLN B 49 7.196 -14.354 -9.219 1.00 0.00 N ATOM 1066 CA GLN B 49 6.958 -15.825 -9.224 1.00 0.00 C ATOM 1067 C GLN B 49 5.557 -16.136 -8.689 1.00 0.00 C ATOM 1068 O GLN B 49 4.788 -15.247 -8.384 1.00 0.00 O ATOM 1069 CB GLN B 49 8.026 -16.406 -8.296 1.00 0.00 C ATOM 1070 CG GLN B 49 8.522 -17.738 -8.860 1.00 0.00 C ATOM 1071 CD GLN B 49 9.047 -17.527 -10.281 1.00 0.00 C ATOM 1072 OE1 GLN B 49 8.586 -18.159 -11.211 1.00 0.00 O ATOM 1073 NE2 GLN B 49 9.998 -16.659 -10.491 1.00 0.00 N ATOM 0 H GLN B 49 6.882 -13.866 -8.381 1.00 0.00 H new ATOM 0 HA GLN B 49 7.017 -16.248 -10.227 1.00 0.00 H new ATOM 0 HB2 GLN B 49 8.857 -15.708 -8.199 1.00 0.00 H new ATOM 0 HB3 GLN B 49 7.615 -16.552 -7.297 1.00 0.00 H new ATOM 0 HG2 GLN B 49 9.311 -18.142 -8.226 1.00 0.00 H new ATOM 0 HG3 GLN B 49 7.712 -18.467 -8.865 1.00 0.00 H new ATOM 0 HE21 GLN B 49 10.385 -16.128 -9.711 1.00 0.00 H new ATOM 0 HE22 GLN B 49 10.354 -16.511 -11.435 1.00 0.00 H new ATOM 1082 N LEU B 50 5.222 -17.391 -8.573 1.00 0.00 N ATOM 1083 CA LEU B 50 3.872 -17.757 -8.058 1.00 0.00 C ATOM 1084 C LEU B 50 3.978 -18.261 -6.616 1.00 0.00 C ATOM 1085 O LEU B 50 4.727 -19.170 -6.319 1.00 0.00 O ATOM 1086 CB LEU B 50 3.386 -18.875 -8.982 1.00 0.00 C ATOM 1087 CG LEU B 50 2.093 -19.471 -8.425 1.00 0.00 C ATOM 1088 CD1 LEU B 50 0.915 -18.565 -8.785 1.00 0.00 C ATOM 1089 CD2 LEU B 50 1.871 -20.859 -9.031 1.00 0.00 C ATOM 0 H LEU B 50 5.824 -18.179 -8.812 1.00 0.00 H new ATOM 0 HA LEU B 50 3.188 -16.909 -8.050 1.00 0.00 H new ATOM 0 HB2 LEU B 50 3.216 -18.484 -9.985 1.00 0.00 H new ATOM 0 HB3 LEU B 50 4.149 -19.649 -9.066 1.00 0.00 H new ATOM 0 HG LEU B 50 2.169 -19.553 -7.341 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -0.006 -18.991 -8.387 1.00 0.00 H new ATOM 0 HD12 LEU B 50 1.072 -17.576 -8.355 1.00 0.00 H new ATOM 0 HD13 LEU B 50 0.838 -18.482 -9.869 1.00 0.00 H new ATOM 0 HD21 LEU B 50 0.949 -21.286 -8.635 1.00 0.00 H new ATOM 0 HD22 LEU B 50 1.795 -20.775 -10.115 1.00 0.00 H new ATOM 0 HD23 LEU B 50 2.710 -21.506 -8.775 1.00 0.00 H new ATOM 1101 N LEU B 51 3.233 -17.676 -5.718 1.00 0.00 N ATOM 1102 CA LEU B 51 3.292 -18.122 -4.297 1.00 0.00 C ATOM 1103 C LEU B 51 2.520 -19.433 -4.121 1.00 0.00 C ATOM 1104 O LEU B 51 1.337 -19.507 -4.384 1.00 0.00 O ATOM 1105 CB LEU B 51 2.628 -16.998 -3.501 1.00 0.00 C ATOM 1106 CG LEU B 51 2.846 -17.234 -2.006 1.00 0.00 C ATOM 1107 CD1 LEU B 51 4.327 -17.058 -1.671 1.00 0.00 C ATOM 1108 CD2 LEU B 51 2.019 -16.225 -1.207 1.00 0.00 C ATOM 0 H LEU B 51 2.587 -16.910 -5.907 1.00 0.00 H new ATOM 0 HA LEU B 51 4.313 -18.308 -3.965 1.00 0.00 H new ATOM 0 HB2 LEU B 51 3.047 -16.035 -3.793 1.00 0.00 H new ATOM 0 HB3 LEU B 51 1.561 -16.962 -3.723 1.00 0.00 H new ATOM 0 HG LEU B 51 2.535 -18.246 -1.749 1.00 0.00 H new ATOM 0 HD11 LEU B 51 4.481 -17.226 -0.605 1.00 0.00 H new ATOM 0 HD12 LEU B 51 4.917 -17.776 -2.241 1.00 0.00 H new ATOM 0 HD13 LEU B 51 4.640 -16.046 -1.928 1.00 0.00 H new ATOM 0 HD21 LEU B 51 2.173 -16.391 -0.141 1.00 0.00 H new ATOM 0 HD22 LEU B 51 2.331 -15.213 -1.465 1.00 0.00 H new ATOM 0 HD23 LEU B 51 0.963 -16.351 -1.445 1.00 0.00 H new ATOM 1120 N ASP B 52 3.181 -20.467 -3.677 1.00 0.00 N ATOM 1121 CA ASP B 52 2.483 -21.771 -3.485 1.00 0.00 C ATOM 1122 C ASP B 52 1.937 -21.872 -2.058 1.00 0.00 C ATOM 1123 O ASP B 52 2.683 -21.925 -1.100 1.00 0.00 O ATOM 1124 CB ASP B 52 3.555 -22.834 -3.726 1.00 0.00 C ATOM 1125 CG ASP B 52 3.343 -23.471 -5.100 1.00 0.00 C ATOM 1126 OD1 ASP B 52 2.872 -22.778 -5.986 1.00 0.00 O ATOM 1127 OD2 ASP B 52 3.655 -24.641 -5.243 1.00 0.00 O ATOM 0 H ASP B 52 4.173 -20.466 -3.439 1.00 0.00 H new ATOM 0 HA ASP B 52 1.635 -21.889 -4.159 1.00 0.00 H new ATOM 0 HB2 ASP B 52 4.547 -22.385 -3.671 1.00 0.00 H new ATOM 0 HB3 ASP B 52 3.507 -23.597 -2.949 1.00 0.00 H new ATOM 1132 N ASP B 53 0.641 -21.899 -1.908 1.00 0.00 N ATOM 1133 CA ASP B 53 0.050 -21.996 -0.543 1.00 0.00 C ATOM 1134 C ASP B 53 0.189 -23.422 -0.006 1.00 0.00 C ATOM 1135 O ASP B 53 -0.231 -23.726 1.094 1.00 0.00 O ATOM 1136 CB ASP B 53 -1.423 -21.629 -0.720 1.00 0.00 C ATOM 1137 CG ASP B 53 -2.064 -22.569 -1.743 1.00 0.00 C ATOM 1138 OD1 ASP B 53 -1.996 -23.770 -1.539 1.00 0.00 O ATOM 1139 OD2 ASP B 53 -2.611 -22.072 -2.713 1.00 0.00 O ATOM 0 H ASP B 53 -0.034 -21.858 -2.671 1.00 0.00 H new ATOM 0 HA ASP B 53 0.549 -21.340 0.170 1.00 0.00 H new ATOM 0 HB2 ASP B 53 -1.944 -21.703 0.234 1.00 0.00 H new ATOM 0 HB3 ASP B 53 -1.514 -20.595 -1.053 1.00 0.00 H new ATOM 1144 N GLY B 54 0.777 -24.300 -0.772 1.00 0.00 N ATOM 1145 CA GLY B 54 0.944 -25.704 -0.302 1.00 0.00 C ATOM 1146 C GLY B 54 2.200 -25.802 0.564 1.00 0.00 C ATOM 1147 O GLY B 54 2.487 -26.830 1.146 1.00 0.00 O ATOM 0 H GLY B 54 1.148 -24.106 -1.702 1.00 0.00 H new ATOM 0 HA2 GLY B 54 0.069 -26.015 0.270 1.00 0.00 H new ATOM 0 HA3 GLY B 54 1.023 -26.378 -1.155 1.00 0.00 H new ATOM 1151 N LYS B 55 2.943 -24.735 0.667 1.00 0.00 N ATOM 1152 CA LYS B 55 4.155 -24.744 1.495 1.00 0.00 C ATOM 1153 C LYS B 55 4.226 -23.428 2.256 1.00 0.00 C ATOM 1154 O LYS B 55 3.836 -22.384 1.772 1.00 0.00 O ATOM 1155 CB LYS B 55 5.318 -24.867 0.509 1.00 0.00 C ATOM 1156 CG LYS B 55 5.114 -23.886 -0.648 1.00 0.00 C ATOM 1157 CD LYS B 55 6.127 -24.184 -1.755 1.00 0.00 C ATOM 1158 CE LYS B 55 5.842 -25.564 -2.351 1.00 0.00 C ATOM 1159 NZ LYS B 55 6.369 -25.498 -3.743 1.00 0.00 N ATOM 0 H LYS B 55 2.749 -23.849 0.200 1.00 0.00 H new ATOM 0 HA LYS B 55 4.174 -25.555 2.222 1.00 0.00 H new ATOM 0 HB2 LYS B 55 6.261 -24.658 1.015 1.00 0.00 H new ATOM 0 HB3 LYS B 55 5.380 -25.887 0.128 1.00 0.00 H new ATOM 0 HG2 LYS B 55 4.099 -23.972 -1.037 1.00 0.00 H new ATOM 0 HG3 LYS B 55 5.235 -22.862 -0.296 1.00 0.00 H new ATOM 0 HD2 LYS B 55 6.067 -23.422 -2.532 1.00 0.00 H new ATOM 0 HD3 LYS B 55 7.140 -24.152 -1.354 1.00 0.00 H new ATOM 0 HE2 LYS B 55 6.335 -26.350 -1.779 1.00 0.00 H new ATOM 0 HE3 LYS B 55 4.775 -25.785 -2.343 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 6.746 -26.428 -4.016 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 5.602 -25.232 -4.392 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 7.128 -24.788 -3.794 1.00 0.00 H new ATOM 1173 N THR B 56 4.725 -23.485 3.432 1.00 0.00 N ATOM 1174 CA THR B 56 4.851 -22.265 4.271 1.00 0.00 C ATOM 1175 C THR B 56 6.053 -21.443 3.811 1.00 0.00 C ATOM 1176 O THR B 56 6.812 -21.857 2.957 1.00 0.00 O ATOM 1177 CB THR B 56 5.063 -22.780 5.696 1.00 0.00 C ATOM 1178 OG1 THR B 56 4.763 -24.167 5.748 1.00 0.00 O ATOM 1179 CG2 THR B 56 4.146 -22.021 6.656 1.00 0.00 C ATOM 0 H THR B 56 5.064 -24.341 3.871 1.00 0.00 H new ATOM 0 HA THR B 56 3.975 -21.620 4.203 1.00 0.00 H new ATOM 0 HB THR B 56 6.101 -22.623 5.988 1.00 0.00 H new ATOM 0 HG1 THR B 56 4.900 -24.497 6.660 1.00 0.00 H new ATOM 0 HG21 THR B 56 4.298 -22.388 7.671 1.00 0.00 H new ATOM 0 HG22 THR B 56 4.379 -20.957 6.617 1.00 0.00 H new ATOM 0 HG23 THR B 56 3.107 -22.176 6.365 1.00 0.00 H new ATOM 1187 N LEU B 57 6.228 -20.281 4.365 1.00 0.00 N ATOM 1188 CA LEU B 57 7.381 -19.429 3.956 1.00 0.00 C ATOM 1189 C LEU B 57 8.683 -20.226 4.059 1.00 0.00 C ATOM 1190 O LEU B 57 9.503 -20.213 3.163 1.00 0.00 O ATOM 1191 CB LEU B 57 7.386 -18.267 4.949 1.00 0.00 C ATOM 1192 CG LEU B 57 6.185 -17.360 4.682 1.00 0.00 C ATOM 1193 CD1 LEU B 57 5.519 -16.989 6.009 1.00 0.00 C ATOM 1194 CD2 LEU B 57 6.656 -16.087 3.977 1.00 0.00 C ATOM 0 H LEU B 57 5.625 -19.881 5.084 1.00 0.00 H new ATOM 0 HA LEU B 57 7.297 -19.084 2.926 1.00 0.00 H new ATOM 0 HB2 LEU B 57 7.348 -18.647 5.970 1.00 0.00 H new ATOM 0 HB3 LEU B 57 8.312 -17.699 4.855 1.00 0.00 H new ATOM 0 HG LEU B 57 5.468 -17.884 4.050 1.00 0.00 H new ATOM 0 HD11 LEU B 57 4.663 -16.342 5.818 1.00 0.00 H new ATOM 0 HD12 LEU B 57 5.184 -17.895 6.514 1.00 0.00 H new ATOM 0 HD13 LEU B 57 6.235 -16.465 6.642 1.00 0.00 H new ATOM 0 HD21 LEU B 57 5.801 -15.439 3.786 1.00 0.00 H new ATOM 0 HD22 LEU B 57 7.373 -15.564 4.610 1.00 0.00 H new ATOM 0 HD23 LEU B 57 7.131 -16.349 3.032 1.00 0.00 H new ATOM 1206 N GLY B 58 8.871 -20.926 5.143 1.00 0.00 N ATOM 1207 CA GLY B 58 10.112 -21.732 5.302 1.00 0.00 C ATOM 1208 C GLY B 58 10.035 -22.956 4.391 1.00 0.00 C ATOM 1209 O GLY B 58 11.007 -23.347 3.776 1.00 0.00 O ATOM 0 H GLY B 58 8.218 -20.974 5.925 1.00 0.00 H new ATOM 0 HA2 GLY B 58 10.985 -21.131 5.050 1.00 0.00 H new ATOM 0 HA3 GLY B 58 10.228 -22.043 6.340 1.00 0.00 H new ATOM 1213 N GLU B 59 8.883 -23.565 4.297 1.00 0.00 N ATOM 1214 CA GLU B 59 8.746 -24.763 3.421 1.00 0.00 C ATOM 1215 C GLU B 59 8.715 -24.335 1.957 1.00 0.00 C ATOM 1216 O GLU B 59 8.604 -25.145 1.058 1.00 0.00 O ATOM 1217 CB GLU B 59 7.422 -25.412 3.825 1.00 0.00 C ATOM 1218 CG GLU B 59 7.691 -26.803 4.403 1.00 0.00 C ATOM 1219 CD GLU B 59 8.175 -26.669 5.849 1.00 0.00 C ATOM 1220 OE1 GLU B 59 7.401 -26.207 6.671 1.00 0.00 O ATOM 1221 OE2 GLU B 59 9.310 -27.032 6.108 1.00 0.00 O ATOM 0 H GLU B 59 8.034 -23.285 4.788 1.00 0.00 H new ATOM 0 HA GLU B 59 9.580 -25.456 3.534 1.00 0.00 H new ATOM 0 HB2 GLU B 59 6.911 -24.793 4.562 1.00 0.00 H new ATOM 0 HB3 GLU B 59 6.763 -25.487 2.960 1.00 0.00 H new ATOM 0 HG2 GLU B 59 6.784 -27.406 4.366 1.00 0.00 H new ATOM 0 HG3 GLU B 59 8.441 -27.319 3.803 1.00 0.00 H new ATOM 1228 N CYS B 60 8.823 -23.064 1.719 1.00 0.00 N ATOM 1229 CA CYS B 60 8.816 -22.557 0.319 1.00 0.00 C ATOM 1230 C CYS B 60 10.138 -21.845 0.026 1.00 0.00 C ATOM 1231 O CYS B 60 10.511 -21.651 -1.114 1.00 0.00 O ATOM 1232 CB CYS B 60 7.649 -21.572 0.258 1.00 0.00 C ATOM 1233 SG CYS B 60 7.108 -21.383 -1.459 1.00 0.00 S ATOM 0 H CYS B 60 8.917 -22.346 2.437 1.00 0.00 H new ATOM 0 HA CYS B 60 8.707 -23.355 -0.416 1.00 0.00 H new ATOM 0 HB2 CYS B 60 6.824 -21.931 0.873 1.00 0.00 H new ATOM 0 HB3 CYS B 60 7.952 -20.607 0.663 1.00 0.00 H new ATOM 0 HG CYS B 60 6.114 -20.547 -1.511 1.00 0.00 H new ATOM 1239 N GLY B 61 10.847 -21.452 1.051 1.00 0.00 N ATOM 1240 CA GLY B 61 12.142 -20.750 0.832 1.00 0.00 C ATOM 1241 C GLY B 61 11.858 -19.339 0.331 1.00 0.00 C ATOM 1242 O GLY B 61 12.581 -18.791 -0.477 1.00 0.00 O ATOM 0 H GLY B 61 10.585 -21.587 2.027 1.00 0.00 H new ATOM 0 HA2 GLY B 61 12.713 -20.713 1.760 1.00 0.00 H new ATOM 0 HA3 GLY B 61 12.748 -21.293 0.107 1.00 0.00 H new ATOM 1246 N PHE B 62 10.799 -18.753 0.804 1.00 0.00 N ATOM 1247 CA PHE B 62 10.439 -17.378 0.362 1.00 0.00 C ATOM 1248 C PHE B 62 10.459 -16.423 1.561 1.00 0.00 C ATOM 1249 O PHE B 62 9.449 -16.159 2.184 1.00 0.00 O ATOM 1250 CB PHE B 62 9.033 -17.531 -0.230 1.00 0.00 C ATOM 1251 CG PHE B 62 8.198 -16.308 0.062 1.00 0.00 C ATOM 1252 CD1 PHE B 62 8.557 -15.067 -0.475 1.00 0.00 C ATOM 1253 CD2 PHE B 62 7.060 -16.423 0.866 1.00 0.00 C ATOM 1254 CE1 PHE B 62 7.775 -13.938 -0.206 1.00 0.00 C ATOM 1255 CE2 PHE B 62 6.279 -15.295 1.136 1.00 0.00 C ATOM 1256 CZ PHE B 62 6.636 -14.051 0.600 1.00 0.00 C ATOM 0 H PHE B 62 10.161 -19.169 1.483 1.00 0.00 H new ATOM 0 HA PHE B 62 11.134 -16.958 -0.365 1.00 0.00 H new ATOM 0 HB2 PHE B 62 9.101 -17.683 -1.307 1.00 0.00 H new ATOM 0 HB3 PHE B 62 8.551 -18.415 0.187 1.00 0.00 H new ATOM 0 HD1 PHE B 62 9.436 -14.980 -1.096 1.00 0.00 H new ATOM 0 HD2 PHE B 62 6.784 -17.382 1.278 1.00 0.00 H new ATOM 0 HE1 PHE B 62 8.050 -12.979 -0.620 1.00 0.00 H new ATOM 0 HE2 PHE B 62 5.400 -15.383 1.758 1.00 0.00 H new ATOM 0 HZ PHE B 62 6.033 -13.180 0.808 1.00 0.00 H new ATOM 1266 N THR B 63 11.615 -15.910 1.890 1.00 0.00 N ATOM 1267 CA THR B 63 11.729 -14.974 3.047 1.00 0.00 C ATOM 1268 C THR B 63 13.199 -14.780 3.415 1.00 0.00 C ATOM 1269 O THR B 63 14.084 -14.960 2.603 1.00 0.00 O ATOM 1270 CB THR B 63 10.977 -15.646 4.204 1.00 0.00 C ATOM 1271 OG1 THR B 63 11.496 -15.183 5.442 1.00 0.00 O ATOM 1272 CG2 THR B 63 11.140 -17.165 4.122 1.00 0.00 C ATOM 0 H THR B 63 12.491 -16.101 1.404 1.00 0.00 H new ATOM 0 HA THR B 63 11.315 -13.992 2.817 1.00 0.00 H new ATOM 0 HB THR B 63 9.919 -15.394 4.133 1.00 0.00 H new ATOM 0 HG1 THR B 63 11.142 -15.733 6.171 1.00 0.00 H new ATOM 0 HG21 THR B 63 10.603 -17.634 4.947 1.00 0.00 H new ATOM 0 HG22 THR B 63 10.736 -17.524 3.175 1.00 0.00 H new ATOM 0 HG23 THR B 63 12.198 -17.421 4.185 1.00 0.00 H new ATOM 1280 N SER B 64 13.461 -14.421 4.638 1.00 0.00 N ATOM 1281 CA SER B 64 14.875 -14.220 5.074 1.00 0.00 C ATOM 1282 C SER B 64 14.922 -13.502 6.425 1.00 0.00 C ATOM 1283 O SER B 64 15.835 -12.753 6.709 1.00 0.00 O ATOM 1284 CB SER B 64 15.511 -13.354 3.987 1.00 0.00 C ATOM 1285 OG SER B 64 16.480 -14.121 3.283 1.00 0.00 O ATOM 0 H SER B 64 12.758 -14.257 5.359 1.00 0.00 H new ATOM 0 HA SER B 64 15.400 -15.167 5.201 1.00 0.00 H new ATOM 0 HB2 SER B 64 14.746 -12.993 3.299 1.00 0.00 H new ATOM 0 HB3 SER B 64 15.979 -12.476 4.433 1.00 0.00 H new ATOM 0 HG SER B 64 16.027 -14.768 2.703 1.00 0.00 H new ATOM 1291 N GLN B 