USER MOD reduce.3.24.130724 H: found=0, std=0, add=1135, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1139 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 149 SER OG : rot 146:sc= -0.665 USER MOD Set 1.2: A 155 THR OG1 : rot -62:sc= 1.02 USER MOD Set 2.1: A 25 GLN : amide:sc= -14.3! C(o=-14!,f=-27!) USER MOD Set 2.2: A 153 ASN : amide:sc= -0.123! C(o=-14!,f=-19!) USER MOD Set 3.1: A 8 LYS NZ :NH3+ 165:sc= -0.519 (180deg=-1.26) USER MOD Set 3.2: A 57 GLN :FLIP amide:sc= -0.576 F(o=-3.7,f=-1.1) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 177:sc= 1.11 (180deg=1.1) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot -38:sc= -0.311 USER MOD Single : A 23 THR OG1 : rot 87:sc= 0.955 USER MOD Single : A 30 GLN : amide:sc= 0.0103 X(o=0.01,f=-0.061) USER MOD Single : A 41 ASN : amide:sc= -2.21! C(o=-2.2!,f=-2.5!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.0317 USER MOD Single : A 45 LYS NZ :NH3+ 169:sc= 0.698 (180deg=0.508) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= -0.164 K(o=-0.16,f=-2.6!) USER MOD Single : A 52 GLN :FLIP amide:sc= -2.12! C(o=-4.8!,f=-2.1!) USER MOD Single : A 54 TYR OH : rot 177:sc= 0.164 USER MOD Single : A 55 HIS : no HD1:sc= -3.17 K(o=-3.2,f=-8.2!) USER MOD Single : A 61 THR OG1 : rot 28:sc= -0.253 USER MOD Single : A 79 ASN : amide:sc= -0.668 X(o=-0.67,f=-0.21) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 TYR OH : rot 86:sc= 1.45 USER MOD Single : A 86 SER OG : rot 179:sc= -3.63! USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0.441 USER MOD Single : A 91 LYS NZ :NH3+ -147:sc= -0.296 (180deg=-1.52!) USER MOD Single : A 92 SER OG : rot -48:sc= 0.159 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 HIS : no HD1:sc= -7.41! C(o=-7.4!,f=-7.4!) USER MOD Single : A 102 LYS NZ :NH3+ -147:sc= -0.178 (180deg=-0.949) USER MOD Single : A 111 GLN : amide:sc= -0.337 K(o=-0.34,f=-1.8) USER MOD Single : A 115 MET CE :methyl -177:sc= -1.89 (180deg=-1.94) USER MOD Single : A 119 ASN : amide:sc= -2.75! C(o=-2.8!,f=-7.1!) USER MOD Single : A 120 LYS NZ :NH3+ -116:sc= 1.05 (180deg=-1.18) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 HIS : no HD1:sc= -2.63! C(o=-2.6!,f=-5.5!) USER MOD Single : A 125 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot -56:sc= -3.79! USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0265) USER MOD Single : A 140 SER OG : rot -70:sc= 0.607 USER MOD Single : A 142 ASN : amide:sc= -0.256 X(o=-0.26,f=-0.56) USER MOD Single : A 148 SER OG : rot 140:sc= -1.05 USER MOD Single : A 151 LYS NZ :NH3+ -124:sc= 0 (180deg=-0.00503) USER MOD Single : A 154 GLN :FLIP amide:sc=-0.00696 F(o=-1.5!,f=-0.007) USER MOD Single : A 169 LYS NZ :NH3+ -158:sc= -0.15 (180deg=-0.845) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 6 -13.834 -4.579 -5.851 1.00 0.00 N ATOM 2 CA SER A 6 -12.771 -4.249 -6.781 1.00 0.00 C ATOM 3 C SER A 6 -12.135 -2.921 -6.401 1.00 0.00 C ATOM 4 O SER A 6 -12.744 -1.859 -6.540 1.00 0.00 O ATOM 5 CB SER A 6 -13.327 -4.150 -8.189 1.00 0.00 C ATOM 6 OG SER A 6 -12.547 -4.956 -9.064 1.00 0.00 O ATOM 0 HA SER A 6 -12.018 -5.036 -6.740 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.366 -4.478 -8.205 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.315 -3.113 -8.524 1.00 0.00 H new ATOM 0 HG SER A 6 -12.907 -4.894 -9.974 1.00 0.00 H new ATOM 12 N ARG A 7 -10.911 -2.997 -5.919 1.00 0.00 N ATOM 13 CA ARG A 7 -10.173 -1.809 -5.507 1.00 0.00 C ATOM 14 C ARG A 7 -8.717 -1.933 -5.934 1.00 0.00 C ATOM 15 O ARG A 7 -8.118 -2.993 -5.774 1.00 0.00 O ATOM 16 CB ARG A 7 -10.268 -1.630 -3.990 1.00 0.00 C ATOM 17 CG ARG A 7 -11.591 -2.218 -3.488 1.00 0.00 C ATOM 18 CD ARG A 7 -11.771 -1.905 -1.999 1.00 0.00 C ATOM 19 NE ARG A 7 -13.175 -2.033 -1.626 1.00 0.00 N ATOM 20 CZ ARG A 7 -13.551 -2.045 -0.351 1.00 0.00 C ATOM 21 NH1 ARG A 7 -12.658 -1.948 0.596 1.00 0.00 N ATOM 22 NH2 ARG A 7 -14.815 -2.156 -0.047 1.00 0.00 N ATOM 0 H ARG A 7 -10.400 -3.872 -5.801 1.00 0.00 H new ATOM 0 HA ARG A 7 -10.609 -0.933 -5.988 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -9.429 -2.125 -3.501 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -10.207 -0.572 -3.733 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -12.422 -1.804 -4.058 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -11.602 -3.297 -3.645 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -11.164 -2.585 -1.401 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -11.421 -0.895 -1.787 1.00 0.00 H new ATOM 0 HE ARG A 7 -13.882 -2.115 -2.357 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -11.670 -1.863 0.358 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -12.948 -1.957 1.574 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -15.513 -2.233 -0.787 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -15.105 -2.165 0.931 1.00 0.00 H new ATOM 36 N LYS A 8 -8.139 -0.865 -6.479 1.00 0.00 N ATOM 37 CA LYS A 8 -6.761 -0.927 -6.908 1.00 0.00 C ATOM 38 C LYS A 8 -5.901 -0.158 -5.929 1.00 0.00 C ATOM 39 O LYS A 8 -6.216 0.968 -5.576 1.00 0.00 O ATOM 40 CB LYS A 8 -6.624 -0.352 -8.320 1.00 0.00 C ATOM 41 CG LYS A 8 -7.881 -0.676 -9.131 1.00 0.00 C ATOM 42 CD LYS A 8 -7.691 -0.217 -10.578 1.00 0.00 C ATOM 43 CE LYS A 8 -8.780 -0.833 -11.458 1.00 0.00 C ATOM 44 NZ LYS A 8 -9.940 -1.226 -10.609 1.00 0.00 N ATOM 0 H LYS A 8 -8.600 0.033 -6.628 1.00 0.00 H new ATOM 0 HA LYS A 8 -6.429 -1.965 -6.932 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -6.479 0.727 -8.271 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -5.745 -0.770 -8.810 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -8.079 -1.748 -9.102 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -8.747 -0.180 -8.692 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -7.736 0.871 -10.634 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -6.706 -0.515 -10.938 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -9.097 -0.118 -12.217 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -8.389 -1.704 -11.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -10.768 -1.404 -11.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -9.706 -2.090 -10.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -10.157 -0.459 -9.941 1.00 0.00 H new ATOM 58 N ILE A 9 -4.837 -0.783 -5.461 1.00 0.00 N ATOM 59 CA ILE A 9 -3.976 -0.152 -4.502 1.00 0.00 C ATOM 60 C ILE A 9 -2.706 0.393 -5.187 1.00 0.00 C ATOM 61 O ILE A 9 -1.963 -0.336 -5.816 1.00 0.00 O ATOM 62 CB ILE A 9 -3.653 -1.155 -3.372 1.00 0.00 C ATOM 63 CG1 ILE A 9 -4.752 -2.268 -3.229 1.00 0.00 C ATOM 64 CG2 ILE A 9 -3.539 -0.394 -2.072 1.00 0.00 C ATOM 65 CD1 ILE A 9 -6.083 -1.749 -2.686 1.00 0.00 C ATOM 0 H ILE A 9 -4.556 -1.725 -5.734 1.00 0.00 H new ATOM 0 HA ILE A 9 -4.480 0.706 -4.058 1.00 0.00 H new ATOM 0 HB ILE A 9 -2.716 -1.654 -3.620 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -4.921 -2.727 -4.203 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -4.380 -3.051 -2.568 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -3.311 -1.088 -1.263 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -2.742 0.345 -2.152 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -4.482 0.111 -1.862 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -6.793 -2.573 -2.614 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -5.929 -1.316 -1.698 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -6.478 -0.987 -3.358 1.00 0.00 H new ATOM 77 N ALA A 10 -2.470 1.695 -5.077 1.00 0.00 N ATOM 78 CA ALA A 10 -1.304 2.304 -5.734 1.00 0.00 C ATOM 79 C ALA A 10 -0.060 2.137 -4.883 1.00 0.00 C ATOM 80 O ALA A 10 -0.099 2.368 -3.680 1.00 0.00 O ATOM 81 CB ALA A 10 -1.528 3.792 -5.907 1.00 0.00 C ATOM 0 H ALA A 10 -3.054 2.345 -4.551 1.00 0.00 H new ATOM 0 HA ALA A 10 -1.174 1.810 -6.697 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -0.660 4.236 -6.394 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -2.413 3.958 -6.521 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -1.672 4.254 -4.930 1.00 0.00 H new ATOM 87 N ILE A 11 1.043 1.749 -5.522 1.00 0.00 N ATOM 88 CA ILE A 11 2.296 1.532 -4.806 1.00 0.00 C ATOM 89 C ILE A 11 3.171 2.754 -4.851 1.00 0.00 C ATOM 90 O ILE A 11 3.425 3.330 -5.908 1.00 0.00 O ATOM 91 CB ILE A 11 3.057 0.345 -5.397 1.00 0.00 C ATOM 92 CG1 ILE A 11 2.101 -0.834 -5.618 1.00 0.00 C ATOM 93 CG2 ILE A 11 4.165 -0.077 -4.429 1.00 0.00 C ATOM 94 CD1 ILE A 11 2.842 -1.968 -6.330 1.00 0.00 C ATOM 0 H ILE A 11 1.093 1.580 -6.527 1.00 0.00 H new ATOM 0 HA ILE A 11 2.043 1.320 -3.767 1.00 0.00 H new ATOM 0 HB ILE A 11 3.491 0.638 -6.353 1.00 0.00 H new ATOM 0 HG12 ILE A 11 1.712 -1.184 -4.662 1.00 0.00 H new ATOM 0 HG13 ILE A 11 1.245 -0.515 -6.213 1.00 0.00 H new ATOM 0 HG21 ILE A 11 4.710 -0.923 -4.847 1.00 0.00 H new ATOM 0 HG22 ILE A 11 4.851 0.756 -4.275 1.00 0.00 H new ATOM 0 HG23 ILE A 11 3.724 -0.365 -3.475 1.00 0.00 H new ATOM 0 HD11 ILE A 11 2.162 -2.805 -6.487 1.00 0.00 H new ATOM 0 HD12 ILE A 11 3.210 -1.614 -7.293 1.00 0.00 H new ATOM 0 HD13 ILE A 11 3.683 -2.294 -5.718 1.00 0.00 H new ATOM 106 N LEU A 12 3.607 3.146 -3.667 1.00 0.00 N ATOM 107 CA LEU A 12 4.439 4.312 -3.515 1.00 0.00 C ATOM 108 C LEU A 12 5.701 3.962 -2.731 1.00 0.00 C ATOM 109 O LEU A 12 5.701 3.959 -1.500 1.00 0.00 O ATOM 110 CB LEU A 12 3.634 5.373 -2.777 1.00 0.00 C ATOM 111 CG LEU A 12 3.403 6.575 -3.690 1.00 0.00 C ATOM 112 CD1 LEU A 12 2.634 6.127 -4.934 1.00 0.00 C ATOM 113 CD2 LEU A 12 2.590 7.638 -2.948 1.00 0.00 C ATOM 0 H LEU A 12 3.393 2.665 -2.794 1.00 0.00 H new ATOM 0 HA LEU A 12 4.745 4.686 -4.492 1.00 0.00 H new ATOM 0 HB2 LEU A 12 2.678 4.959 -2.456 1.00 0.00 H new ATOM 0 HB3 LEU A 12 4.165 5.685 -1.877 1.00 0.00 H new ATOM 0 HG LEU A 12 4.365 6.995 -3.984 1.00 0.00 H new ATOM 0 HD11 LEU A 12 2.468 6.984 -5.587 1.00 0.00 H new ATOM 0 HD12 LEU A 12 3.212 5.371 -5.466 1.00 0.00 H new ATOM 0 HD13 LEU A 12 1.674 5.706 -4.636 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.427 8.494 -3.603 1.00 0.00 H new ATOM 0 HD22 LEU A 12 1.628 7.219 -2.652 1.00 0.00 H new ATOM 0 HD23 LEU A 12 3.135 7.959 -2.060 1.00 0.00 H new ATOM 125 N GLY A 13 6.770 3.652 -3.453 1.00 0.00 N ATOM 126 CA GLY A 13 8.027 3.284 -2.819 1.00 0.00 C ATOM 127 C GLY A 13 9.218 3.877 -3.560 1.00 0.00 C ATOM 128 O GLY A 13 9.272 3.845 -4.789 1.00 0.00 O ATOM 0 H GLY A 13 6.791 3.648 -4.473 1.00 0.00 H new ATOM 0 HA2 GLY A 13 8.030 3.631 -1.786 1.00 0.00 H new ATOM 0 HA3 GLY A 13 8.118 2.198 -2.791 1.00 0.00 H new ATOM 132 N TYR A 14 10.165 4.417 -2.798 1.00 0.00 N ATOM 133 CA TYR A 14 11.368 5.013 -3.370 1.00 0.00 C ATOM 134 C TYR A 14 12.044 4.048 -4.335 1.00 0.00 C ATOM 135 O TYR A 14 11.436 3.099 -4.821 1.00 0.00 O ATOM 136 CB TYR A 14 12.340 5.384 -2.243 1.00 0.00 C ATOM 137 CG TYR A 14 12.801 6.810 -2.426 1.00 0.00 C ATOM 138 CD1 TYR A 14 11.870 7.853 -2.369 1.00 0.00 C ATOM 139 CD2 TYR A 14 14.153 7.089 -2.660 1.00 0.00 C ATOM 140 CE1 TYR A 14 12.291 9.177 -2.551 1.00 0.00 C ATOM 141 CE2 TYR A 14 14.574 8.412 -2.837 1.00 0.00 C ATOM 142 CZ TYR A 14 13.643 9.455 -2.784 1.00 0.00 C ATOM 143 OH TYR A 14 14.058 10.759 -2.962 1.00 0.00 O ATOM 0 H TYR A 14 10.122 4.454 -1.780 1.00 0.00 H new ATOM 0 HA TYR A 14 11.084 5.909 -3.922 1.00 0.00 H new ATOM 0 HB2 TYR A 14 11.852 5.270 -1.275 1.00 0.00 H new ATOM 0 HB3 TYR A 14 13.196 4.710 -2.250 1.00 0.00 H new ATOM 0 HD1 TYR A 14 10.828 7.638 -2.185 1.00 0.00 H new ATOM 0 HD2 TYR A 14 14.871 6.283 -2.704 1.00 0.00 H new ATOM 0 HE1 TYR A 14 11.573 9.983 -2.512 1.00 0.00 H new ATOM 0 HE2 TYR A 14 15.617 8.628 -3.014 1.00 0.00 H new ATOM 0 HH TYR A 14 15.026 10.777 -3.112 1.00 0.00 H new ATOM 153 N ARG A 15 13.301 4.311 -4.623 1.00 0.00 N ATOM 154 CA ARG A 15 14.052 3.469 -5.540 1.00 0.00 C ATOM 155 C ARG A 15 14.839 2.401 -4.787 1.00 0.00 C ATOM 156 O ARG A 15 15.462 2.673 -3.761 1.00 0.00 O ATOM 157 CB ARG A 15 15.009 4.321 -6.366 1.00 0.00 C ATOM 158 CG ARG A 15 15.932 5.114 -5.438 1.00 0.00 C ATOM 159 CD ARG A 15 17.382 4.682 -5.668 1.00 0.00 C ATOM 160 NE ARG A 15 18.261 5.334 -4.705 1.00 0.00 N ATOM 161 CZ ARG A 15 18.447 4.827 -3.490 1.00 0.00 C ATOM 162 NH1 ARG A 15 17.834 3.730 -3.138 1.00 0.00 N ATOM 163 NH2 ARG A 15 19.243 5.429 -2.648 1.00 0.00 N ATOM 0 H ARG A 15 13.826 5.097 -4.239 1.00 0.00 H new ATOM 0 HA ARG A 15 13.341 2.973 -6.200 1.00 0.00 H new ATOM 0 HB2 ARG A 15 15.600 3.685 -7.025 1.00 0.00 H new ATOM 0 HB3 ARG A 15 14.446 5.003 -7.003 1.00 0.00 H new ATOM 0 HG2 ARG A 15 15.825 6.182 -5.628 1.00 0.00 H new ATOM 0 HG3 ARG A 15 15.652 4.945 -4.398 1.00 0.00 H new ATOM 0 HD2 ARG A 15 17.466 3.599 -5.573 1.00 0.00 H new ATOM 0 HD3 ARG A 15 17.689 4.938 -6.682 1.00 0.00 H new ATOM 0 HE ARG A 15 18.742 6.194 -4.968 1.00 0.00 H new ATOM 0 HH11 ARG A 15 17.211 3.260 -3.795 1.00 0.00 H new ATOM 0 HH12 ARG A 15 17.978 3.342 -2.206 1.00 0.00 H new ATOM 0 HH21 ARG A 15 19.721 6.287 -2.923 1.00 0.00 H new ATOM 0 HH22 ARG A 15 19.387 5.041 -1.716 1.00 0.00 H new ATOM 177 N SER A 16 14.816 1.188 -5.323 1.00 0.00 N ATOM 178 CA SER A 16 15.536 0.077 -4.726 1.00 0.00 C ATOM 179 C SER A 16 15.064 -0.205 -3.302 1.00 0.00 C ATOM 180 O SER A 16 15.766 -0.852 -2.526 1.00 0.00 O ATOM 181 CB SER A 16 17.019 0.392 -4.726 1.00 0.00 C ATOM 182 OG SER A 16 17.387 0.930 -5.989 1.00 0.00 O ATOM 0 H SER A 16 14.304 0.951 -6.173 1.00 0.00 H new ATOM 0 HA SER A 16 15.340 -0.817 -5.318 1.00 0.00 H new ATOM 0 HB2 SER A 16 17.251 1.104 -3.934 1.00 0.00 H new ATOM 0 HB3 SER A 16 17.594 -0.511 -4.522 1.00 0.00 H new ATOM 0 HG SER A 16 18.345 1.136 -5.990 1.00 0.00 H new ATOM 188 N VAL A 17 13.872 0.274 -2.965 1.00 0.00 N ATOM 189 CA VAL A 17 13.319 0.054 -1.630 1.00 0.00 C ATOM 190 C VAL A 17 12.805 -1.375 -1.497 1.00 0.00 C ATOM 191 O VAL A 17 12.667 -1.897 -0.389 1.00 0.00 O ATOM 192 CB VAL A 17 12.176 1.028 -1.369 1.00 0.00 C ATOM 193 CG1 VAL A 17 11.182 0.958 -2.525 1.00 0.00 C ATOM 194 CG2 VAL A 17 11.474 0.643 -0.066 1.00 0.00 C ATOM 0 H VAL A 17 13.273 0.813 -3.590 1.00 0.00 H new ATOM 0 HA VAL A 17 14.110 0.219 -0.899 1.00 0.00 H new ATOM 0 HB VAL A 17 12.566 2.042 -1.286 1.00 0.00 H new ATOM 0 HG11 VAL A 17 10.362 1.653 -2.343 1.00 0.00 H new ATOM 0 HG12 VAL A 17 11.685 1.226 -3.454 1.00 0.00 H new ATOM 0 HG13 VAL A 17 10.788 -0.055 -2.605 1.00 0.00 H new ATOM 0 HG21 VAL A 17 10.655 1.337 0.125 1.00 0.00 H new ATOM 0 HG22 VAL A 17 11.079 -0.369 -0.151 1.00 0.00 H new ATOM 0 HG23 VAL A 17 12.186 0.687 0.758 1.00 0.00 H new ATOM 204 N GLY A 18 12.521 -2.002 -2.633 1.00 0.00 N ATOM 205 CA GLY A 18 12.021 -3.369 -2.630 1.00 0.00 C ATOM 206 C GLY A 18 10.500 -3.404 -2.737 1.00 0.00 C ATOM 207 O GLY A 18 9.864 -4.365 -2.304 1.00 0.00 O ATOM 0 H GLY A 18 12.628 -1.589 -3.559 1.00 0.00 H new ATOM 0 HA2 GLY A 18 12.459 -3.920 -3.462 1.00 0.00 H new ATOM 0 HA3 GLY A 18 12.335 -3.871 -1.715 1.00 0.00 H new ATOM 211 N LYS A 19 9.915 -2.359 -3.319 1.00 0.00 N ATOM 212 CA LYS A 19 8.464 -2.309 -3.471 1.00 0.00 C ATOM 213 C LYS A 19 8.008 -3.302 -4.532 1.00 0.00 C ATOM 214 O LYS A 19 6.918 -3.866 -4.441 1.00 0.00 O ATOM 215 CB LYS A 19 8.007 -0.893 -3.845 1.00 0.00 C ATOM 216 CG LYS A 19 8.599 -0.481 -5.196 1.00 0.00 C ATOM 217 CD LYS A 19 8.722 1.047 -5.242 1.00 0.00 C ATOM 218 CE LYS A 19 9.145 1.502 -6.641 1.00 0.00 C ATOM 219 NZ LYS A 19 10.611 1.291 -6.810 1.00 0.00 N ATOM 0 H LYS A 19 10.414 -1.549 -3.687 1.00 0.00 H new ATOM 0 HA LYS A 19 8.011 -2.579 -2.517 1.00 0.00 H new ATOM 0 HB2 LYS A 19 6.919 -0.855 -3.891 1.00 0.00 H new ATOM 0 HB3 LYS A 19 8.318 -0.188 -3.074 1.00 0.00 H new ATOM 0 HG2 LYS A 19 9.577 -0.942 -5.335 1.00 0.00 H new ATOM 0 HG3 LYS A 19 7.963 -0.832 -6.009 1.00 0.00 H new ATOM 0 HD2 LYS A 19 7.769 1.504 -4.976 1.00 0.00 H new ATOM 0 HD3 LYS A 19 9.453 1.383 -4.506 1.00 0.00 H new ATOM 0 HE2 LYS A 19 8.596 0.942 -7.398 1.00 0.00 H new ATOM 0 HE3 LYS A 19 8.900 2.555 -6.