65 13.944 -13.723 7.256 1.00 0.00 N ATOM 1292 CA GLN B 65 13.932 -13.052 8.587 1.00 0.00 C ATOM 1293 C GLN B 65 14.027 -11.537 8.405 1.00 0.00 C ATOM 1294 O GLN B 65 14.319 -10.806 9.330 1.00 0.00 O ATOM 1295 CB GLN B 65 15.168 -13.585 9.315 1.00 0.00 C ATOM 1296 CG GLN B 65 15.089 -13.206 10.795 1.00 0.00 C ATOM 1297 CD GLN B 65 16.006 -14.123 11.607 1.00 0.00 C ATOM 1298 OE1 GLN B 65 17.059 -13.710 12.050 1.00 0.00 O ATOM 1299 NE2 GLN B 65 15.647 -15.358 11.823 1.00 0.00 N ATOM 0 H GLN B 65 13.152 -14.339 7.073 1.00 0.00 H new ATOM 0 HA GLN B 65 13.018 -13.252 9.145 1.00 0.00 H new ATOM 0 HB2 GLN B 65 15.228 -14.668 9.208 1.00 0.00 H new ATOM 0 HB3 GLN B 65 16.073 -13.171 8.870 1.00 0.00 H new ATOM 0 HG2 GLN B 65 15.385 -12.166 10.931 1.00 0.00 H new ATOM 0 HG3 GLN B 65 14.062 -13.295 11.150 1.00 0.00 H new ATOM 0 HE21 GLN B 65 14.763 -15.705 11.451 1.00 0.00 H new ATOM 0 HE22 GLN B 65 16.250 -15.977 12.364 1.00 0.00 H new ATOM 1308 N THR B 66 13.781 -11.062 7.216 1.00 0.00 N ATOM 1309 CA THR B 66 13.854 -9.596 6.968 1.00 0.00 C ATOM 1310 C THR B 66 12.976 -9.224 5.775 1.00 0.00 C ATOM 1311 O THR B 66 13.198 -8.231 5.112 1.00 0.00 O ATOM 1312 CB THR B 66 15.326 -9.315 6.665 1.00 0.00 C ATOM 1313 OG1 THR B 66 15.449 -8.021 6.088 1.00 0.00 O ATOM 1314 CG2 THR B 66 15.858 -10.364 5.688 1.00 0.00 C ATOM 0 H THR B 66 13.532 -11.627 6.404 1.00 0.00 H new ATOM 0 HA THR B 66 13.500 -9.013 7.818 1.00 0.00 H new ATOM 0 HB THR B 66 15.903 -9.359 7.589 1.00 0.00 H new ATOM 0 HG1 THR B 66 14.929 -7.982 5.258 1.00 0.00 H new ATOM 0 HG21 THR B 66 16.907 -10.162 5.473 1.00 0.00 H new ATOM 0 HG22 THR B 66 15.763 -11.355 6.131 1.00 0.00 H new ATOM 0 HG23 THR B 66 15.284 -10.323 4.762 1.00 0.00 H new ATOM 1322 N ALA B 67 11.978 -10.014 5.501 1.00 0.00 N ATOM 1323 CA ALA B 67 11.079 -9.705 4.352 1.00 0.00 C ATOM 1324 C ALA B 67 10.313 -8.410 4.631 1.00 0.00 C ATOM 1325 O ALA B 67 9.110 -8.406 4.800 1.00 0.00 O ATOM 1326 CB ALA B 67 10.124 -10.893 4.259 1.00 0.00 C ATOM 0 H ALA B 67 11.744 -10.860 6.021 1.00 0.00 H new ATOM 0 HA ALA B 67 11.626 -9.560 3.420 1.00 0.00 H new ATOM 0 HB1 ALA B 67 9.429 -10.738 3.433 1.00 0.00 H new ATOM 0 HB2 ALA B 67 10.694 -11.806 4.087 1.00 0.00 H new ATOM 0 HB3 ALA B 67 9.566 -10.985 5.191 1.00 0.00 H new ATOM 1332 N ARG B 68 11.012 -7.311 4.674 1.00 0.00 N ATOM 1333 CA ARG B 68 10.352 -6.000 4.935 1.00 0.00 C ATOM 1334 C ARG B 68 11.402 -4.880 4.966 1.00 0.00 C ATOM 1335 O ARG B 68 11.388 -4.000 4.129 1.00 0.00 O ATOM 1336 CB ARG B 68 9.668 -6.158 6.297 1.00 0.00 C ATOM 1337 CG ARG B 68 9.551 -4.792 6.978 1.00 0.00 C ATOM 1338 CD ARG B 68 8.746 -4.932 8.273 1.00 0.00 C ATOM 1339 NE ARG B 68 9.559 -4.235 9.308 1.00 0.00 N ATOM 1340 CZ ARG B 68 10.490 -4.880 9.960 1.00 0.00 C ATOM 1341 NH1 ARG B 68 10.721 -6.139 9.702 1.00 0.00 N ATOM 1342 NH2 ARG B 68 11.192 -4.262 10.869 1.00 0.00 N ATOM 0 H ARG B 68 12.022 -7.264 4.538 1.00 0.00 H new ATOM 0 HA ARG B 68 9.634 -5.733 4.160 1.00 0.00 H new ATOM 0 HB2 ARG B 68 8.679 -6.597 6.169 1.00 0.00 H new ATOM 0 HB3 ARG B 68 10.241 -6.840 6.925 1.00 0.00 H new ATOM 0 HG2 ARG B 68 10.543 -4.396 7.195 1.00 0.00 H new ATOM 0 HG3 ARG B 68 9.064 -4.082 6.310 1.00 0.00 H new ATOM 0 HD2 ARG B 68 7.759 -4.480 8.175 1.00 0.00 H new ATOM 0 HD3 ARG B 68 8.592 -5.980 8.531 1.00 0.00 H new ATOM 0 HE ARG B 68 9.388 -3.250 9.509 1.00 0.00 H new ATOM 0 HH11 ARG B 68 10.174 -6.622 8.990 1.00 0.00 H new ATOM 0 HH12 ARG B 68 11.448 -6.639 10.213 1.00 0.00 H new ATOM 0 HH21 ARG B 68 11.014 -3.278 11.069 1.00 0.00 H new ATOM 0 HH22 ARG B 68 11.919 -4.763 11.380 1.00 0.00 H new ATOM 1356 N PRO B 69 12.286 -4.952 5.930 1.00 0.00 N ATOM 1357 CA PRO B 69 13.356 -3.928 6.058 1.00 0.00 C ATOM 1358 C PRO B 69 14.389 -4.093 4.936 1.00 0.00 C ATOM 1359 O PRO B 69 14.225 -3.575 3.850 1.00 0.00 O ATOM 1360 CB PRO B 69 13.974 -4.226 7.422 1.00 0.00 C ATOM 1361 CG PRO B 69 13.679 -5.670 7.669 1.00 0.00 C ATOM 1362 CD PRO B 69 12.375 -5.975 6.979 1.00 0.00 C ATOM 0 HA PRO B 69 12.986 -2.906 5.980 1.00 0.00 H new ATOM 0 HB2 PRO B 69 15.047 -4.037 7.420 1.00 0.00 H new ATOM 0 HB3 PRO B 69 13.541 -3.596 8.199 1.00 0.00 H new ATOM 0 HG2 PRO B 69 14.479 -6.300 7.279 1.00 0.00 H new ATOM 0 HG3 PRO B 69 13.607 -5.872 8.738 1.00 0.00 H new ATOM 0 HD2 PRO B 69 12.371 -6.981 6.558 1.00 0.00 H new ATOM 0 HD3 PRO B 69 11.534 -5.914 7.669 1.00 0.00 H new ATOM 1370 N GLN B 70 15.451 -4.815 5.186 1.00 0.00 N ATOM 1371 CA GLN B 70 16.484 -5.010 4.127 1.00 0.00 C ATOM 1372 C GLN B 70 15.833 -5.582 2.866 1.00 0.00 C ATOM 1373 O GLN B 70 15.436 -4.855 1.977 1.00 0.00 O ATOM 1374 CB GLN B 70 17.480 -6.008 4.719 1.00 0.00 C ATOM 1375 CG GLN B 70 18.770 -5.279 5.100 1.00 0.00 C ATOM 1376 CD GLN B 70 19.954 -6.242 4.987 1.00 0.00 C ATOM 1377 OE1 GLN B 70 20.581 -6.570 5.974 1.00 0.00 O ATOM 1378 NE2 GLN B 70 20.288 -6.711 3.816 1.00 0.00 N ATOM 0 H GLN B 70 15.646 -5.276 6.075 1.00 0.00 H new ATOM 0 HA GLN B 70 16.970 -4.077 3.843 1.00 0.00 H new ATOM 0 HB2 GLN B 70 17.050 -6.490 5.597 1.00 0.00 H new ATOM 0 HB3 GLN B 70 17.695 -6.795 3.996 1.00 0.00 H new ATOM 0 HG2 GLN B 70 18.922 -4.421 4.445 1.00 0.00 H new ATOM 0 HG3 GLN B 70 18.696 -4.895 6.117 1.00 0.00 H new ATOM 0 HE21 GLN B 70 19.761 -6.435 2.987 1.00 0.00 H new ATOM 0 HE22 GLN B 70 21.076 -7.353 3.730 1.00 0.00 H new ATOM 1387 N ALA B 71 15.705 -6.880 2.787 1.00 0.00 N ATOM 1388 CA ALA B 71 15.062 -7.492 1.589 1.00 0.00 C ATOM 1389 C ALA B 71 13.604 -7.819 1.916 1.00 0.00 C ATOM 1390 O ALA B 71 13.324 -8.752 2.640 1.00 0.00 O ATOM 1391 CB ALA B 71 15.856 -8.771 1.319 1.00 0.00 C ATOM 0 H ALA B 71 16.017 -7.541 3.498 1.00 0.00 H new ATOM 0 HA ALA B 71 15.065 -6.832 0.722 1.00 0.00 H new ATOM 0 HB1 ALA B 71 15.441 -9.280 0.449 1.00 0.00 H new ATOM 0 HB2 ALA B 71 16.899 -8.518 1.129 1.00 0.00 H new ATOM 0 HB3 ALA B 71 15.794 -9.428 2.187 1.00 0.00 H new ATOM 1397 N PRO B 72 12.725 -7.017 1.382 1.00 0.00 N ATOM 1398 CA PRO B 72 11.277 -7.198 1.633 1.00 0.00 C ATOM 1399 C PRO B 72 10.685 -8.307 0.765 1.00 0.00 C ATOM 1400 O PRO B 72 11.160 -8.594 -0.316 1.00 0.00 O ATOM 1401 CB PRO B 72 10.681 -5.848 1.248 1.00 0.00 C ATOM 1402 CG PRO B 72 11.642 -5.253 0.263 1.00 0.00 C ATOM 1403 CD PRO B 72 12.996 -5.874 0.506 1.00 0.00 C ATOM 0 HA PRO B 72 11.070 -7.491 2.662 1.00 0.00 H new ATOM 0 HB2 PRO B 72 9.691 -5.967 0.808 1.00 0.00 H new ATOM 0 HB3 PRO B 72 10.566 -5.206 2.121 1.00 0.00 H new ATOM 0 HG2 PRO B 72 11.311 -5.446 -0.758 1.00 0.00 H new ATOM 0 HG3 PRO B 72 11.691 -4.171 0.383 1.00 0.00 H new ATOM 0 HD2 PRO B 72 13.460 -6.191 -0.428 1.00 0.00 H new ATOM 0 HD3 PRO B 72 13.678 -5.166 0.977 1.00 0.00 H new ATOM 1411 N ALA B 73 9.631 -8.916 1.234 1.00 0.00 N ATOM 1412 CA ALA B 73 8.970 -9.995 0.447 1.00 0.00 C ATOM 1413 C ALA B 73 7.630 -9.474 -0.079 1.00 0.00 C ATOM 1414 O ALA B 73 6.846 -8.910 0.657 1.00 0.00 O ATOM 1415 CB ALA B 73 8.755 -11.139 1.439 1.00 0.00 C ATOM 0 H ALA B 73 9.197 -8.711 2.134 1.00 0.00 H new ATOM 0 HA ALA B 73 9.559 -10.321 -0.410 1.00 0.00 H new ATOM 0 HB1 ALA B 73 8.271 -11.974 0.932 1.00 0.00 H new ATOM 0 HB2 ALA B 73 9.718 -11.464 1.834 1.00 0.00 H new ATOM 0 HB3 ALA B 73 8.123 -10.796 2.258 1.00 0.00 H new ATOM 1421 N THR B 74 7.368 -9.631 -1.347 1.00 0.00 N ATOM 1422 CA THR B 74 6.087 -9.110 -1.903 1.00 0.00 C ATOM 1423 C THR B 74 5.273 -10.216 -2.573 1.00 0.00 C ATOM 1424 O THR B 74 5.794 -11.052 -3.285 1.00 0.00 O ATOM 1425 CB THR B 74 6.501 -8.061 -2.935 1.00 0.00 C ATOM 1426 OG1 THR B 74 6.564 -6.785 -2.312 1.00 0.00 O ATOM 1427 CG2 THR B 74 5.483 -8.025 -4.078 1.00 0.00 C ATOM 0 H THR B 74 7.980 -10.094 -2.018 1.00 0.00 H new ATOM 0 HA THR B 74 5.453 -8.699 -1.117 1.00 0.00 H new ATOM 0 HB THR B 74 7.480 -8.319 -3.338 1.00 0.00 H new ATOM 0 HG1 THR B 74 5.656 -6.472 -2.115 1.00 0.00 H new ATOM 0 HG21 THR B 74 5.784 -7.275 -4.810 1.00 0.00 H new ATOM 0 HG22 THR B 74 5.439 -9.003 -4.557 1.00 0.00 H new ATOM 0 HG23 THR B 74 4.500 -7.771 -3.682 1.00 0.00 H new ATOM 1435 N VAL B 75 3.989 -10.198 -2.365 1.00 0.00 N ATOM 1436 CA VAL B 75 3.104 -11.213 -3.000 1.00 0.00 C ATOM 1437 C VAL B 75 2.070 -10.483 -3.868 1.00 0.00 C ATOM 1438 O VAL B 75 1.555 -9.449 -3.494 1.00 0.00 O ATOM 1439 CB VAL B 75 2.433 -11.982 -1.844 1.00 0.00 C ATOM 1440 CG1 VAL B 75 3.036 -11.565 -0.497 1.00 0.00 C ATOM 1441 CG2 VAL B 75 0.927 -11.695 -1.835 1.00 0.00 C ATOM 0 H VAL B 75 3.509 -9.517 -1.777 1.00 0.00 H new ATOM 0 HA VAL B 75 3.646 -11.907 -3.643 1.00 0.00 H new ATOM 0 HB VAL B 75 2.604 -13.048 -1.994 1.00 0.00 H new ATOM 0 HG11 VAL B 75 2.550 -12.118 0.306 1.00 0.00 H new ATOM 0 HG12 VAL B 75 4.104 -11.783 -0.493 1.00 0.00 H new ATOM 0 HG13 VAL B 75 2.884 -10.496 -0.345 1.00 0.00 H new ATOM 0 HG21 VAL B 75 0.458 -12.241 -1.016 1.00 0.00 H new ATOM 0 HG22 VAL B 75 0.761 -10.626 -1.701 1.00 0.00 H new ATOM 0 HG23 VAL B 75 0.490 -12.014 -2.781 1.00 0.00 H new ATOM 1451 N GLY B 76 1.773 -11.001 -5.027 1.00 0.00 N ATOM 1452 CA GLY B 76 0.796 -10.339 -5.917 1.00 0.00 C ATOM 1453 C GLY B 76 -0.561 -11.005 -5.765 1.00 0.00 C ATOM 1454 O GLY B 76 -0.670 -12.143 -5.359 1.00 0.00 O ATOM 0 H GLY B 76 2.173 -11.864 -5.394 1.00 0.00 H new ATOM 0 HA2 GLY B 76 0.723 -9.280 -5.670 1.00 0.00 H new ATOM 0 HA3 GLY B 76 1.130 -10.403 -6.953 1.00 0.00 H new ATOM 1458 N LEU B 77 -1.591 -10.301 -6.094 1.00 0.00 N ATOM 1459 CA LEU B 77 -2.958 -10.880 -5.986 1.00 0.00 C ATOM 1460 C LEU B 77 -3.683 -10.774 -7.321 1.00 0.00 C ATOM 1461 O LEU B 77 -3.949 -9.699 -7.818 1.00 0.00 O ATOM 1462 CB LEU B 77 -3.684 -10.020 -4.955 1.00 0.00 C ATOM 1463 CG LEU B 77 -2.809 -9.837 -3.719 1.00 0.00 C ATOM 1464 CD1 LEU B 77 -2.211 -8.430 -3.726 1.00 0.00 C ATOM 1465 CD2 LEU B 77 -3.667 -10.020 -2.467 1.00 0.00 C ATOM 0 H LEU B 77 -1.553 -9.341 -6.437 1.00 0.00 H new ATOM 0 HA LEU B 77 -2.924 -11.932 -5.704 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -3.927 -9.049 -5.386 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -4.627 -10.490 -4.677 1.00 0.00 H new ATOM 0 HG LEU B 77 -2.005 -10.573 -3.723 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -1.585 -8.296 -2.844 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -1.607 -8.296 -4.623 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -3.014 -7.693 -3.716 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -3.048 -9.891 -1.579 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -4.467 -9.279 -2.463 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -4.099 -11.021 -2.465 1.00 0.00 H new ATOM 1477 N ALA B 78 -4.025 -11.886 -7.886 1.00 0.00 N ATOM 1478 CA ALA B 78 -4.764 -11.880 -9.181 1.00 0.00 C ATOM 1479 C ALA B 78 -5.708 -13.082 -9.265 1.00 0.00 C ATOM 1480 O ALA B 78 -5.455 -14.121 -8.688 1.00 0.00 O ATOM 1481 CB ALA B 78 -3.688 -11.973 -10.257 1.00 0.00 C ATOM 0 H ALA B 78 -3.826 -12.812 -7.508 1.00 0.00 H new ATOM 0 HA ALA B 78 -5.378 -10.987 -9.294 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -4.157 -11.974 -11.241 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -3.017 -11.118 -10.175 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -3.120 -12.894 -10.125 1.00 0.00 H new ATOM 1487 N PHE B 79 -6.776 -12.963 -10.003 1.00 0.00 N ATOM 1488 CA PHE B 79 -7.712 -14.116 -10.149 1.00 0.00 C ATOM 1489 C PHE B 79 -7.539 -14.718 -11.546 1.00 0.00 C ATOM 1490 O PHE B 79 -7.627 -14.027 -12.541 1.00 0.00 O ATOM 1491 CB PHE B 79 -9.115 -13.530 -9.979 1.00 0.00 C ATOM 1492 CG PHE B 79 -9.450 -13.441 -8.510 1.00 0.00 C ATOM 1493 CD1 PHE B 79 -8.560 -12.820 -7.626 1.00 0.00 C ATOM 1494 CD2 PHE B 79 -10.651 -13.981 -8.034 1.00 0.00 C ATOM 1495 CE1 PHE B 79 -8.872 -12.739 -6.264 1.00 0.00 C ATOM 1496 CE2 PHE B 79 -10.961 -13.898 -6.671 1.00 0.00 C ATOM 1497 CZ PHE B 79 -10.072 -13.277 -5.787 1.00 0.00 C ATOM 0 H PHE B 79 -7.042 -12.120 -10.511 1.00 0.00 H new ATOM 0 HA PHE B 79 -7.529 -14.906 -9.420 1.00 0.00 H new ATOM 0 HB2 PHE B 79 -9.165 -12.541 -10.435 1.00 0.00 H new ATOM 0 HB3 PHE B 79 -9.846 -14.155 -10.492 1.00 0.00 H new ATOM 0 HD1 PHE B 79 -7.634 -12.404 -7.994 1.00 0.00 H new ATOM 0 HD2 PHE B 79 -11.337 -14.461 -8.717 1.00 0.00 H new ATOM 0 HE1 PHE B 79 -8.186 -12.261 -5.581 1.00 0.00 H new ATOM 0 HE2 PHE B 79 -11.887 -14.314 -6.302 1.00 0.00 H new ATOM 0 HZ PHE B 79 -10.312 -13.213 -4.736 1.00 0.00 H new ATOM 1507 N ARG B 80 -7.270 -15.991 -11.631 1.00 0.00 N ATOM 1508 CA ARG B 80 -7.068 -16.612 -12.971 1.00 0.00 C ATOM 1509 C ARG B 80 -8.391 -17.110 -13.558 1.00 0.00 C ATOM 1510 O ARG B 80 -8.938 -18.106 -13.128 1.00 0.00 O ATOM 1511 CB ARG B 80 -6.120 -17.785 -12.727 1.00 0.00 C ATOM 1512 CG ARG B 80 -4.784 -17.263 -12.197 1.00 0.00 C ATOM 1513 CD ARG B 80 -3.639 -17.880 -13.004 1.00 0.00 C ATOM 1514 NE ARG B 80 -2.821 -16.720 -13.457 1.00 0.00 N ATOM 