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 10.890 1.552 -7.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 11.128 1.883 -6.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 10.839 0.290 -6.642 1.00 0.00 H new ATOM 233 N SER A 20 8.853 -3.518 -5.533 1.00 0.00 N ATOM 234 CA SER A 20 8.530 -4.454 -6.601 1.00 0.00 C ATOM 235 C SER A 20 8.748 -5.895 -6.143 1.00 0.00 C ATOM 236 O SER A 20 7.994 -6.797 -6.515 1.00 0.00 O ATOM 237 CB SER A 20 9.392 -4.163 -7.829 1.00 0.00 C ATOM 238 OG SER A 20 9.262 -2.790 -8.174 1.00 0.00 O ATOM 0 H SER A 20 9.760 -3.061 -5.627 1.00 0.00 H new ATOM 0 HA SER A 20 7.479 -4.329 -6.861 1.00 0.00 H new ATOM 0 HB2 SER A 20 10.435 -4.401 -7.621 1.00 0.00 H new ATOM 0 HB3 SER A 20 9.082 -4.791 -8.664 1.00 0.00 H new ATOM 0 HG SER A 20 9.814 -2.597 -8.960 1.00 0.00 H new ATOM 244 N SER A 21 9.776 -6.110 -5.320 1.00 0.00 N ATOM 245 CA SER A 21 10.067 -7.436 -4.818 1.00 0.00 C ATOM 246 C SER A 21 8.902 -7.932 -3.996 1.00 0.00 C ATOM 247 O SER A 21 8.435 -9.057 -4.174 1.00 0.00 O ATOM 248 CB SER A 21 11.310 -7.390 -3.942 1.00 0.00 C ATOM 249 OG SER A 21 11.064 -6.501 -2.862 1.00 0.00 O ATOM 0 H SER A 21 10.412 -5.382 -4.994 1.00 0.00 H new ATOM 0 HA SER A 21 10.236 -8.108 -5.659 1.00 0.00 H new ATOM 0 HB2 SER A 21 11.547 -8.386 -3.567 1.00 0.00 H new ATOM 0 HB3 SER A 21 12.170 -7.054 -4.521 1.00 0.00 H new ATOM 0 HG SER A 21 10.540 -5.736 -3.180 1.00 0.00 H new ATOM 255 N LEU A 22 8.432 -7.086 -3.088 1.00 0.00 N ATOM 256 CA LEU A 22 7.320 -7.474 -2.252 1.00 0.00 C ATOM 257 C LEU A 22 6.091 -7.705 -3.112 1.00 0.00 C ATOM 258 O LEU A 22 5.482 -8.762 -3.039 1.00 0.00 O ATOM 259 CB LEU A 22 7.035 -6.420 -1.173 1.00 0.00 C ATOM 260 CG LEU A 22 5.675 -6.684 -0.502 1.00 0.00 C ATOM 261 CD1 LEU A 22 5.593 -8.131 0.011 1.00 0.00 C ATOM 262 CD2 LEU A 22 5.511 -5.732 0.684 1.00 0.00 C ATOM 0 H LEU A 22 8.798 -6.149 -2.919 1.00 0.00 H new ATOM 0 HA LEU A 22 7.580 -8.401 -1.741 1.00 0.00 H new ATOM 0 HB2 LEU A 22 7.826 -6.437 -0.423 1.00 0.00 H new ATOM 0 HB3 LEU A 22 7.039 -5.425 -1.619 1.00 0.00 H new ATOM 0 HG LEU A 22 4.886 -6.523 -1.237 1.00 0.00 H new ATOM 0 HD11 LEU A 22 4.624 -8.296 0.482 1.00 0.00 H new ATOM 0 HD12 LEU A 22 5.713 -8.821 -0.825 1.00 0.00 H new ATOM 0 HD13 LEU A 22 6.384 -8.304 0.740 1.00 0.00 H new ATOM 0 HD21 LEU A 22 4.550 -5.912 1.165 1.00 0.00 H new ATOM 0 HD22 LEU A 22 6.314 -5.903 1.401 1.00 0.00 H new ATOM 0 HD23 LEU A 22 5.553 -4.701 0.332 1.00 0.00 H new ATOM 274 N THR A 23 5.732 -6.718 -3.933 1.00 0.00 N ATOM 275 CA THR A 23 4.577 -6.847 -4.798 1.00 0.00 C ATOM 276 C THR A 23 4.482 -8.267 -5.340 1.00 0.00 C ATOM 277 O THR A 23 3.396 -8.835 -5.411 1.00 0.00 O ATOM 278 CB THR A 23 4.681 -5.859 -5.960 1.00 0.00 C ATOM 279 OG1 THR A 23 4.852 -4.544 -5.449 1.00 0.00 O ATOM 280 CG2 THR A 23 3.403 -5.927 -6.785 1.00 0.00 C ATOM 0 H THR A 23 6.226 -5.829 -4.012 1.00 0.00 H new ATOM 0 HA THR A 23 3.680 -6.627 -4.219 1.00 0.00 H new ATOM 0 HB THR A 23 5.535 -6.113 -6.587 1.00 0.00 H new ATOM 0 HG1 THR A 23 5.805 -4.373 -5.298 1.00 0.00 H new ATOM 0 HG21 THR A 23 3.469 -5.225 -7.616 1.00 0.00 H new ATOM 0 HG22 THR A 23 3.274 -6.937 -7.173 1.00 0.00 H new ATOM 0 HG23 THR A 23 2.551 -5.667 -6.157 1.00 0.00 H new ATOM 288 N ILE A 24 5.632 -8.830 -5.705 1.00 0.00 N ATOM 289 CA ILE A 24 5.687 -10.193 -6.231 1.00 0.00 C ATOM 290 C ILE A 24 5.567 -11.203 -5.086 1.00 0.00 C ATOM 291 O ILE A 24 4.893 -12.226 -5.207 1.00 0.00 O ATOM 292 CB ILE A 24 7.015 -10.399 -6.983 1.00 0.00 C ATOM 293 CG1 ILE A 24 6.888 -9.981 -8.459 1.00 0.00 C ATOM 294 CG2 ILE A 24 7.425 -11.869 -6.927 1.00 0.00 C ATOM 295 CD1 ILE A 24 6.979 -8.458 -8.577 1.00 0.00 C ATOM 0 H ILE A 24 6.538 -8.364 -5.646 1.00 0.00 H new ATOM 0 HA ILE A 24 4.857 -10.348 -6.920 1.00 0.00 H new ATOM 0 HB ILE A 24 7.769 -9.778 -6.499 1.00 0.00 H new ATOM 0 HG12 ILE A 24 7.677 -10.448 -9.048 1.00 0.00 H new ATOM 0 HG13 ILE A 24 5.939 -10.330 -8.865 1.00 0.00 H new ATOM 0 HG21 ILE A 24 8.365 -12.005 -7.461 1.00 0.00 H new ATOM 0 HG22 ILE A 24 7.551 -12.172 -5.888 1.00 0.00 H new ATOM 0 HG23 ILE A 24 6.652 -12.480 -7.392 1.00 0.00 H new ATOM 0 HD11 ILE A 24 6.889 -8.168 -9.624 1.00 0.00 H new ATOM 0 HD12 ILE A 24 6.174 -8.000 -8.003 1.00 0.00 H new ATOM 0 HD13 ILE A 24 7.940 -8.120 -8.189 1.00 0.00 H new ATOM 307 N GLN A 25 6.233 -10.909 -3.980 1.00 0.00 N ATOM 308 CA GLN A 25 6.205 -11.788 -2.814 1.00 0.00 C ATOM 309 C GLN A 25 4.799 -11.918 -2.246 1.00 0.00 C ATOM 310 O GLN A 25 4.407 -12.992 -1.825 1.00 0.00 O ATOM 311 CB GLN A 25 7.110 -11.228 -1.721 1.00 0.00 C ATOM 312 CG GLN A 25 7.296 -12.251 -0.598 1.00 0.00 C ATOM 313 CD GLN A 25 8.498 -13.134 -0.881 1.00 0.00 C ATOM 314 OE1 GLN A 25 8.434 -14.342 -0.673 1.00 0.00 O ATOM 315 NE2 GLN A 25 9.605 -12.596 -1.320 1.00 0.00 N ATOM 0 H GLN A 25 6.800 -10.070 -3.862 1.00 0.00 H new ATOM 0 HA GLN A 25 6.551 -12.770 -3.138 1.00 0.00 H new ATOM 0 HB2 GLN A 25 8.079 -10.964 -2.144 1.00 0.00 H new ATOM 0 HB3 GLN A 25 6.678 -10.312 -1.318 1.00 0.00 H new ATOM 0 HG2 GLN A 25 7.431 -11.736 0.353 1.00 0.00 H new ATOM 0 HG3 GLN A 25 6.400 -12.865 -0.504 1.00 0.00 H new ATOM 0 HE21 GLN A 25 9.651 -11.591 -1.491 1.00 0.00 H new ATOM 0 HE22 GLN A 25 10.423 -13.181 -1.492 1.00 0.00 H new ATOM 324 N PHE A 26 4.075 -10.810 -2.196 1.00 0.00 N ATOM 325 CA PHE A 26 2.730 -10.788 -1.637 1.00 0.00 C ATOM 326 C PHE A 26 1.709 -11.382 -2.596 1.00 0.00 C ATOM 327 O PHE A 26 1.030 -12.359 -2.279 1.00 0.00 O ATOM 328 CB PHE A 26 2.354 -9.335 -1.331 1.00 0.00 C ATOM 329 CG PHE A 26 0.864 -9.129 -1.507 1.00 0.00 C ATOM 330 CD1 PHE A 26 -0.048 -9.983 -0.874 1.00 0.00 C ATOM 331 CD2 PHE A 26 0.396 -8.078 -2.308 1.00 0.00 C ATOM 332 CE1 PHE A 26 -1.423 -9.789 -1.043 1.00 0.00 C ATOM 333 CE2 PHE A 26 -0.981 -7.884 -2.475 1.00 0.00 C ATOM 334 CZ PHE A 26 -1.889 -8.739 -1.843 1.00 0.00 C ATOM 0 H PHE A 26 4.400 -9.906 -2.539 1.00 0.00 H new ATOM 0 HA PHE A 26 2.722 -11.393 -0.730 1.00 0.00 H new ATOM 0 HB2 PHE A 26 2.645 -9.084 -0.311 1.00 0.00 H new ATOM 0 HB3 PHE A 26 2.901 -8.664 -1.993 1.00 0.00 H new ATOM 0 HD1 PHE A 26 0.311 -10.792 -0.255 1.00 0.00 H new ATOM 0 HD2 PHE A 26 1.097 -7.418 -2.796 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -2.125 -10.449 -0.556 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -1.341 -7.074 -3.092 1.00 0.00 H new ATOM 0 HZ PHE A 26 -2.951 -8.589 -1.972 1.00 0.00 H new ATOM 344 N VAL A 27 1.594 -10.765 -3.757 1.00 0.00 N ATOM 345 CA VAL A 27 0.636 -11.207 -4.762 1.00 0.00 C ATOM 346 C VAL A 27 0.678 -12.718 -4.929 1.00 0.00 C ATOM 347 O VAL A 27 -0.360 -13.375 -5.001 1.00 0.00 O ATOM 348 CB VAL A 27 0.951 -10.533 -6.089 1.00 0.00 C ATOM 349 CG1 VAL A 27 2.309 -11.022 -6.578 1.00 0.00 C ATOM 350 CG2 VAL A 27 -0.114 -10.884 -7.121 1.00 0.00 C ATOM 0 H VAL A 27 2.151 -9.955 -4.031 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.366 -10.929 -4.434 1.00 0.00 H new ATOM 0 HB VAL A 27 0.967 -9.452 -5.952 1.00 0.00 H new ATOM 0 HG11 VAL A 27 2.546 -10.546 -7.529 1.00 0.00 H new ATOM 0 HG12 VAL A 27 3.073 -10.767 -5.844 1.00 0.00 H new ATOM 0 HG13 VAL A 27 2.280 -12.103 -6.711 1.00 0.00 H new ATOM 0 HG21 VAL A 27 0.121 -10.396 -8.067 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -0.138 -11.964 -7.266 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -1.088 -10.543 -6.769 1.00 0.00 H new ATOM 360 N GLU A 28 1.884 -13.264 -4.983 1.00 0.00 N ATOM 361 CA GLU A 28 2.054 -14.698 -5.133 1.00 0.00 C ATOM 362 C GLU A 28 2.159 -15.340 -3.763 1.00 0.00 C ATOM 363 O GLU A 28 1.903 -16.531 -3.595 1.00 0.00 O ATOM 364 CB GLU A 28 3.317 -15.000 -5.937 1.00 0.00 C ATOM 365 CG GLU A 28 2.939 -15.711 -7.237 1.00 0.00 C ATOM 366 CD GLU A 28 2.340 -17.079 -6.928 1.00 0.00 C ATOM 367 OE1 GLU A 28 3.093 -17.963 -6.553 1.00 0.00 O ATOM 368 OE2 GLU A 28 1.137 -17.223 -7.069 1.00 0.00 O ATOM 0 H GLU A 28 2.755 -12.736 -4.925 1.00 0.00 H new ATOM 0 HA GLU A 28 1.193 -15.103 -5.664 1.00 0.00 H new ATOM 0 HB2 GLU A 28 3.850 -14.075 -6.158 1.00 0.00 H new ATOM 0 HB3 GLU A 28 3.992 -15.625 -5.352 1.00 0.00 H new ATOM 0 HG2 GLU A 28 2.222 -15.109 -7.795 1.00 0.00 H new ATOM 0 HG3 GLU A 28 3.820 -15.825 -7.868 1.00 0.00 H new ATOM 375 N GLY A 29 2.567 -14.534 -2.794 1.00 0.00 N ATOM 376 CA GLY A 29 2.742 -15.020 -1.441 1.00 0.00 C ATOM 377 C GLY A 29 3.958 -15.920 -1.387 1.00 0.00 C ATOM 378 O GLY A 29 4.045 -16.819 -0.551 1.00 0.00 O ATOM 0 H GLY A 29 2.781 -13.545 -2.922 1.00 0.00 H new ATOM 0 HA2 GLY A 29 2.864 -14.182 -0.754 1.00 0.00 H new ATOM 0 HA3 GLY A 29 1.855 -15.568 -1.121 1.00 0.00 H new ATOM 382 N GLN A 30 4.884 -15.681 -2.313 1.00 0.00 N ATOM 383 CA GLN A 30 6.093 -16.501 -2.399 1.00 0.00 C ATOM 384 C GLN A 30 7.298 -15.716 -2.916 1.00 0.00 C ATOM 385 O GLN A 30 7.184 -14.900 -3.830 1.00 0.00 O ATOM 386 CB GLN A 30 5.836 -17.670 -3.356 1.00 0.00 C ATOM 387 CG GLN A 30 5.406 -18.922 -2.587 1.00 0.00 C ATOM 388 CD GLN A 30 4.471 -19.754 -3.454 1.00 0.00 C ATOM 389 OE1 GLN A 30 4.727 -20.934 -3.694 1.00 0.00 O ATOM 390 NE2 GLN A 30 3.393 -19.202 -3.943 1.00 0.00 N ATOM 0 H GLN A 30 4.824 -14.936 -3.007 1.00 0.00 H new ATOM 0 HA GLN A 30 6.322 -16.848 -1.391 1.00 0.00 H new ATOM 0 HB2 GLN A 30 5.062 -17.395 -4.073 1.00 0.00 H new ATOM 0 HB3 GLN A 30 6.739 -17.882 -3.928 1.00 0.00 H new ATOM 0 HG2 GLN A 30 6.281 -19.510 -2.309 1.00 0.00 H new ATOM 0 HG3 GLN A 30 4.905 -18.639 -1.661 1.00 0.00 H new ATOM 0 HE21 GLN A 30 3.185 -18.224 -3.742 1.00 0.00 H new ATOM 0 HE22 GLN A 30 2.760 -19.749 -4.526 1.00 0.00 H new ATOM 399 N PHE A 31 8.460 -16.014 -2.342 1.00 0.00 N ATOM 400 CA PHE A 31 9.711 -15.387 -2.751 1.00 0.00 C ATOM 401 C PHE A 31 10.194 -16.042 -4.041 1.00 0.00 C ATOM 402 O PHE A 31 10.870 -17.070 -4.006 1.00 0.00 O ATOM 403 CB PHE A 31 10.766 -15.591 -1.654 1.00 0.00 C ATOM 404 CG PHE A 31 12.147 -15.582 -2.263 1.00 0.00 C ATOM 405 CD1 PHE A 31 12.491 -14.590 -3.182 1.00 0.00 C ATOM 406 CD2 PHE A 31 13.080 -16.562 -1.905 1.00 0.00 C ATOM 407 CE1 PHE A 31 13.772 -14.571 -3.748 1.00 0.00 C ATOM 408 CE2 PHE A 31 14.362 -16.547 -2.470 1.00 0.00 C ATOM 409 CZ PHE A 31 14.708 -15.551 -3.392 1.00 0.00 C ATOM 0 H PHE A 31 8.560 -16.692 -1.586 1.00 0.00 H new ATOM 0 HA PHE A 31 9.554 -14.320 -2.911 1.00 0.00 H new ATOM 0 HB2 PHE A 31 10.683 -14.802 -0.906 1.00 0.00 H new ATOM 0 HB3 PHE A 31 10.591 -16.536 -1.140 1.00 0.00 H new ATOM 0 HD1 PHE A 31 11.769 -13.836 -3.457 1.00 0.00 H new ATOM 0 HD2 PHE A 31 12.812 -17.329 -1.194 1.00 0.00 H new ATOM 0 HE1 PHE A 31 14.038 -13.802 -4.458 1.00 0.00 H new ATOM 0 HE2 PHE A 31 15.083 -17.303 -2.195 1.00 0.00 H new ATOM 0 HZ PHE A 31 15.696 -15.538 -3.828 1.00 0.00 H new ATOM 538 N GLU A 40 7.349 -0.625 -14.855 1.00 0.00 N ATOM 539 CA GLU A 40 6.112 0.123 -14.768 1.00 0.00 C ATOM 540 C GLU A 40 4.958 -0.747 -15.209 1.00 0.00 C ATOM 541 O GLU A 40 4.942 -1.240 -16.337 1.00 0.00 O ATOM 542 CB GLU A 40 6.184 1.341 -15.665 1.00 0.00 C ATOM 543 CG GLU A 40 7.251 1.124 -16.741 1.00 0.00 C ATOM 544 CD GLU A 40 7.101 2.167 -17.842 1.00 0.00 C ATOM 545 OE1 GLU A 40 7.573 3.275 -17.649 1.00 0.00 O ATOM 546 OE2 GLU A 40 6.518 1.843 -18.863 1.00 0.00 O ATOM 0 HA GLU A 40 5.961 0.438 -13.735 1.00 0.00 H new ATOM 0 HB2 GLU A 40 5.215 1.520 -16.131 1.00 0.00 H new ATOM 0 HB3 GLU A 40 6.423 2.226 -15.075 1.00 0.00 H new ATOM 0 HG2 GLU A 40 8.245 1.191 -16.298 1.00 0.00 H new ATOM 0 HG3 GLU A 40 7.157 0.123 -17.162 1.00 0.00 H new ATOM 553 N ASN A 41 3.999 -0.957 -14.316 1.00 0.00 N ATOM 554 CA ASN A 41 2.869 -1.810 -14.665 1.00 0.00 C ATOM 555 C ASN A 41 1.934 -2.070 -13.492 1.00 0.00 C ATOM 556 O ASN A 41 2.209 -1.688 -12.353 1.00 0.00 O ATOM 557 CB ASN A 41 3.400 -3.148 -15.138 1.00 0.00 C ATOM 558 CG ASN A 41 3.306 -3.255 -16.657 1.00 0.00 C ATOM 559 OD1 ASN A 41 2.279 -2.912 -17.242 1.00 0.00 O ATOM 560 ND2 ASN A 41 4.323 -3.714 -17.333 1.00 0.00 N ATOM 0 H ASN A 41 3.978 -0.564 -13.375 1.00 0.00 H new ATOM 0 HA ASN A 41 2.303 -1.291 -15.438 1.00 0.00 H new ATOM 0 HB2 ASN A 41 4.437 -3.266 -14.823 1.00 0.00 