1515 CZ ARG B 80 -1.717 -16.919 -14.125 1.00 0.00 C ATOM 1516 NH1 ARG B 80 -1.329 -18.136 -14.399 1.00 0.00 N ATOM 1517 NH2 ARG B 80 -1.002 -15.902 -14.520 1.00 0.00 N ATOM 0 H ARG B 80 -7.182 -16.625 -10.837 1.00 0.00 H new ATOM 0 HA ARG B 80 -6.666 -15.895 -13.687 1.00 0.00 H new ATOM 0 HB2 ARG B 80 -6.561 -18.479 -12.011 1.00 0.00 H new ATOM 0 HB3 ARG B 80 -5.964 -18.338 -13.653 1.00 0.00 H new ATOM 0 HG2 ARG B 80 -4.751 -16.176 -12.271 1.00 0.00 H new ATOM 0 HG3 ARG B 80 -4.676 -17.514 -11.142 1.00 0.00 H new ATOM 0 HD2 ARG B 80 -3.050 -18.565 -12.394 1.00 0.00 H new ATOM 0 HD3 ARG B 80 -4.016 -18.452 -13.851 1.00 0.00 H new ATOM 0 HE ARG B 80 -3.124 -15.769 -13.245 1.00 0.00 H new ATOM 0 HH11 ARG B 80 -1.889 -18.931 -14.091 1.00 0.00 H new ATOM 0 HH12 ARG B 80 -0.466 -18.291 -14.921 1.00 0.00 H new ATOM 0 HH21 ARG B 80 -1.305 -14.952 -14.307 1.00 0.00 H new ATOM 0 HH22 ARG B 80 -0.139 -16.057 -15.042 1.00 0.00 H new ATOM 1599 N GLU B 86 -8.474 -10.380 -13.481 1.00 0.00 N ATOM 1600 CA GLU B 86 -8.361 -9.493 -12.282 1.00 0.00 C ATOM 1601 C GLU B 86 -7.046 -8.707 -12.281 1.00 0.00 C ATOM 1602 O GLU B 86 -6.962 -7.628 -12.834 1.00 0.00 O ATOM 1603 CB GLU B 86 -8.433 -10.432 -11.077 1.00 0.00 C ATOM 1604 CG GLU B 86 -9.766 -10.230 -10.353 1.00 0.00 C ATOM 1605 CD GLU B 86 -9.945 -8.748 -10.017 1.00 0.00 C ATOM 1606 OE1 GLU B 86 -9.363 -8.309 -9.040 1.00 0.00 O ATOM 1607 OE2 GLU B 86 -10.662 -8.078 -10.742 1.00 0.00 O ATOM 0 HA GLU B 86 -9.154 -8.745 -12.268 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -8.337 -11.468 -11.403 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -7.604 -10.234 -10.398 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -10.588 -10.573 -10.980 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -9.791 -10.826 -9.441 1.00 0.00 H new ATOM 1614 N ALA B 87 -6.023 -9.216 -11.645 1.00 0.00 N ATOM 1615 CA ALA B 87 -4.739 -8.459 -11.601 1.00 0.00 C ATOM 1616 C ALA B 87 -3.568 -9.303 -12.122 1.00 0.00 C ATOM 1617 O ALA B 87 -3.484 -9.594 -13.299 1.00 0.00 O ATOM 1618 CB ALA B 87 -4.542 -8.109 -10.124 1.00 0.00 C ATOM 0 H ALA B 87 -6.021 -10.113 -11.160 1.00 0.00 H new ATOM 0 HA ALA B 87 -4.772 -7.574 -12.237 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -3.615 -7.548 -10.003 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -5.380 -7.503 -9.779 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -4.491 -9.026 -9.537 1.00 0.00 H new ATOM 1624 N LEU B 88 -2.645 -9.657 -11.261 1.00 0.00 N ATOM 1625 CA LEU B 88 -1.454 -10.438 -11.695 1.00 0.00 C ATOM 1626 C LEU B 88 -0.413 -9.461 -12.229 1.00 0.00 C ATOM 1627 O LEU B 88 0.712 -9.815 -12.516 1.00 0.00 O ATOM 1628 CB LEU B 88 -1.923 -11.394 -12.792 1.00 0.00 C ATOM 1629 CG LEU B 88 -1.105 -12.685 -12.712 1.00 0.00 C ATOM 1630 CD1 LEU B 88 0.365 -12.347 -12.449 1.00 0.00 C ATOM 1631 CD2 LEU B 88 -1.632 -13.545 -11.564 1.00 0.00 C ATOM 0 H LEU B 88 -2.670 -9.434 -10.266 1.00 0.00 H new ATOM 0 HA LEU B 88 -1.008 -11.006 -10.878 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -2.984 -11.613 -12.672 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -1.801 -10.932 -13.772 1.00 0.00 H new ATOM 0 HG LEU B 88 -1.192 -13.227 -13.653 1.00 0.00 H new ATOM 0 HD11 LEU B 88 0.946 -13.268 -12.392 1.00 0.00 H new ATOM 0 HD12 LEU B 88 0.746 -11.727 -13.260 1.00 0.00 H new ATOM 0 HD13 LEU B 88 0.451 -11.805 -11.507 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -1.052 -14.466 -11.503 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -1.541 -12.996 -10.627 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -2.680 -13.787 -11.742 1.00 0.00 H new ATOM 1643 N CYS B 89 -0.785 -8.215 -12.323 1.00 0.00 N ATOM 1644 CA CYS B 89 0.157 -7.182 -12.789 1.00 0.00 C ATOM 1645 C CYS B 89 0.280 -6.164 -11.669 1.00 0.00 C ATOM 1646 O CYS B 89 -0.653 -5.449 -11.367 1.00 0.00 O ATOM 1647 CB CYS B 89 -0.489 -6.557 -14.026 1.00 0.00 C ATOM 1648 SG CYS B 89 -1.160 -7.864 -15.086 1.00 0.00 S ATOM 0 H CYS B 89 -1.717 -7.872 -12.091 1.00 0.00 H new ATOM 0 HA CYS B 89 1.148 -7.564 -13.036 1.00 0.00 H new ATOM 0 HB2 CYS B 89 -1.283 -5.873 -13.728 1.00 0.00 H new ATOM 0 HB3 CYS B 89 0.247 -5.970 -14.576 1.00 0.00 H new ATOM 0 HG CYS B 89 -2.066 -8.530 -14.433 1.00 0.00 H new ATOM 1654 N ILE B 90 1.395 -6.111 -11.024 1.00 0.00 N ATOM 1655 CA ILE B 90 1.521 -5.156 -9.902 1.00 0.00 C ATOM 1656 C ILE B 90 2.038 -3.820 -10.409 1.00 0.00 C ATOM 1657 O ILE B 90 3.187 -3.674 -10.775 1.00 0.00 O ATOM 1658 CB ILE B 90 2.533 -5.792 -8.954 1.00 0.00 C ATOM 1659 CG1 ILE B 90 1.943 -7.074 -8.364 1.00 0.00 C ATOM 1660 CG2 ILE B 90 2.856 -4.812 -7.827 1.00 0.00 C ATOM 1661 CD1 ILE B 90 0.573 -6.769 -7.758 1.00 0.00 C ATOM 0 H ILE B 90 2.219 -6.679 -11.219 1.00 0.00 H new ATOM 0 HA ILE B 90 0.566 -4.965 -9.412 1.00 0.00 H new ATOM 0 HB ILE B 90 3.445 -6.032 -9.500 1.00 0.00 H new ATOM 0 HG12 ILE B 90 1.849 -7.835 -9.139 1.00 0.00 H new ATOM 0 HG13 ILE B 90 2.609 -7.477 -7.601 1.00 0.00 H new ATOM 0 HG21 ILE B 90 3.579 -5.264 -7.148 1.00 0.00 H new ATOM 0 HG22 ILE B 90 3.276 -3.898 -8.248 1.00 0.00 H new ATOM 0 HG23 ILE B 90 1.944 -4.574 -7.280 1.00 0.00 H new ATOM 0 HD11 ILE B 90 0.150 -7.681 -7.337 1.00 0.00 H new ATOM 0 HD12 ILE B 90 0.681 -6.022 -6.971 1.00 0.00 H new ATOM 0 HD13 ILE B 90 -0.091 -6.386 -8.533 1.00 0.00 H new ATOM 1673 N GLU B 91 1.180 -2.843 -10.428 1.00 0.00 N ATOM 1674 CA GLU B 91 1.594 -1.493 -10.909 1.00 0.00 C ATOM 1675 C GLU B 91 2.431 -0.791 -9.834 1.00 0.00 C ATOM 1676 O GLU B 91 1.922 -0.417 -8.797 1.00 0.00 O ATOM 1677 CB GLU B 91 0.287 -0.738 -11.150 1.00 0.00 C ATOM 1678 CG GLU B 91 0.572 0.544 -11.934 1.00 0.00 C ATOM 1679 CD GLU B 91 0.238 0.323 -13.410 1.00 0.00 C ATOM 1680 OE1 GLU B 91 -0.309 -0.721 -13.724 1.00 0.00 O ATOM 1681 OE2 GLU B 91 0.533 1.203 -14.202 1.00 0.00 O ATOM 0 H GLU B 91 0.207 -2.918 -10.131 1.00 0.00 H new ATOM 0 HA GLU B 91 2.205 -1.542 -11.811 1.00 0.00 H new ATOM 0 HB2 GLU B 91 -0.411 -1.367 -11.703 1.00 0.00 H new ATOM 0 HB3 GLU B 91 -0.186 -0.497 -10.198 1.00 0.00 H new ATOM 0 HG2 GLU B 91 -0.021 1.367 -11.535 1.00 0.00 H new ATOM 0 HG3 GLU B 91 1.620 0.824 -11.825 1.00 0.00 H new ATOM 1688 N PRO B 92 3.696 -0.646 -10.123 1.00 0.00 N ATOM 1689 CA PRO B 92 4.627 0.007 -9.169 1.00 0.00 C ATOM 1690 C PRO B 92 4.380 1.517 -9.122 1.00 0.00 C ATOM 1691 O PRO B 92 3.854 2.101 -10.048 1.00 0.00 O ATOM 1692 CB PRO B 92 6.005 -0.297 -9.748 1.00 0.00 C ATOM 1693 CG PRO B 92 5.770 -0.523 -11.209 1.00 0.00 C ATOM 1694 CD PRO B 92 4.374 -1.072 -11.352 1.00 0.00 C ATOM 0 HA PRO B 92 4.509 -0.351 -8.146 1.00 0.00 H new ATOM 0 HB2 PRO B 92 6.694 0.531 -9.583 1.00 0.00 H new ATOM 0 HB3 PRO B 92 6.445 -1.177 -9.278 1.00 0.00 H new ATOM 0 HG2 PRO B 92 5.877 0.408 -11.765 1.00 0.00 H new ATOM 0 HG3 PRO B 92 6.502 -1.222 -11.614 1.00 0.00 H new ATOM 0 HD2 PRO B 92 3.879 -0.676 -12.239 1.00 0.00 H new ATOM 0 HD3 PRO B 92 4.380 -2.158 -11.448 1.00 0.00 H new ATOM 1702 N PHE B 93 4.760 2.152 -8.047 1.00 0.00 N ATOM 1703 CA PHE B 93 4.553 3.624 -7.938 1.00 0.00 C ATOM 1704 C PHE B 93 5.602 4.364 -8.776 1.00 0.00 C ATOM 1705 O PHE B 93 5.823 4.047 -9.927 1.00 0.00 O ATOM 1706 CB PHE B 93 4.725 3.939 -6.450 1.00 0.00 C ATOM 1707 CG PHE B 93 4.051 2.867 -5.626 1.00 0.00 C ATOM 1708 CD1 PHE B 93 2.877 2.262 -6.091 1.00 0.00 C ATOM 1709 CD2 PHE B 93 4.600 2.479 -4.398 1.00 0.00 C ATOM 1710 CE1 PHE B 93 2.253 1.268 -5.329 1.00 0.00 C ATOM 1711 CE2 PHE B 93 3.976 1.484 -3.636 1.00 0.00 C ATOM 1712 CZ PHE B 93 2.802 0.879 -4.101 1.00 0.00 C ATOM 0 H PHE B 93 5.205 1.715 -7.240 1.00 0.00 H new ATOM 0 HA PHE B 93 3.576 3.936 -8.306 1.00 0.00 H new ATOM 0 HB2 PHE B 93 5.784 3.993 -6.199 1.00 0.00 H new ATOM 0 HB3 PHE B 93 4.293 4.913 -6.222 1.00 0.00 H new ATOM 0 HD1 PHE B 93 2.453 2.563 -7.038 1.00 0.00 H new ATOM 0 HD2 PHE B 93 5.505 2.947 -4.039 1.00 0.00 H new ATOM 0 HE1 PHE B 93 1.348 0.801 -5.688 1.00 0.00 H new ATOM 0 HE2 PHE B 93 4.400 1.183 -2.689 1.00 0.00 H new ATOM 0 HZ PHE B 93 2.320 0.112 -3.513 1.00 0.00 H new ATOM 2071 N MET C 17 -5.086 -5.296 14.088 1.00 0.00 N ATOM 2072 CA MET C 17 -5.579 -3.987 13.570 1.00 0.00 C ATOM 2073 C MET C 17 -4.662 -3.479 12.455 1.00 0.00 C ATOM 2074 O MET C 17 -3.460 -3.656 12.496 1.00 0.00 O ATOM 2075 CB MET C 17 -5.535 -3.044 14.773 1.00 0.00 C ATOM 2076 CG MET C 17 -6.328 -3.654 15.930 1.00 0.00 C ATOM 2077 SD MET C 17 -8.083 -3.720 15.489 1.00 0.00 S ATOM 2078 CE MET C 17 -8.701 -2.730 16.871 1.00 0.00 C ATOM 0 HA MET C 17 -6.581 -4.061 13.146 1.00 0.00 H new ATOM 0 HB2 MET C 17 -4.502 -2.873 15.077 1.00 0.00 H new ATOM 0 HB3 MET C 17 -5.953 -2.074 14.503 1.00 0.00 H new ATOM 0 HG2 MET C 17 -5.959 -4.656 16.150 1.00 0.00 H new ATOM 0 HG3 MET C 17 -6.191 -3.059 16.833 1.00 0.00 H new ATOM 0 HE1 MET C 17 -9.785 -2.640 16.798 1.00 0.00 H new ATOM 0 HE2 MET C 17 -8.440 -3.215 17.812 1.00 0.00 H new ATOM 0 HE3 MET C 17 -8.251 -1.738 16.838 1.00 0.00 H new ATOM 2088 N TYR C 18 -5.218 -2.846 11.459 1.00 0.00 N ATOM 2089 CA TYR C 18 -4.378 -2.325 10.342 1.00 0.00 C ATOM 2090 C TYR C 18 -4.967 -1.019 9.796 1.00 0.00 C ATOM 2091 O TYR C 18 -6.128 -0.719 9.998 1.00 0.00 O ATOM 2092 CB TYR C 18 -4.391 -3.432 9.281 1.00 0.00 C ATOM 2093 CG TYR C 18 -5.591 -3.286 8.370 1.00 0.00 C ATOM 2094 CD1 TYR C 18 -6.830 -2.883 8.886 1.00 0.00 C ATOM 2095 CD2 TYR C 18 -5.461 -3.562 7.004 1.00 0.00 C ATOM 2096 CE1 TYR C 18 -7.934 -2.756 8.036 1.00 0.00 C ATOM 2097 CE2 TYR C 18 -6.567 -3.435 6.155 1.00 0.00 C ATOM 2098 CZ TYR C 18 -7.803 -3.032 6.670 1.00 0.00 C ATOM 2099 OH TYR C 18 -8.893 -2.906 5.833 1.00 0.00 O ATOM 0 H TYR C 18 -6.218 -2.667 11.370 1.00 0.00 H new ATOM 0 HA TYR C 18 -3.362 -2.092 10.660 1.00 0.00 H new ATOM 0 HB2 TYR C 18 -3.474 -3.390 8.693 1.00 0.00 H new ATOM 0 HB3 TYR C 18 -4.413 -4.408 9.766 1.00 0.00 H new ATOM 0 HD1 TYR C 18 -6.933 -2.670 9.940 1.00 0.00 H new ATOM 0 HD2 TYR C 18 -4.507 -3.873 6.605 1.00 0.00 H new ATOM 0 HE1 TYR C 18 -8.888 -2.445 8.434 1.00 0.00 H new ATOM 0 HE2 TYR C 18 -6.465 -3.649 5.101 1.00 0.00 H new ATOM 0 HH TYR C 18 -8.630 -3.134 4.917 1.00 0.00 H new ATOM 2109 N VAL C 19 -4.176 -0.236 9.113 1.00 0.00 N ATOM 2110 CA VAL C 19 -4.697 1.052 8.567 1.00 0.00 C ATOM 2111 C VAL C 19 -4.253 1.242 7.112 1.00 0.00 C ATOM 2112 O VAL C 19 -3.190 0.809 6.713 1.00 0.00 O ATOM 2113 CB VAL C 19 -4.092 2.136 9.463 1.00 0.00 C ATOM 2114 CG1 VAL C 19 -2.587 2.252 9.198 1.00 0.00 C ATOM 2115 CG2 VAL C 19 -4.765 3.476 9.165 1.00 0.00 C ATOM 0 H VAL C 19 -3.196 -0.431 8.910 1.00 0.00 H new ATOM 0 HA VAL C 19 -5.787 1.084 8.565 1.00 0.00 H new ATOM 0 HB VAL C 19 -4.253 1.868 10.507 1.00 0.00 H new ATOM 0 HG11 VAL C 19 -2.163 3.025 9.839 1.00 0.00 H new ATOM 0 HG12 VAL C 19 -2.105 1.298 9.413 1.00 0.00 H new ATOM 0 HG13 VAL C 19 -2.421 2.515 8.153 1.00 0.00 H new ATOM 0 HG21 VAL C 19 -4.335 4.249 9.802 1.00 0.00 H new ATOM 0 HG22 VAL C 19 -4.606 3.738 8.119 1.00 0.00 H new ATOM 0 HG23 VAL C 19 -5.834 3.398 9.361 1.00 0.00 H new ATOM 2125 N LYS C 20 -5.063 1.892 6.318 1.00 0.00 N ATOM 2126 CA LYS C 20 -4.701 2.120 4.897 1.00 0.00 C ATOM 2127 C LYS C 20 -4.245 3.569 4.701 1.00 0.00 C ATOM 2128 O LYS C 20 -4.824 4.489 5.243 1.00 0.00 O ATOM 2129 CB LYS C 20 -5.987 1.850 4.115 1.00 0.00 C ATOM 2130 CG LYS C 20 -7.207 2.299 4.921 1.00 0.00 C ATOM 2131 CD LYS C 20 -8.437 2.322 4.012 1.00 0.00 C ATOM 2132 CE LYS C 20 -8.846 0.888 3.672 1.00 0.00 C ATOM 2133 NZ LYS C 20 -9.699 0.452 4.812 1.00 0.00 N ATOM 0 H LYS C 20 -5.965 2.276 6.600 1.00 0.00 H new ATOM 0 HA LYS C 20 -3.883 1.480 4.566 1.00 0.00 H new ATOM 0 HB2 LYS C 20 -5.958 2.379 3.162 1.00 0.00 H new ATOM 0 HB3 LYS C 20 -6.065 0.787 3.887 1.00 0.00 H new ATOM 0 HG2 LYS C 20 -7.373 1.621 5.758 1.00 0.00 H new ATOM 0 HG3 LYS C 20 -7.034 3.289 5.342 1.00 0.00 H new ATOM 0 HD2 LYS C 20 -9.259 2.838 4.508 1.00 0.00 H new ATOM 0 HD3 LYS C 20 -8.217 2.875 3.099 1.00 0.00 H new ATOM 0 HE2 LYS C 20 -9.393 0.846 2.730 1.00 0.00 H new ATOM 0 HE3 LYS C 20 -7.974 0.244 3.562 1.00 0.00 H new ATOM 0 HZ1 LYS C 20 -9.542 -0.559 4.996 1.00 0.00 H new ATOM 0 HZ2 LYS C 20 -9.452 1.001 5.660 1.00 0.00 H new ATOM 0 HZ3 LYS C 20 -10.700 0.610 4.577 1.00 0.00 H new ATOM 2147 N LEU C 21 -3.209 3.779 3.936 1.00 0.00 N ATOM 2148 CA LEU C 21 -2.717 5.169 3.712 1.00 0.00 C ATOM 2149 C LEU C 21 -2.876 5.544 2.238 1.00 0.00 C ATOM 2150 O LEU C 21 -2.453 4.823 1.357 1.00 0.00 O ATOM 2151 CB LEU C 21 -1.232 5.153 4.103 1.00 0.00 C ATOM 2152 CG LEU C 21 -0.935 3.968 5.031 1.00 0.00 C ATOM 2153 CD1 LEU C 21 0.566 3.892 5.301 1.00 0.00 C ATOM 2154 CD2 LEU C 21 -1.678 4.151 6.354 1.00 0.00 C ATOM 0 H LEU C 21 -2.682 3.049 3.456 1.00 0.00 H new ATOM 0 HA LEU C 21 -3.275 5.899 4.298 1.00 0.00 H new ATOM 0 HB2 LEU C 21 -0.614 5.085 3.207 1.00 0.00 H new ATOM 0 HB3 LEU C 21 -0.970 6.087 4.600 1.00 0.00 H new ATOM 0 HG LEU C 21 -1.267 3.047 4.552 1.00 0.00 H new ATOM 0 HD11 LEU C 21 0.775 3.050 5.960 1.00 0.00 H new ATOM 0 HD12 LEU C 21 1.099 3.757 4.360 1.00 0.00 H new ATOM 0 HD13 LEU C 21 0.897 4.815 5.776 1.00 0.00 H new ATOM 0 HD21 LEU C 21 -1.465 3.308 7.011 1.00 0.00 H new ATOM 0 HD22 LEU C 21 -1.350 5.074 6.831 1.00 0.00 H new ATOM 0 HD23 LEU C 21 -2.750 4.202 6.165 1.00 0.00 H new ATOM 2166 N ILE C 22 -3.486 6.663 1.961 1.00 0.00 N ATOM 2167 CA ILE C 22 -3.671 7.073 0.546 1.00 0.00 C ATOM 2168 C ILE C 22 -2.782 8.278 0.228 1.00 0.00 C ATOM 2169 O ILE C 22 -2.603 9.165 1.039 1.00 0.00 O ATOM 2170 CB ILE C 22 -5.147 7.449 0.440 1.00 0.00 C ATOM 2171 CG1 ILE C 22 -5.976 6.189 0.175 1.00 0.00 C ATOM 2172 CG2 ILE C 22 -5.344 8.440 -0.705 1.00 0.00 C ATOM 2173 CD1 ILE C 22 -6.761 5.819 1.435 1.00 0.00 C ATOM 0 H ILE C 22 -3.863 7.309 2.654 1.00 0.00 H new ATOM 0 HA ILE C 22 -3.399 6.285 -0.157 1.00 0.00 H new ATOM 0 HB ILE C 22 -5.471 7.909 1.374 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -6.661 6.360 -0.656 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -5.323 5.366 -0.114 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -6.398 8.706 -0.778 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -4.755 9.337 -0.515 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -5.019 7.984 -1.640 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -7.351 4.922 1.246 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -6.067 5.631 2.254 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -7.425 6.640 1.704 1.00 0.00 H new ATOM 2185 N SER C 23 -2.229 8.314 -0.948 1.00 0.00 N ATOM 2186 CA SER C 23 -1.352 9.458 -1.331 1.00 0.00 C ATOM 2187 C SER C 23 -2.050 10.328 -2.380 1.00 0.00 C ATOM 2188 O SER C 23 -2.884 9.863 -3.130 1.00 0.00 O ATOM 2189 CB SER C 23 -0.096 8.814 -1.918 1.00 0.00 C ATOM 2190 OG SER C 23 0.899 9.813 -2.101 1.00 0.00 O ATOM 0 H SER C 23 -2.345 7.599 -1.666 1.00 0.00 H new ATOM 0 HA SER C 23 -1.120 10.104 -0.484 1.00 0.00 H new ATOM 0 HB2 SER C 23 0.273 8.034 -1.252 1.00 0.00 H new ATOM 0 HB3 SER C 23 -0.328 8.336 -2.870 1.00 0.00 H new ATOM 0 HG SER C 23 0.787 10.514 -1.425 1.00 0.00 H new ATOM 2196 N SER C 24 -1.718 11.589 -2.436 1.00 0.00 N ATOM 2197 CA SER C 24 -2.366 12.485 -3.437 1.00 0.00 C ATOM 2198 C SER C 24 -2.173 11.927 -4.849 1.00 0.00 C ATOM 2199 O SER C 24 -2.859 12.310 -5.776 1.00 0.00 O ATOM 2200 CB SER C 24 -1.653 13.828 -3.288 1.00 0.00 C ATOM 2201 OG SER C 24 -2.617 14.874 -3.298 1.00 0.00 O ATOM 0 H SER C 24 -1.028 12.037 -1.834 1.00 0.00 H new ATOM 0 HA SER C 24 -3.440 12.575 -3.276 1.00 0.00 H new ATOM 0 HB2 SER C 24 -1.085 13.850 -2.358 1.00 0.00 H new ATOM 0 HB3 SER C 24 -0.940 13.967 -4.101 1.00 0.00 H new ATOM 0 HG SER C 24 -2.164 15.737 -3.201 1.00 0.00 H new ATOM 2207 N ASP C 25 -1.243 11.027 -5.021 1.00 0.00 N ATOM 2208 CA ASP C 25 -1.009 10.447 -6.374 1.00 0.00 C ATOM 2209 C ASP C 25 -2.140 9.481 -6.738 1.00 0.00 C ATOM 2210 O ASP C 25 -2.560 9.402 -7.876 1.00 0.00 O ATOM 2211 CB ASP C 25 0.318 9.698 -6.261 1.00 0.00 C ATOM 2212 CG ASP C 25 1.433 10.531 -6.894 1.00 0.00 C ATOM 2213 OD1 ASP C 25 1.325 10.830 -8.072 1.00 0.00 O ATOM 2214 OD2 ASP C 25 2.375 10.858 -6.191 1.00 0.00 O ATOM 0 H ASP C 25 -0.636 10.669 -4.284 1.00 0.00 H new ATOM 0 HA ASP C 25 -0.981 11.211 -7.151 1.00 0.00 H new ATOM 0 HB2 ASP C 25 0.548 9.501 -5.214 1.00 0.00 H new ATOM 0 HB3 ASP C 25 0.245 8.731 -6.759 1.00 0.00 H new ATOM 2219 N GLY C 26 -2.636 8.746 -5.782 1.00 0.00 N ATOM 2220 CA GLY C 26 -3.739 7.787 -6.074 1.00 0.00 C ATOM 2221 C GLY C 26 -3.335 6.387 -5.606 1.00 0.00 C ATOM 2222 O GLY C 26 -4.116 5.457 -5.658 1.00 0.00 O ATOM 0 H GLY C 26 -2.325 8.768 -4.811 1.00 0.00 H new ATOM 0 HA2 GLY C 26 -4.652 8.102 -5.569 1.00 0.00 H new ATOM 0 HA3 GLY C 26 -3.953 7.777 -7.143 1.00 0.00 H new ATOM 2226 N HIS C 27 -2.123 6.228 -5.150 1.00 0.00 N ATOM 2227 CA HIS C 27 -1.673 4.885 -4.681 1.00 0.00 C ATOM 2228 C HIS C 27 -2.214 4.609 -3.276 1.00 0.00 C ATOM 2229 O HIS C 27 -2.462 5.514 -2.505 1.00 0.00 O ATOM 2230 CB HIS C 27 -0.146 4.963 -4.661 1.00 0.00 C ATOM 2231 CG HIS C 27 0.374 4.946 -6.073 1.00 0.00 C ATOM 2232 ND1 HIS C 27 -0.102 4.359 -7.219 1.00 0.00 N flip ATOM 2233 CD2 HIS C 27 1.539 5.601 -6.439 1.00 0.00 C flip ATOM 2234 CE1 HIS C 27 0.753 4.643 -8.280 1.00 0.00 C flip ATOM 2235 NE2 HIS C 27 1.724 5.395 -7.755 1.00 0.00 N flip ATOM 0 H HIS C 27 -1.425 6.968 -5.082 1.00 0.00 H new ATOM 0 HA HIS C 27 -2.031 4.081 -5.324 1.00 0.00 H new ATOM 0 HB2 HIS C 27 0.176 5.873 -4.154 1.00 0.00 H new ATOM 0 HB3 HIS C 27 0.265 4.123 -4.100 1.00 0.00 H new ATOM 0 HD2 HIS C 27 2.182 6.173 -5.786 1.00 0.00 H new ATOM 0 HE1 HIS C 27 0.653 4.324 -9.307 1.00 0.00 H new ATOM 0 HE2 HIS C 27 2.510 5.768 -8.287 1.00 0.00 H new ATOM 2243 N GLU C 28 -2.397 3.362 -2.936 1.00 0.00 N ATOM 2244 CA GLU C 28 -2.922 3.027 -1.582 1.00 0.00 C ATOM 2245 C GLU C 28 -1.977 2.051 -0.882 1.00 0.00 C ATOM 2246 O GLU C 28 -1.405 1.169 -1.494 1.00 0.00 O ATOM 2247 CB GLU C 28 -4.283 2.370 -1.823 1.00 0.00 C ATOM 2248 CG GLU C 28 -4.979 3.034 -3.015 1.00 0.00 C ATOM 2249 CD GLU C 28 -5.331 4.480 -2.662 1.00 0.00 C ATOM 2250 OE1 GLU C 28 -6.242 4.672 -1.874 1.00 0.00 O ATOM 2251 OE2 GLU C 28 -4.683 5.372 -3.187 1.00 0.00 O ATOM 0 H GLU C 28 -2.206 2.561 -3.538 1.00 0.00 H new ATOM 0 HA GLU C 28 -3.007 3.908 -0.946 1.00 0.00 H new ATOM 0 HB2 GLU C 28 -4.154 1.305 -2.014 1.00 0.00 H new ATOM 0 HB3 GLU C 28 -4.904 2.461 -0.932 1.00 0.00 H new ATOM 0 HG2 GLU C 28 -4.328 3.010 -3.889 1.00 0.00 H new ATOM 0 HG3 GLU C 28 -5.882 2.482 -3.275 1.00 0.00 H new ATOM 2258 N PHE C 29 -1.816 2.205 0.397 1.00 0.00 N ATOM 2259 CA PHE C 29 -0.916 1.295 1.162 1.00 0.00 C ATOM 2260 C PHE C 29 -1.521 1.025 2.535 1.00 0.00 C ATOM 2261 O PHE C 29 -2.031 1.914 3.181 1.00 0.00 O ATOM 2262 CB PHE C 29 0.403 2.056 1.292 1.00 0.00 C ATOM 2263 CG PHE C 29 1.557 1.118 1.028 1.00 0.00 C ATOM 2264 CD1 PHE C 29 1.913 0.801 -0.289 1.00 0.00 C ATOM 2265 CD2 PHE C 29 2.271 0.566 2.099 1.00 0.00 C ATOM 2266 CE1 PHE C 29 2.982 -0.069 -0.534 1.00 0.00 C ATOM 2267 CE2 PHE C 29 3.341 -0.303 1.852 1.00 0.00 C ATOM 2268 CZ PHE C 29 3.696 -0.621 0.536 1.00 0.00 C ATOM 0 H PHE C 29 -2.272 2.928 0.954 1.00 0.00 H new ATOM 0 HA PHE C 29 -0.774 0.331 0.673 1.00 0.00 H new ATOM 0 HB2 PHE C 29 0.427 2.886 0.586 1.00 0.00 H new ATOM 0 HB3 PHE C 29 0.490 2.484 2.290 1.00 0.00 H new ATOM 0 HD1 PHE C 29 1.363 1.227 -1.115 1.00 0.00 H new ATOM 0 HD2 PHE C 29 1.997 0.810 3.115 1.00 0.00 H new ATOM 0 HE1 PHE C 29 3.256 -0.315 -1.549 1.00 0.00 H new ATOM 0 HE2 PHE C 29 3.893 -0.728 2.677 1.00 0.00 H new ATOM 0 HZ PHE C 29 4.521 -1.292 0.346 1.00 0.00 H new ATOM 2278 N ILE C 30 -1.485 -0.195 2.984 1.00 0.00 N ATOM 2279 CA ILE C 30 -2.076 -0.504 4.314 1.00 0.00 C ATOM 2280 C ILE C 30 -1.001 -1.000 5.280 1.00 0.00 C ATOM 2281 O ILE C 30 -0.254 -1.909 4.982 1.00 0.00 O ATOM 2282 CB ILE C 30 -3.092 -1.605 4.042 1.00 0.00 C ATOM 2283 CG1 ILE C 30 -4.068 -1.149 2.953 1.00 0.00 C ATOM 2284 CG2 ILE C 30 -3.870 -1.917 5.320 1.00 0.00 C ATOM 2285 CD1 ILE C 30 -3.597 -1.656 1.587 1.00 0.00 C ATOM 0 H ILE C 30 -1.075 -0.989 2.492 1.00 0.00 H new ATOM 0 HA ILE C 30 -2.529 0.374 4.774 1.00 0.00 H new ATOM 0 HB ILE C 30 -2.567 -2.500 3.709 1.00 0.00 H new ATOM 0 HG12 ILE C 30 -5.068 -1.528 3.166 1.00 0.00 H new ATOM 0 HG13 ILE C 30 -4.134 -0.061 2.944 1.00 0.00 H new ATOM 0 HG21 ILE C 30 -4.596 -2.705 5.121 1.00 0.00 H new ATOM 0 HG22 ILE C 30 -3.179 -2.248 6.095 1.00 0.00 H new ATOM 0 HG23 ILE C 30 -4.391 -1.021 5.657 1.00 0.00 H new ATOM 0 HD11 ILE C 30 -4.295 -1.328 0.817 1.00 0.00 H new ATOM 0 HD12 ILE C 30 -2.606 -1.256 1.372 1.00 0.00 H new ATOM 0 HD13 ILE C 30 -3.554 -2.745 1.598 1.00 0.00 H new ATOM 2297 N VAL C 31 -0.927 -0.414 6.441 1.00 0.00 N ATOM 2298 CA VAL C 31 0.090 -0.854 7.438 1.00 0.00 C ATOM 2299 C VAL C 31 -0.604 -1.294 8.730 1.00 0.00 C ATOM 2300 O VAL C 31 -1.488 -0.628 9.230 1.00 0.00 O ATOM 2301 CB VAL C 31 0.965 0.376 7.684 1.00 0.00 C ATOM 2302 CG1 VAL C 31 1.623 0.804 6.371 1.00 0.00 C ATOM 2303 CG2 VAL C 31 0.100 1.520 8.215 1.00 0.00 C ATOM 0 H VAL C 31 -1.528 0.353 6.744 1.00 0.00 H new ATOM 0 HA VAL C 31 0.678 -1.702 7.087 1.00 0.00 H new ATOM 0 HB VAL C 31 1.735 0.133 8.416 1.00 0.00 H new ATOM 0 HG11 VAL C 31 2.247 1.681 6.545 1.00 0.00 H new ATOM 0 HG12 VAL C 31 2.240 -0.010 5.991 1.00 0.00 H new ATOM 0 HG13 VAL C 31 0.852 1.047 5.640 1.00 0.00 H new ATOM 0 HG21 VAL C 31 0.724 2.397 8.390 1.00 0.00 H new ATOM 0 HG22 VAL C 31 -0.671 1.763 7.483 1.00 0.00 H new ATOM 0 HG23 VAL C 31 -0.370 1.217 9.150 1.00 0.00 H new ATOM 2313 N LYS C 32 -0.213 -2.417 9.270 1.00 0.00 N ATOM 2314 CA LYS C 32 -0.854 -2.907 10.524 1.00 0.00 C ATOM 2315 C LYS C 32 -0.878 -1.798 11.578 1.00 0.00 C ATOM 2316 O LYS C 32 -0.007 -0.952 11.623 1.00 0.00 O ATOM 2317 CB LYS C 32 0.026 -4.068 10.989 1.00 0.00 C ATOM 2318 CG LYS C 32 -0.558 -5.389 10.482 1.00 0.00 C ATOM 2319 CD LYS C 32 -0.950 -6.267 11.671 1.00 0.00 C ATOM 2320 CE LYS C 32 0.043 -7.423 11.805 1.00 0.00 C ATOM 2321 NZ LYS C 32 0.026 -8.100 10.479 1.00 0.00 N ATOM 0 H LYS C 32 0.523 -3.016 8.897 1.00 0.00 H new ATOM 0 HA LYS C 32 -1.888 -3.214 10.365 1.00 0.00 H new ATOM 0 HB2 LYS C 32 1.042 -3.940 10.615 1.00 0.00 H new ATOM 0 HB3 LYS C 32 0.086 -4.079 12.077 1.00 0.00 H new ATOM 0 HG2 LYS C 32 -1.430 -5.196 9.856 1.00 0.00 H new ATOM 0 HG3 LYS C 32 0.173 -5.906 9.860 1.00 0.00 H new ATOM 0 HD2 LYS C 32 -0.959 -5.675 12.586 1.00 0.00 H new ATOM 0 HD3 LYS C 32 -1.959 -6.655 11.532 1.00 0.00 H new ATOM 0 HE2 LYS C 32 1.041 -7.060 12.050 1.00 0.00 H new ATOM 0 HE3 LYS C 32 -0.252 -8.107 12.601 1.00 0.00 H new ATOM 0 HZ1 LYS C 32 0.132 -9.126 10.612 1.00 0.00 H new ATOM 0 HZ2 LYS C 32 -0.877 -7.904 10.001 1.00 0.00 H new ATOM 0 HZ3 LYS C 32 0.811 -7.743 9.897 1.00 0.00 H new ATOM 2335 N ARG C 33 -1.869 -1.799 12.430 1.00 0.00 N ATOM 2336 CA ARG C 33 -1.949 -0.748 13.485 1.00 0.00 C ATOM 2337 C ARG C 33 -0.552 -0.455 14.034 1.00 0.00 C ATOM 2338 O ARG C 33 -0.031 0.632 13.882 1.00 0.00 O ATOM 2339 CB ARG C 33 -2.838 -1.347 14.574 1.00 0.00 C ATOM 2340 CG ARG C 33 -2.697 -0.524 15.856 1.00 0.00 C ATOM 2341 CD ARG C 33 -3.885 -0.810 16.778 1.00 0.00 C ATOM 2342 NE ARG C 33 -3.867 0.292 17.780 1.00 0.00 N ATOM 2343 CZ ARG C 33 -4.524 0.166 18.901 1.00 0.00 C ATOM 2344 NH1 ARG C 33 -5.197 -0.925 19.145 1.00 0.00 N ATOM 2345 NH2 ARG C 33 -4.507 1.132 19.778 1.00 0.00 N ATOM 0 H ARG C 33 -2.626 -2.482 12.440 1.00 0.00 H new ATOM 0 HA ARG C 33 -2.349 0.193 13.107 1.00 0.00 H new ATOM 0 HB2 ARG C 33 -3.878 -1.355 14.246 1.00 0.00 H new ATOM 0 HB3 ARG C 33 -2.555 -2.383 14.761 1.00 0.00 H new ATOM 0 HG2 ARG C 33 -1.763 -0.773 16.360 1.00 0.00 H new ATOM 0 HG3 ARG C 33 -2.656 0.539 15.616 1.00 0.00 H new ATOM 0 HD2 ARG C 33 -4.822 -0.823 16.222 1.00 0.00 H new ATOM 0 HD3 ARG C 33 -3.786 -1.783 17.259 1.00 0.00 H new ATOM 0 HE ARG C 33 -3.341 1.145 17.590 1.00 0.00 H new ATOM 0 HH11 ARG C 33 -5.210 -1.680 18.460 1.00 0.00 H new ATOM 0 HH12 ARG C 33 -5.710 -1.023 20.021 1.00 0.00 H new ATOM 0 HH21 ARG C 33 -3.981 1.985 19.587 1.00 0.00 H new ATOM 0 HH22 ARG C 33 -5.020 1.034 20.654 1.00 0.00 H new ATOM 2359 N GLU C 34 0.062 -1.420 14.660 1.00 0.00 N ATOM 2360 CA GLU C 34 1.430 -1.196 15.206 1.00 0.00 C ATOM 2361 C GLU C 34 2.322 -0.603 14.117 1.00 0.00 C ATOM 2362 O GLU C 34 2.996 0.387 14.324 1.00 0.00 O ATOM 2363 CB GLU C 34 1.927 -2.582 15.620 1.00 0.00 C ATOM 2364 CG GLU C 34 2.696 -2.475 16.938 1.00 0.00 C ATOM 2365 CD GLU C 34 2.278 -3.614 17.869 1.00 0.00 C ATOM 2366 OE1 GLU C 34 1.708 -4.575 17.378 1.00 0.00 O ATOM 2367 OE2 GLU C 34 2.533 -3.507 19.057 1.00 0.00 O ATOM 0 H GLU C 34 -0.323 -2.352 14.817 1.00 0.00 H new ATOM 0 HA GLU C 34 1.440 -0.502 16.046 1.00 0.00 H new ATOM 0 HB2 GLU C 34 1.084 -3.264 15.733 1.00 0.00 H new ATOM 0 HB3 GLU C 34 2.570 -2.996 14.844 1.00 0.00 H new ATOM 0 HG2 GLU C 34 3.769 -2.521 16.750 1.00 0.00 H new ATOM 0 HG3 GLU C 34 2.496 -1.513 17.411 1.00 0.00 H new ATOM 2374 N HIS C 35 2.321 -1.191 12.950 1.00 0.00 N ATOM 2375 CA HIS C 35 3.158 -0.643 11.849 1.00 0.00 C ATOM 2376 C HIS C 35 2.800 0.826 11.631 1.00 0.00 C ATOM 2377 O HIS C 35 3.656 1.661 11.421 1.00 0.00 O ATOM 2378 CB HIS C 35 2.796 -1.477 10.620 1.00 0.00 C ATOM 2379 CG HIS C 35 3.955 -2.364 10.256 1.00 0.00 C ATOM 2380 ND1 HIS C 35 3.978 -3.110 9.087 1.00 0.00 N ATOM 2381 CD2 HIS C 35 5.140 -2.635 10.897 1.00 0.00 C ATOM 2382 CE1 HIS C 35 5.141 -3.787 9.062 1.00 0.00 C ATOM 2383 NE2 HIS C 35 5.886 -3.534 10.141 1.00 0.00 N ATOM 0 H HIS C 35 1.779 -2.022 12.715 1.00 0.00 H new ATOM 0 HA HIS C 35 4.226 -0.692 12.062 