H new ATOM 0 HB3 ASN A 41 2.832 -3.955 -14.675 1.00 0.00 H new ATOM 0 HD21 ASN A 41 4.268 -3.789 -18.349 1.00 0.00 H new ATOM 0 HD22 ASN A 41 5.173 -3.998 -16.846 1.00 0.00 H new ATOM 567 N THR A 42 0.828 -2.750 -13.805 1.00 0.00 N ATOM 568 CA THR A 42 -0.176 -3.100 -12.811 1.00 0.00 C ATOM 569 C THR A 42 -0.170 -4.604 -12.520 1.00 0.00 C ATOM 570 O THR A 42 0.086 -5.421 -13.406 1.00 0.00 O ATOM 571 CB THR A 42 -1.562 -2.698 -13.318 1.00 0.00 C ATOM 572 OG1 THR A 42 -1.427 -1.932 -14.506 1.00 0.00 O ATOM 573 CG2 THR A 42 -2.271 -1.868 -12.252 1.00 0.00 C ATOM 0 H THR A 42 0.609 -3.069 -14.749 1.00 0.00 H new ATOM 0 HA THR A 42 0.061 -2.566 -11.891 1.00 0.00 H new ATOM 0 HB THR A 42 -2.147 -3.593 -13.529 1.00 0.00 H new ATOM 0 HG1 THR A 42 -2.315 -1.675 -14.832 1.00 0.00 H new ATOM 0 HG21 THR A 42 -3.259 -1.581 -12.612 1.00 0.00 H new ATOM 0 HG22 THR A 42 -2.374 -2.457 -11.341 1.00 0.00 H new ATOM 0 HG23 THR A 42 -1.687 -0.972 -12.041 1.00 0.00 H new ATOM 581 N PHE A 43 -0.482 -4.954 -11.274 1.00 0.00 N ATOM 582 CA PHE A 43 -0.544 -6.348 -10.843 1.00 0.00 C ATOM 583 C PHE A 43 -1.926 -6.649 -10.313 1.00 0.00 C ATOM 584 O PHE A 43 -2.760 -5.752 -10.218 1.00 0.00 O ATOM 585 CB PHE A 43 0.481 -6.618 -9.744 1.00 0.00 C ATOM 586 CG PHE A 43 1.653 -7.393 -10.297 1.00 0.00 C ATOM 587 CD1 PHE A 43 2.234 -7.030 -11.517 1.00 0.00 C ATOM 588 CD2 PHE A 43 2.156 -8.481 -9.581 1.00 0.00 C ATOM 589 CE1 PHE A 43 3.320 -7.758 -12.020 1.00 0.00 C ATOM 590 CE2 PHE A 43 3.241 -9.210 -10.081 1.00 0.00 C ATOM 591 CZ PHE A 43 3.823 -8.849 -11.301 1.00 0.00 C ATOM 0 H PHE A 43 -0.698 -4.282 -10.538 1.00 0.00 H new ATOM 0 HA PHE A 43 -0.322 -6.986 -11.698 1.00 0.00 H new ATOM 0 HB2 PHE A 43 0.827 -5.675 -9.321 1.00 0.00 H new ATOM 0 HB3 PHE A 43 0.016 -7.179 -8.934 1.00 0.00 H new ATOM 0 HD1 PHE A 43 1.845 -6.188 -12.071 1.00 0.00 H new ATOM 0 HD2 PHE A 43 1.707 -8.761 -8.639 1.00 0.00 H new ATOM 0 HE1 PHE A 43 3.769 -7.478 -12.962 1.00 0.00 H new ATOM 0 HE2 PHE A 43 3.629 -10.051 -9.525 1.00 0.00 H new ATOM 0 HZ PHE A 43 4.660 -9.412 -11.688 1.00 0.00 H new ATOM 601 N THR A 44 -2.180 -7.912 -9.998 1.00 0.00 N ATOM 602 CA THR A 44 -3.482 -8.291 -9.515 1.00 0.00 C ATOM 603 C THR A 44 -3.447 -9.470 -8.551 1.00 0.00 C ATOM 604 O THR A 44 -2.487 -10.238 -8.511 1.00 0.00 O ATOM 605 CB THR A 44 -4.353 -8.650 -10.711 1.00 0.00 C ATOM 606 OG1 THR A 44 -3.610 -8.475 -11.909 1.00 0.00 O ATOM 607 CG2 THR A 44 -5.578 -7.762 -10.736 1.00 0.00 C ATOM 0 H THR A 44 -1.507 -8.675 -10.070 1.00 0.00 H new ATOM 0 HA THR A 44 -3.885 -7.444 -8.961 1.00 0.00 H new ATOM 0 HB THR A 44 -4.667 -9.691 -10.629 1.00 0.00 H new ATOM 0 HG1 THR A 44 -4.170 -8.708 -12.678 1.00 0.00 H new ATOM 0 HG21 THR A 44 -6.199 -8.022 -11.593 1.00 0.00 H new ATOM 0 HG22 THR A 44 -6.149 -7.904 -9.818 1.00 0.00 H new ATOM 0 HG23 THR A 44 -5.270 -6.719 -10.814 1.00 0.00 H new ATOM 615 N LYS A 45 -4.533 -9.605 -7.784 1.00 0.00 N ATOM 616 CA LYS A 45 -4.659 -10.691 -6.824 1.00 0.00 C ATOM 617 C LYS A 45 -6.116 -10.876 -6.398 1.00 0.00 C ATOM 618 O LYS A 45 -6.684 -10.028 -5.711 1.00 0.00 O ATOM 619 CB LYS A 45 -3.806 -10.412 -5.587 1.00 0.00 C ATOM 620 CG LYS A 45 -3.517 -11.734 -4.867 1.00 0.00 C ATOM 621 CD LYS A 45 -3.258 -11.472 -3.382 1.00 0.00 C ATOM 622 CE LYS A 45 -3.044 -12.803 -2.658 1.00 0.00 C ATOM 623 NZ LYS A 45 -1.653 -12.865 -2.128 1.00 0.00 N ATOM 0 H LYS A 45 -5.333 -8.973 -7.814 1.00 0.00 H new ATOM 0 HA LYS A 45 -4.311 -11.604 -7.308 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -2.872 -9.929 -5.875 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -4.326 -9.726 -4.919 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -4.361 -12.414 -4.984 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -2.651 -12.221 -5.316 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -2.381 -10.836 -3.262 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -4.102 -10.939 -2.943 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -3.760 -12.904 -1.842 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -3.221 -13.633 -3.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -1.563 -13.676 -1.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -0.985 -12.975 -2.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -1.438 -11.987 -1.613 1.00 0.00 H new ATOM 637 N LEU A 46 -6.713 -11.987 -6.822 1.00 0.00 N ATOM 638 CA LEU A 46 -8.102 -12.278 -6.497 1.00 0.00 C ATOM 639 C LEU A 46 -8.190 -13.392 -5.453 1.00 0.00 C ATOM 640 O LEU A 46 -7.736 -14.512 -5.690 1.00 0.00 O ATOM 641 CB LEU A 46 -8.845 -12.733 -7.755 1.00 0.00 C ATOM 642 CG LEU A 46 -9.085 -11.545 -8.695 1.00 0.00 C ATOM 643 CD1 LEU A 46 -7.805 -11.204 -9.454 1.00 0.00 C ATOM 644 CD2 LEU A 46 -10.183 -11.902 -9.698 1.00 0.00 C ATOM 0 H LEU A 46 -6.255 -12.699 -7.391 1.00 0.00 H new ATOM 0 HA LEU A 46 -8.554 -11.370 -6.098 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -8.266 -13.500 -8.269 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -9.798 -13.184 -7.479 1.00 0.00 H new ATOM 0 HG LEU A 46 -9.389 -10.683 -8.102 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -7.990 -10.359 -10.118 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -7.020 -10.943 -8.744 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -7.491 -12.066 -10.043 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -10.354 -11.058 -10.366 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -9.875 -12.770 -10.281 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -11.104 -12.133 -9.163 1.00 0.00 H new ATOM 656 N ILE A 47 -8.785 -13.082 -4.301 1.00 0.00 N ATOM 657 CA ILE A 47 -8.936 -14.070 -3.231 1.00 0.00 C ATOM 658 C ILE A 47 -10.217 -13.816 -2.440 1.00 0.00 C ATOM 659 O ILE A 47 -10.828 -12.753 -2.556 1.00 0.00 O ATOM 660 CB ILE A 47 -7.731 -14.030 -2.283 1.00 0.00 C ATOM 661 CG1 ILE A 47 -7.760 -12.745 -1.449 1.00 0.00 C ATOM 662 CG2 ILE A 47 -6.432 -14.079 -3.090 1.00 0.00 C ATOM 663 CD1 ILE A 47 -8.242 -13.068 -0.031 1.00 0.00 C ATOM 0 H ILE A 47 -9.168 -12.162 -4.085 1.00 0.00 H new ATOM 0 HA ILE A 47 -8.993 -15.056 -3.692 1.00 0.00 H new ATOM 0 HB ILE A 47 -7.780 -14.893 -1.619 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -6.766 -12.299 -1.414 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -8.422 -12.013 -1.912 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -5.580 -14.050 -2.410 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -6.400 -15.000 -3.673 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -6.389 -13.222 -3.762 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -8.263 -12.154 0.563 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -9.244 -13.495 -0.076 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -7.562 -13.785 0.430 1.00 0.00 H new ATOM 675 N THR A 48 -10.615 -14.799 -1.636 1.00 0.00 N ATOM 676 CA THR A 48 -11.826 -14.677 -0.826 1.00 0.00 C ATOM 677 C THR A 48 -11.490 -14.584 0.661 1.00 0.00 C ATOM 678 O THR A 48 -10.792 -15.441 1.203 1.00 0.00 O ATOM 679 CB THR A 48 -12.733 -15.882 -1.064 1.00 0.00 C ATOM 680 OG1 THR A 48 -12.828 -16.135 -2.459 1.00 0.00 O ATOM 681 CG2 THR A 48 -14.124 -15.598 -0.497 1.00 0.00 C ATOM 0 H THR A 48 -10.120 -15.684 -1.528 1.00 0.00 H new ATOM 0 HA THR A 48 -12.338 -13.762 -1.123 1.00 0.00 H new ATOM 0 HB THR A 48 -12.313 -16.756 -0.565 1.00 0.00 H new ATOM 0 HG1 THR A 48 -13.409 -16.909 -2.612 1.00 0.00 H new ATOM 0 HG21 THR A 48 -14.770 -16.459 -0.668 1.00 0.00 H new ATOM 0 HG22 THR A 48 -14.049 -15.408 0.574 1.00 0.00 H new ATOM 0 HG23 THR A 48 -14.547 -14.724 -0.992 1.00 0.00 H new ATOM 689 N VAL A 49 -12.000 -13.538 1.314 1.00 0.00 N ATOM 690 CA VAL A 49 -11.764 -13.336 2.739 1.00 0.00 C ATOM 691 C VAL A 49 -13.097 -13.275 3.478 1.00 0.00 C ATOM 692 O VAL A 49 -14.041 -12.633 3.023 1.00 0.00 O ATOM 693 CB VAL A 49 -10.984 -12.038 2.954 1.00 0.00 C ATOM 694 CG1 VAL A 49 -11.825 -10.849 2.487 1.00 0.00 C ATOM 695 CG2 VAL A 49 -10.649 -11.879 4.440 1.00 0.00 C ATOM 0 H VAL A 49 -12.578 -12.820 0.877 1.00 0.00 H new ATOM 0 HA VAL A 49 -11.180 -14.169 3.130 1.00 0.00 H new ATOM 0 HB VAL A 49 -10.060 -12.074 2.378 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -11.267 -9.926 2.641 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -12.056 -10.961 1.428 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -12.752 -10.812 3.059 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -10.093 -10.954 4.591 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -11.572 -11.847 5.020 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -10.043 -12.724 4.769 1.00 0.00 H new ATOM 705 N ASN A 50 -13.176 -13.956 4.614 1.00 0.00 N ATOM 706 CA ASN A 50 -14.411 -13.973 5.386 1.00 0.00 C ATOM 707 C ASN A 50 -15.527 -14.607 4.563 1.00 0.00 C ATOM 708 O ASN A 50 -16.681 -14.659 4.991 1.00 0.00 O ATOM 709 CB ASN A 50 -14.808 -12.545 5.770 1.00 0.00 C ATOM 710 CG ASN A 50 -15.747 -12.570 6.972 1.00 0.00 C ATOM 711 OD1 ASN A 50 -16.080 -13.640 7.480 1.00 0.00 O ATOM 712 ND2 ASN A 50 -16.199 -11.446 7.458 1.00 0.00 N ATOM 0 H ASN A 50 -12.411 -14.497 5.017 1.00 0.00 H new ATOM 0 HA ASN A 50 -14.252 -14.558 6.292 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -13.918 -11.962 6.006 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -15.296 -12.055 4.927 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -16.829 -11.454 8.260 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -15.922 -10.560 7.036 1.00 0.00 H new ATOM 719 N GLY A 51 -15.169 -15.086 3.373 1.00 0.00 N ATOM 720 CA GLY A 51 -16.137 -15.715 2.481 1.00 0.00 C ATOM 721 C GLY A 51 -16.545 -14.759 1.369 1.00 0.00 C ATOM 722 O GLY A 51 -17.145 -15.167 0.374 1.00 0.00 O ATOM 0 H GLY A 51 -14.218 -15.050 3.006 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -15.708 -16.620 2.050 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -17.017 -16.018 3.048 1.00 0.00 H new ATOM 726 N GLN A 52 -16.201 -13.488 1.537 1.00 0.00 N ATOM 727 CA GLN A 52 -16.521 -12.483 0.534 1.00 0.00 C ATOM 728 C GLN A 52 -15.364 -12.361 -0.445 1.00 0.00 C ATOM 729 O GLN A 52 -14.201 -12.451 -0.052 1.00 0.00 O ATOM 730 CB GLN A 52 -16.790 -11.137 1.212 1.00 0.00 C ATOM 731 CG GLN A 52 -16.868 -10.020 0.165 1.00 0.00 C ATOM 732 CD GLN A 52 -17.812 -10.419 -0.965 1.00 0.00 C ATOM 733 OE1 GLN A 52 -17.387 -10.391 -2.198 1.00 0.00 O flip ATOM 734 NE2 GLN A 52 -18.967 -10.765 -0.716 1.00 0.00 N flip ATOM 0 H GLN A 52 -15.704 -13.131 2.353 1.00 0.00 H new ATOM 0 HA GLN A 52 -17.417 -12.782 -0.009 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -17.723 -11.185 1.773 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -15.998 -10.918 1.929 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -17.217 -9.099 0.631 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -15.875 -9.818 -0.236 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -19.296 -10.786 0.249 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -19.595 -11.031 -1.475 1.00 0.00 H new ATOM 743 N GLU A 53 -15.676 -12.176 -1.721 1.00 0.00 N ATOM 744 CA GLU A 53 -14.641 -12.070 -2.728 1.00 0.00 C ATOM 745 C GLU A 53 -13.974 -10.705 -2.690 1.00 0.00 C ATOM 746 O GLU A 53 -14.606 -9.689 -2.393 1.00 0.00 O ATOM 747 CB GLU A 53 -15.247 -12.310 -4.095 1.00 0.00 C ATOM 748 CG GLU A 53 -14.744 -13.641 -4.646 1.00 0.00 C ATOM 749 CD GLU A 53 -15.419 -13.944 -5.980 1.00 0.00 C ATOM 750 OE1 GLU A 53 -16.608 -13.697 -6.088 1.00 0.00 O ATOM 751 OE2 GLU A 53 -14.735 -14.417 -6.873 1.00 0.00 O ATOM 0 H GLU A 53 -16.629 -12.097 -2.076 1.00 0.00 H new ATOM 0 HA GLU A 53 -13.879 -12.822 -2.523 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -16.335 -12.320 -4.026 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -14.978 -11.499 -4.772 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -13.663 -13.604 -4.777 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -14.952 -14.440 -3.934 1.00 0.00 H new ATOM 758 N TYR A 54 -12.688 -10.704 -2.992 1.00 0.00 N ATOM 759 CA TYR A 54 -11.899 -9.477 -2.998 1.00 0.00 C ATOM 760 C TYR A 54 -10.957 -9.464 -4.198 1.00 0.00 C ATOM 761 O TYR A 54 -10.152 -10.378 -4.376 1.00 0.00 O ATOM 762 CB TYR A 54 -11.073 -9.374 -1.714 1.00 0.00 C ATOM 763 CG TYR A 54 -11.866 -8.667 -0.641 1.00 0.00 C ATOM 764 CD1 TYR A 54 -12.902 -9.339 0.004 1.00 0.00 C ATOM 765 CD2 TYR A 54 -11.563 -7.345 -0.291 1.00 0.00 C ATOM 766 CE1 TYR A 54 -13.642 -8.696 1.003 1.00 0.00 C ATOM 767 CE2 TYR A 54 -12.302 -6.700 0.707 1.00 0.00 C ATOM 768 CZ TYR A 54 -13.343 -7.375 1.354 1.00 0.00 C ATOM 769 OH TYR A 54 -14.072 -6.740 2.338 1.00 0.00 O ATOM 0 H TYR A 54 -12.162 -11.542 -3.238 1.00 0.00 H new ATOM 0 HA TYR A 54 -12.582 -8.630 -3.061 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -10.792 -10.370 -1.372 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -10.148 -8.832 -1.910 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -13.135 -10.358 -0.267 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -10.760 -6.824 -0.791 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -14.444 -9.219 1.503 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -12.069 -5.681 0.978 1.00 0.00 H new ATOM 0 HH TYR A 54 -13.703 -5.845 2.492 1.00 0.00 H new ATOM 779 N HIS A 55 -11.065 -8.425 -5.018 1.00 0.00 N ATOM 780 CA HIS A 55 -10.230 -8.293 -6.200 1.00 0.00 C ATOM 781 C HIS A 55 -9.369 -7.042 -6.081 1.00 0.00 C ATOM 782 O HIS A 55 -9.896 -5.930 -6.072 1.00 0.00 O ATOM 783 CB HIS A 55 -11.130 -8.162 -7.427 1.00 0.00 C ATOM 784 CG HIS A 55 -11.885 -9.445 -7.649 1.00 0.00 C ATOM 785 ND1 HIS A 55 -11.838 -10.495 -6.745 1.00 0.00 N ATOM 786 CD2 HIS A 55 -12.725 -9.852 -8.655 1.00 0.00 C ATOM 787 CE1 HIS A 55 -12.630 -11.473 -7.221 1.00 0.00 C ATOM 788 NE2 HIS A 55 -13.195 -11.133 -8.382 1.00 0.00 N ATOM 0 H HIS A 55 -11.726 -7.660 -4.883 1.00 0.00 H new ATOM 0 HA HIS A 55 -9.588 -9.169 -6.295 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -11.830 -7.338 -7.289 