1.00 0.00 H new ATOM 0 HB2 HIS C 35 1.912 -2.081 10.825 1.00 0.00 H new ATOM 0 HB3 HIS C 35 2.548 -0.823 9.784 1.00 0.00 H new ATOM 0 HD1 HIS C 35 3.247 -3.140 8.376 1.00 0.00 H new ATOM 0 HD2 HIS C 35 5.446 -2.214 11.844 1.00 0.00 H new ATOM 0 HE1 HIS C 35 5.436 -4.454 8.266 1.00 0.00 H new ATOM 2391 N ALA C 36 1.538 1.148 11.693 1.00 0.00 N ATOM 2392 CA ALA C 36 1.118 2.566 11.505 1.00 0.00 C ATOM 2393 C ALA C 36 1.285 3.332 12.818 1.00 0.00 C ATOM 2394 O ALA C 36 1.379 4.544 12.833 1.00 0.00 O ATOM 2395 CB ALA C 36 -0.356 2.495 11.105 1.00 0.00 C ATOM 0 H ALA C 36 0.778 0.490 11.866 1.00 0.00 H new ATOM 0 HA ALA C 36 1.714 3.083 10.753 1.00 0.00 H new ATOM 0 HB1 ALA C 36 -0.739 3.503 10.948 1.00 0.00 H new ATOM 0 HB2 ALA C 36 -0.456 1.921 10.184 1.00 0.00 H new ATOM 0 HB3 ALA C 36 -0.925 2.010 11.898 1.00 0.00 H new ATOM 2401 N LEU C 37 1.329 2.635 13.921 1.00 0.00 N ATOM 2402 CA LEU C 37 1.498 3.327 15.229 1.00 0.00 C ATOM 2403 C LEU C 37 2.817 4.104 15.237 1.00 0.00 C ATOM 2404 O LEU C 37 3.065 4.919 16.104 1.00 0.00 O ATOM 2405 CB LEU C 37 1.526 2.207 16.270 1.00 0.00 C ATOM 2406 CG LEU C 37 1.796 2.801 17.654 1.00 0.00 C ATOM 2407 CD1 LEU C 37 0.528 3.482 18.174 1.00 0.00 C ATOM 2408 CD2 LEU C 37 2.204 1.684 18.617 1.00 0.00 C ATOM 0 H LEU C 37 1.255 1.619 13.972 1.00 0.00 H new ATOM 0 HA LEU C 37 0.701 4.044 15.429 1.00 0.00 H new ATOM 0 HB2 LEU C 37 0.575 1.674 16.271 1.00 0.00 H new ATOM 0 HB3 LEU C 37 2.299 1.481 16.017 1.00 0.00 H new ATOM 0 HG LEU C 37 2.600 3.534 17.584 1.00 0.00 H new ATOM 0 HD11 LEU C 37 0.720 3.905 19.160 1.00 0.00 H new ATOM 0 HD12 LEU C 37 0.235 4.277 17.489 1.00 0.00 H new ATOM 0 HD13 LEU C 37 -0.276 2.749 18.244 1.00 0.00 H new ATOM 0 HD21 LEU C 37 2.397 2.106 19.603 1.00 0.00 H new ATOM 0 HD22 LEU C 37 1.400 0.952 18.687 1.00 0.00 H new ATOM 0 HD23 LEU C 37 3.107 1.197 18.248 1.00 0.00 H new ATOM 2420 N THR C 38 3.667 3.858 14.275 1.00 0.00 N ATOM 2421 CA THR C 38 4.968 4.580 14.225 1.00 0.00 C ATOM 2422 C THR C 38 4.772 5.996 13.690 1.00 0.00 C ATOM 2423 O THR C 38 5.718 6.732 13.492 1.00 0.00 O ATOM 2424 CB THR C 38 5.849 3.756 13.287 1.00 0.00 C ATOM 2425 OG1 THR C 38 5.074 3.307 12.186 1.00 0.00 O ATOM 2426 CG2 THR C 38 6.414 2.551 14.041 1.00 0.00 C ATOM 0 H THR C 38 3.514 3.187 13.522 1.00 0.00 H new ATOM 0 HA THR C 38 5.419 4.682 15.212 1.00 0.00 H new ATOM 0 HB THR C 38 6.672 4.373 12.925 1.00 0.00 H new ATOM 0 HG1 THR C 38 4.834 4.071 11.622 1.00 0.00 H new ATOM 0 HG21 THR C 38 7.042 1.964 13.371 1.00 0.00 H new ATOM 0 HG22 THR C 38 7.009 2.897 14.886 1.00 0.00 H new ATOM 0 HG23 THR C 38 5.594 1.932 14.404 1.00 0.00 H new ATOM 2434 N SER C 39 3.552 6.385 13.467 1.00 0.00 N ATOM 2435 CA SER C 39 3.288 7.757 12.954 1.00 0.00 C ATOM 2436 C SER C 39 2.998 8.706 14.115 1.00 0.00 C ATOM 2437 O SER C 39 3.321 9.875 14.072 1.00 0.00 O ATOM 2438 CB SER C 39 2.051 7.617 12.072 1.00 0.00 C ATOM 2439 OG SER C 39 1.963 8.740 11.206 1.00 0.00 O ATOM 0 H SER C 39 2.722 5.811 13.618 1.00 0.00 H new ATOM 0 HA SER C 39 4.140 8.163 12.409 1.00 0.00 H new ATOM 0 HB2 SER C 39 2.108 6.697 11.489 1.00 0.00 H new ATOM 0 HB3 SER C 39 1.156 7.548 12.690 1.00 0.00 H new ATOM 0 HG SER C 39 1.349 9.401 11.589 1.00 0.00 H new ATOM 2445 N GLY C 40 2.376 8.215 15.150 1.00 0.00 N ATOM 2446 CA GLY C 40 2.048 9.092 16.308 1.00 0.00 C ATOM 2447 C GLY C 40 0.711 9.783 16.042 1.00 0.00 C ATOM 2448 O GLY C 40 0.001 10.162 16.953 1.00 0.00 O ATOM 0 H GLY C 40 2.080 7.243 15.244 1.00 0.00 H new ATOM 0 HA2 GLY C 40 1.992 8.503 17.223 1.00 0.00 H new ATOM 0 HA3 GLY C 40 2.833 9.834 16.454 1.00 0.00 H new ATOM 2452 N THR C 41 0.359 9.939 14.794 1.00 0.00 N ATOM 2453 CA THR C 41 -0.935 10.594 14.455 1.00 0.00 C ATOM 2454 C THR C 41 -1.890 9.561 13.853 1.00 0.00 C ATOM 2455 O THR C 41 -3.087 9.611 14.059 1.00 0.00 O ATOM 2456 CB THR C 41 -0.582 11.667 13.424 1.00 0.00 C ATOM 2457 OG1 THR C 41 0.107 12.730 14.067 1.00 0.00 O ATOM 2458 CG2 THR C 41 -1.863 12.202 12.781 1.00 0.00 C ATOM 0 H THR C 41 0.915 9.640 13.993 1.00 0.00 H new ATOM 0 HA THR C 41 -1.429 11.023 15.327 1.00 0.00 H new ATOM 0 HB THR C 41 0.055 11.234 12.652 1.00 0.00 H new ATOM 0 HG1 THR C 41 0.336 13.418 13.408 1.00 0.00 H new ATOM 0 HG21 THR C 41 -1.610 12.967 12.047 1.00 0.00 H new ATOM 0 HG22 THR C 41 -2.391 11.386 12.288 1.00 0.00 H new ATOM 0 HG23 THR C 41 -2.503 12.635 13.550 1.00 0.00 H new ATOM 2466 N ILE C 42 -1.367 8.618 13.114 1.00 0.00 N ATOM 2467 CA ILE C 42 -2.242 7.576 12.506 1.00 0.00 C ATOM 2468 C ILE C 42 -2.892 6.741 13.614 1.00 0.00 C ATOM 2469 O ILE C 42 -4.055 6.398 13.546 1.00 0.00 O ATOM 2470 CB ILE C 42 -1.302 6.714 11.654 1.00 0.00 C ATOM 2471 CG1 ILE C 42 -1.313 7.227 10.211 1.00 0.00 C ATOM 2472 CG2 ILE C 42 -1.770 5.258 11.674 1.00 0.00 C ATOM 2473 CD1 ILE C 42 0.122 7.461 9.734 1.00 0.00 C ATOM 0 H ILE C 42 -0.373 8.525 12.906 1.00 0.00 H new ATOM 0 HA ILE C 42 -3.048 8.000 11.908 1.00 0.00 H new ATOM 0 HB ILE C 42 -0.293 6.774 12.061 1.00 0.00 H new ATOM 0 HG12 ILE C 42 -1.809 6.505 9.562 1.00 0.00 H new ATOM 0 HG13 ILE C 42 -1.882 8.154 10.149 1.00 0.00 H new ATOM 0 HG21 ILE C 42 -1.098 4.651 11.067 1.00 0.00 H new ATOM 0 HG22 ILE C 42 -1.766 4.889 12.699 1.00 0.00 H new ATOM 0 HG23 ILE C 42 -2.780 5.195 11.270 1.00 0.00 H new ATOM 0 HD11 ILE C 42 0.109 7.826 8.707 1.00 0.00 H new ATOM 0 HD12 ILE C 42 0.603 8.200 10.375 1.00 0.00 H new ATOM 0 HD13 ILE C 42 0.678 6.524 9.779 1.00 0.00 H new ATOM 2485 N LYS C 43 -2.147 6.419 14.635 1.00 0.00 N ATOM 2486 CA LYS C 43 -2.717 5.611 15.751 1.00 0.00 C ATOM 2487 C LYS C 43 -3.916 6.337 16.365 1.00 0.00 C ATOM 2488 O LYS C 43 -4.891 5.725 16.756 1.00 0.00 O ATOM 2489 CB LYS C 43 -1.582 5.491 16.769 1.00 0.00 C ATOM 2490 CG LYS C 43 -1.418 6.819 17.511 1.00 0.00 C ATOM 2491 CD LYS C 43 -0.218 6.730 18.456 1.00 0.00 C ATOM 2492 CE LYS C 43 0.045 8.104 19.078 1.00 0.00 C ATOM 2493 NZ LYS C 43 -0.102 7.895 20.545 1.00 0.00 N ATOM 0 H LYS C 43 -1.167 6.680 14.745 1.00 0.00 H new ATOM 0 HA LYS C 43 -3.072 4.635 15.420 1.00 0.00 H new ATOM 0 HB2 LYS C 43 -1.798 4.691 17.477 1.00 0.00 H new ATOM 0 HB3 LYS C 43 -0.653 5.228 16.264 1.00 0.00 H new ATOM 0 HG2 LYS C 43 -1.274 7.631 16.798 1.00 0.00 H new ATOM 0 HG3 LYS C 43 -2.323 7.047 18.075 1.00 0.00 H new ATOM 0 HD2 LYS C 43 -0.411 5.996 19.238 1.00 0.00 H new ATOM 0 HD3 LYS C 43 0.663 6.391 17.911 1.00 0.00 H new ATOM 0 HE2 LYS C 43 1.042 8.466 18.829 1.00 0.00 H new ATOM 0 HE3 LYS C 43 -0.665 8.846 18.712 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 0.064 8.793 21.042 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 -1.063 7.557 20.753 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 0.591 7.189 20.866 1.00 0.00 H new ATOM 2507 N ALA C 44 -3.850 7.636 16.454 1.00 0.00 N ATOM 2508 CA ALA C 44 -4.984 8.403 17.043 1.00 0.00 C ATOM 2509 C ALA C 44 -6.216 8.307 16.138 1.00 0.00 C ATOM 2510 O ALA C 44 -7.322 8.108 16.600 1.00 0.00 O ATOM 2511 CB ALA C 44 -4.487 9.845 17.123 1.00 0.00 C ATOM 0 H ALA C 44 -3.059 8.201 16.144 1.00 0.00 H new ATOM 0 HA ALA C 44 -5.279 8.019 18.020 1.00 0.00 H new ATOM 0 HB1 ALA C 44 -5.268 10.476 17.548 1.00 0.00 H new ATOM 0 HB2 ALA C 44 -3.600 9.890 17.755 1.00 0.00 H new ATOM 0 HB3 ALA C 44 -4.238 10.200 16.123 1.00 0.00 H new ATOM 2517 N MET C 45 -6.034 8.448 14.854 1.00 0.00 N ATOM 2518 CA MET C 45 -7.198 8.365 13.925 1.00 0.00 C ATOM 2519 C MET C 45 -7.681 6.918 13.806 1.00 0.00 C ATOM 2520 O MET C 45 -8.848 6.658 13.590 1.00 0.00 O ATOM 2521 CB MET C 45 -6.672 8.866 12.579 1.00 0.00 C ATOM 2522 CG MET C 45 -5.483 8.008 12.144 1.00 0.00 C ATOM 2523 SD MET C 45 -5.108 8.336 10.404 1.00 0.00 S ATOM 2524 CE MET C 45 -4.089 9.809 10.667 1.00 0.00 C ATOM 0 H MET C 45 -5.132 8.617 14.408 1.00 0.00 H new ATOM 0 HA MET C 45 -8.045 8.954 14.276 1.00 0.00 H new ATOM 0 HB2 MET C 45 -7.461 8.820 11.828 1.00 0.00 H new ATOM 0 HB3 MET C 45 -6.370 9.910 12.660 1.00 0.00 H new ATOM 0 HG2 MET C 45 -4.614 8.231 12.763 1.00 0.00 H new ATOM 0 HG3 MET C 45 -5.712 6.952 12.285 1.00 0.00 H new ATOM 0 HE1 MET C 45 -4.575 10.673 10.213 1.00 0.00 H new ATOM 0 HE2 MET C 45 -3.967 9.981 11.736 1.00 0.00 H new ATOM 0 HE3 MET C 45 -3.111 9.661 10.210 1.00 0.00 H new ATOM 2534 N LEU C 46 -6.793 5.970 13.945 1.00 0.00 N ATOM 2535 CA LEU C 46 -7.209 4.542 13.838 1.00 0.00 C ATOM 2536 C LEU C 46 -7.492 3.966 15.229 1.00 0.00 C ATOM 2537 O LEU C 46 -7.850 2.814 15.372 1.00 0.00 O ATOM 2538 CB LEU C 46 -6.020 3.828 13.192 1.00 0.00 C ATOM 2539 CG LEU C 46 -4.830 3.833 14.152 1.00 0.00 C ATOM 2540 CD1 LEU C 46 -4.992 2.706 15.174 1.00 0.00 C ATOM 2541 CD2 LEU C 46 -3.538 3.619 13.359 1.00 0.00 C ATOM 0 H LEU C 46 -5.801 6.122 14.127 1.00 0.00 H new ATOM 0 HA LEU C 46 -8.122 4.422 13.254 1.00 0.00 H new ATOM 0 HB2 LEU C 46 -6.292 2.803 12.941 1.00 0.00 H new ATOM 0 HB3 LEU C 46 -5.749 4.323 12.260 1.00 0.00 H new ATOM 0 HG LEU C 46 -4.786 4.790 14.672 1.00 0.00 H new ATOM 0 HD11 LEU C 46 -4.143 2.710 15.858 1.00 0.00 H new ATOM 0 HD12 LEU C 46 -5.913 2.856 15.738 1.00 0.00 H new ATOM 0 HD13 LEU C 46 -5.035 1.748 14.656 1.00 0.00 H new ATOM 0 HD21 LEU C 46 -2.688 3.622 14.041 1.00 0.00 H new ATOM 0 HD22 LEU C 46 -3.584 2.661 12.840 1.00 0.00 H new ATOM 0 HD23 LEU C 46 -3.421 4.421 12.630 1.00 0.00 H new ATOM 2697 N ASN C 58 -10.191 2.316 10.285 1.00 0.00 N ATOM 2698 CA ASN C 58 -8.719 2.516 10.427 1.00 0.00 C ATOM 2699 C ASN C 58 -8.102 2.870 9.072 1.00 0.00 C ATOM 2700 O ASN C 58 -7.622 2.014 8.354 1.00 0.00 O ATOM 2701 CB ASN C 58 -8.183 1.173 10.926 1.00 0.00 C ATOM 2702 CG ASN C 58 -8.816 0.839 12.278 1.00 0.00 C ATOM 2703 OD1 ASN C 58 -8.663 1.665 13.278 1.00 0.00 O flip ATOM 2704 ND2 ASN C 58 -9.456 -0.182 12.426 1.00 0.00 N flip ATOM 0 HA ASN C 58 -8.476 3.330 11.110 1.00 0.00 H new ATOM 0 HB2 ASN C 58 -8.409 0.389 10.204 1.00 0.00 H new ATOM 0 HB3 ASN C 58 -7.098 1.216 11.022 1.00 0.00 H new ATOM 0 HD21 ASN C 58 -9.575 -0.827 11.645 1.00 0.00 H new ATOM 0 HD22 ASN C 58 -9.874 -0.395 13.332 1.00 0.00 H new ATOM 2711 N GLU C 59 -8.110 4.124 8.714 1.00 0.00 N ATOM 2712 CA GLU C 59 -7.524 4.525 7.403 1.00 0.00 C ATOM 2713 C GLU C 59 -6.787 5.858 7.531 1.00 0.00 C ATOM 2714 O GLU C 59 -7.002 6.615 8.458 1.00 0.00 O ATOM 2715 CB GLU C 59 -8.720 4.662 6.460 1.00 0.00 C ATOM 2716 CG GLU C 59 -9.708 5.678 7.035 1.00 0.00 C ATOM 2717 CD GLU C 59 -11.138 5.230 6.726 1.00 0.00 C ATOM 2718 OE1 GLU C 59 -11.491 4.129 7.117 1.00 0.00 O ATOM 2719 OE2 GLU C 59 -11.856 5.997 6.105 1.00 0.00 O ATOM 0 H GLU C 59 -8.496 4.887 9.270 1.00 0.00 H new ATOM 0 HA GLU C 59 -6.797 3.798 7.040 1.00 0.00 H new ATOM 0 HB2 GLU C 59 -8.384 4.983 5.474 1.00 0.00 H new ATOM 0 HB3 GLU C 59 -9.208 3.696 6.332 1.00 0.00 H new ATOM 0 HG2 GLU C 59 -9.568 5.768 8.112 1.00 0.00 H new ATOM 0 HG3 GLU C 59 -9.524 6.663 6.607 1.00 0.00 H new ATOM 2726 N VAL C 60 -5.914 6.150 6.606 1.00 0.00 N ATOM 2727 CA VAL C 60 -5.158 7.433 6.668 1.00 0.00 C ATOM 2728 C VAL C 60 -5.323 8.203 5.355 1.00 0.00 C ATOM 2729 O VAL C 60 -5.562 7.629 4.311 1.00 0.00 O ATOM 2730 CB VAL C 60 -3.697 7.028 6.868 1.00 0.00 C ATOM 2731 CG1 VAL C 60 -2.927 8.179 7.514 1.00 0.00 C ATOM 2732 CG2 VAL C 60 -3.625 5.800 7.780 1.00 0.00 C ATOM 0 H VAL C 60 -5.691 5.554 5.809 1.00 0.00 H new ATOM 0 HA VAL C 60 -5.513 8.082 7.469 1.00 0.00 H new ATOM 0 HB VAL C 60 -3.256 6.792 5.900 1.00 0.00 H new ATOM 0 HG11 VAL C 60 -1.886 7.887 7.655 1.00 0.00 H new ATOM 0 HG12 VAL C 60 -2.973 9.056 6.868 1.00 0.00 H new ATOM 0 HG13 VAL C 60 -3.371 8.417 8.481 1.00 0.00 H new ATOM 0 HG21 VAL C 60 -2.583 5.513 7.922 1.00 0.00 H new ATOM 0 HG22 VAL C 60 -4.070 6.038 8.746 1.00 0.00 H new ATOM 0 HG23 VAL C 60 -4.170 4.974 7.322 1.00 0.00 H new ATOM 2742 N ASN C 61 -5.192 9.498 5.402 1.00 0.00 N ATOM 2743 CA ASN C 61 -5.336 10.309 4.164 1.00 0.00 C ATOM 2744 C ASN C 61 -4.233 11.365 4.104 1.00 0.00 C ATOM 2745 O ASN C 61 -4.173 12.264 4.920 1.00 0.00 O ATOM 2746 CB ASN C 61 -6.710 10.971 4.280 1.00 0.00 C ATOM 2747 CG ASN C 61 -6.887 11.540 5.689 1.00 0.00 C ATOM 2748 OD1 ASN C 61 -7.413 10.879 6.562 1.00 0.00 O ATOM 2749 ND2 ASN C 61 -6.465 12.746 5.949 1.00 0.00 N ATOM 0 H ASN C 61 -4.991 10.031 6.248 1.00 0.00 H new ATOM 0 HA ASN C 61 -5.253 9.707 3.259 1.00 0.00 H new ATOM 0 HB2 ASN C 61 -6.805 11.766 3.541 1.00 0.00 H new ATOM 0 HB3 ASN C 61 -7.494 10.244 4.069 1.00 0.00 H new ATOM 0 HD21 ASN C 61 -6.577 13.135 6.886 1.00 0.00 H new ATOM 0 HD22 ASN C 61 -6.023 13.301 5.216 1.00 0.00 H new ATOM 2756 N PHE C 62 -3.361 11.259 3.147 1.00 0.00 N ATOM 2757 CA PHE C 62 -2.254 12.251 3.028 1.00 0.00 C ATOM 2758 C PHE C 62 -2.459 13.131 1.793 1.00 0.00 C ATOM 2759 O PHE C 62 -2.234 12.712 0.676 1.00 0.00 O ATOM 2760 CB PHE C 62 -0.987 11.410 2.883 1.00 0.00 C ATOM 2761 