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -10.529 -7.927 -8.306 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -12.982 -9.267 -9.526 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -12.789 -12.419 -6.724 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -13.834 -11.692 -8.947 1.00 0.00 H new ATOM 797 N LEU A 56 -8.047 -7.223 -5.978 1.00 0.00 N ATOM 798 CA LEU A 56 -7.148 -6.077 -5.845 1.00 0.00 C ATOM 799 C LEU A 56 -6.157 -5.981 -6.997 1.00 0.00 C ATOM 800 O LEU A 56 -5.659 -6.983 -7.503 1.00 0.00 O ATOM 801 CB LEU A 56 -6.364 -6.146 -4.539 1.00 0.00 C ATOM 802 CG LEU A 56 -7.169 -5.515 -3.401 1.00 0.00 C ATOM 803 CD1 LEU A 56 -8.494 -6.250 -3.246 1.00 0.00 C ATOM 804 CD2 LEU A 56 -6.377 -5.613 -2.093 1.00 0.00 C ATOM 0 H LEU A 56 -7.586 -8.133 -5.984 1.00 0.00 H new ATOM 0 HA LEU A 56 -7.784 -5.192 -5.855 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -6.135 -7.184 -4.299 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -5.412 -5.627 -4.651 1.00 0.00 H new ATOM 0 HG LEU A 56 -7.358 -4.467 -3.632 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -9.067 -5.800 -2.435 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -9.061 -6.178 -4.174 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -8.304 -7.299 -3.017 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -6.953 -5.163 -1.284 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -6.185 -6.661 -1.862 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.429 -5.085 -2.201 1.00 0.00 H new ATOM 816 N GLN A 57 -5.871 -4.743 -7.367 1.00 0.00 N ATOM 817 CA GLN A 57 -4.921 -4.441 -8.438 1.00 0.00 C ATOM 818 C GLN A 57 -3.972 -3.328 -7.999 1.00 0.00 C ATOM 819 O GLN A 57 -4.418 -2.267 -7.600 1.00 0.00 O ATOM 820 CB GLN A 57 -5.672 -4.016 -9.702 1.00 0.00 C ATOM 821 CG GLN A 57 -7.105 -4.553 -9.653 1.00 0.00 C ATOM 822 CD GLN A 57 -7.789 -4.341 -11.000 1.00 0.00 C ATOM 823 OE1 GLN A 57 -9.021 -3.913 -11.036 1.00 0.00 O flip ATOM 824 NE2 GLN A 57 -7.185 -4.573 -12.047 1.00 0.00 N flip ATOM 0 H GLN A 57 -6.287 -3.917 -6.937 1.00 0.00 H new ATOM 0 HA GLN A 57 -4.340 -5.337 -8.655 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -5.683 -2.929 -9.783 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -5.160 -4.396 -10.586 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -7.096 -5.614 -9.404 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -7.665 -4.046 -8.868 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -6.222 -4.908 -12.017 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -7.648 -4.431 -12.945 1.00 0.00 H new ATOM 833 N LEU A 58 -2.662 -3.571 -8.050 1.00 0.00 N ATOM 834 CA LEU A 58 -1.712 -2.563 -7.608 1.00 0.00 C ATOM 835 C LEU A 58 -0.810 -2.102 -8.716 1.00 0.00 C ATOM 836 O LEU A 58 -0.605 -2.804 -9.697 1.00 0.00 O ATOM 837 CB LEU A 58 -0.863 -3.064 -6.434 1.00 0.00 C ATOM 838 CG LEU A 58 -1.549 -4.218 -5.703 1.00 0.00 C ATOM 839 CD1 LEU A 58 -2.929 -3.783 -5.212 1.00 0.00 C ATOM 840 CD2 LEU A 58 -1.659 -5.468 -6.595 1.00 0.00 C ATOM 0 H LEU A 58 -2.246 -4.439 -8.386 1.00 0.00 H new ATOM 0 HA LEU A 58 -2.310 -1.713 -7.279 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.110 -3.390 -6.800 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -0.683 -2.245 -5.737 1.00 0.00 H new ATOM 0 HG LEU A 58 -0.935 -4.484 -4.843 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -3.409 -4.613 -4.693 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -2.823 -2.940 -4.529 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -3.541 -3.485 -6.063 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.152 -6.268 -6.042 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.242 -5.230 -7.485 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -0.661 -5.793 -6.891 1.00 0.00 H new ATOM 852 N VAL A 59 -0.303 -0.885 -8.558 1.00 0.00 N ATOM 853 CA VAL A 59 0.554 -0.306 -9.587 1.00 0.00 C ATOM 854 C VAL A 59 1.830 0.322 -9.039 1.00 0.00 C ATOM 855 O VAL A 59 1.846 0.928 -7.972 1.00 0.00 O ATOM 856 CB VAL A 59 -0.236 0.760 -10.359 1.00 0.00 C ATOM 857 CG1 VAL A 59 -0.038 2.134 -9.712 1.00 0.00 C ATOM 858 CG2 VAL A 59 0.238 0.820 -11.820 1.00 0.00 C ATOM 0 H VAL A 59 -0.465 -0.290 -7.746 1.00 0.00 H new ATOM 0 HA VAL A 59 0.860 -1.126 -10.236 1.00 0.00 H new ATOM 0 HB VAL A 59 -1.292 0.492 -10.331 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -0.603 2.883 -10.268 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -0.391 2.105 -8.681 1.00 0.00 H new ATOM 0 HG13 VAL A 59 1.021 2.394 -9.726 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -0.331 1.580 -12.356 1.00 0.00 H new ATOM 0 HG22 VAL A 59 1.298 1.072 -11.849 1.00 0.00 H new ATOM 0 HG23 VAL A 59 0.083 -0.150 -12.293 1.00 0.00 H new ATOM 868 N ASP A 60 2.892 0.188 -9.828 1.00 0.00 N ATOM 869 CA ASP A 60 4.190 0.757 -9.483 1.00 0.00 C ATOM 870 C ASP A 60 4.627 1.712 -10.592 1.00 0.00 C ATOM 871 O ASP A 60 4.671 1.317 -11.775 1.00 0.00 O ATOM 872 CB ASP A 60 5.231 -0.354 -9.322 1.00 0.00 C ATOM 873 CG ASP A 60 5.882 -0.271 -7.944 1.00 0.00 C ATOM 874 OD1 ASP A 60 6.199 0.831 -7.525 1.00 0.00 O ATOM 875 OD2 ASP A 60 6.059 -1.310 -7.332 1.00 0.00 O ATOM 0 H ASP A 60 2.878 -0.313 -10.716 1.00 0.00 H new ATOM 0 HA ASP A 60 4.106 1.297 -8.540 1.00 0.00 H new ATOM 0 HB2 ASP A 60 4.758 -1.327 -9.450 1.00 0.00 H new ATOM 0 HB3 ASP A 60 5.992 -0.265 -10.098 1.00 0.00 H new ATOM 880 N THR A 61 4.924 2.970 -10.215 1.00 0.00 N ATOM 881 CA THR A 61 5.333 3.976 -11.192 1.00 0.00 C ATOM 882 C THR A 61 4.356 4.018 -12.345 1.00 0.00 C ATOM 883 O THR A 61 3.199 4.395 -12.194 1.00 0.00 O ATOM 884 CB THR A 61 6.719 3.671 -11.755 1.00 0.00 C ATOM 885 OG1 THR A 61 6.758 2.328 -12.216 1.00 0.00 O ATOM 886 CG2 THR A 61 7.780 3.874 -10.679 1.00 0.00 C ATOM 0 H THR A 61 4.887 3.303 -9.252 1.00 0.00 H new ATOM 0 HA THR A 61 5.354 4.936 -10.676 1.00 0.00 H new ATOM 0 HB THR A 61 6.923 4.348 -12.584 1.00 0.00 H new ATOM 0 HG1 THR A 61 5.859 2.050 -12.489 1.00 0.00 H new ATOM 0 HG21 THR A 61 8.764 3.653 -11.092 1.00 0.00 H new ATOM 0 HG22 THR A 61 7.755 4.907 -10.334 1.00 0.00 H new ATOM 0 HG23 THR A 61 7.581 3.206 -9.841 1.00 0.00 H new ATOM 1134 N ILE A 78 -8.495 4.000 -9.174 1.00 0.00 N ATOM 1135 CA ILE A 78 -8.198 3.134 -8.080 1.00 0.00 C ATOM 1136 C ILE A 78 -9.064 3.417 -6.875 1.00 0.00 C ATOM 1137 O ILE A 78 -9.891 4.329 -6.882 1.00 0.00 O ATOM 1138 CB ILE A 78 -6.765 3.346 -7.735 1.00 0.00 C ATOM 1139 CG1 ILE A 78 -6.524 4.755 -7.198 1.00 0.00 C ATOM 1140 CG2 ILE A 78 -5.918 3.128 -8.983 1.00 0.00 C ATOM 1141 CD1 ILE A 78 -5.068 4.831 -6.825 1.00 0.00 C ATOM 0 HA ILE A 78 -8.397 2.102 -8.369 1.00 0.00 H new ATOM 0 HB ILE A 78 -6.488 2.636 -6.956 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -6.770 5.504 -7.951 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -7.156 4.953 -6.333 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -4.866 3.281 -8.740 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -6.062 2.111 -9.347 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -6.219 3.836 -9.755 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -4.844 5.823 -6.434 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -4.848 4.083 -6.064 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.456 4.642 -7.707 1.00 0.00 H new ATOM 1153 N ASN A 79 -8.853 2.634 -5.832 1.00 0.00 N ATOM 1154 CA ASN A 79 -9.606 2.814 -4.606 1.00 0.00 C ATOM 1155 C ASN A 79 -8.777 2.305 -3.447 1.00 0.00 C ATOM 1156 O ASN A 79 -9.300 1.866 -2.429 1.00 0.00 O ATOM 1157 CB ASN A 79 -10.945 2.075 -4.688 1.00 0.00 C ATOM 1158 CG ASN A 79 -12.026 3.013 -5.217 1.00 0.00 C ATOM 1159 OD1 ASN A 79 -12.754 2.661 -6.144 1.00 0.00 O ATOM 1160 ND2 ASN A 79 -12.174 4.194 -4.681 1.00 0.00 N ATOM 0 H ASN A 79 -8.173 1.874 -5.810 1.00 0.00 H new ATOM 0 HA ASN A 79 -9.822 3.872 -4.457 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -10.852 1.208 -5.342 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -11.225 1.702 -3.703 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -12.894 4.826 -5.031 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -11.570 4.485 -3.912 1.00 0.00 H new ATOM 1167 N GLY A 80 -7.466 2.346 -3.635 1.00 0.00 N ATOM 1168 CA GLY A 80 -6.547 1.872 -2.615 1.00 0.00 C ATOM 1169 C GLY A 80 -5.216 2.598 -2.665 1.00 0.00 C ATOM 1170 O GLY A 80 -4.872 3.242 -3.656 1.00 0.00 O ATOM 0 H GLY A 80 -7.018 2.701 -4.480 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -6.997 2.007 -1.631 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -6.381 0.803 -2.745 1.00 0.00 H new ATOM 1174 N TYR A 81 -4.458 2.445 -1.594 1.00 0.00 N ATOM 1175 CA TYR A 81 -3.140 3.045 -1.513 1.00 0.00 C ATOM 1176 C TYR A 81 -2.213 2.241 -0.602 1.00 0.00 C ATOM 1177 O TYR A 81 -2.533 2.012 0.565 1.00 0.00 O ATOM 1178 CB TYR A 81 -3.230 4.482 -0.998 1.00 0.00 C ATOM 1179 CG TYR A 81 -2.535 5.432 -1.949 1.00 0.00 C ATOM 1180 CD1 TYR A 81 -1.274 5.118 -2.474 1.00 0.00 C ATOM 1181 CD2 TYR A 81 -3.153 6.640 -2.300 1.00 0.00 C ATOM 1182 CE1 TYR A 81 -0.639 5.997 -3.338 1.00 0.00 C ATOM 1183 CE2 TYR A 81 -2.511 7.525 -3.173 1.00 0.00 C ATOM 1184 CZ TYR A 81 -1.252 7.204 -3.693 1.00 0.00 C ATOM 1185 OH TYR A 81 -0.615 8.077 -4.554 1.00 0.00 O ATOM 0 H TYR A 81 -4.733 1.911 -0.770 1.00 0.00 H new ATOM 0 HA TYR A 81 -2.725 3.045 -2.521 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -4.275 4.770 -0.887 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -2.774 4.549 -0.010 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -0.795 4.188 -2.205 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -4.124 6.887 -1.897 1.00 0.00 H new ATOM 0 HE1 TYR A 81 0.333 5.749 -3.739 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -2.987 8.455 -3.445 1.00 0.00 H new ATOM 0 HH TYR A 81 -1.179 8.866 -4.696 1.00 0.00 H new ATOM 1195 N ILE A 82 -1.064 1.837 -1.124 1.00 0.00 N ATOM 1196 CA ILE A 82 -0.097 1.087 -0.331 1.00 0.00 C ATOM 1197 C ILE A 82 1.294 1.679 -0.523 1.00 0.00 C ATOM 1198 O ILE A 82 1.928 1.497 -1.552 1.00 0.00 O ATOM 1199 CB ILE A 82 -0.116 -0.376 -0.756 1.00 0.00 C ATOM 1200 CG1 ILE A 82 0.949 -1.164 0.004 1.00 0.00 C ATOM 1201 CG2 ILE A 82 0.174 -0.444 -2.244 1.00 0.00 C ATOM 1202 CD1 ILE A 82 0.794 -2.643 -0.332 1.00 0.00 C ATOM 0 H ILE A 82 -0.778 2.014 -2.087 1.00 0.00 H new ATOM 0 HA ILE A 82 -0.361 1.151 0.725 1.00 0.00 H new ATOM 0 HB ILE A 82 -1.092 -0.809 -0.535 1.00 0.00 H new ATOM 0 HG12 ILE A 82 1.945 -0.816 -0.271 1.00 0.00 H new ATOM 0 HG13 ILE A 82 0.842 -1.007 1.077 1.00 0.00 H new ATOM 0 HG21 ILE A 82 0.165 -1.484 -2.569 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -0.588 0.113 -2.789 1.00 0.00 H new ATOM 0 HG23 ILE A 82 1.154 -0.010 -2.444 1.00 0.00 H new ATOM 0 HD11 ILE A 82 1.549 -3.219 0.204 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -0.199 -2.981 -0.036 1.00 0.00 H new ATOM 0 HD13 ILE A 82 0.921 -2.788 -1.405 1.00 0.00 H new ATOM 1214 N LEU A 83 1.768 2.405 0.465 1.00 0.00 N ATOM 1215 CA LEU A 83 3.073 3.030 0.345 1.00 0.00 C ATOM 1216 C LEU A 83 4.154 2.191 1.008 1.00 0.00 C ATOM 1217 O LEU A 83 4.065 1.853 2.189 1.00 0.00 O ATOM 1218 CB LEU A 83 3.031 4.418 0.970 1.00 0.00 C ATOM 1219 CG LEU A 83 1.676 5.080 0.682 1.00 0.00 C ATOM 1220 CD1 LEU A 83 0.734 4.886 1.875 1.00 0.00 C ATOM 1221 CD2 LEU A 83 1.877 6.579 0.446 1.00 0.00 C ATOM 0 H LEU A 83 1.283 2.577 1.346 1.00 0.00 H new ATOM 0 HA LEU A 83 3.319 3.111 -0.714 1.00 0.00 H new ATOM 0 HB2 LEU A 83 3.189 4.347 2.046 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.838 5.031 0.569 1.00 0.00 H new ATOM 0 HG LEU A 83 1.240 4.620 -0.205 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -0.225 5.359 1.662 1.00 0.00 H new ATOM 0 HD12 LEU A 83 0.583 3.821 2.050 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.173 5.340 2.763 1.00 0.00 H new ATOM 0 HD21 LEU A 83 0.914 7.047 0.242 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.319 7.031 1.334 1.00 0.00 H new ATOM 0 HD23 LEU A 83 2.541 6.727 -0.406 1.00 0.00 H new ATOM 1233 N VAL A 84 5.180 1.859 0.227 1.00 0.00 N ATOM 1234 CA VAL A 84 6.288 1.058 0.732 1.00 0.00 C ATOM 1235 C VAL A 84 7.453 1.963 1.127 1.00 0.00 C ATOM 1236 O VAL A 84 7.829 2.868 0.386 1.00 0.00 O ATOM 1237 CB VAL A 84 6.736 0.040 -0.335 1.00 0.00 C ATOM 1238 CG1 VAL A 84 8.260 -0.136 -0.311 1.00 0.00 C ATOM 1239 CG2 VAL A 84 6.083 -1.317 -0.054 1.00 0.00 C ATOM 0 H VAL A 84 5.265 2.131 -0.752 1.00 0.00 H new ATOM 0 HA VAL A 84 5.956 0.513 1.615 1.00 0.00 H new ATOM 0 HB VAL A 84 6.433 0.413 -1.313 1.00 0.00 H new ATOM 0 HG11 VAL A 84 8.555 -0.859 -1.072 1.00 0.00 H new ATOM 0 HG12 VAL A 84 8.740 0.821 -0.514 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.569 -0.496 0.670 1.00 0.00 H new ATOM 0 HG21 VAL A 84 6.400 -2.037 -0.809 1.00 0.00 H new ATOM 0 HG22 VAL A 84 6.385 -1.669 0.932 1.00 0.00 H new ATOM 0 HG23 VAL A 84 4.998 -1.212 -0.085 1.00 0.00 H new ATOM 1249 N TYR A 85 8.015 1.711 2.305 1.00 0.00 N ATOM 1250 CA TYR A 85 9.135 2.507 2.796 1.00 0.00 C ATOM 1251 C TYR A 85 10.201 1.611 3.422 1.00 0.00 C ATOM 1252 O TYR A 85 9.891 0.586 4.021 1.00 0.00 O ATOM 1253 CB TYR A 85 8.649 3.543 3.814 1.00 0.00 C ATOM 1254 CG TYR A 85 8.123 2.860 5.054 1.00 0.00 C ATOM 1255 CD1 TYR A 85 9.013 2.374 6.018 1.00 0.00 C ATOM 1256 CD2 TYR A 85 6.742 2.729 5.247 1.00 0.00 C ATOM 1257 CE1 TYR A 85 8.523 1.755 7.174 1.00 0.00 C ATOM 1258 CE2 TYR A 85 6.253 2.111 6.405 1.00 0.00 C ATOM 1259 CZ TYR A 85 7.144 1.623 7.367 1.00 0.00 C ATOM 1260 OH TYR A 85 6.662 1.015 8.509 1.00 0.00 O ATOM 0 H TYR A 85 7.716 0.966 2.934 1.00 0.00 H new ATOM 0 HA TYR A 85 9.579 3.030 1.949 1.00 0.00 H new ATOM 0 HB2 TYR A 85 9.467 4.212 4.080 1.00 0.00 H new ATOM 0 HB3 TYR A 85 7.866 4.158 3.370 1.00 0.00 H new ATOM 0 HD1 TYR A 85 10.078 2.476 5.870 1.00 0.00 H new ATOM 0 HD2 TYR A 85 6.055 3.104 4.503 1.00 0.00 H new ATOM 0 HE1 TYR A 85 9.210 1.379 7.917 1.00 0.00 H new ATOM 0 HE2 TYR A 85 5.188 2.011 6.555 1.00 0.00 H new ATOM 0 HH TYR A 85 6.596 1.677 9.229 