CG PHE C 62 -0.687 10.721 4.194 1.00 0.00 C ATOM 2762 CD1 PHE C 62 -0.031 11.417 5.215 1.00 0.00 C ATOM 2763 CD2 PHE C 62 -1.066 9.387 4.386 1.00 0.00 C ATOM 2764 CE1 PHE C 62 0.246 10.779 6.430 1.00 0.00 C ATOM 2765 CE2 PHE C 62 -0.789 8.749 5.601 1.00 0.00 C ATOM 2766 CZ PHE C 62 -0.134 9.445 6.623 1.00 0.00 C ATOM 0 H PHE C 62 -3.364 10.526 2.437 1.00 0.00 H new ATOM 0 HA PHE C 62 -2.205 12.920 3.887 1.00 0.00 H new ATOM 0 HB2 PHE C 62 -1.117 10.671 2.093 1.00 0.00 H new ATOM 0 HB3 PHE C 62 -0.149 12.043 2.592 1.00 0.00 H new ATOM 0 HD1 PHE C 62 0.262 12.446 5.066 1.00 0.00 H new ATOM 0 HD2 PHE C 62 -1.572 8.850 3.597 1.00 0.00 H new ATOM 0 HE1 PHE C 62 0.753 11.316 7.218 1.00 0.00 H new ATOM 0 HE2 PHE C 62 -1.081 7.720 5.749 1.00 0.00 H new ATOM 0 HZ PHE C 62 0.079 8.953 7.561 1.00 0.00 H new ATOM 2776 N ARG C 63 -2.886 14.349 1.987 1.00 0.00 N ATOM 2777 CA ARG C 63 -3.106 15.256 0.825 1.00 0.00 C ATOM 2778 C ARG C 63 -1.866 16.125 0.588 1.00 0.00 C ATOM 2779 O ARG C 63 -1.835 16.947 -0.307 1.00 0.00 O ATOM 2780 CB ARG C 63 -4.301 16.125 1.222 1.00 0.00 C ATOM 2781 CG ARG C 63 -4.986 16.661 -0.037 1.00 0.00 C ATOM 2782 CD ARG C 63 -6.166 15.757 -0.401 1.00 0.00 C ATOM 2783 NE ARG C 63 -7.180 16.671 -0.995 1.00 0.00 N ATOM 2784 CZ ARG C 63 -8.330 16.199 -1.396 1.00 0.00 C ATOM 2785 NH1 ARG C 63 -8.594 14.927 -1.274 1.00 0.00 N ATOM 2786 NH2 ARG C 63 -9.217 17.001 -1.918 1.00 0.00 N ATOM 0 H ARG C 63 -3.092 14.755 2.900 1.00 0.00 H new ATOM 0 HA ARG C 63 -3.289 14.706 -0.098 1.00 0.00 H new ATOM 0 HB2 ARG C 63 -5.008 15.542 1.812 1.00 0.00 H new ATOM 0 HB3 ARG C 63 -3.969 16.953 1.848 1.00 0.00 H new ATOM 0 HG2 ARG C 63 -5.334 17.680 0.131 1.00 0.00 H new ATOM 0 HG3 ARG C 63 -4.275 16.699 -0.862 1.00 0.00 H new ATOM 0 HD2 ARG C 63 -5.868 14.984 -1.109 1.00 0.00 H new ATOM 0 HD3 ARG C 63 -6.560 15.248 0.479 1.00 0.00 H new ATOM 0 HE ARG C 63 -6.977 17.666 -1.089 1.00 0.00 H new ATOM 0 HH11 ARG C 63 -7.902 14.299 -0.865 1.00 0.00 H new ATOM 0 HH12 ARG C 63 -9.493 14.560 -1.588 1.00 0.00 H new ATOM 0 HH21 ARG C 63 -9.012 17.996 -2.013 1.00 0.00 H new ATOM 0 HH22 ARG C 63 -10.115 16.633 -2.231 1.00 0.00 H new ATOM 2800 N GLU C 64 -0.845 15.950 1.382 1.00 0.00 N ATOM 2801 CA GLU C 64 0.389 16.767 1.201 1.00 0.00 C ATOM 2802 C GLU C 64 1.622 15.861 1.124 1.00 0.00 C ATOM 2803 O GLU C 64 2.733 16.287 1.365 1.00 0.00 O ATOM 2804 CB GLU C 64 0.459 17.661 2.439 1.00 0.00 C ATOM 2805 CG GLU C 64 1.345 18.872 2.146 1.00 0.00 C ATOM 2806 CD GLU C 64 0.494 19.996 1.552 1.00 0.00 C ATOM 2807 OE1 GLU C 64 -0.701 20.001 1.799 1.00 0.00 O ATOM 2808 OE2 GLU C 64 1.051 20.833 0.861 1.00 0.00 O ATOM 0 H GLU C 64 -0.812 15.277 2.148 1.00 0.00 H new ATOM 0 HA GLU C 64 0.365 17.347 0.279 1.00 0.00 H new ATOM 0 HB2 GLU C 64 -0.542 17.989 2.720 1.00 0.00 H new ATOM 0 HB3 GLU C 64 0.860 17.100 3.283 1.00 0.00 H new ATOM 0 HG2 GLU C 64 1.828 19.213 3.062 1.00 0.00 H new ATOM 0 HG3 GLU C 64 2.138 18.596 1.451 1.00 0.00 H new ATOM 2815 N ILE C 65 1.433 14.614 0.788 1.00 0.00 N ATOM 2816 CA ILE C 65 2.594 13.682 0.695 1.00 0.00 C ATOM 2817 C ILE C 65 2.511 12.871 -0.603 1.00 0.00 C ATOM 2818 O ILE C 65 1.545 12.171 -0.836 1.00 0.00 O ATOM 2819 CB ILE C 65 2.464 12.773 1.922 1.00 0.00 C ATOM 2820 CG1 ILE C 65 3.338 13.320 3.055 1.00 0.00 C ATOM 2821 CG2 ILE C 65 2.919 11.354 1.571 1.00 0.00 C ATOM 2822 CD1 ILE C 65 2.647 13.076 4.399 1.00 0.00 C ATOM 0 H ILE C 65 0.526 14.200 0.574 1.00 0.00 H new ATOM 0 HA ILE C 65 3.552 14.202 0.678 1.00 0.00 H new ATOM 0 HB ILE C 65 1.422 12.747 2.240 1.00 0.00 H new ATOM 0 HG12 ILE C 65 4.314 12.834 3.043 1.00 0.00 H new ATOM 0 HG13 ILE C 65 3.511 14.387 2.912 1.00 0.00 H new ATOM 0 HG21 ILE C 65 2.824 10.714 2.448 1.00 0.00 H new ATOM 0 HG22 ILE C 65 2.298 10.961 0.766 1.00 0.00 H new ATOM 0 HG23 ILE C 65 3.960 11.375 1.249 1.00 0.00 H new ATOM 0 HD11 ILE C 65 3.270 13.466 5.204 1.00 0.00 H new ATOM 0 HD12 ILE C 65 1.682 13.582 4.409 1.00 0.00 H new ATOM 0 HD13 ILE C 65 2.497 12.006 4.542 1.00 0.00 H new ATOM 2834 N PRO C 66 3.531 12.997 -1.409 1.00 0.00 N ATOM 2835 CA PRO C 66 3.576 12.268 -2.702 1.00 0.00 C ATOM 2836 C PRO C 66 3.836 10.777 -2.471 1.00 0.00 C ATOM 2837 O PRO C 66 4.116 10.348 -1.369 1.00 0.00 O ATOM 2838 CB PRO C 66 4.745 12.918 -3.437 1.00 0.00 C ATOM 2839 CG PRO C 66 5.620 13.474 -2.360 1.00 0.00 C ATOM 2840 CD PRO C 66 4.727 13.819 -1.196 1.00 0.00 C ATOM 0 HA PRO C 66 2.641 12.327 -3.259 1.00 0.00 H new ATOM 0 HB2 PRO C 66 5.282 12.190 -4.045 1.00 0.00 H new ATOM 0 HB3 PRO C 66 4.400 13.703 -4.110 1.00 0.00 H new ATOM 0 HG2 PRO C 66 6.375 12.746 -2.063 1.00 0.00 H new ATOM 0 HG3 PRO C 66 6.151 14.358 -2.713 1.00 0.00 H new ATOM 0 HD2 PRO C 66 5.205 13.588 -0.244 1.00 0.00 H new ATOM 0 HD3 PRO C 66 4.483 14.881 -1.181 1.00 0.00 H new ATOM 2848 N SER C 67 3.746 9.985 -3.505 1.00 0.00 N ATOM 2849 CA SER C 67 3.983 8.521 -3.347 1.00 0.00 C ATOM 2850 C SER C 67 5.387 8.267 -2.793 1.00 0.00 C ATOM 2851 O SER C 67 5.566 7.525 -1.848 1.00 0.00 O ATOM 2852 CB SER C 67 3.852 7.946 -4.756 1.00 0.00 C ATOM 2853 OG SER C 67 4.502 8.810 -5.678 1.00 0.00 O ATOM 0 H SER C 67 3.519 10.288 -4.452 1.00 0.00 H new ATOM 0 HA SER C 67 3.281 8.062 -2.651 1.00 0.00 H new ATOM 0 HB2 SER C 67 4.295 6.951 -4.798 1.00 0.00 H new ATOM 0 HB3 SER C 67 2.800 7.838 -5.021 1.00 0.00 H new ATOM 0 HG SER C 67 4.421 8.443 -6.583 1.00 0.00 H new ATOM 2859 N HIS C 68 6.383 8.877 -3.373 1.00 0.00 N ATOM 2860 CA HIS C 68 7.774 8.671 -2.876 1.00 0.00 C ATOM 2861 C HIS C 68 7.792 8.680 -1.344 1.00 0.00 C ATOM 2862 O HIS C 68 8.455 7.877 -0.715 1.00 0.00 O ATOM 2863 CB HIS C 68 8.576 9.853 -3.424 1.00 0.00 C ATOM 2864 CG HIS C 68 8.314 10.001 -4.898 1.00 0.00 C ATOM 2865 ND1 HIS C 68 8.143 11.239 -5.497 1.00 0.00 N ATOM 2866 CD2 HIS C 68 8.192 9.077 -5.905 1.00 0.00 C ATOM 2867 CE1 HIS C 68 7.929 11.029 -6.808 1.00 0.00 C ATOM 2868 NE2 HIS C 68 7.948 9.729 -7.111 1.00 0.00 N ATOM 0 H HIS C 68 6.295 9.509 -4.169 1.00 0.00 H new ATOM 0 HA HIS C 68 8.188 7.715 -3.198 1.00 0.00 H new ATOM 0 HB2 HIS C 68 8.297 10.768 -2.901 1.00 0.00 H new ATOM 0 HB3 HIS C 68 9.640 9.696 -3.247 1.00 0.00 H new ATOM 0 HD2 HIS C 68 8.273 8.007 -5.781 1.00 0.00 H new ATOM 0 HE1 HIS C 68 7.762 11.816 -7.528 1.00 0.00 H new ATOM 0 HE2 HIS C 68 7.813 9.305 -8.029 1.00 0.00 H new ATOM 2876 N VAL C 69 7.068 9.581 -0.739 1.00 0.00 N ATOM 2877 CA VAL C 69 7.041 9.643 0.747 1.00 0.00 C ATOM 2878 C VAL C 69 6.029 8.632 1.292 1.00 0.00 C ATOM 2879 O VAL C 69 6.250 8.001 2.307 1.00 0.00 O ATOM 2880 CB VAL C 69 6.608 11.073 1.062 1.00 0.00 C ATOM 2881 CG1 VAL C 69 5.987 11.124 2.455 1.00 0.00 C ATOM 2882 CG2 VAL C 69 7.826 11.996 1.011 1.00 0.00 C ATOM 0 H VAL C 69 6.493 10.278 -1.212 1.00 0.00 H new ATOM 0 HA VAL C 69 8.002 9.400 1.200 1.00 0.00 H new ATOM 0 HB VAL C 69 5.873 11.400 0.327 1.00 0.00 H new ATOM 0 HG11 VAL C 69 5.678 12.145 2.679 1.00 0.00 H new ATOM 0 HG12 VAL C 69 5.118 10.466 2.490 1.00 0.00 H new ATOM 0 HG13 VAL C 69 6.720 10.797 3.192 1.00 0.00 H new ATOM 0 HG21 VAL C 69 7.518 13.017 1.236 1.00 0.00 H new ATOM 0 HG22 VAL C 69 8.562 11.669 1.746 1.00 0.00 H new ATOM 0 HG23 VAL C 69 8.268 11.961 0.015 1.00 0.00 H new ATOM 2892 N LEU C 70 4.921 8.476 0.619 1.00 0.00 N ATOM 2893 CA LEU C 70 3.888 7.507 1.082 1.00 0.00 C ATOM 2894 C LEU C 70 4.562 6.236 1.606 1.00 0.00 C ATOM 2895 O LEU C 70 4.137 5.652 2.583 1.00 0.00 O ATOM 2896 CB LEU C 70 3.043 7.228 -0.172 1.00 0.00 C ATOM 2897 CG LEU C 70 2.647 5.748 -0.256 1.00 0.00 C ATOM 2898 CD1 LEU C 70 3.869 4.908 -0.641 1.00 0.00 C ATOM 2899 CD2 LEU C 70 2.103 5.281 1.096 1.00 0.00 C ATOM 0 H LEU C 70 4.686 8.981 -0.236 1.00 0.00 H new ATOM 0 HA LEU C 70 3.277 7.885 1.902 1.00 0.00 H new ATOM 0 HB2 LEU C 70 2.146 7.847 -0.154 1.00 0.00 H new ATOM 0 HB3 LEU C 70 3.606 7.508 -1.063 1.00 0.00 H new ATOM 0 HG LEU C 70 1.874 5.625 -1.014 1.00 0.00 H new ATOM 0 HD11 LEU C 70 3.584 3.857 -0.700 1.00 0.00 H new ATOM 0 HD12 LEU C 70 4.246 5.237 -1.610 1.00 0.00 H new ATOM 0 HD13 LEU C 70 4.647 5.031 0.112 1.00 0.00 H new ATOM 0 HD21 LEU C 70 1.823 4.230 1.032 1.00 0.00 H new ATOM 0 HD22 LEU C 70 2.870 5.406 1.860 1.00 0.00 H new ATOM 0 HD23 LEU C 70 1.228 5.874 1.360 1.00 0.00 H new ATOM 2911 N SER C 71 5.611 5.804 0.964 1.00 0.00 N ATOM 2912 CA SER C 71 6.310 4.573 1.424 1.00 0.00 C ATOM 2913 C SER C 71 7.564 4.957 2.203 1.00 0.00 C ATOM 2914 O SER C 71 8.035 4.223 3.049 1.00 0.00 O ATOM 2915 CB SER C 71 6.679 3.824 0.144 1.00 0.00 C ATOM 2916 OG SER C 71 7.507 2.715 0.471 1.00 0.00 O ATOM 0 H SER C 71 6.014 6.251 0.140 1.00 0.00 H new ATOM 0 HA SER C 71 5.694 3.962 2.084 1.00 0.00 H new ATOM 0 HB2 SER C 71 5.777 3.482 -0.364 1.00 0.00 H new ATOM 0 HB3 SER C 71 7.199 4.491 -0.544 1.00 0.00 H new ATOM 0 HG SER C 71 7.744 2.231 -0.348 1.00 0.00 H new ATOM 2922 N LYS C 72 8.103 6.109 1.925 1.00 0.00 N ATOM 2923 CA LYS C 72 9.328 6.551 2.653 1.00 0.00 C ATOM 2924 C LYS C 72 9.099 6.466 4.162 1.00 0.00 C ATOM 2925 O LYS C 72 9.665 5.632 4.841 1.00 0.00 O ATOM 2926 CB LYS C 72 9.554 7.999 2.218 1.00 0.00 C ATOM 2927 CG LYS C 72 10.979 8.427 2.580 1.00 0.00 C ATOM 2928 CD LYS C 72 11.972 7.358 2.116 1.00 0.00 C ATOM 2929 CE LYS C 72 13.395 7.920 2.185 1.00 0.00 C ATOM 2930 NZ LYS C 72 14.159 7.161 1.158 1.00 0.00 N ATOM 0 H LYS C 72 7.751 6.764 1.227 1.00 0.00 H new ATOM 0 HA LYS C 72 10.192 5.926 2.428 1.00 0.00 H new ATOM 0 HB2 LYS C 72 9.396 8.096 1.144 1.00 0.00 H new ATOM 0 HB3 LYS C 72 8.832 8.653 2.706 1.00 0.00 H new ATOM 0 HG2 LYS C 72 11.213 9.382 2.110 1.00 0.00 H new ATOM 0 HG3 LYS C 72 11.063 8.572 3.657 1.00 0.00 H new ATOM 0 HD2 LYS C 72 11.889 6.471 2.745 1.00 0.00 H new ATOM 0 HD3 LYS C 72 11.740 7.049 1.097 1.00 0.00 H new ATOM 0 HE2 LYS C 72 13.407 8.990 1.976 1.00 0.00 H new ATOM 0 HE3 LYS C 72 13.825 7.784 3.177 1.00 0.00 H new ATOM 0 HZ1 LYS C 72 15.093 7.600 1.025 1.00 0.00 H new ATOM 0 HZ2 LYS C 72 14.280 6.177 1.472 1.00 0.00 H new ATOM 0 HZ3 LYS C 72 13.639 7.175 0.258 1.00 0.00 H new ATOM 2944 N VAL C 73 8.269 7.319 4.692 1.00 0.00 N ATOM 2945 CA VAL C 73 8.003 7.278 6.162 1.00 0.00 C ATOM 2946 C VAL C 73 7.386 5.929 6.535 1.00 0.00 C ATOM 2947 O VAL C 73 7.646 5.387 7.591 1.00 0.00 O ATOM 2948 CB VAL C 73 7.020 8.426 6.478 1.00 0.00 C ATOM 2949 CG1 VAL C 73 6.234 8.848 5.234 1.00 0.00 C ATOM 2950 CG2 VAL C 73 6.030 7.964 7.549 1.00 0.00 C ATOM 0 H VAL C 73 7.764 8.040 4.177 1.00 0.00 H new ATOM 0 HA VAL C 73 8.924 7.397 6.733 1.00 0.00 H new ATOM 0 HB VAL C 73 7.600 9.279 6.830 1.00 0.00 H new ATOM 0 HG11 VAL C 73 5.552 9.658 5.492 1.00 0.00 H new ATOM 0 HG12 VAL C 73 6.927 9.189 4.464 1.00 0.00 H new ATOM 0 HG13 VAL C 73 5.663 7.999 4.859 1.00 0.00 H new ATOM 0 HG21 VAL C 73 5.334 8.772 7.774 1.00 0.00 H new ATOM 0 HG22 VAL C 73 5.476 7.100 7.183 1.00 0.00 H new ATOM 0 HG23 VAL C 73 6.574 7.690 8.453 1.00 0.00 H new ATOM 2960 N CYS C 74 6.568 5.383 5.680 1.00 0.00 N ATOM 2961 CA CYS C 74 5.935 4.073 5.994 1.00 0.00 C ATOM 2962 C CYS C 74 7.017 3.018 6.236 1.00 0.00 C ATOM 2963 O CYS C 74 6.919 2.202 7.132 1.00 0.00 O ATOM 2964 CB CYS C 74 5.107 3.724 4.758 1.00 0.00 C ATOM 2965 SG CYS C 74 3.449 4.429 4.926 1.00 0.00 S ATOM 0 H CYS C 74 6.311 5.786 4.779 1.00 0.00 H new ATOM 0 HA CYS C 74 5.319 4.112 6.893 1.00 0.00 H new ATOM 0 HB2 CYS C 74 5.590 4.113 3.862 1.00 0.00 H new ATOM 0 HB3 CYS C 74 5.044 2.642 4.643 1.00 0.00 H new ATOM 0 HG CYS C 74 3.152 5.100 3.853 1.00 0.00 H new ATOM 2971 N MET C 75 8.058 3.031 5.452 1.00 0.00 N ATOM 2972 CA MET C 75 9.141 2.033 5.660 1.00 0.00 C ATOM 2973 C MET C 75 9.721 2.210 7.059 1.00 0.00 C ATOM 2974 O MET C 75 10.033 1.252 7.737 1.00 0.00 O ATOM 2975 CB MET C 75 10.187 2.341 4.588 1.00 0.00 C ATOM 2976 CG MET C 75 10.358 1.124 3.678 1.00 0.00 C ATOM 2977 SD MET C 75 11.150 -0.215 4.603 1.00 0.00 S ATOM 2978 CE MET C 75 12.761 0.580 4.820 1.00 0.00 C ATOM 0 H MET C 75 8.205 3.684 4.682 1.00 0.00 H new ATOM 0 HA MET C 75 8.791 1.004 5.580 1.00 0.00 H new ATOM 0 HB2 MET C 75 9.878 3.206 4.002 1.00 0.00 H new ATOM 0 HB3 MET C 75 11.138 2.596 5.055 1.00 0.00 H new ATOM 0 HG2 MET C 75 9.388 0.797 3.304 1.00 0.00 H new ATOM 0 HG3 MET C 75 10.962 1.388 2.810 1.00 0.00 H new ATOM 0 HE1 MET C 75 13.553 -0.151 4.656 1.00 0.00 H new ATOM 0 HE2 MET C 75 12.864 1.394 4.103 1.00 0.00 H new ATOM 0 HE3 MET C 75 12.838 0.976 5.832 1.00 0.00 H new ATOM 2988 N TYR C 76 9.850 3.429 7.508 1.00 0.00 N ATOM 2989 CA TYR C 76 10.388 3.647 8.875 1.00 0.00 C ATOM 2990 C TYR C 76 9.318 3.266 9.895 1.00 0.00 C ATOM 2991 O TYR C 76 9.613 2.972 11.037 1.00 0.00 O ATOM 2992 CB TYR C 76 10.731 5.136 8.957 1.00 0.00 C ATOM 2993 CG TYR C 76 12.101 5.298 9.578 1.00 0.00 C ATOM 2994 CD1 TYR C 76 13.090 4.330 9.356 1.00 0.00 C ATOM 2995 