1.00 0.00 H new ATOM 1270 N SER A 86 11.460 2.000 3.263 1.00 0.00 N ATOM 1271 CA SER A 86 12.568 1.218 3.806 1.00 0.00 C ATOM 1272 C SER A 86 12.858 1.623 5.249 1.00 0.00 C ATOM 1273 O SER A 86 12.738 2.794 5.609 1.00 0.00 O ATOM 1274 CB SER A 86 13.816 1.444 2.959 1.00 0.00 C ATOM 1275 OG SER A 86 14.644 2.389 3.615 1.00 0.00 O ATOM 0 H SER A 86 11.740 2.846 2.766 1.00 0.00 H new ATOM 0 HA SER A 86 12.291 0.164 3.786 1.00 0.00 H new ATOM 0 HB2 SER A 86 14.352 0.505 2.818 1.00 0.00 H new ATOM 0 HB3 SER A 86 13.540 1.806 1.969 1.00 0.00 H new ATOM 0 HG SER A 86 15.459 2.531 3.089 1.00 0.00 H new ATOM 1281 N VAL A 87 13.229 0.646 6.079 1.00 0.00 N ATOM 1282 CA VAL A 87 13.519 0.920 7.481 1.00 0.00 C ATOM 1283 C VAL A 87 14.839 1.680 7.638 1.00 0.00 C ATOM 1284 O VAL A 87 15.381 1.771 8.740 1.00 0.00 O ATOM 1285 CB VAL A 87 13.590 -0.392 8.260 1.00 0.00 C ATOM 1286 CG1 VAL A 87 12.304 -1.183 8.057 1.00 0.00 C ATOM 1287 CG2 VAL A 87 14.770 -1.220 7.758 1.00 0.00 C ATOM 0 H VAL A 87 13.334 -0.331 5.805 1.00 0.00 H new ATOM 0 HA VAL A 87 12.716 1.543 7.876 1.00 0.00 H new ATOM 0 HB VAL A 87 13.718 -0.171 9.320 1.00 0.00 H new ATOM 0 HG11 VAL A 87 12.360 -2.118 8.615 1.00 0.00 H new ATOM 0 HG12 VAL A 87 11.457 -0.598 8.414 1.00 0.00 H new ATOM 0 HG13 VAL A 87 12.174 -1.400 6.997 1.00 0.00 H new ATOM 0 HG21 VAL A 87 14.820 -2.156 8.314 1.00 0.00 H new ATOM 0 HG22 VAL A 87 14.639 -1.435 6.697 1.00 0.00 H new ATOM 0 HG23 VAL A 87 15.695 -0.661 7.904 1.00 0.00 H new ATOM 1297 N THR A 88 15.360 2.207 6.530 1.00 0.00 N ATOM 1298 CA THR A 88 16.629 2.931 6.565 1.00 0.00 C ATOM 1299 C THR A 88 16.562 4.224 5.767 1.00 0.00 C ATOM 1300 O THR A 88 17.418 5.097 5.905 1.00 0.00 O ATOM 1301 CB THR A 88 17.721 2.053 5.950 1.00 0.00 C ATOM 1302 OG1 THR A 88 18.955 2.308 6.607 1.00 0.00 O ATOM 1303 CG2 THR A 88 17.860 2.372 4.450 1.00 0.00 C ATOM 0 H THR A 88 14.929 2.147 5.608 1.00 0.00 H new ATOM 0 HA THR A 88 16.847 3.171 7.606 1.00 0.00 H new ATOM 0 HB THR A 88 17.453 1.003 6.070 1.00 0.00 H new ATOM 0 HG1 THR A 88 19.656 1.746 6.216 1.00 0.00 H new ATOM 0 HG21 THR A 88 18.638 1.745 4.015 1.00 0.00 H new ATOM 0 HG22 THR A 88 16.913 2.176 3.947 1.00 0.00 H new ATOM 0 HG23 THR A 88 18.127 3.421 4.324 1.00 0.00 H new ATOM 1311 N SER A 89 15.586 4.303 4.880 1.00 0.00 N ATOM 1312 CA SER A 89 15.470 5.444 4.011 1.00 0.00 C ATOM 1313 C SER A 89 14.631 6.538 4.622 1.00 0.00 C ATOM 1314 O SER A 89 13.416 6.586 4.427 1.00 0.00 O ATOM 1315 CB SER A 89 14.845 5.006 2.686 1.00 0.00 C ATOM 1316 OG SER A 89 14.876 6.087 1.765 1.00 0.00 O ATOM 0 H SER A 89 14.869 3.590 4.748 1.00 0.00 H new ATOM 0 HA SER A 89 16.471 5.844 3.850 1.00 0.00 H new ATOM 0 HB2 SER A 89 15.389 4.153 2.280 1.00 0.00 H new ATOM 0 HB3 SER A 89 13.817 4.681 2.847 1.00 0.00 H new ATOM 0 HG SER A 89 14.477 5.805 0.916 1.00 0.00 H new ATOM 1322 N ILE A 90 15.291 7.464 5.304 1.00 0.00 N ATOM 1323 CA ILE A 90 14.577 8.591 5.853 1.00 0.00 C ATOM 1324 C ILE A 90 14.030 9.344 4.660 1.00 0.00 C ATOM 1325 O ILE A 90 13.196 10.241 4.773 1.00 0.00 O ATOM 1326 CB ILE A 90 15.512 9.468 6.682 1.00 0.00 C ATOM 1327 CG1 ILE A 90 15.522 8.977 8.136 1.00 0.00 C ATOM 1328 CG2 ILE A 90 15.065 10.935 6.636 1.00 0.00 C ATOM 1329 CD1 ILE A 90 14.329 9.559 8.903 1.00 0.00 C ATOM 0 H ILE A 90 16.295 7.453 5.484 1.00 0.00 H new ATOM 0 HA ILE A 90 13.777 8.279 6.524 1.00 0.00 H new ATOM 0 HB ILE A 90 16.516 9.399 6.263 1.00 0.00 H new ATOM 0 HG12 ILE A 90 15.482 7.888 8.159 1.00 0.00 H new ATOM 0 HG13 ILE A 90 16.453 9.272 8.620 1.00 0.00 H new ATOM 0 HG21 ILE A 90 15.746 11.542 7.234 1.00 0.00 H new ATOM 0 HG22 ILE A 90 15.076 11.287 5.604 1.00 0.00 H new ATOM 0 HG23 ILE A 90 14.055 11.020 7.037 1.00 0.00 H new ATOM 0 HD11 ILE A 90 14.349 9.202 9.933 1.00 0.00 H new ATOM 0 HD12 ILE A 90 14.387 10.647 8.895 1.00 0.00 H new ATOM 0 HD13 ILE A 90 13.401 9.242 8.427 1.00 0.00 H new ATOM 1341 N LYS A 91 14.507 8.912 3.492 1.00 0.00 N ATOM 1342 CA LYS A 91 14.079 9.478 2.232 1.00 0.00 C ATOM 1343 C LYS A 91 12.702 8.938 1.881 1.00 0.00 C ATOM 1344 O LYS A 91 11.775 9.708 1.634 1.00 0.00 O ATOM 1345 CB LYS A 91 15.076 9.124 1.135 1.00 0.00 C ATOM 1346 CG LYS A 91 16.431 8.767 1.759 1.00 0.00 C ATOM 1347 CD LYS A 91 17.493 8.669 0.661 1.00 0.00 C ATOM 1348 CE LYS A 91 18.359 7.431 0.903 1.00 0.00 C ATOM 1349 NZ LYS A 91 18.722 7.353 2.348 1.00 0.00 N ATOM 0 H LYS A 91 15.196 8.165 3.403 1.00 0.00 H new ATOM 0 HA LYS A 91 14.030 10.563 2.320 1.00 0.00 H new ATOM 0 HB2 LYS A 91 14.703 8.284 0.549 1.00 0.00 H new ATOM 0 HB3 LYS A 91 15.191 9.964 0.450 1.00 0.00 H new ATOM 0 HG2 LYS A 91 16.717 9.524 2.489 1.00 0.00 H new ATOM 0 HG3 LYS A 91 16.358 7.820 2.294 1.00 0.00 H new ATOM 0 HD2 LYS A 91 17.016 8.608 -0.317 1.00 0.00 H new ATOM 0 HD3 LYS A 91 18.113 9.566 0.658 1.00 0.00 H new ATOM 0 HE2 LYS A 91 17.820 6.532 0.604 1.00 0.00 H new ATOM 0 HE3 LYS A 91 19.261 7.480 0.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 19.668 6.933 2.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 18.723 8.309 2.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 18.028 6.762 2.849 1.00 0.00 H new ATOM 1363 N SER A 92 12.561 7.611 1.879 1.00 0.00 N ATOM 1364 CA SER A 92 11.271 7.008 1.574 1.00 0.00 C ATOM 1365 C SER A 92 10.215 7.479 2.576 1.00 0.00 C ATOM 1366 O SER A 92 9.043 7.640 2.230 1.00 0.00 O ATOM 1367 CB SER A 92 11.379 5.482 1.616 1.00 0.00 C ATOM 1368 OG SER A 92 11.366 5.041 2.968 1.00 0.00 O ATOM 0 H SER A 92 13.310 6.949 2.081 1.00 0.00 H new ATOM 0 HA SER A 92 10.972 7.317 0.572 1.00 0.00 H new ATOM 0 HB2 SER A 92 10.550 5.033 1.068 1.00 0.00 H new ATOM 0 HB3 SER A 92 12.297 5.158 1.126 1.00 0.00 H new ATOM 0 HG SER A 92 12.006 5.569 3.490 1.00 0.00 H new ATOM 1374 N PHE A 93 10.641 7.689 3.821 1.00 0.00 N ATOM 1375 CA PHE A 93 9.733 8.123 4.880 1.00 0.00 C ATOM 1376 C PHE A 93 9.297 9.578 4.717 1.00 0.00 C ATOM 1377 O PHE A 93 8.103 9.878 4.674 1.00 0.00 O ATOM 1378 CB PHE A 93 10.418 7.951 6.232 1.00 0.00 C ATOM 1379 CG PHE A 93 9.740 6.832 6.972 1.00 0.00 C ATOM 1380 CD1 PHE A 93 8.456 7.024 7.489 1.00 0.00 C ATOM 1381 CD2 PHE A 93 10.384 5.601 7.130 1.00 0.00 C ATOM 1382 CE1 PHE A 93 7.812 5.983 8.166 1.00 0.00 C ATOM 1383 CE2 PHE A 93 9.745 4.561 7.807 1.00 0.00 C ATOM 1384 CZ PHE A 93 8.456 4.749 8.327 1.00 0.00 C ATOM 0 H PHE A 93 11.608 7.566 4.120 1.00 0.00 H new ATOM 0 HA PHE A 93 8.838 7.504 4.818 1.00 0.00 H new ATOM 0 HB2 PHE A 93 11.476 7.728 6.095 1.00 0.00 H new ATOM 0 HB3 PHE A 93 10.359 8.875 6.807 1.00 0.00 H new ATOM 0 HD1 PHE A 93 7.961 7.976 7.366 1.00 0.00 H new ATOM 0 HD2 PHE A 93 11.376 5.455 6.728 1.00 0.00 H new ATOM 0 HE1 PHE A 93 6.819 6.130 8.564 1.00 0.00 H new ATOM 0 HE2 PHE A 93 10.243 3.611 7.931 1.00 0.00 H new ATOM 0 HZ PHE A 93 7.961 3.944 8.850 1.00 0.00 H new ATOM 1394 N GLU A 94 10.269 10.479 4.659 1.00 0.00 N ATOM 1395 CA GLU A 94 9.979 11.905 4.541 1.00 0.00 C ATOM 1396 C GLU A 94 9.258 12.237 3.236 1.00 0.00 C ATOM 1397 O GLU A 94 8.343 13.062 3.225 1.00 0.00 O ATOM 1398 CB GLU A 94 11.281 12.701 4.614 1.00 0.00 C ATOM 1399 CG GLU A 94 11.699 12.875 6.075 1.00 0.00 C ATOM 1400 CD GLU A 94 11.161 14.193 6.619 1.00 0.00 C ATOM 1401 OE1 GLU A 94 11.731 15.222 6.292 1.00 0.00 O ATOM 1402 OE2 GLU A 94 10.191 14.157 7.357 1.00 0.00 O ATOM 0 H GLU A 94 11.263 10.250 4.691 1.00 0.00 H new ATOM 0 HA GLU A 94 9.321 12.176 5.366 1.00 0.00 H new ATOM 0 HB2 GLU A 94 12.065 12.185 4.061 1.00 0.00 H new ATOM 0 HB3 GLU A 94 11.149 13.676 4.145 1.00 0.00 H new ATOM 0 HG2 GLU A 94 11.320 12.045 6.671 1.00 0.00 H new ATOM 0 HG3 GLU A 94 12.786 12.856 6.155 1.00 0.00 H new ATOM 1409 N VAL A 95 9.667 11.612 2.139 1.00 0.00 N ATOM 1410 CA VAL A 95 9.032 11.890 0.855 1.00 0.00 C ATOM 1411 C VAL A 95 7.606 11.360 0.835 1.00 0.00 C ATOM 1412 O VAL A 95 6.727 11.956 0.216 1.00 0.00 O ATOM 1413 CB VAL A 95 9.825 11.272 -0.294 1.00 0.00 C ATOM 1414 CG1 VAL A 95 11.277 11.752 -0.245 1.00 0.00 C ATOM 1415 CG2 VAL A 95 9.783 9.758 -0.162 1.00 0.00 C ATOM 0 H VAL A 95 10.419 10.924 2.109 1.00 0.00 H new ATOM 0 HA VAL A 95 9.012 12.972 0.724 1.00 0.00 H new ATOM 0 HB VAL A 95 9.386 11.575 -1.245 1.00 0.00 H new ATOM 0 HG11 VAL A 95 11.836 11.306 -1.068 1.00 0.00 H new ATOM 0 HG12 VAL A 95 11.304 12.838 -0.334 1.00 0.00 H new ATOM 0 HG13 VAL A 95 11.727 11.454 0.702 1.00 0.00 H new ATOM 0 HG21 VAL A 95 10.347 9.306 -0.978 1.00 0.00 H new ATOM 0 HG22 VAL A 95 10.224 9.463 0.790 1.00 0.00 H new ATOM 0 HG23 VAL A 95 8.748 9.418 -0.203 1.00 0.00 H new ATOM 1425 N ILE A 96 7.374 10.242 1.514 1.00 0.00 N ATOM 1426 CA ILE A 96 6.039 9.665 1.557 1.00 0.00 C ATOM 1427 C ILE A 96 5.080 10.601 2.287 1.00 0.00 C ATOM 1428 O ILE A 96 3.939 10.777 1.865 1.00 0.00 O ATOM 1429 CB ILE A 96 6.085 8.298 2.244 1.00 0.00 C ATOM 1430 CG1 ILE A 96 6.285 7.217 1.180 1.00 0.00 C ATOM 1431 CG2 ILE A 96 4.778 8.030 2.999 1.00 0.00 C ATOM 1432 CD1 ILE A 96 6.695 5.909 1.852 1.00 0.00 C ATOM 0 H ILE A 96 8.083 9.725 2.034 1.00 0.00 H new ATOM 0 HA ILE A 96 5.677 9.532 0.538 1.00 0.00 H new ATOM 0 HB ILE A 96 6.909 8.285 2.958 1.00 0.00 H new ATOM 0 HG12 ILE A 96 5.364 7.074 0.614 1.00 0.00 H new ATOM 0 HG13 ILE A 96 7.051 7.529 0.470 1.00 0.00 H new ATOM 0 HG21 ILE A 96 4.830 7.054 3.481 1.00 0.00 H new ATOM 0 HG22 ILE A 96 4.630 8.801 3.756 1.00 0.00 H new ATOM 0 HG23 ILE A 96 3.943 8.045 2.298 1.00 0.00 H new ATOM 0 HD11 ILE A 96 6.837 5.139 1.093 1.00 0.00 H new ATOM 0 HD12 ILE A 96 7.627 6.057 2.398 1.00 0.00 H new ATOM 0 HD13 ILE A 96 5.914 5.596 2.545 1.00 0.00 H new ATOM 1444 N LYS A 97 5.548 11.203 3.377 1.00 0.00 N ATOM 1445 CA LYS A 97 4.706 12.119 4.138 1.00 0.00 C ATOM 1446 C LYS A 97 4.477 13.400 3.344 1.00 0.00 C ATOM 1447 O LYS A 97 3.435 14.046 3.471 1.00 0.00 O ATOM 1448 CB LYS A 97 5.359 12.452 5.480 1.00 0.00 C ATOM 1449 CG LYS A 97 4.272 12.843 6.484 1.00 0.00 C ATOM 1450 CD LYS A 97 4.918 13.437 7.738 1.00 0.00 C ATOM 1451 CE LYS A 97 3.834 13.730 8.777 1.00 0.00 C ATOM 1452 NZ LYS A 97 4.344 14.726 9.762 1.00 0.00 N ATOM 0 H LYS A 97 6.490 11.076 3.748 1.00 0.00 H new ATOM 0 HA LYS A 97 3.747 11.636 4.323 1.00 0.00 H new ATOM 0 HB2 LYS A 97 5.920 11.593 5.849 1.00 0.00 H new ATOM 0 HB3 LYS A 97 6.070 13.269 5.359 1.00 0.00 H new ATOM 0 HG2 LYS A 97 3.592 13.568 6.035 1.00 0.00 H new ATOM 0 HG3 LYS A 97 3.677 11.969 6.749 1.00 0.00 H new ATOM 0 HD2 LYS A 97 5.651 12.742 8.147 1.00 0.00 H new ATOM 0 HD3 LYS A 97 5.453 14.353 7.486 1.00 0.00 H new ATOM 0 HE2 LYS A 97 2.939 14.114 8.286 1.00 0.00 H new ATOM 0 HE3 LYS A 97 3.548 12.811 9.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 3.607 14.925 10.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 5.186 14.343 10.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 4.596 15.606 9.268 1.00 0.00 H new ATOM 1466 N VAL A 98 5.448 13.745 2.505 1.00 0.00 N ATOM 1467 CA VAL A 98 5.337 14.935 1.677 1.00 0.00 C ATOM 1468 C VAL A 98 4.365 14.660 0.544 1.00 0.00 C ATOM 1469 O VAL A 98 3.273 15.228 0.496 1.00 0.00 O ATOM 1470 CB VAL A 98 6.708 15.299 1.123 1.00 0.00 C ATOM 1471 CG1 VAL A 98 6.563 16.396 0.076 1.00 0.00 C ATOM 1472 CG2 VAL A 98 7.603 15.795 2.260 1.00 0.00 C ATOM 0 H VAL A 98 6.314 13.220 2.382 1.00 0.00 H new ATOM 0 HA VAL A 98 4.967 15.771 2.271 1.00 0.00 H new ATOM 0 HB VAL A 98 7.157 14.418 0.664 1.00 0.00 H new ATOM 0 HG11 VAL A 98 7.546 16.654 -0.319 1.00 0.00 H new ATOM 0 HG12 VAL A 98 5.927 16.042 -0.736 1.00 0.00 H new ATOM 0 HG13 VAL A 98 6.112 17.277 0.532 1.00 0.00 H new ATOM 0 HG21 VAL A 98 8.584 16.055 1.863 1.00 0.00 H new ATOM 0 HG22 VAL A 98 7.153 16.674 2.720 1.00 0.00 H new ATOM 0 HG23 VAL A 98 7.711 15.009 3.008 1.00 0.00 H new ATOM 1482 N ILE A 99 4.758 13.764 -0.351 1.00 0.00 N ATOM 1483 CA ILE A 99 3.904 13.388 -1.467 1.00 0.00 C ATOM 1484 C ILE A 99 2.473 13.238 -0.983 1.00 0.00 C ATOM 1485 O ILE A 99 1.599 14.003 -1.366 1.00 0.00 O ATOM 1486 CB ILE A 99 4.375 12.058 -2.058 1.00 0.00 C ATOM 1487 CG1 ILE A 99 5.816 12.201 -2.568 1.00 0.00 C ATOM 1488 CG2 ILE A 99 3.445 11.644 -3.202 1.00 0.00 C ATOM 1489 CD1 ILE A 99 5.824 12.748 -3.998 1.00 0.00 C ATOM 0 H ILE A 99 5.659 13.286 -0.326 1.00 0.00 H new ATOM 0 HA ILE A 99 3.956 14.163 -2.231 1.00 0.00 H new ATOM 0 HB ILE A 99 4.349 11.288 -1.287 1.00 0.00 H new ATOM 0 HG12 ILE A 99 6.376 12.869 -1.913 1.00 0.00 H new ATOM 0 HG13 ILE A 99 6.317 11.233 -2.539 1.00 0.00 H new ATOM 0 HG21 ILE A 99 3.783 10.696 -3.621 1.00 0.00 H new ATOM 0 HG22 ILE A 99 2.429 11.531 -2.823 1.00 0.00 H new ATOM 0 HG23 ILE A 99 3.460 12.409 -3.978 1.00 0.00 H new ATOM 0 HD11 ILE A 99 6.853 12.844 -4.345 1.00 0.00 H new ATOM 0 HD12 ILE A 99 5.282 12.065 -4.652 1.00 0.00 H new ATOM 0 HD13 ILE A 99 5.343 13.726 -4.016 1.00 0.00 H new ATOM 1501 N HIS A 100 2.243 12.246 -0.136 1.00 0.00 N ATOM 1502 CA HIS A 100 0.906 12.007 0.383 1.00 0.00 C ATOM 1503 C HIS A 100 0.217 13.315 0.754 1.00 0.00 C ATOM 1504 O HIS A 100 -0.778 13.679 0.149 1.00 0.00 O ATOM 1505 CB HIS A 100 0.981 11.106 1.617 1.00 0.00 C ATOM 1506 CG HIS A 100 -0.345 11.114 2.325 1.00 0.00 C ATOM 1507 ND1 HIS A 100 -0.768 12.191 3.088 1.00 0.00 N ATOM 1508 CD2 HIS A 100 -1.355 10.186 2.396 1.00 0.00 C ATOM 1509 CE1 HIS A 100 -1.982 11.887 3.580 1.00 0.00 C ATOM 1510 NE2 HIS A 100 -2.387 10.676 3.189 1.00 0.00 N ATOM 0 H HIS A 100 2.956 11.600 0.203 1.00 0.00 H new ATOM 0 HA HIS A 100 0.324 11.518 -0.398 1.00 0.00 H new ATOM 0 HB2 HIS A 100 1.242 10.089 1.323 1.00 0.00 H new ATOM 0 HB3 HIS A 100 1.766 11.455 2.288 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -1.349 9.222 1.910 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -2.560 12.543 4.215 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -3.264 10.211 3.422 1.00 0.00 H new ATOM 1519 N GLY A 101 0.750 14.012 1.748 1.00 0.00 N ATOM 1520 CA GLY A 101 0.167 15.264 2.206 1.00 0.00 C ATOM 1521 C GLY A 101 -0.438 16.068 1.071 1.00 0.00 C ATOM 1522 O GLY A 101 -1.648 16.286 1.015 1.00 0.00 O ATOM 0 H GLY A 101 1.589 13.729 2.254 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -0.602 15.053 2.949 1.00 0.00 H new ATOM 0 HA3 GLY A 101 0.934 15.859 2.701 1.00 0.00 H new ATOM 1526 N LYS A 102 0.419 16.505 0.182 1.00 0.00 N ATOM 1527 CA LYS A 102 -0.010 17.305 -0.966 1.00 0.00 C ATOM 1528 C LYS A 102 -0.847 16.474 -1.936 1.00 0.00 C ATOM 1529 O LYS A 102 -2.020 16.771 -2.154 1.00 0.00 O ATOM 1530 CB LYS A 102 1.214 17.864 -1.691 1.00 0.00 C ATOM 1531 CG LYS A 102 0.770 18.878 -2.751 1.00 0.00 C ATOM 1532 CD LYS A 102 0.150 20.112 -2.083 1.00 0.00 C ATOM 1533 CE LYS A 102 0.479 21.357 -2.907 1.00 0.00 C ATOM 1534 NZ LYS A 102 1.950 21.594 -2.883 1.00 0.00 N ATOM 0 H LYS A 102 1.422 16.326 0.221 1.00 0.00 H new ATOM 0 HA LYS A 102 -0.627 18.125 -0.598 1.00 0.00 H new ATOM 0 HB2 LYS A 102 1.885 18.341 -0.977 1.00 0.00 H new ATOM 0 HB3 LYS A 102 1.772 17.054 -2.160 1.00 0.00 H new ATOM 0 HG2 LYS A 102 1.624 19.176 -3.359 1.00 0.00 H new ATOM 0 HG3 LYS A 102 0.046 18.418 -3.423 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -0.930 19.991 -2.003 1.00 0.00 H new ATOM 0 HD3 LYS A 102 0.535 20.222 -1.069 1.00 0.00 H new ATOM 0 HE2 LYS A 102 0.137 21.227 -3.934 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -0.046 22.223 -2.