CD2 TYR C 76 12.385 6.413 10.378 1.00 0.00 C ATOM 2996 CE1 TYR C 76 14.356 4.475 9.932 1.00 0.00 C ATOM 2997 CE2 TYR C 76 13.653 6.556 10.953 1.00 0.00 C ATOM 2998 CZ TYR C 76 14.638 5.587 10.732 1.00 0.00 C ATOM 2999 OH TYR C 76 15.887 5.729 11.300 1.00 0.00 O ATOM 0 H TYR C 76 9.608 4.274 6.991 1.00 0.00 H new ATOM 0 HA TYR C 76 11.270 3.041 9.084 1.00 0.00 H new ATOM 0 HB2 TYR C 76 10.715 5.580 7.962 1.00 0.00 H new ATOM 0 HB3 TYR C 76 9.984 5.661 9.553 1.00 0.00 H new ATOM 0 HD1 TYR C 76 12.874 3.470 8.739 1.00 0.00 H new ATOM 0 HD2 TYR C 76 11.626 7.162 10.551 1.00 0.00 H new ATOM 0 HE1 TYR C 76 15.116 3.728 9.759 1.00 0.00 H new ATOM 0 HE2 TYR C 76 13.872 7.416 11.569 1.00 0.00 H new ATOM 0 HH TYR C 76 15.916 6.556 11.824 1.00 0.00 H new ATOM 3009 N PHE C 77 8.077 3.237 9.486 1.00 0.00 N ATOM 3010 CA PHE C 77 7.003 2.837 10.433 1.00 0.00 C ATOM 3011 C PHE C 77 7.227 1.378 10.812 1.00 0.00 C ATOM 3012 O PHE C 77 6.994 0.966 11.931 1.00 0.00 O ATOM 3013 CB PHE C 77 5.695 2.979 9.654 1.00 0.00 C ATOM 3014 CG PHE C 77 5.094 4.356 9.844 1.00 0.00 C ATOM 3015 CD1 PHE C 77 5.679 5.286 10.716 1.00 0.00 C ATOM 3016 CD2 PHE C 77 3.943 4.703 9.123 1.00 0.00 C ATOM 3017 CE1 PHE C 77 5.112 6.557 10.863 1.00 0.00 C ATOM 3018 CE2 PHE C 77 3.376 5.972 9.275 1.00 0.00 C ATOM 3019 CZ PHE C 77 3.962 6.900 10.142 1.00 0.00 C ATOM 0 H PHE C 77 7.765 3.472 8.544 1.00 0.00 H new ATOM 0 HA PHE C 77 6.989 3.439 11.341 1.00 0.00 H new ATOM 0 HB2 PHE C 77 5.878 2.802 8.594 1.00 0.00 H new ATOM 0 HB3 PHE C 77 4.986 2.220 9.986 1.00 0.00 H new ATOM 0 HD1 PHE C 77 6.566 5.022 11.273 1.00 0.00 H new ATOM 0 HD2 PHE C 77 3.493 3.989 8.449 1.00 0.00 H new ATOM 0 HE1 PHE C 77 5.562 7.274 11.533 1.00 0.00 H new ATOM 0 HE2 PHE C 77 2.486 6.236 8.723 1.00 0.00 H new ATOM 0 HZ PHE C 77 3.527 7.882 10.255 1.00 0.00 H new ATOM 3029 N THR C 78 7.704 0.597 9.879 1.00 0.00 N ATOM 3030 CA THR C 78 7.976 -0.836 10.176 1.00 0.00 C ATOM 3031 C THR C 78 9.418 -0.974 10.666 1.00 0.00 C ATOM 3032 O THR C 78 9.711 -1.738 11.564 1.00 0.00 O ATOM 3033 CB THR C 78 7.779 -1.566 8.848 1.00 0.00 C ATOM 3034 OG1 THR C 78 8.881 -1.297 7.992 1.00 0.00 O ATOM 3035 CG2 THR C 78 6.488 -1.084 8.186 1.00 0.00 C ATOM 0 H THR C 78 7.916 0.891 8.926 1.00 0.00 H new ATOM 0 HA THR C 78 7.324 -1.244 10.949 1.00 0.00 H new ATOM 0 HB THR C 78 7.714 -2.639 9.030 1.00 0.00 H new ATOM 0 HG1 THR C 78 9.029 -0.329 7.944 1.00 0.00 H new ATOM 0 HG21 THR C 78 6.348 -1.605 7.239 1.00 0.00 H new ATOM 0 HG22 THR C 78 5.643 -1.292 8.843 1.00 0.00 H new ATOM 0 HG23 THR C 78 6.551 -0.011 8.004 1.00 0.00 H new ATOM 3043 N TYR C 79 10.316 -0.219 10.093 1.00 0.00 N ATOM 3044 CA TYR C 79 11.737 -0.281 10.535 1.00 0.00 C ATOM 3045 C TYR C 79 11.824 0.138 12.002 1.00 0.00 C ATOM 3046 O TYR C 79 12.463 -0.508 12.809 1.00 0.00 O ATOM 3047 CB TYR C 79 12.469 0.726 9.646 1.00 0.00 C ATOM 3048 CG TYR C 79 13.958 0.602 9.859 1.00 0.00 C ATOM 3049 CD1 TYR C 79 14.672 -0.418 9.217 1.00 0.00 C ATOM 3050 CD2 TYR C 79 14.627 1.508 10.692 1.00 0.00 C ATOM 3051 CE1 TYR C 79 16.053 -0.533 9.409 1.00 0.00 C ATOM 3052 CE2 TYR C 79 16.009 1.392 10.884 1.00 0.00 C ATOM 3053 CZ TYR C 79 16.721 0.371 10.243 1.00 0.00 C ATOM 3054 OH TYR C 79 18.083 0.259 10.430 1.00 0.00 O ATOM 0 H TYR C 79 10.126 0.439 9.337 1.00 0.00 H new ATOM 0 HA TYR C 79 12.166 -1.279 10.451 1.00 0.00 H new ATOM 0 HB2 TYR C 79 12.225 0.546 8.599 1.00 0.00 H new ATOM 0 HB3 TYR C 79 12.141 1.739 9.880 1.00 0.00 H new ATOM 0 HD1 TYR C 79 14.156 -1.116 8.574 1.00 0.00 H new ATOM 0 HD2 TYR C 79 14.077 2.295 11.186 1.00 0.00 H new ATOM 0 HE1 TYR C 79 16.604 -1.319 8.914 1.00 0.00 H new ATOM 0 HE2 TYR C 79 16.526 2.090 11.526 1.00 0.00 H new ATOM 0 HH TYR C 79 18.291 -0.625 10.799 1.00 0.00 H new ATOM 3064 N LYS C 80 11.178 1.217 12.351 1.00 0.00 N ATOM 3065 CA LYS C 80 11.209 1.686 13.765 1.00 0.00 C ATOM 3066 C LYS C 80 10.562 0.644 14.683 1.00 0.00 C ATOM 3067 O LYS C 80 10.960 0.473 15.818 1.00 0.00 O ATOM 3068 CB LYS C 80 10.393 2.980 13.765 1.00 0.00 C ATOM 3069 CG LYS C 80 10.050 3.368 15.205 1.00 0.00 C ATOM 3070 CD LYS C 80 10.261 4.872 15.391 1.00 0.00 C ATOM 3071 CE LYS C 80 9.577 5.329 16.681 1.00 0.00 C ATOM 3072 NZ LYS C 80 9.057 6.691 16.379 1.00 0.00 N ATOM 0 H LYS C 80 10.628 1.795 11.716 1.00 0.00 H new ATOM 0 HA LYS C 80 12.225 1.841 14.129 1.00 0.00 H new ATOM 0 HB2 LYS C 80 10.959 3.779 13.287 1.00 0.00 H new ATOM 0 HB3 LYS C 80 9.479 2.846 13.186 1.00 0.00 H new ATOM 0 HG2 LYS C 80 9.016 3.105 15.428 1.00 0.00 H new ATOM 0 HG3 LYS C 80 10.678 2.813 15.902 1.00 0.00 H new ATOM 0 HD2 LYS C 80 11.327 5.098 15.432 1.00 0.00 H new ATOM 0 HD3 LYS C 80 9.853 5.415 14.539 1.00 0.00 H new ATOM 0 HE2 LYS C 80 8.770 4.652 16.961 1.00 0.00 H new ATOM 0 HE3 LYS C 80 10.279 5.350 17.514 1.00 0.00 H new ATOM 0 HZ1 LYS C 80 8.836 7.183 17.268 1.00 0.00 H new ATOM 0 HZ2 LYS C 80 9.776 7.229 15.855 1.00 0.00 H new ATOM 0 HZ3 LYS C 80 8.195 6.613 15.803 1.00 0.00 H new ATOM 3086 N VAL C 81 9.565 -0.050 14.202 1.00 0.00 N ATOM 3087 CA VAL C 81 8.892 -1.075 15.053 1.00 0.00 C ATOM 3088 C VAL C 81 9.897 -2.136 15.510 1.00 0.00 C ATOM 3089 O VAL C 81 9.939 -2.506 16.666 1.00 0.00 O ATOM 3090 CB VAL C 81 7.828 -1.699 14.151 1.00 0.00 C ATOM 3091 CG1 VAL C 81 7.233 -2.929 14.838 1.00 0.00 C ATOM 3092 CG2 VAL C 81 6.720 -0.677 13.889 1.00 0.00 C ATOM 0 H VAL C 81 9.188 0.048 13.259 1.00 0.00 H new ATOM 0 HA VAL C 81 8.462 -0.641 15.956 1.00 0.00 H new ATOM 0 HB VAL C 81 8.282 -1.995 13.205 1.00 0.00 H new ATOM 0 HG11 VAL C 81 6.474 -3.374 14.194 1.00 0.00 H new ATOM 0 HG12 VAL C 81 8.022 -3.658 15.026 1.00 0.00 H new ATOM 0 HG13 VAL C 81 6.779 -2.633 15.784 1.00 0.00 H new ATOM 0 HG21 VAL C 81 5.960 -1.121 13.246 1.00 0.00 H new ATOM 0 HG22 VAL C 81 6.267 -0.381 14.835 1.00 0.00 H new ATOM 0 HG23 VAL C 81 7.143 0.200 13.399 1.00 0.00 H new ATOM 3102 N ARG C 82 10.702 -2.633 14.612 1.00 0.00 N ATOM 3103 CA ARG C 82 11.697 -3.673 14.998 1.00 0.00 C ATOM 3104 C ARG C 82 12.968 -3.018 15.545 1.00 0.00 C ATOM 3105 O ARG C 82 13.784 -3.658 16.179 1.00 0.00 O ATOM 3106 CB ARG C 82 11.999 -4.430 13.705 1.00 0.00 C ATOM 3107 CG ARG C 82 12.316 -5.891 14.030 1.00 0.00 C ATOM 3108 CD ARG C 82 13.658 -6.273 13.401 1.00 0.00 C ATOM 3109 NE ARG C 82 14.660 -6.073 14.484 1.00 0.00 N ATOM 3110 CZ ARG C 82 15.860 -6.572 14.364 1.00 0.00 C ATOM 3111 NH1 ARG C 82 16.184 -7.248 13.296 1.00 0.00 N ATOM 3112 NH2 ARG C 82 16.737 -6.395 15.315 1.00 0.00 N ATOM 0 H ARG C 82 10.714 -2.364 13.628 1.00 0.00 H new ATOM 0 HA ARG C 82 11.320 -4.332 15.780 1.00 0.00 H new ATOM 0 HB2 ARG C 82 11.145 -4.374 13.030 1.00 0.00 H new ATOM 0 HB3 ARG C 82 12.842 -3.970 13.190 1.00 0.00 H new ATOM 0 HG2 ARG C 82 12.354 -6.035 15.110 1.00 0.00 H new ATOM 0 HG3 ARG C 82 11.526 -6.539 13.650 1.00 0.00 H new ATOM 0 HD2 ARG C 82 13.652 -7.306 13.054 1.00 0.00 H new ATOM 0 HD3 ARG C 82 13.881 -5.648 12.536 1.00 0.00 H new ATOM 0 HE ARG C 82 14.408 -5.546 15.320 1.00 0.00 H new ATOM 0 HH11 ARG C 82 15.499 -7.387 12.553 1.00 0.00 H new ATOM 0 HH12 ARG C 82 17.122 -7.637 13.204 1.00 0.00 H new ATOM 0 HH21 ARG C 82 16.484 -5.867 16.150 1.00 0.00 H new ATOM 0 HH22 ARG C 82 17.675 -6.784 15.223 1.00 0.00 H new ATOM 3126 N TYR C 83 13.144 -1.747 15.306 1.00 0.00 N ATOM 3127 CA TYR C 83 14.364 -1.059 15.816 1.00 0.00 C ATOM 3128 C TYR C 83 14.045 -0.305 17.110 1.00 0.00 C ATOM 3129 O TYR C 83 14.929 0.051 17.865 1.00 0.00 O ATOM 3130 CB TYR C 83 14.762 -0.085 14.707 1.00 0.00 C ATOM 3131 CG TYR C 83 15.561 -0.821 13.658 1.00 0.00 C ATOM 3132 CD1 TYR C 83 14.946 -1.805 12.873 1.00 0.00 C ATOM 3133 CD2 TYR C 83 16.915 -0.522 13.470 1.00 0.00 C ATOM 3134 CE1 TYR C 83 15.687 -2.490 11.903 1.00 0.00 C ATOM 3135 CE2 TYR C 83 17.656 -1.207 12.499 1.00 0.00 C ATOM 3136 CZ TYR C 83 17.041 -2.191 11.715 1.00 0.00 C ATOM 3137 OH TYR C 83 17.771 -2.866 10.758 1.00 0.00 O ATOM 0 H TYR C 83 12.498 -1.157 14.781 1.00 0.00 H new ATOM 0 HA TYR C 83 15.167 -1.759 16.049 1.00 0.00 H new ATOM 0 HB2 TYR C 83 13.872 0.357 14.259 1.00 0.00 H new ATOM 0 HB3 TYR C 83 15.351 0.734 15.121 1.00 0.00 H new ATOM 0 HD1 TYR C 83 13.901 -2.035 13.016 1.00 0.00 H new ATOM 0 HD2 TYR C 83 17.389 0.238 14.074 1.00 0.00 H new ATOM 0 HE1 TYR C 83 15.213 -3.250 11.299 1.00 0.00 H new ATOM 0 HE2 TYR C 83 18.701 -0.977 12.355 1.00 0.00 H new ATOM 0 HH TYR C 83 17.180 -3.131 10.022 1.00 0.00 H new ATOM 3274 N PHE C 93 18.662 6.247 8.183 1.00 0.00 N ATOM 3275 CA PHE C 93 17.995 6.240 6.849 1.00 0.00 C ATOM 3276 C PHE C 93 18.753 7.150 5.877 1.00 0.00 C ATOM 3277 O PHE C 93 19.108 8.262 6.216 1.00 0.00 O ATOM 3278 CB PHE C 93 16.590 6.782 7.108 1.00 0.00 C ATOM 3279 CG PHE C 93 15.569 5.833 6.528 1.00 0.00 C ATOM 3280 CD1 PHE C 93 15.673 4.458 6.769 1.00 0.00 C ATOM 3281 CD2 PHE C 93 14.516 6.328 5.748 1.00 0.00 C ATOM 3282 CE1 PHE C 93 14.727 3.579 6.232 1.00 0.00 C ATOM 3283 CE2 PHE C 93 13.570 5.449 5.210 1.00 0.00 C ATOM 3284 CZ PHE C 93 13.674 4.074 5.452 1.00 0.00 C ATOM 0 HA PHE C 93 17.972 5.246 6.401 1.00 0.00 H new ATOM 0 HB2 PHE C 93 16.426 6.899 8.179 1.00 0.00 H new ATOM 0 HB3 PHE C 93 16.481 7.769 6.659 1.00 0.00 H new ATOM 0 HD1 PHE C 93 16.485 4.076 7.370 1.00 0.00 H new ATOM 0 HD2 PHE C 93 14.434 7.389 5.562 1.00 0.00 H new ATOM 0 HE1 PHE C 93 14.808 2.518 6.419 1.00 0.00 H new ATOM 0 HE2 PHE C 93 12.759 5.831 4.608 1.00 0.00 H new ATOM 0 HZ PHE C 93 12.943 3.396 5.038 1.00 0.00 H new ATOM 3294 N PRO C 94 18.978 6.640 4.698 1.00 0.00 N ATOM 3295 CA PRO C 94 19.706 7.409 3.660 1.00 0.00 C ATOM 3296 C PRO C 94 18.821 8.519 3.085 1.00 0.00 C ATOM 3297 O PRO C 94 17.654 8.316 2.809 1.00 0.00 O ATOM 3298 CB PRO C 94 20.019 6.363 2.595 1.00 0.00 C ATOM 3299 CG PRO C 94 18.977 5.305 2.771 1.00 0.00 C ATOM 3300 CD PRO C 94 18.579 5.310 4.224 1.00 0.00 C ATOM 0 HA PRO C 94 20.597 7.904 4.046 1.00 0.00 H new ATOM 0 HB2 PRO C 94 19.978 6.794 1.595 1.00 0.00 H new ATOM 0 HB3 PRO C 94 21.021 5.955 2.726 1.00 0.00 H new ATOM 0 HG2 PRO C 94 18.115 5.505 2.135 1.00 0.00 H new ATOM 0 HG3 PRO C 94 19.367 4.329 2.482 1.00 0.00 H new ATOM 0 HD2 PRO C 94 17.508 5.148 4.345 1.00 0.00 H new ATOM 0 HD3 PRO C 94 19.085 4.520 4.779 1.00 0.00 H new ATOM 3308 N ILE C 95 19.369 9.688 2.894 1.00 0.00 N ATOM 3309 CA ILE C 95 18.565 10.809 2.328 1.00 0.00 C ATOM 3310 C ILE C 95 19.232 11.329 1.051 1.00 0.00 C ATOM 3311 O ILE C 95 20.434 11.492 0.991 1.00 0.00 O ATOM 3312 CB ILE C 95 18.562 11.890 3.409 1.00 0.00 C ATOM 3313 CG1 ILE C 95 18.240 11.256 4.766 1.00 0.00 C ATOM 3314 CG2 ILE C 95 17.505 12.942 3.075 1.00 0.00 C ATOM 3315 CD1 ILE C 95 16.766 10.853 4.811 1.00 0.00 C ATOM 0 H ILE C 95 20.340 9.916 3.106 1.00 0.00 H new ATOM 0 HA ILE C 95 17.553 10.502 2.065 1.00 0.00 H new ATOM 0 HB ILE C 95 19.544 12.362 3.453 1.00 0.00 H new ATOM 0 HG12 ILE C 95 18.871 10.382 4.929 1.00 0.00 H new ATOM 0 HG13 ILE C 95 18.459 11.961 5.568 1.00 0.00 H new ATOM 0 HG21 ILE C 95 17.503 13.713 3.846 1.00 0.00 H new ATOM 0 HG22 ILE C 95 17.734 13.394 2.110 1.00 0.00 H new ATOM 0 HG23 ILE C 95 16.523 12.470 3.031 1.00 0.00 H new ATOM 0 HD11 ILE C 95 16.541 10.403 5.778 1.00 0.00 H new ATOM 0 HD12 ILE C 95 16.143 11.736 4.668 1.00 0.00 H new ATOM 0 HD13 ILE C 95 16.561 10.133 4.019 1.00 0.00 H new ATOM 3327 N ALA C 96 18.466 11.582 0.025 1.00 0.00 N ATOM 3328 CA ALA C 96 19.069 12.081 -1.245 1.00 0.00 C ATOM 3329 C ALA C 96 18.102 13.024 -1.966 1.00 0.00 C ATOM 3330 O ALA C 96 16.971 13.190 -1.554 1.00 0.00 O ATOM 3331 CB ALA C 96 19.308 10.827 -2.082 1.00 0.00 C ATOM 0 H ALA C 96 17.453 11.466 0.010 1.00 0.00 H new ATOM 0 HA ALA C 96 19.986 12.644 -1.070 1.00 0.00 H new ATOM 0 HB1 ALA C 96 19.752 11.106 -3.037 1.00 0.00 H new ATOM 0 HB2 ALA C 96 19.984 10.158 -1.550 1.00 0.00 H new ATOM 0 HB3 ALA C 96 18.359 10.320 -2.257 1.00 0.00 H new ATOM 3337 N PRO C 97 18.585 13.606 -3.031 1.00 0.00 N ATOM 3338 CA PRO C 97 17.755 14.537 -3.834 1.00 0.00 C ATOM 3339 C PRO C 97 16.701 13.751 -4.615 1.00 0.00 C ATOM 3340 O PRO C 97 16.827 13.528 -5.803 1.00 0.00 O ATOM 3341 CB PRO C 97 18.761 15.191 -4.777 1.00 0.00 C ATOM 3342 CG PRO C 97 19.885 14.211 -4.885 1.00 0.00 C ATOM 3343 CD PRO C 97 19.935 13.452 -3.583 1.00 0.00 C ATOM 0 HA PRO C 97 17.213 15.267 -3.233 1.00 0.00 H new ATOM 0 HB2 PRO C 97 18.316 15.390 -5.752 1.00 0.00 H new ATOM 0 HB3 PRO C 97 19.107 16.147 -4.383 1.00 0.00 H new ATOM 0 HG2 PRO C 97 19.725 13.531 -5.722 1.00 0.00 H new ATOM 0 HG3 PRO C 97 20.829 14.725 -5.068 1.00 0.00 H new ATOM 0 HD2 PRO C 97 20.184 12.403 -3.742 1.00 0.00 H new ATOM 0 HD3 PRO C 97 20.690 13.861 -2.911 1.00 0.00 H new ATOM 3351 N GLU C 98 15.663 13.324 -3.952 1.00 0.00 N ATOM 3352 CA GLU C 98 14.596 12.546 -4.634 1.00 0.00 C ATOM 3353 C GLU C 98 13.584 12.145 -3.577 1.00 0.00 C ATOM 3354 O GLU C 98 12.389 12.131 -3.800 1.00 0.00 O ATOM 3355 CB GLU C 98 15.297 11.317 -5.216 1.00 0.00 C ATOM 3356 CG GLU C 98 15.047 11.255 -6.725 1.00 0.00 C ATOM 3357 CD GLU C 98 16.175 10.469 -7.397 1.00 0.00 C ATOM 3358 OE1 GLU C 98 16.086 9.253 -7.429 1.00 0.00 O ATOM 3359 OE2 GLU C 98 17.110 11.096 -7.868 1.00 0.00 O ATOM 0 H GLU C 98 15.508 13.483 -2.956 1.00 0.00 H new ATOM 0 HA GLU C 98 14.080 13.098 -5.420 1.00 0.00 H new ATOM 0 HB2 GLU C 98 16.367 11.366 -5.015 1.00 0.00 H new ATOM 0 HB3 GLU C 98 14.924 10.411 -4.737 1.00 0.00 H new ATOM 0 HG2 GLU C 98 14.087 10.779 -6.926 1.00 0.00 H new ATOM 0 HG3 GLU C 98 14.995 12.263 -7.138 1.00 0.00 H new ATOM 3366 N ILE C 99 14.072 11.860 -2.405 1.00 0.00 N ATOM 3367 CA ILE C 99 13.173 11.503 -1.288 1.00 0.00 C ATOM 3368 C ILE C 99 13.716 12.136 -0.008 1.00 0.00 C ATOM 3369 O ILE C 99 14.905 12.140 0.232 1.00 0.00 O ATOM 3370 CB ILE C 99 13.221 9.978 -1.203 1.00 0.00 C ATOM 3371 CG1 ILE C 99 12.174 9.491 -0.200 1.00 0.00 C ATOM 3372 CG2 ILE C 99 14.610 9.534 -0.744 1.00 0.00 C ATOM 3373 CD1 ILE C 99 10.775 9.857 -0.701 1.00 0.00 C ATOM 0 H ILE C 99 15.066 11.860 -2.176 1.00 0.00 H new ATOM 0 HA ILE C 99 12.151 11.854 -1.429 1.00 0.00 H new ATOM 0 HB ILE C 99 13.011 9.554 -2.185 1.00 0.00 H new ATOM 0 HG12 ILE C 99 12.254 8.412 -0.070 1.00 0.00 H new ATOM 0 HG13 ILE C 99 12.352 9.943 0.776 1.00 0.00 H new ATOM 0 HG21 ILE C 99 14.643 8.446 -0.684 1.00 0.00 H new ATOM 0 HG22 ILE C 99 15.357 9.881 -1.458 1.00 0.00 H new ATOM 0 HG23 ILE C 99 14.822 9.958 0.237 1.00 0.00 H new ATOM 0 HD11 ILE C 99 10.030 9.509 0.015 1.00 0.00 H new ATOM 0 HD12 ILE C 99 10.698 10.939 -0.808 1.00 0.00 H new ATOM 0 HD13 ILE C 99 10.599 9.384 -1.667 1.00 0.00 H new ATOM 3385 N ALA C 100 12.838 12.672 0.791 1.00 0.00 N ATOM 3386 CA ALA C 100 13.227 13.340 2.081 1.00 0.00 C ATOM 3387 C ALA C 100 12.732 14.787 2.068 1.00 0.00 C ATOM 3388 O ALA C 100 12.344 15.331 3.083 1.00 0.00 O ATOM 3389 CB ALA C 100 14.756 13.310 2.165 1.00 0.00 C ATOM 0 H ALA C 100 11.835 12.679 0.605 1.00 0.00 H new ATOM 0 HA ALA C 100 12.787 12.830 2.938 1.00 0.00 H new ATOM 0 HB1 ALA C 100 15.079 13.787 3.090 1.00 0.00 H new ATOM 0 HB2 ALA C 100 15.101 12.276 2.150 1.00 0.00 H new ATOM 0 HB3 ALA C 100 15.178 13.845 1.314 1.00 0.00 H new ATOM 3395 N LEU C 101 12.740 15.411 0.922 1.00 0.00 N ATOM 3396 CA LEU C 101 12.267 16.823 0.838 1.00 0.00 C ATOM 3397 C LEU C 101 10.798 16.910 1.261 1.00 0.00 C ATOM 3398 O LEU C 101 10.412 17.767 2.031 1.00 0.00 O ATOM 3399 CB LEU C 101 12.426 17.210 -0.633 1.00 0.00 C ATOM 3400 CG LEU C 101 11.645 18.496 -0.909 1.00 0.00 C ATOM 3401 CD1 LEU C 101 12.403 19.344 -1.934 1.00 0.00 C ATOM 3402 CD2 LEU C 101 10.263 18.142 -1.465 1.00 0.00 C ATOM 0 H LEU C 101 13.053 15.005 0.040 1.00 0.00 H new ATOM 0 HA LEU C 101 12.829 17.487 1.495 1.00 0.00 H new ATOM 0 HB2 LEU C 101 13.480 17.354 -0.870 1.00 0.00 H new ATOM 0 HB3 LEU C 101 12.062 16.406 -1.273 1.00 0.00 H new ATOM 0 HG LEU C 101 11.533 19.059 0.017 1.00 0.00 H new ATOM 0 HD11 LEU C 101 11.847 20.260 -2.131 1.00 0.00 H new ATOM 0 HD12 LEU C 101 13.388 19.595 -1.541 1.00 0.00 H new ATOM 0 HD13 LEU C 101 12.514 18.781 -2.861 1.00 0.00 H new ATOM 0 HD21 LEU C 101 9.705 19.057 -1.662 1.00 0.00 H new ATOM 0 HD22 LEU C 101 10.377 17.579 -2.392 1.00 0.00 H new ATOM 0 HD23 LEU C 101 9.722 17.537 -0.737 1.00 0.00 H new ATOM 3414 N GLU C 102 9.975 16.025 0.765 1.00 0.00 N ATOM 3415 CA GLU C 102 8.534 16.056 1.140 1.00 0.00 C ATOM 3416 C GLU C 102 8.374 15.742 2.631 1.00 0.00 C ATOM 3417 O GLU C 102 7.514 16.279 3.300 1.00 0.00 O ATOM 3418 CB GLU C 102 7.878 14.972 0.286 1.00 0.00 C ATOM 3419 CG GLU C 102 7.607 15.522 -1.115 1.00 0.00 C ATOM 3420 CD GLU C 102 8.359 14.684 -2.148 1.00 0.00 C ATOM 3421 OE1 GLU C 102 8.759 13.581 -1.810 1.00 0.00 O ATOM 3422 OE2 GLU C 102 8.522 15.156 -3.261 1.00 0.00 O ATOM 0 H GLU C 102 10.239 15.283 0.117 1.00 0.00 H new ATOM 0 HA GLU C 102 8.081 17.033 0.970 1.00 0.00 H new ATOM 0 HB2 GLU C 102 8.527 14.098 0.226 1.00 0.00 H new ATOM 0 HB3 GLU C 102 6.946 14.645 0.747 1.00 0.00 H new ATOM 0 HG2 GLU C 102 6.537 15.502 -1.324 1.00 0.00 H new ATOM 0 HG3 GLU C 102 7.924 16.563 -1.176 1.00 0.00 H new ATOM 3429 N LEU C 103 9.199 14.878 3.154 1.00 0.00 N ATOM 3430 CA LEU C 103 9.099 14.527 4.598 1.00 0.00 C ATOM 3431 C LEU C 103 9.310 15.771 5.463 1.00 0.00 C ATOM 3432 O LEU C 103 8.856 15.834 6.588 1.00 0.00 O ATOM 3433 CB LEU C 103 10.228 13.521 4.834 1.00 0.00 C ATOM 3434 CG LEU C 103 9.798 12.109 4.413 1.00 0.00 C ATOM 3435 CD1 LEU C 103 8.379 12.122 3.839 1.00 0.00 C ATOM 3436 CD2 LEU C 103 10.765 11.585 3.349 1.00 0.00 C ATOM 0 H LEU C 103 9.940 14.399 2.642 1.00 0.00 H new ATOM 0 HA LEU C 103 8.121 14.121 4.857 1.00 0.00 H new ATOM 0 HB2 LEU C 103 11.111 13.820 4.270 1.00 0.00 H new ATOM 0 HB3 LEU C 103 10.507 13.522 5.888 1.00 0.00 H new ATOM 0 HG LEU C 103 9.814 11.463 5.291 1.00 0.00 H new ATOM 0 HD11 LEU C 103 8.095 11.111 3.547 1.00 0.00 H new ATOM 0 HD12 LEU C 103 7.684 12.490 4.594 1.00 0.00 H new ATOM 0 HD13 LEU C 103 8.345 12.774 2.966 1.00 0.00 H new ATOM 0 HD21 LEU C 103 10.464 10.582 3.046 1.00 0.00 H new ATOM 0 HD22 LEU C 103 10.746 12.246 2.483 1.00 0.00 H new ATOM 0 HD23 LEU C 103 11.774 11.553 3.759 1.00 0.00 H new ATOM 3448 N LEU C 104 9.989 16.762 4.953 1.00 0.00 N ATOM 3449 CA LEU C 104 10.214 17.995 5.760 1.00 0.00 C ATOM 3450 C LEU C 104 8.945 18.336 6.547 1.00 0.00 C ATOM 3451 O LEU C 104 8.888 18.179 7.750 1.00 0.00 O ATOM 3452 CB LEU C 104 10.530 19.089 4.739 1.00 0.00 C ATOM 3453 CG LEU C 104 11.531 20.076 5.340 1.00 0.00 C ATOM 3454 CD1 LEU C 104 10.916 20.741 6.572 1.00 0.00 C ATOM 3455 CD2 LEU C 104 12.802 19.328 5.747 1.00 0.00 C ATOM 0 H LEU C 104 10.396 16.772 4.018 1.00 0.00 H new ATOM 0 HA LEU C 104 11.020 17.879 6.485 1.00 0.00 H new ATOM 0 HB2 LEU C 104 10.940 18.646 3.831 1.00 0.00 H new ATOM 0 HB3 LEU C 104 9.616 19.610 4.454 1.00 0.00 H new ATOM 0 HG LEU C 104 11.777 20.838 4.601 1.00 0.00 H new ATOM 0 HD11 LEU C 104 11.630 21.445 7.000 1.00 0.00 H new ATOM 0 HD12 LEU C 104 10.010 21.274 6.284 1.00 0.00 H new ATOM 0 HD13 LEU C 104 10.669 19.979 7.312 1.00 0.00 H new ATOM 0 HD21 LEU C 104 13.516 20.031 6.176 1.00 0.00 H new ATOM 0 HD22 LEU C 104 12.555 18.566 6.486 1.00 0.00 H new ATOM 0 HD23 LEU C 104 13.242 18.854 4.870 1.00 0.00 H new ATOM 3467 N MET C 105 7.925 18.793 5.874 1.00 0.00 N ATOM 3468 CA MET C 105 6.657 19.133 6.580 1.00 0.00 C ATOM 3469 C MET C 105 5.773 17.888 6.704 1.00 0.00 C ATOM 3470 O MET C 105 4.872 17.833 7.518 1.00 0.00 O ATOM 3471 CB MET C 105 5.982 20.184 5.699 1.00 0.00 C ATOM 3472 CG MET C 105 6.762 21.497 5.781 1.00 0.00 C ATOM 3473 SD MET C 105 6.168 22.632 4.502 1.00 0.00 S ATOM 3474 CE MET C 105 6.680 21.650 3.071 1.00 0.00 C ATOM 0 H MET C 105 7.915 18.946 4.866 1.00 0.00 H new ATOM 0 HA MET C 105 6.832 19.501 7.591 1.00 0.00 H new ATOM 0 HB2 MET C 105 5.942 19.837 4.667 1.00 0.00 H new ATOM 0 HB3 MET C 105 4.953 20.339 6.023 1.00 0.00 H new ATOM 0 HG2 MET C 105 6.638 21.945 6.767 1.00 0.00 H new ATOM 0 HG3 MET C 105 7.827 21.308 5.649 1.00 0.00 H new ATOM 0 HE1 MET C 105 6.963 22.316 2.256 1.00 0.00 H new ATOM 0 HE2 MET C 105 7.532 21.027 3.343 1.00 0.00 H new ATOM 0 HE3 MET C 105 5.854 21.015 2.751 1.00 0.00 H new ATOM 3484 N ALA C 106 6.020 16.889 5.898 1.00 0.00 N ATOM 3485 CA ALA C 106 5.187 15.652 5.964 1.00 0.00 C ATOM 3486 C ALA C 106 5.666 14.738 7.096 1.00 0.00 C ATOM 3487 O ALA C 106 4.893 14.319 7.932 1.00 0.00 O ATOM 3488 CB ALA C 106 5.382 14.970 4.611 1.00 0.00 C ATOM 0 H ALA C 106 6.762 16.876 5.198 1.00 0.00 H new ATOM 0 HA ALA C 106 4.139 15.877 6.164 1.00 0.00 H new ATOM 0 HB1 ALA C 106 4.800 14.049 4.580 1.00 0.00 H new ATOM 0 HB2 ALA C 106 5.049 15.637 3.816 1.00 0.00 H new ATOM 0 HB3 ALA C 106 6.437 14.737 4.470 1.00 0.00 H new ATOM 3494 N ALA C 107 6.932 14.425 7.131 1.00 0.00 N ATOM 3495 CA ALA C 107 7.449 13.539 8.210 1.00 0.00 C ATOM 3496 C ALA C 107 7.122 14.141 9.577 1.00 0.00 C ATOM 3497 O ALA C 107 6.696 13.455 10.485 1.00 0.00 O ATOM 3498 CB ALA C 107 8.961 13.492 7.995 1.00 0.00 C ATOM 0 H ALA C 107 7.630 14.745 6.459 1.00 0.00 H new ATOM 0 HA ALA C 107 7.004 12.544 8.180 1.00 0.00 H new ATOM 0 HB1 ALA C 107 9.417 12.856 8.754 1.00 0.00 H new ATOM 0 HB2 ALA C 107 9.175 13.087 7.006 1.00 0.00 H new ATOM 0 HB3 ALA C 107 9.371 14.499 8.072 1.00 0.00 H new ATOM 3504 N ASN C 108 7.317 15.422 9.726 1.00 0.00 N ATOM 3505 CA ASN C 108 7.015 16.076 11.031 1.00 0.00 C ATOM 3506 C ASN C 108 5.504 16.096 11.275 1.00 0.00 C ATOM 3507 O ASN C 108 5.046 16.010 12.396 1.00 0.00 O ATOM 3508 CB ASN C 108 7.556 17.501 10.895 1.00 0.00 C ATOM 3509 CG ASN C 108 7.408 18.231 12.230 1.00 0.00 C ATOM 3510 OD1 ASN C 108 6.464 18.004 12.960 1.00 0.00 O ATOM 3511 ND2 ASN C 108 8.309 19.108 12.584 1.00 0.00 N ATOM 0 H ASN C 108 7.672 16.045 9.001 1.00 0.00 H new ATOM 0 HA ASN C 108 7.465 15.548 11.872 1.00 0.00 H new ATOM 0 HB2 ASN C 108 8.604 17.477 10.596 1.00 0.00 H new ATOM 0 HB3 ASN C 108 7.014 18.035 10.114 1.00 0.00 H new ATOM 0 HD21 ASN C 108 8.219 19.601 13.472 1.00 0.00 H new ATOM 0 HD22 ASN C 108 9.102 19.300 11.972 1.00 0.00 H new ATOM 3518 N PHE C 109 4.727 16.209 10.232 1.00 0.00 N ATOM 3519 CA PHE C 109 3.246 16.233 10.408 1.00 0.00 C ATOM 3520 C PHE C 109 2.778 14.929 11.057 1.00 0.00 C ATOM 3521 O PHE C 109 1.716 14.862 11.645 1.00 0.00 O ATOM 3522 CB PHE C 109 2.681 16.366 8.992 1.00 0.00 C ATOM 3523 CG PHE C 109 1.238 15.919 8.979 1.00 0.00 C ATOM 3524 CD1 PHE C 109 0.241 16.756 9.495 1.00 0.00 C ATOM 3525 CD2 PHE C 109 0.898 14.668 8.451 1.00 0.00 C ATOM 3526 CE1 PHE C 109 -1.097 16.341 9.483 1.00 0.00 C ATOM 3527 CE2 PHE C 109 -0.440 14.254 8.439 1.00 0.00 C ATOM 3528 CZ PHE C 109 -1.437 15.090 8.955 1.00 0.00 C ATOM 0 H PHE C 109 5.052 16.286 9.268 1.00 0.00 H new ATOM 0 HA PHE C 109 2.915 17.047 11.053 1.00 0.00 H new ATOM 0 HB2 PHE C 109 2.755 17.400 8.656 1.00 0.00 H new ATOM 0 HB3 PHE C 109 3.266 15.762 8.298 1.00 0.00 H new ATOM 0 HD1 PHE C 109 0.503 17.721 9.902 1.00 0.00 H new ATOM 0 HD2 PHE C 109 1.667 14.022 8.053 1.00 0.00 H new ATOM 0 HE1 PHE C 109 -1.866 16.986 9.881 1.00 0.00 H new ATOM 0 HE2 PHE C 109 -0.703 13.289 8.031 1.00 0.00 H new ATOM 0 HZ PHE C 109 -2.468 14.770 8.946 1.00 0.00 H new ATOM 3538 N LEU C 110 3.567 13.895 10.962 1.00 0.00 N ATOM 3539 CA LEU C 110 3.173 12.597 11.579 1.00 0.00 C ATOM 3540 C LEU C 110 3.584 12.577 13.052 1.00 0.00 C ATOM 3541 O LEU C 110 4.395 11.775 13.470 1.00 0.00 O ATOM 3542 CB LEU C 110 3.937 11.531 10.794 1.00 0.00 C ATOM 3543 CG LEU C 110 3.857 11.839 9.298 1.00 0.00 C ATOM 3544 CD1 LEU C 110 4.583 10.748 8.512 1.00 0.00 C ATOM 3545 CD2 LEU C 110 2.390 11.887 8.865 1.00 0.00 C ATOM 0 H LEU C 110 4.468 13.892 10.484 1.00 0.00 H new ATOM 0 HA LEU C 110 2.097 12.430 11.542 1.00 0.00 H new ATOM 0 HB2 LEU C 110 4.978 11.505 11.115 1.00 0.00 H new ATOM 0 HB3 LEU C 110 3.517 10.546 10.996 1.00 0.00 H new ATOM 0 HG LEU C 110 4.327 12.803 9.101 1.00 0.00 H new ATOM 0 HD11 LEU C 110 4.526 10.968 7.446 1.00 0.00 H new ATOM 0 HD12 LEU C 110 5.628 10.712 8.819 1.00 0.00 H new ATOM 0 HD13 LEU C 110 4.114 9.784 8.709 1.00 0.00 H new ATOM 0 HD21 LEU C 110 2.332 12.107 7.799 1.00 0.00 H new ATOM 0 HD22 LEU C 110 1.920 10.923 9.063 1.00 0.00 H new ATOM 0 HD23 LEU C 110 1.871 12.665 9.424 1.00 0.00 H new ATOM 3557 N ASP C 111 3.034 13.458 13.840 1.00 0.00 N ATOM 3558 CA ASP C 111 3.393 13.493 15.287 1.00 0.00 C ATOM 3559 C ASP C 111 4.879 13.825 15.457 1.00 0.00 C ATOM 3560 O ASP C 111 5.736 13.191 14.877 1.00 0.00 O ATOM 3561 CB ASP C 111 3.096 12.085 15.804 1.00 0.00 C ATOM 3562 CG ASP C 111 3.070 12.096 17.333 1.00 0.00 C ATOM 3563 OD1 ASP C 111 4.139 12.091 17.922 1.00 0.00 O ATOM 3564 OD2 ASP C 111 1.985 12.108 17.888 1.00 0.00 O ATOM 0 H ASP C 111 2.351 14.156 13.545 1.00 0.00 H new ATOM 0 HA ASP C 111 2.834 14.254 15.832 1.00 0.00 H new ATOM 0 HB2 ASP C 111 2.138 11.739 15.416 1.00 0.00 H new ATOM 0 HB3 ASP C 111 3.855 11.388 15.448 1.00 0.00 H new ATOM 3569 N CYS C 112 5.186 14.815 16.249 1.00 0.00 N ATOM 3570 CA CYS C 112 6.615 15.188 16.458 1.00 0.00 C ATOM 3571 C CYS C 112 7.312 14.146 17.337 1.00 0.00 C ATOM 3572 O CYS C 112 7.477 13.027 16.878 1.00 0.00 O ATOM 3573 CB CYS C 112 6.570 16.543 17.165 1.00 0.00 C ATOM 3574 SG CYS C 112 5.624 16.390 18.701 1.00 0.00 S ATOM 3575 OXT CYS C 112 7.667 14.485 18.454 1.00 0.00 O ATOM 0 H CYS C 112 4.510 15.382 16.761 1.00 0.00 H new ATOM 0 HA CYS C 112 7.171 15.234 15.522 1.00 0.00 H new ATOM 0 HB2 CYS C 112 7.582 16.886 17.381 1.00 0.00 H new ATOM 0 HB3 CYS C 112 6.112 17.289 16.516 1.00 0.00 H new ATOM 0 HG CYS C 112 6.118 15.427 19.421 1.00 0.00 H new