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 2.137 22.616 -2.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 2.351 21.196 -2.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 2.389 21.135 -3.706 1.00 0.00 H new ATOM 1548 N LEU A 103 -0.233 15.448 -2.523 1.00 0.00 N ATOM 1549 CA LEU A 103 -0.928 14.588 -3.480 1.00 0.00 C ATOM 1550 C LEU A 103 -2.396 14.401 -3.056 1.00 0.00 C ATOM 1551 O LEU A 103 -3.321 14.744 -3.797 1.00 0.00 O ATOM 1552 CB LEU A 103 -0.230 13.218 -3.550 1.00 0.00 C ATOM 1553 CG LEU A 103 -0.531 12.505 -4.882 1.00 0.00 C ATOM 1554 CD1 LEU A 103 -2.042 12.344 -5.067 1.00 0.00 C ATOM 1555 CD2 LEU A 103 0.044 13.305 -6.057 1.00 0.00 C ATOM 0 H LEU A 103 0.740 15.192 -2.354 1.00 0.00 H new ATOM 0 HA LEU A 103 -0.900 15.059 -4.463 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.846 13.350 -3.440 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.561 12.596 -2.719 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.064 11.520 -4.857 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.241 11.839 -6.012 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -2.448 11.752 -4.247 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -2.514 13.326 -5.074 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -0.177 12.789 -6.991 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.406 14.298 -6.076 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.124 13.398 -5.940 1.00 0.00 H new ATOM 1567 N LEU A 104 -2.601 13.876 -1.845 1.00 0.00 N ATOM 1568 CA LEU A 104 -3.955 13.675 -1.326 1.00 0.00 C ATOM 1569 C LEU A 104 -4.740 14.974 -1.457 1.00 0.00 C ATOM 1570 O LEU A 104 -5.848 15.002 -1.984 1.00 0.00 O ATOM 1571 CB LEU A 104 -3.887 13.184 0.145 1.00 0.00 C ATOM 1572 CG LEU A 104 -4.759 14.024 1.085 1.00 0.00 C ATOM 1573 CD1 LEU A 104 -6.216 13.888 0.673 1.00 0.00 C ATOM 1574 CD2 LEU A 104 -4.599 13.511 2.521 1.00 0.00 C ATOM 0 H LEU A 104 -1.856 13.586 -1.212 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.471 12.908 -1.903 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -4.206 12.143 0.192 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -2.853 13.216 0.488 1.00 0.00 H new ATOM 0 HG LEU A 104 -4.453 15.069 1.029 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -6.840 14.484 1.339 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.339 14.240 -0.351 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -6.516 12.842 0.735 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -5.218 14.107 3.191 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.910 12.468 2.571 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -3.555 13.593 2.823 1.00 0.00 H new ATOM 1586 N ASP A 105 -4.154 16.040 -0.964 1.00 0.00 N ATOM 1587 CA ASP A 105 -4.777 17.347 -1.011 1.00 0.00 C ATOM 1588 C ASP A 105 -5.215 17.671 -2.431 1.00 0.00 C ATOM 1589 O ASP A 105 -6.175 18.410 -2.650 1.00 0.00 O ATOM 1590 CB ASP A 105 -3.756 18.364 -0.540 1.00 0.00 C ATOM 1591 CG ASP A 105 -3.421 19.340 -1.663 1.00 0.00 C ATOM 1592 OD1 ASP A 105 -2.909 18.895 -2.677 1.00 0.00 O ATOM 1593 OD2 ASP A 105 -3.680 20.519 -1.492 1.00 0.00 O ATOM 0 H ASP A 105 -3.236 16.029 -0.520 1.00 0.00 H new ATOM 0 HA ASP A 105 -5.660 17.367 -0.372 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -4.146 18.909 0.320 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -2.851 17.854 -0.210 1.00 0.00 H new ATOM 1676 N GLN A 111 -11.941 9.097 2.467 1.00 0.00 N ATOM 1677 CA GLN A 111 -11.066 8.121 3.102 1.00 0.00 C ATOM 1678 C GLN A 111 -10.967 6.864 2.253 1.00 0.00 C ATOM 1679 O GLN A 111 -11.945 6.138 2.081 1.00 0.00 O ATOM 1680 CB GLN A 111 -11.581 7.748 4.490 1.00 0.00 C ATOM 1681 CG GLN A 111 -11.924 9.017 5.275 1.00 0.00 C ATOM 1682 CD GLN A 111 -12.265 8.662 6.718 1.00 0.00 C ATOM 1683 OE1 GLN A 111 -13.437 8.640 7.094 1.00 0.00 O ATOM 1684 NE2 GLN A 111 -11.305 8.382 7.558 1.00 0.00 N ATOM 0 HA GLN A 111 -10.079 8.574 3.198 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -12.463 7.114 4.402 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -10.826 7.171 5.025 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -11.081 9.708 5.251 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -12.767 9.526 4.808 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -10.334 8.400 7.247 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -11.526 8.145 8.525 1.00 0.00 H new ATOM 1693 N ILE A 112 -9.773 6.611 1.739 1.00 0.00 N ATOM 1694 CA ILE A 112 -9.530 5.433 0.916 1.00 0.00 C ATOM 1695 C ILE A 112 -8.496 4.542 1.607 1.00 0.00 C ATOM 1696 O ILE A 112 -7.646 5.046 2.328 1.00 0.00 O ATOM 1697 CB ILE A 112 -9.010 5.855 -0.460 1.00 0.00 C ATOM 1698 CG1 ILE A 112 -8.214 7.154 -0.324 1.00 0.00 C ATOM 1699 CG2 ILE A 112 -10.192 6.079 -1.405 1.00 0.00 C ATOM 1700 CD1 ILE A 112 -7.295 7.320 -1.536 1.00 0.00 C ATOM 0 H ILE A 112 -8.956 7.205 1.877 1.00 0.00 H new ATOM 0 HA ILE A 112 -10.462 4.882 0.787 1.00 0.00 H new ATOM 0 HB ILE A 112 -8.367 5.073 -0.862 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -8.893 8.003 -0.251 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -7.625 7.137 0.593 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -9.822 6.380 -2.385 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -10.762 5.155 -1.500 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -10.835 6.862 -1.004 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -6.728 8.246 -1.439 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -6.606 6.477 -1.589 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -7.895 7.356 -2.445 1.00 0.00 H new ATOM 1712 N PRO A 113 -8.540 3.249 1.412 1.00 0.00 N ATOM 1713 CA PRO A 113 -7.563 2.328 2.052 1.00 0.00 C ATOM 1714 C PRO A 113 -6.133 2.851 1.951 1.00 0.00 C ATOM 1715 O PRO A 113 -5.611 3.050 0.853 1.00 0.00 O ATOM 1716 CB PRO A 113 -7.701 1.027 1.263 1.00 0.00 C ATOM 1717 CG PRO A 113 -9.037 1.073 0.593 1.00 0.00 C ATOM 1718 CD PRO A 113 -9.516 2.529 0.588 1.00 0.00 C ATOM 0 HA PRO A 113 -7.763 2.212 3.117 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -6.902 0.933 0.528 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -7.629 0.163 1.924 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -8.965 0.692 -0.426 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -9.750 0.439 1.121 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -9.551 2.930 -0.425 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -10.521 2.616 1.000 1.00 0.00 H new ATOM 1726 N ILE A 114 -5.497 3.049 3.106 1.00 0.00 N ATOM 1727 CA ILE A 114 -4.125 3.520 3.148 1.00 0.00 C ATOM 1728 C ILE A 114 -3.308 2.541 3.966 1.00 0.00 C ATOM 1729 O ILE A 114 -3.671 2.208 5.098 1.00 0.00 O ATOM 1730 CB ILE A 114 -4.041 4.916 3.763 1.00 0.00 C ATOM 1731 CG1 ILE A 114 -5.134 5.814 3.180 1.00 0.00 C ATOM 1732 CG2 ILE A 114 -2.664 5.498 3.455 1.00 0.00 C ATOM 1733 CD1 ILE A 114 -4.677 7.277 3.179 1.00 0.00 C ATOM 0 H ILE A 114 -5.916 2.889 4.022 1.00 0.00 H new ATOM 0 HA ILE A 114 -3.735 3.583 2.132 1.00 0.00 H new ATOM 0 HB ILE A 114 -4.186 4.856 4.842 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -5.369 5.499 2.163 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -6.048 5.712 3.765 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -2.586 6.496 3.887 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -1.894 4.856 3.883 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -2.528 5.558 2.375 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -5.465 7.904 2.761 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -4.465 7.593 4.201 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -3.776 7.376 2.574 1.00 0.00 H new ATOM 1745 N MET A 115 -2.227 2.054 3.377 1.00 0.00 N ATOM 1746 CA MET A 115 -1.389 1.080 4.051 1.00 0.00 C ATOM 1747 C MET A 115 0.066 1.510 4.075 1.00 0.00 C ATOM 1748 O MET A 115 0.710 1.630 3.032 1.00 0.00 O ATOM 1749 CB MET A 115 -1.505 -0.265 3.336 1.00 0.00 C ATOM 1750 CG MET A 115 -0.955 -1.366 4.232 1.00 0.00 C ATOM 1751 SD MET A 115 -2.254 -1.930 5.350 1.00 0.00 S ATOM 1752 CE MET A 115 -1.151 -2.740 6.520 1.00 0.00 C ATOM 0 H MET A 115 -1.913 2.315 2.442 1.00 0.00 H new ATOM 0 HA MET A 115 -1.732 0.997 5.082 1.00 0.00 H new ATOM 0 HB2 MET A 115 -2.547 -0.469 3.089 1.00 0.00 H new ATOM 0 HB3 MET A 115 -0.954 -0.238 2.396 1.00 0.00 H new ATOM 0 HG2 MET A 115 -0.594 -2.197 3.626 1.00 0.00 H new ATOM 0 HG3 MET A 115 -0.104 -0.995 4.803 1.00 0.00 H new ATOM 0 HE1 MET A 115 -1.739 -3.225 7.299 1.00 0.00 H new ATOM 0 HE2 MET A 115 -0.553 -3.488 5.999 1.00 0.00 H new ATOM 0 HE3 MET A 115 -0.492 -1.999 6.971 1.00 0.00 H new ATOM 1762 N LEU A 116 0.591 1.707 5.278 1.00 0.00 N ATOM 1763 CA LEU A 116 1.969 2.080 5.435 1.00 0.00 C ATOM 1764 C LEU A 116 2.773 0.835 5.706 1.00 0.00 C ATOM 1765 O LEU A 116 2.822 0.343 6.833 1.00 0.00 O ATOM 1766 CB LEU A 116 2.105 3.001 6.614 1.00 0.00 C ATOM 1767 CG LEU A 116 2.006 4.449 6.141 1.00 0.00 C ATOM 1768 CD1 LEU A 116 1.511 5.296 7.292 1.00 0.00 C ATOM 1769 CD2 LEU A 116 3.382 4.947 5.706 1.00 0.00 C ATOM 0 H LEU A 116 0.074 1.612 6.152 1.00 0.00 H new ATOM 0 HA LEU A 116 2.323 2.579 4.533 1.00 0.00 H new ATOM 0 HB2 LEU A 116 1.324 2.792 7.345 1.00 0.00 H new ATOM 0 HB3 LEU A 116 3.060 2.834 7.112 1.00 0.00 H new ATOM 0 HG LEU A 116 1.320 4.516 5.297 1.00 0.00 H new ATOM 0 HD11 LEU A 116 1.434 6.335 6.972 1.00 0.00 H new ATOM 0 HD12 LEU A 116 0.531 4.941 7.610 1.00 0.00 H new ATOM 0 HD13 LEU A 116 2.211 5.224 8.124 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.305 5.981 5.369 1.00 0.00 H new ATOM 0 HD22 LEU A 116 4.072 4.890 6.547 1.00 0.00 H new ATOM 0 HD23 LEU A 116 3.752 4.326 4.890 1.00 0.00 H new ATOM 1781 N VAL A 117 3.378 0.321 4.659 1.00 0.00 N ATOM 1782 CA VAL A 117 4.160 -0.885 4.769 1.00 0.00 C ATOM 1783 C VAL A 117 5.644 -0.584 4.728 1.00 0.00 C ATOM 1784 O VAL A 117 6.156 0.055 3.818 1.00 0.00 O ATOM 1785 CB VAL A 117 3.762 -1.862 3.664 1.00 0.00 C ATOM 1786 CG1 VAL A 117 4.464 -3.205 3.855 1.00 0.00 C ATOM 1787 CG2 VAL A 117 2.264 -2.088 3.760 1.00 0.00 C ATOM 0 H VAL A 117 3.342 0.721 3.722 1.00 0.00 H new ATOM 0 HA VAL A 117 3.954 -1.347 5.734 1.00 0.00 H new ATOM 0 HB VAL A 117 4.045 -1.449 2.696 1.00 0.00 H new ATOM 0 HG11 VAL A 117 4.168 -3.887 3.058 1.00 0.00 H new ATOM 0 HG12 VAL A 117 5.544 -3.059 3.825 1.00 0.00 H new ATOM 0 HG13 VAL A 117 4.182 -3.629 4.819 1.00 0.00 H new ATOM 0 HG21 VAL A 117 1.950 -2.783 2.981 1.00 0.00 H new ATOM 0 HG22 VAL A 117 2.021 -2.504 4.738 1.00 0.00 H new ATOM 0 HG23 VAL A 117 1.744 -1.139 3.630 1.00 0.00 H new ATOM 1797 N GLY A 118 6.310 -1.083 5.737 1.00 0.00 N ATOM 1798 CA GLY A 118 7.748 -0.923 5.868 1.00 0.00 C ATOM 1799 C GLY A 118 8.427 -2.178 5.350 1.00 0.00 C ATOM 1800 O GLY A 118 8.347 -3.233 5.977 1.00 0.00 O ATOM 0 H GLY A 118 5.878 -1.612 6.494 1.00 0.00 H new ATOM 0 HA2 GLY A 118 8.084 -0.052 5.305 1.00 0.00 H new ATOM 0 HA3 GLY A 118 8.016 -0.752 6.911 1.00 0.00 H new ATOM 1804 N ASN A 119 9.061 -2.074 4.189 1.00 0.00 N ATOM 1805 CA ASN A 119 9.698 -3.239 3.598 1.00 0.00 C ATOM 1806 C ASN A 119 11.191 -3.283 3.909 1.00 0.00 C ATOM 1807 O ASN A 119 11.732 -2.383 4.549 1.00 0.00 O ATOM 1808 CB ASN A 119 9.491 -3.227 2.081 1.00 0.00 C ATOM 1809 CG ASN A 119 10.064 -4.498 1.461 1.00 0.00 C ATOM 1810 OD1 ASN A 119 9.681 -5.603 1.846 1.00 0.00 O ATOM 1811 ND2 ASN A 119 10.965 -4.408 0.518 1.00 0.00 N ATOM 0 H ASN A 119 9.146 -1.213 3.649 1.00 0.00 H new ATOM 0 HA ASN A 119 9.237 -4.127 4.031 1.00 0.00 H new ATOM 0 HB2 ASN A 119 8.428 -3.149 1.852 1.00 0.00 H new ATOM 0 HB3 ASN A 119 9.975 -2.352 1.647 1.00 0.00 H new ATOM 0 HD21 ASN A 119 11.352 -5.254 0.100 1.00 0.00 H new ATOM 0 HD22 ASN A 119 11.281 -3.492 0.200 1.00 0.00 H new ATOM 1818 N LYS A 120 11.845 -4.358 3.461 1.00 0.00 N ATOM 1819 CA LYS A 120 13.283 -4.540 3.705 1.00 0.00 C ATOM 1820 C LYS A 120 13.522 -4.644 5.209 1.00 0.00 C ATOM 1821 O LYS A 120 14.188 -3.807 5.817 1.00 0.00 O ATOM 1822 CB LYS A 120 14.098 -3.385 3.095 1.00 0.00 C ATOM 1823 CG LYS A 120 14.595 -3.787 1.705 1.00 0.00 C ATOM 1824 CD LYS A 120 15.384 -2.632 1.087 1.00 0.00 C ATOM 1825 CE LYS A 120 15.833 -3.015 -0.326 1.00 0.00 C ATOM 1826 NZ LYS A 120 17.001 -2.175 -0.722 1.00 0.00 N ATOM 0 H LYS A 120 11.408 -5.112 2.931 1.00 0.00 H new ATOM 0 HA LYS A 120 13.616 -5.459 3.223 1.00 0.00 H new ATOM 0 HB2 LYS A 120 13.482 -2.488 3.027 1.00 0.00 H new ATOM 0 HB3 LYS A 120 14.944 -3.143 3.739 1.00 0.00 H new ATOM 0 HG2 LYS A 120 15.225 -4.674 1.776 1.00 0.00 H new ATOM 0 HG3 LYS A 120 13.750 -4.046 1.067 1.00 0.00 H new ATOM 0 HD2 LYS A 120 14.767 -1.734 1.053 1.00 0.00 H new ATOM 0 HD3 LYS A 120 16.251 -2.399 1.705 1.00 0.00 H new ATOM 0 HE2 LYS A 120 16.103 -4.071 -0.360 1.00 0.00 H new ATOM 0 HE3 LYS A 120 15.014 -2.873 -1.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 16.740 -1.577 -1.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 17.282 -1.572 0.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 17.796 -2.790 -0.988 1.00 0.00 H new ATOM 1840 N LYS A 121 12.910 -5.660 5.801 1.00 0.00 N ATOM 1841 CA LYS A 121 12.978 -5.881 7.239 1.00 0.00 C ATOM 1842 C LYS A 121 14.369 -6.259 7.751 1.00 0.00 C ATOM 1843 O LYS A 121 14.648 -6.068 8.927 1.00 0.00 O ATOM 1844 CB LYS A 121 11.999 -6.985 7.627 1.00 0.00 C ATOM 1845 CG LYS A 121 11.668 -6.868 9.115 1.00 0.00 C ATOM 1846 CD LYS A 121 10.724 -8.002 9.526 1.00 0.00 C ATOM 1847 CE LYS A 121 10.943 -8.337 11.001 1.00 0.00 C ATOM 1848 NZ LYS A 121 12.042 -9.333 11.127 1.00 0.00 N ATOM 0 H LYS A 121 12.354 -6.353 5.300 1.00 0.00 H new ATOM 0 HA LYS A 121 12.721 -4.928 7.702 1.00 0.00 H new ATOM 0 HB2 LYS A 121 11.089 -6.905 7.033 1.00 0.00 H new ATOM 0 HB3 LYS A 121 12.433 -7.962 7.415 1.00 0.00 H new ATOM 0 HG2 LYS A 121 12.583 -6.912 9.705 1.00 0.00 H new ATOM 0 HG3 LYS A 121 11.203 -5.903 9.319 1.00 0.00 H new ATOM 0 HD2 LYS A 121 9.688 -7.706 9.359 1.00 0.00 H new ATOM 0 HD3 LYS A 121 10.907 -8.883 8.911 1.00 0.00 H new ATOM 0 HE2 LYS A 121 11.192 -7.433 11.557 1.00 0.00 H new ATOM 0 HE3 LYS A 121 10.026 -8.735 11.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 12.191 -9.561 12.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 11.787 -10.198 10.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 12.917 -8.937 10.729 1.00 0.00 H new ATOM 1862 N ASP A 122 15.236 -6.819 6.915 1.00 0.00 N ATOM 1863 CA ASP A 122 16.551 -7.208 7.422 1.00 0.00 C ATOM 1864 C ASP A 122 17.441 -5.997 7.653 1.00 0.00 C ATOM 1865 O ASP A 122 18.582 -6.133 8.095 1.00 0.00 O ATOM 1866 CB ASP A 122 17.236 -8.219 6.506 1.00 0.00 C ATOM 1867 CG ASP A 122 17.020 -7.865 5.046 1.00 0.00 C ATOM 1868 OD1 ASP A 122 15.870 -7.842 4.625 1.00 0.00 O ATOM 1869 OD2 ASP A 122 18.010 -7.661 4.358 1.00 0.00 O ATOM 0 H ASP A 122 15.067 -7.008 5.927 1.00 0.00 H new ATOM 0 HA ASP A 122 16.388 -7.693 8.385 1.00 0.00 H new ATOM 0 HB2 ASP A 122 18.304 -8.246 6.723 1.00 0.00 H new ATOM 0 HB3 ASP A 122 16.845 -9.217 6.703 1.00 0.00 H new ATOM 1874 N LEU A 123 16.898 -4.808 7.420 1.00 0.00 N ATOM 1875 CA LEU A 123 17.635 -3.601 7.682 1.00 0.00 C ATOM 1876 C LEU A 123 17.242 -3.161 9.074 1.00 0.00 C ATOM 1877 O LEU A 123 18.014 -2.510 9.751 1.00 0.00 O ATOM 1878 CB LEU A 123 17.317 -2.515 6.644 1.00 0.00 C ATOM 1879 CG LEU A 123 18.353 -2.548 5.516 1.00 0.00 C ATOM 1880 CD1 LEU A 123 18.281 -3.895 4.813 1.00 0.00 C ATOM 1881 CD2 LEU A 123 18.054 -1.434 4.510 1.00 0.00 C ATOM 0 H LEU A 123 15.957 -4.665 7.053 1.00 0.00 H new ATOM 0 HA LEU A 123 18.709 -3.775 7.613 1.00 0.00 H new ATOM 0 HB2 LEU A 123 16.318 -2.672 6.236 1.00 0.00 H new ATOM 0 HB3 LEU A 123 17.317 -1.534 7.120 1.00 0.00 H new ATOM 0 HG LEU A 123 19.350 -2.400 5.932 1.00 0.00 H new ATOM 0 HD11 LEU A 123 19.016 -3.925 4.009 1.00 0.00 H new ATOM 0 HD12 LEU A 123 18.492 -4.690 5.528 1.00 0.00 H new ATOM 0 HD13 LEU A 123 17.283 -4.036 4.398 1.00 0.00 H new ATOM 0 HD21 LEU A 123 18.792 -1.460 3.709 1.00 0.00 H new ATOM 0 HD22 LEU A 123 17.058 -1.580 4.091 1.00 0.00 H new ATOM 0 HD23 LEU A 123 18.098 -0.468 5.013 1.00 0.00 H new ATOM 1893 N HIS A 124 16.029 -3.572 9.487 1.00 0.00 N ATOM 1894 CA HIS A 124 15.500 -3.269 10.823 1.00 0.00 C ATOM 1895 C HIS A 124 16.619 -3.074 11.833 1.00 0.00 C ATOM 1896 O HIS A 124 16.545 -2.196 12.687 1.00 0.00 O ATOM 1897 CB HIS A 124 14.603 -4.400 11.302 1.00 0.00 C ATOM 1898 CG HIS A 124 14.454 -4.333 12.796 1.00 0.00 C ATOM 1899 ND1 HIS A 124 13.301 -3.865 13.407 1.00 0.00 N ATOM 1900 CD2 HIS A 124 15.301 -4.687 13.817 1.00 0.00 C ATOM 1901 CE1 HIS A 124 13.485 -3.947 14.737 1.00 0.00 C ATOM 1902 NE2 HIS A 124 14.688 -4.443 15.041 1.00 0.00 N ATOM 0 H HIS A 124 15.394 -4.120 8.906 1.00 0.00 H new ATOM 0 HA HIS A 124 14.929 -2.344 10.745 1.00 0.00 H new ATOM 0 HB2 HIS A 124 13.625 -4.327 10.826 1.00 0.00 H new ATOM 0 HB3 HIS A 124 15.028 -5.361 11.012 1.00 0.00 H new ATOM 0 HD2 HIS A 124 16.293 -5.094 13.689 1.00 0.00 H new ATOM 0 HE1 HIS A 124 12.750 -3.648 15.470 1.00 0.00 H new ATOM 0 HE2 HIS A 124 15.074 -4.607 15.971 1.00 0.00 H new ATOM 1911 N MET A 125 17.677 -3.875 11.734 1.00 0.00 N ATOM 1912 CA MET A 125 18.797 -3.716 12.659 1.00 0.00 C ATOM 1913 C MET A 125 19.158 -2.231 12.745 1.00 0.00 C ATOM 1914 O MET A 125 19.838 -1.780 13.667 1.00 0.00 O ATOM 1915 CB MET A 125 19.998 -4.529 12.176 1.00 0.00 C ATOM 1916 CG MET A 125 19.627 -6.014 12.150 1.00 0.00 C ATOM 1917 SD MET A 125 20.406 -6.856 13.551 1.00 0.00 S ATOM 1918 CE MET A 125 18.885 -7.402 14.366 1.00 0.00 C ATOM 0 H MET A 125 17.783 -4.619 11.045 1.00 0.00 H new ATOM 0 HA MET A 125 18.515 -4.081 13.647 1.00 0.00 H new ATOM 0 HB2 MET A 125 20.298 -4.200 11.181 1.00 0.00 H new ATOM 0 HB3 MET A 125 20.850 -4.367 12.836 1.00 0.00 H new ATOM 0 HG2 MET A 125 18.544 -6.130 12.199 1.00 0.00 H new ATOM 0 HG3 MET A 125 19.954 -6.465 11.213 1.00 0.00 H new ATOM 0 HE1 MET A 125 19.136 -7.954 15.272 1.00 0.00 H new ATOM 0 HE2 MET A 125 18.279 -6.534 14.626 1.00 0.00 H new ATOM 0 HE3 MET A 125 18.323 -8.048 13.692 1.00 0.00 H new ATOM 1928 N GLU A 126 18.657 -1.492 11.759 1.00 0.00 N ATOM 1929 CA GLU A 126 18.848 -0.060 11.640 1.00 0.00 C ATOM 1930 C GLU A 126 17.624 0.678 12.185 1.00 0.00 C ATOM 1931 O GLU A 126 17.727 1.497 13.098 1.00 0.00 O ATOM 1932 CB GLU A 126 19.010 0.267 10.161 1.00 0.00 C ATOM 1933 CG GLU A 126 20.358 -0.250 9.668 1.00 0.00 C ATOM 1934 CD GLU A 126 21.492 0.566 10.280 1.00 0.00 C ATOM 1935 OE1 GLU A 126 21.792 1.621 9.747 1.00 0.00 O ATOM 1936 OE2 GLU A 126 22.043 0.124 11.275 1.00 0.00 O ATOM 0 H GLU A 126 18.094 -1.887 11.006 1.00 0.00 H new ATOM 0 HA GLU A 126 19.726 0.249 12.207 1.00 0.00 H new ATOM 0 HB2 GLU A 126 18.203 -0.188 9.587 1.00 0.00 H new ATOM 0 HB3 GLU A 126 18.944 1.344 10.007 1.00 0.00 H new ATOM 0 HG2 GLU A 126 20.472 -1.301 9.934 1.00 0.00 H new ATOM 0 HG3 GLU A 126 20.403 -0.190 8.581 1.00 0.00 H new ATOM 1943 N ARG A 127 16.471 0.360 11.599 1.00 0.00 N ATOM 1944 CA ARG A 127 15.196 0.959 11.983 1.00 0.00 C ATOM 1945 C ARG A 127 15.373 2.400 12.440 1.00 0.00 C ATOM 1946 O ARG A 127 15.171 2.725 13.610 1.00 0.00 O ATOM 1947 CB ARG A 127 14.547 0.130 13.092 1.00 0.00 C ATOM 1948 CG ARG A 127 13.037 0.399 13.165 1.00 0.00 C ATOM 1949 CD ARG A 127 12.287 -0.863 12.722 1.00 0.00 C ATOM 1950 NE ARG A 127 10.858 -0.595 12.574 1.00 0.00 N ATOM 1951 CZ ARG A 127 9.933 -1.456 13.007 1.00 0.00 C ATOM 1952 NH1 ARG A 127 10.274 -2.641 13.425 1.00 0.00 N ATOM 1953 NH2 ARG A 127 8.677 -1.160 12.871 1.00 0.00 N ATOM 0 H ARG A 127 16.395 -0.321 10.844 1.00 0.00 H new ATOM 0 HA ARG A 127 14.547 0.965 11.107 1.00 0.00 H new ATOM 0 HB2 ARG A 127 14.723 -0.930 12.910 1.00 0.00 H new ATOM 0 HB3 ARG A 127 15.010 0.370 14.049 1.00 0.00 H new ATOM 0 HG2 ARG A 127 12.751 0.671 14.181 1.00 0.00 H new ATOM 0 HG3 ARG A 127 12.772 1.240 12.524 1.00 0.00 H new ATOM 0 HD2 ARG A 127 12.694 -1.220 11.776 1.00 0.00 H new ATOM 0 HD3 ARG A 127 12.438 -1.657 13.454 1.00 0.00 H new ATOM 0 HE ARG A 127 10.559 0.272 12.128 1.00 0.00 H new ATOM 0 HH11 ARG A 127 11.255 -2.919 13.424 1.00 0.00 H new ATOM 0 HH12 ARG A 127 9.560 -3.291 13.754 1.00 0.00 H new ATOM 0 HH21 ARG A 127 8.405 -0.278 12.437 1.00 0.00 H new ATOM 0 HH22 ARG A 127 7.962 -1.810 13.198 1.00 0.00 H new ATOM 1967 N VAL A 128 15.735 3.258 11.497 1.00 0.00 N ATOM 1968 CA VAL A 128 15.923 4.672 11.789 1.00 0.00 C ATOM 1969 C VAL A 128 14.614 5.277 12.277 1.00 0.00 C ATOM 1970 O VAL A 128 14.603 6.195 13.097 1.00 0.00 O ATOM 1971 CB VAL A 128 16.380 5.396 10.525 1.00 0.00 C ATOM 1972 CG1 VAL A 128 17.629 4.725 9.983 1.00 0.00 C ATOM 1973 CG2 VAL A 128 15.271 5.323 9.475 1.00 0.00 C ATOM 0 H VAL A 128 15.904 3.000 10.525 1.00 0.00 H new ATOM 0 HA VAL A 128 16.680 4.781 12.566 1.00 0.00 H new ATOM 0 HB VAL A 128 16.598 6.438 10.758 1.00 0.00 H new ATOM 0 HG11 VAL A 128 17.957 5.241 9.080 1.00 0.00 H new ATOM 0 HG12 VAL A 128 18.419 4.768 10.732 1.00 0.00 H new ATOM 0 HG13 VAL A 128 17.409 3.684 9.746 1.00 0.00 H new ATOM 0 HG21 VAL A 128 15.592 5.839 8.570 1.00 0.00 H new ATOM 0 HG22 VAL A 128 15.059 4.280 9.242 1.00 0.00 H new ATOM 0 HG23 VAL A 128 14.370 5.799 9.863 1.00 0.00 H new ATOM 1983 N ILE A 129 13.513 4.746 11.761 1.00 0.00 N ATOM 1984 CA ILE A 129 12.189 5.225 12.139 1.00 0.00 C ATOM 1985 C ILE A 129 11.677 4.469 13.355 1.00 0.00 C ATOM 1986 O ILE A 129 12.089 3.338 13.616 1.00 0.00 O ATOM 1987 CB ILE A 129 11.204 5.076 10.970 1.00 0.00 C ATOM 1988 CG1 ILE A 129 10.287 6.304 10.925 1.00 0.00 C ATOM 1989 CG2 ILE A 129 10.350 3.809 11.143 1.00 0.00 C ATOM 1990 CD1 ILE A 129 11.029 7.485 10.290 1.00 0.00 C ATOM 0 H ILE A 129 13.510 3.985 11.081 1.00 0.00 H new ATOM 0 HA ILE A 129 12.269 6.282 12.392 1.00 0.00 H new ATOM 0 HB ILE A 129 11.768 4.995 10.041 1.00 0.00 H new ATOM 0 HG12 ILE A 129 9.388 6.077 10.352 1.00 0.00 H new ATOM 0 HG13 ILE A 129 9.964 6.565 11.933 1.00 0.00 H new ATOM 0 HG21 ILE A 129 9.658 3.720 10.306 1.00 0.00 H new ATOM 0 HG22 ILE A 129 10.999 2.934 11.172 1.00 0.00 H new ATOM 0 HG23 ILE A 129 9.787 3.874 12.074 1.00 0.00 H new ATOM 0 HD11 ILE A 129 10.372 8.354 10.261 1.00 0.00 H new ATOM 0 HD12 ILE A 129 11.914 7.719 10.881 1.00 0.00 H new ATOM 0 HD13 ILE A 129 11.329 7.223 9.275 1.00 0.00 H new ATOM 2002 N SER A 130 10.782 5.104 14.097 1.00 0.00 N ATOM 2003 CA SER A 130 10.218 4.483 15.291 1.00 0.00 C ATOM 2004 C SER A 130 8.809 3.966 15.031 1.00 0.00 C ATOM 2005 O SER A 130 7.946 4.695 14.540 1.00 0.00 O ATOM 2006 CB SER A 130 10.185 5.491 16.436 1.00 0.00 C ATOM 2007 OG SER A 130 9.326 6.567 16.087 1.00 0.00 O ATOM 0 H SER A 130 10.432 6.041 13.898 1.00 0.00 H new ATOM 0 HA SER A 130 10.852 3.638 15.561 1.00 0.00 H new ATOM 0 HB2 SER A 130 9.833 5.011 17.349 1.00 0.00 H new ATOM 0 HB3 SER A 130 11.190 5.863 16.638 1.00 0.00 H new ATOM 0 HG SER A 130 9.628 6.967 15.245 1.00 0.00 H new ATOM 2013 N TYR A 131 8.581 2.705 15.383 1.00 0.00 N ATOM 2014 CA TYR A 131 7.269 2.091 15.208 1.00 0.00 C ATOM 2015 C TYR A 131 6.187 3.076 15.620 1.00 0.00 C ATOM 2016 O TYR A 131 5.106 3.122 15.034 1.00 0.00 O ATOM 2017 CB TYR A 131 7.173 0.838 16.090 1.00 0.00 C ATOM 2018 CG TYR A 131 6.057 -0.066 15.610 1.00 0.00 C ATOM 2019 CD1 TYR A 131 4.718 0.308 15.787 1.00 0.00 C ATOM 2020 CD2 TYR A 131 6.365 -1.283 14.990 1.00 0.00 C ATOM 2021 CE1 TYR A 131 3.691 -0.534 15.344 1.00 0.00 C ATOM 2022 CE2 TYR A 131 5.338 -2.124 14.546 1.00 0.00 C ATOM 2023 CZ TYR A 131 4.001 -1.750 14.722 1.00 0.00 C ATOM 2024 OH TYR A 131 2.989 -2.579 14.284 1.00 0.00 O ATOM 0 H TYR A 131 9.285 2.089 15.790 1.00 0.00 H new ATOM 0 HA TYR A 131 7.134 1.817 14.162 1.00 0.00 H new ATOM 0 HB2 TYR A 131 8.120 0.299 16.069 1.00 0.00 H new ATOM 0 HB3 TYR A 131 6.994 1.128 17.125 1.00 0.00 H new ATOM 0 HD1 TYR A 131 4.478 1.246 16.265 1.00 0.00 H new ATOM 0 HD2 TYR A 131 7.396 -1.573 14.854 1.00 0.00 H new ATOM 0 HE1 TYR A 131 2.659 -0.246 15.482 1.00 0.00 H new ATOM 0 HE2 TYR A 131 5.578 -3.062 14.067 1.00 0.00 H new ATOM 0 HH TYR A 131 3.377 -3.381 13.875 1.00 0.00 H new ATOM 2034 N GLU A 132 6.504 3.858 16.640 1.00 0.00 N ATOM 2035 CA GLU A 132 5.579 4.852 17.167 1.00 0.00 C ATOM 2036 C GLU A 132 5.324 5.952 16.152 1.00 0.00 C ATOM 2037 O GLU A 132 4.208 6.103 15.659 1.00 0.00 O ATOM 2038 CB GLU A 132 6.163 5.450 18.434 1.00 0.00 C ATOM 2039 CG GLU A 132 6.374 4.336 19.448 1.00 0.00 C ATOM 2040 CD GLU A 132 7.847 4.248 19.823 1.00 0.00 C ATOM 2041 OE1 GLU A 132 8.625 3.831 18.979 1.00 0.00 O ATOM 2042 OE2 GLU A 132 8.177 4.598 20.944 1.00 0.00 O ATOM 0 H GLU A 132 7.402 3.823 17.123 1.00 0.00 H new ATOM 0 HA GLU A 132 4.628 4.365 17.385 1.00 0.00 H new ATOM 0 HB2 GLU A 132 7.109 5.947 18.216 1.00 0.00 H new ATOM 0 HB3 GLU A 132 5.491 6.207 18.839 1.00 0.00 H new ATOM 0 HG2 GLU A 132 5.774 4.524 20.338 1.00 0.00 H new ATOM 0 HG3 GLU A 132 6.038 3.386 19.032 1.00 0.00 H new ATOM 2049 N GLU A 133 6.366 6.715 15.846 1.00 0.00 N ATOM 2050 CA GLU A 133 6.243 7.796 14.883 1.00 0.00 C ATOM 2051 C GLU A 133 5.392 7.347 13.706 1.00 0.00 C ATOM 2052 O GLU A 133 4.551 8.096 13.220 1.00 0.00 O ATOM 2053 CB GLU A 133 7.623 8.211 14.389 1.00 0.00 C ATOM 2054 CG GLU A 133 8.337 9.022 15.474 1.00 0.00 C ATOM 2055 CD GLU A 133 9.841 9.051 15.209 1.00 0.00 C ATOM 2056 OE1 GLU A 133 10.340 8.109 14.610 1.00 0.00 O ATOM 2057 OE2 GLU A 133 10.473 10.014 15.610 1.00 0.00 O ATOM 0 H GLU A 133 7.297 6.605 16.248 1.00 0.00 H new ATOM 0 HA GLU A 133 5.765 8.648 15.367 1.00 0.00 H new ATOM 0 HB2 GLU A 133 8.210 7.328 14.136 1.00 0.00 H new ATOM 0 HB3 GLU A 133 7.531 8.804 13.479 1.00 0.00 H new ATOM 0 HG2 GLU A 133 7.945 10.039 15.495 1.00 0.00 H new ATOM 0 HG3 GLU A 133 8.141 8.584 16.453 1.00 0.00 H new ATOM 2064 N GLY A 134 5.614 6.113 13.264 1.00 0.00 N ATOM 2065 CA GLY A 134 4.871 5.558 12.158 1.00 0.00 C ATOM 2066 C GLY A 134 3.441 5.274 12.566 1.00 0.00 C ATOM 2067 O GLY A 134 2.506 5.440 11.782 1.00 0.00 O ATOM 0 H GLY A 134 6.309 5.482 13.663 1.00 0.00 H new ATOM 0 HA2 GLY A 134 4.884 6.253 11.319 1.00 0.00 H new ATOM 0 HA3 GLY A 134 5.347 4.638 11.818 1.00 0.00 H new ATOM 2071 N LYS A 135 3.287 4.853 13.806 1.00 0.00 N ATOM 2072 CA LYS A 135 1.970 4.552 14.342 1.00 0.00 C ATOM 2073 C LYS A 135 1.120 5.810 14.341 1.00 0.00 C ATOM 2074 O LYS A 135 0.033 5.829 13.776 1.00 0.00 O ATOM 2075 CB LYS A 135 2.087 4.016 15.770 1.00 0.00 C ATOM 2076 CG LYS A 135 0.785 3.313 16.156 1.00 0.00 C ATOM 2077 CD LYS A 135 0.501 3.540 17.642 1.00 0.00 C ATOM 2078 CE LYS A 135 -0.758 2.770 18.046 1.00 0.00 C ATOM 2079 NZ LYS A 135 -1.962 3.491 17.544 1.00 0.00 N ATOM 0 H LYS A 135 4.055 4.711 14.462 1.00 0.00 H new ATOM 0 HA LYS A 135 1.501 3.792 13.717 1.00 0.00 H new ATOM 0 HB2 LYS A 135 2.924 3.321 15.842 1.00 0.00 H new ATOM 0 HB3 LYS A 135 2.291 4.833 16.462 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -0.039 3.697 15.555 1.00 0.00 H new ATOM 0 HG3 LYS A 135 0.861 2.246 15.949 1.00 0.00 H new ATOM 0 HD2 LYS A 135 1.350 3.209 18.240 1.00 0.00 H new ATOM 0 HD3 LYS A 135 0.368 4.604 17.839 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -0.728 1.761 17.636 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -0.805 2.672 19.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -2.820 3.026 17.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -1.939 4.477 17.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -1.968 3.474 16.504 1.00 0.00 H new ATOM 2093 N ALA A 136 1.635 6.861 14.972 1.00 0.00 N ATOM 2094 CA ALA A 136 0.919 8.130 15.040 1.00 0.00 C ATOM 2095 C ALA A 136 0.587 8.633 13.640 1.00 0.00 C ATOM 2096 O ALA A 136 -0.480 9.203 13.414 1.00 0.00 O ATOM 2097 CB ALA A 136 1.774 9.169 15.766 1.00 0.00 C ATOM 0 H ALA A 136 2.541 6.859 15.441 1.00 0.00 H new ATOM 0 HA ALA A 136 -0.011 7.974 15.588 1.00 0.00 H new ATOM 0 HB1 ALA A 136 1.234 10.115 15.814 1.00 0.00 H new ATOM 0 HB2 ALA A 136 1.988 8.822 16.777 1.00 0.00 H new ATOM 0 HB3 ALA A 136 2.710 9.312 15.226 1.00 0.00 H new ATOM 2103 N LEU A 137 1.502 8.412 12.702 1.00 0.00 N ATOM 2104 CA LEU A 137 1.300 8.832 11.337 1.00 0.00 C ATOM 2105 C LEU A 137 0.145 8.050 10.728 1.00 0.00 C ATOM 2106 O LEU A 137 -0.862 8.626 10.312 1.00 0.00 O ATOM 2107 CB LEU A 137 2.595 8.551 10.583 1.00 0.00 C ATOM 2108 CG LEU A 137 2.944 9.692 9.622 1.00 0.00 C ATOM 2109 CD1 LEU A 137 4.339 9.460 9.042 1.00 0.00 C ATOM 2110 CD2 LEU A 137 1.929 9.727 8.494 1.00 0.00 C ATOM 0 H LEU A 137 2.391 7.942 12.872 1.00 0.00 H new ATOM 0 HA LEU A 137 1.053 9.892 11.282 1.00 0.00 H new ATOM 0 HB2 LEU A 137 3.409 8.412 11.295 1.00 0.00 H new ATOM 0 HB3 LEU A 137 2.497 7.620 10.024 1.00 0.00 H new ATOM 0 HG LEU A 137 2.926 10.640 10.160 1.00 0.00 H new ATOM 0 HD11 LEU A 137 4.588 10.271 8.358 1.00 0.00 H new ATOM 0 HD12 LEU A 137 5.069 9.430 9.851 1.00 0.00 H new ATOM 0 HD13 LEU A 137 4.356 8.513 8.503 1.00 0.00 H new ATOM 0 HD21 LEU A 137 2.175 10.538 7.808 1.00 0.00 H new ATOM 0 HD22 LEU A 137 1.949 8.779 7.957 1.00 0.00 H new ATOM 0 HD23 LEU A 137 0.933 9.889 8.906 1.00 0.00 H new ATOM 2122 N ALA A 138 0.302 6.737 10.676 1.00 0.00 N ATOM 2123 CA ALA A 138 -0.730 5.884 10.113 1.00 0.00 C ATOM 2124 C ALA A 138 -2.069 6.139 10.805 1.00 0.00 C ATOM 2125 O ALA A 138 -3.118 6.122 10.168 1.00 0.00 O ATOM 2126 CB ALA A 138 -0.333 4.406 10.242 1.00 0.00 C ATOM 0 H ALA A 138 1.128 6.243 11.014 1.00 0.00 H new ATOM 0 HA ALA A 138 -0.837 6.122 9.055 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -1.117 3.780 9.815 1.00 0.00 H new ATOM 0 HB2 ALA A 138 0.601 4.232 9.708 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -0.201 4.155 11.295 1.00 0.00 H new ATOM 2132 N GLU A 139 -2.031 6.395 12.110 1.00 0.00 N ATOM 2133 CA GLU A 139 -3.252 6.664 12.853 1.00 0.00 C ATOM 2134 C GLU A 139 -3.846 8.004 12.418 1.00 0.00 C ATOM 2135 O GLU A 139 -5.063 8.188 12.438 1.00 0.00 O ATOM 2136 CB GLU A 139 -2.945 6.663 14.359 1.00 0.00 C ATOM 2137 CG GLU A 139 -3.758 7.739 15.072 1.00 0.00 C ATOM 2138 CD GLU A 139 -3.661 7.545 16.582 1.00 0.00 C ATOM 2139 OE1 GLU A 139 -4.440 6.769 17.111 1.00 0.00 O ATOM 2140 OE2 GLU A 139 -2.810 8.177 17.187 1.00 0.00 O ATOM 0 H GLU A 139 -1.177 6.421 12.667 1.00 0.00 H new ATOM 0 HA GLU A 139 -3.986 5.885 12.645 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -3.175 5.685 14.782 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -1.881 6.837 14.519 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -3.389 8.727 14.799 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -4.800 7.689 14.756 1.00 0.00 H new ATOM 2147 N SER A 140 -2.978 8.936 12.038 1.00 0.00 N ATOM 2148 CA SER A 140 -3.427 10.259 11.616 1.00 0.00 C ATOM 2149 C SER A 140 -4.274 10.167 10.351 1.00 0.00 C ATOM 2150 O SER A 140 -5.343 10.772 10.266 1.00 0.00 O ATOM 2151 CB SER A 140 -2.220 11.160 11.356 1.00 0.00 C ATOM 2152 OG SER A 140 -1.717 10.907 10.051 1.00 0.00 O ATOM 0 H SER A 140 -1.967 8.802 12.013 1.00 0.00 H new ATOM 0 HA SER A 140 -4.036 10.683 12.414 1.00 0.00 H new ATOM 0 HB2 SER A 140 -2.506 12.207 11.451 1.00 0.00 H new ATOM 0 HB3 SER A 140 -1.445 10.973 12.099 1.00 0.00 H new ATOM 0 HG SER A 140 -1.293 10.024 10.029 1.00 0.00 H new ATOM 2158 N TRP A 141 -3.796 9.406 9.374 1.00 0.00 N ATOM 2159 CA TRP A 141 -4.531 9.247 8.124 1.00 0.00 C ATOM 2160 C TRP A 141 -5.495 8.071 8.223 1.00 0.00 C ATOM 2161 O TRP A 141 -6.254 7.795 7.294 1.00 0.00 O ATOM 2162 CB TRP A 141 -3.561 9.011 6.967 1.00 0.00 C ATOM 2163 CG TRP A 141 -2.582 10.141 6.886 1.00 0.00 C ATOM 2164 CD1 TRP A 141 -1.245 10.018 7.053 1.00 0.00 C ATOM 2165 CD2 TRP A 141 -2.833 11.554 6.614 1.00 0.00 C ATOM 2166 NE1 TRP A 141 -0.660 11.262 6.908 1.00 0.00 N ATOM 2167 CE2 TRP A 141 -1.595 12.241 6.637 1.00 0.00 C ATOM 2168 CE3 TRP A 141 -4.000 12.301 6.358 1.00 0.00 C ATOM 2169 CZ2 TRP A 141 -1.517 13.616 6.412 1.00 0.00 C ATOM 2170 CZ3 TRP A 141 -3.921 13.685 6.130 1.00 0.00 C ATOM 2171 CH2 TRP A 141 -2.683 14.340 6.159 1.00 0.00 C ATOM 0 H TRP A 141 -2.914 8.895 9.420 1.00 0.00 H new ATOM 0 HA TRP A 141 -5.097 10.160 7.940 1.00 0.00 H new ATOM 0 HB2 TRP A 141 -3.032 8.069 7.111 1.00 0.00 H new ATOM 0 HB3 TRP A 141 -4.112 8.927 6.030 1.00 0.00 H new ATOM 0 HD1 TRP A 141 -0.720 9.098 7.265 1.00 0.00 H new ATOM 0 HE1 TRP A 141 0.342 11.436 6.991 1.00 0.00 H new ATOM 0 HE3 TRP A 141 -4.960 11.807 6.337 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 -0.560 14.117 6.434 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 -4.821 14.248 5.931 1.00 0.00 H new ATOM 0 HH2 TRP A 141 -2.631 15.405 5.986 1.00 0.00 H new ATOM 2182 N ASN A 142 -5.448 7.377 9.353 1.00 0.00 N ATOM 2183 CA ASN A 142 -6.307 6.219 9.574 1.00 0.00 C ATOM 2184 C ASN A 142 -5.773 5.027 8.793 1.00 0.00 C ATOM 2185 O ASN A 142 -6.506 4.090 8.478 1.00 0.00 O ATOM 2186 CB ASN A 142 -7.752 6.515 9.156 1.00 0.00 C ATOM 2187 CG ASN A 142 -8.704 6.009 10.233 1.00 0.00 C ATOM 2188 OD1 ASN A 142 -9.618 5.236 9.946 1.00 0.00 O ATOM 2189 ND2 ASN A 142 -8.537 6.402 11.467 1.00 0.00 N ATOM 0 H ASN A 142 -4.825 7.595 10.131 1.00 0.00 H new ATOM 0 HA ASN A 142 -6.304 5.988 10.639 1.00 0.00 H new ATOM 0 HB2 ASN A 142 -7.888 7.587 9.009 1.00 0.00 H new ATOM 0 HB3 ASN A 142 -7.973 6.033 8.204 1.00 0.00 H new ATOM 0 HD21 ASN A 142 -9.165 6.068 12.198 1.00 0.00 H new ATOM 0 HD22 ASN A 142 -7.778 7.043 11.700 1.00 0.00 H new ATOM 2196 N ALA A 143 -4.481 5.077 8.496 1.00 0.00 N ATOM 2197 CA ALA A 143 -3.819 4.015 7.767 1.00 0.00 C ATOM 2198 C ALA A 143 -3.265 2.996 8.736 1.00 0.00 C ATOM 2199 O ALA A 143 -3.216 3.234 9.943 1.00 0.00 O ATOM 2200 CB ALA A 143 -2.666 4.584 6.945 1.00 0.00 C ATOM 0 H ALA A 143 -3.870 5.852 8.754 1.00 0.00 H new ATOM 0 HA ALA A 143 -4.545 3.543 7.105 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -2.175 3.778 6.401 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -3.051 5.318 6.237 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -1.947 5.064 7.610 1.00 0.00 H new ATOM 2206 N ALA A 144 -2.855 1.863 8.198 1.00 0.00 N ATOM 2207 CA ALA A 144 -2.301 0.803 9.025 1.00 0.00 C ATOM 2208 C ALA A 144 -0.788 0.688 8.830 1.00 0.00 C ATOM 2209 O ALA A 144 -0.293 0.712 7.705 1.00 0.00 O ATOM 2210 CB ALA A 144 -2.990 -0.506 8.681 1.00 0.00 C ATOM 0 H ALA A 144 -2.893 1.652 7.201 1.00 0.00 H new ATOM 0 HA ALA A 144 -2.477 1.040 10.074 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -2.580 -1.306 9.297 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -4.060 -0.415 8.870 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -2.826 -0.738 7.629 1.00 0.00 H new ATOM 2216 N PHE A 145 -0.066 0.580 9.942 1.00 0.00 N ATOM 2217 CA PHE A 145 1.390 0.482 9.915 1.00 0.00 C ATOM 2218 C PHE A 145 1.810 -0.985 9.993 1.00 0.00 C ATOM 2219 O PHE A 145 1.414 -1.714 10.902 1.00 0.00 O ATOM 2220 CB PHE A 145 1.935 1.283 11.105 1.00 0.00 C ATOM 2221 CG PHE A 145 3.430 1.118 11.246 1.00 0.00 C ATOM 2222 CD1 PHE A 145 3.985 -0.086 11.707 1.00 0.00 C ATOM 2223 CD2 PHE A 145 4.263 2.191 10.928 1.00 0.00 C ATOM 2224 CE1 PHE A 145 5.370 -0.209 11.834 1.00 0.00 C ATOM 2225 CE2 PHE A 145 5.651 2.067 11.061 1.00 0.00 C ATOM 2226 CZ PHE A 145 6.204 0.865 11.510 1.00 0.00 C ATOM 0 H PHE A 145 -0.469 0.558 10.879 1.00 0.00 H new ATOM 0 HA PHE A 145 1.793 0.889 8.988 1.00 0.00 H new ATOM 0 HB2 PHE A 145 1.695 2.338 10.975 1.00 0.00 H new ATOM 0 HB3 PHE A 145 1.444 0.955 12.021 1.00 0.00 H new ATOM 0 HD1 PHE A 145 3.342 -0.915 11.963 1.00 0.00 H new ATOM 0 HD2 PHE A 145 3.836 3.119 10.578 1.00 0.00 H new ATOM 0 HE1 PHE A 145 5.798 -1.137 12.184 1.00 0.00 H new ATOM 0 HE2 PHE A 145 6.294 2.900 10.817 1.00 0.00 H new ATOM 0 HZ PHE A 145 7.275 0.766 11.607 1.00 0.00 H new ATOM 2236 N LEU A 146 2.569 -1.418 8.981 1.00 0.00 N ATOM 2237 CA LEU A 146 3.010 -2.802 8.843 1.00 0.00 C ATOM 2238 C LEU A 146 4.490 -2.860 8.484 1.00 0.00 C ATOM 2239 O LEU A 146 4.934 -2.109 7.642 1.00 0.00 O ATOM 2240 CB LEU A 146 2.218 -3.441 7.706 1.00 0.00 C ATOM 2241 CG LEU A 146 1.198 -4.442 8.235 1.00 0.00 C ATOM 2242 CD1 LEU A 146 1.901 -5.631 8.858 1.00 0.00 C ATOM 2243 CD2 LEU A 146 0.314 -3.766 9.253 1.00 0.00 C ATOM 0 H LEU A 146 2.895 -0.809 8.230 1.00 0.00 H new ATOM 0 HA LEU A 146 2.851 -3.325 9.786 1.00 0.00 H new ATOM 0 HB2 LEU A 146 1.707 -2.665 7.135 1.00 0.00 H new ATOM 0 HB3 LEU A 146 2.902 -3.943 7.021 1.00 0.00 H new ATOM 0 HG LEU A 146 0.585 -4.801 7.408 1.00 0.00 H new ATOM 0 HD11 LEU A 146 1.160 -6.337 9.231 1.00 0.00 H new ATOM 0 HD12 LEU A 146 2.523 -6.120 8.108 1.00 0.00 H new ATOM 0 HD13 LEU A 146 2.527 -5.292 9.683 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -0.416 -4.481 9.632 1.00 0.00 H new ATOM 0 HD22 LEU A 146 0.924 -3.398 10.078 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -0.206 -2.930 8.785 1.00 0.00 H new ATOM 2255 N GLU A 147 5.243 -3.758 9.106 1.00 0.00 N ATOM 2256 CA GLU A 147 6.673 -3.899 8.794 1.00 0.00 C ATOM 2257 C GLU A 147 6.947 -5.338 8.379 1.00 0.00 C ATOM 2258 O GLU A 147 6.827 -6.262 9.184 1.00 0.00 O ATOM 2259 CB GLU A 147 7.528 -3.523 10.012 1.00 0.00 C ATOM 2260 CG GLU A 147 9.020 -3.592 9.654 1.00 0.00 C ATOM 2261 CD GLU A 147 9.790 -2.481 10.369 1.00 0.00 C ATOM 2262 OE1 GLU A 147 9.313 -1.351 10.363 1.00 0.00 O ATOM 2263 OE2 GLU A 147 10.845 -2.777 10.922 1.00 0.00 O ATOM 0 H GLU A 147 4.899 -4.397 9.823 1.00 0.00 H new ATOM 0 HA GLU A 147 6.935 -3.226 7.978 1.00 0.00 H new ATOM 0 HB2 GLU A 147 7.273 -2.518 10.348 1.00 0.00 H new ATOM 0 HB3 GLU A 147 7.313 -4.200 10.839 1.00 0.00 H new ATOM 0 HG2 GLU A 147 9.424 -4.564 9.937 1.00 0.00 H new ATOM 0 HG3 GLU A 147 9.147 -3.496 8.576 1.00 0.00 H new ATOM 2270 N SER A 148 7.285 -5.524 7.106 1.00 0.00 N ATOM 2271 CA SER A 148 7.536 -6.861 6.585 1.00 0.00 C ATOM 2272 C SER A 148 8.738 -6.867 5.650 1.00 0.00 C ATOM 2273 O SER A 148 9.397 -5.850 5.469 1.00 0.00 O ATOM 2274 CB SER A 148 6.301 -7.343 5.826 1.00 0.00 C ATOM 2275 OG SER A 148 5.913 -6.349 4.887 1.00 0.00 O ATOM 0 H SER A 148 7.390 -4.773 6.424 1.00 0.00 H new ATOM 0 HA SER A 148 7.749 -7.526 7.422 1.00 0.00 H new ATOM 0 HB2 SER A 148 6.517 -8.280 5.313 1.00 0.00 H new ATOM 0 HB3 SER A 148 5.486 -7.541 6.522 1.00 0.00 H new ATOM 0 HG SER A 148 5.636 -6.779 4.051 1.00 0.00 H new ATOM 2281 N SER A 149 9.025 -8.027 5.068 1.00 0.00 N ATOM 2282 CA SER A 149 10.156 -8.149 4.154 1.00 0.00 C ATOM 2283 C SER A 149 9.804 -9.030 2.960 1.00 0.00 C ATOM 2284 O SER A 149 9.315 -10.143 3.139 1.00 0.00 O ATOM 2285 CB SER A 149 11.348 -8.761 4.888 1.00 0.00 C ATOM 2286 OG SER A 149 10.927 -9.212 6.168 1.00 0.00 O ATOM 0 H SER A 149 8.497 -8.888 5.210 1.00 0.00 H new ATOM 0 HA SER A 149 10.408 -7.152 3.793 1.00 0.00 H new ATOM 0 HB2 SER A 149 11.757 -9.592 4.313 1.00 0.00 H new ATOM 0 HB3 SER A 149 12.144 -8.023 4.993 1.00 0.00 H new ATOM 0 HG SER A 149 11.429 -10.017 6.412 1.00 0.00 H new ATOM 2292 N ALA A 150 10.080 -8.560 1.743 1.00 0.00 N ATOM 2293 CA ALA A 150 9.812 -9.373 0.577 1.00 0.00 C ATOM 2294 C ALA A 150 10.407 -10.749 0.822 1.00 0.00 C ATOM 2295 O ALA A 150 9.686 -11.729 0.940 1.00 0.00 O ATOM 2296 CB ALA A 150 10.448 -8.743 -0.668 1.00 0.00 C ATOM 0 H ALA A 150 10.479 -7.642 1.550 1.00 0.00 H new ATOM 0 HA ALA A 150 8.738 -9.446 0.409 1.00 0.00 H new ATOM 0 HB1 ALA A 150 10.238 -9.365 -1.538 1.00 0.00 H new ATOM 0 HB2 ALA A 150 10.032 -7.748 -0.825 1.00 0.00 H new ATOM 0 HB3 ALA A 150 11.526 -8.668 -0.527 1.00 0.00 H new ATOM 2302 N LYS A 151 11.733 -10.791 0.930 1.00 0.00 N ATOM 2303 CA LYS A 151 12.449 -12.042 1.187 1.00 0.00 C ATOM 2304 C LYS A 151 11.632 -12.973 2.082 1.00 0.00 C ATOM 2305 O LYS A 151 11.727 -14.195 1.973 1.00 0.00 O ATOM 2306 CB LYS A 151 13.790 -11.735 1.857 1.00 0.00 C ATOM 2307 CG LYS A 151 14.482 -13.040 2.253 1.00 0.00 C ATOM 2308 CD LYS A 151 15.971 -12.774 2.488 1.00 0.00 C ATOM 2309 CE LYS A 151 16.629 -14.023 3.073 1.00 0.00 C ATOM 2310 NZ LYS A 151 16.371 -14.076 4.540 1.00 0.00 N ATOM 0 H LYS A 151 12.336 -9.973 0.844 1.00 0.00 H new ATOM 0 HA LYS A 151 12.615 -12.543 0.233 1.00 0.00 H new ATOM 0 HB2 LYS A 151 14.425 -11.168 1.177 1.00 0.00 H new ATOM 0 HB3 LYS A 151 13.633 -11.114 2.739 1.00 0.00 H new ATOM 0 HG2 LYS A 151 14.027 -13.447 3.156 1.00 0.00 H new ATOM 0 HG3 LYS A 151 14.354 -13.785 1.468 1.00 0.00 H new ATOM 0 HD2 LYS A 151 16.455 -12.501 1.550 1.00 0.00 H new ATOM 0 HD3 LYS A 151 16.097 -11.932 3.168 1.00 0.00 H new ATOM 0 HE2 LYS A 151 16.233 -14.916 2.590 1.00 0.00 H new ATOM 0 HE3 LYS A 151 17.702 -14.006 2.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 17.276 -14.134 5.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 15.862 -13.218 4.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 15.795 -14.913 4.761 1.00 0.00 H new ATOM 2324 N GLU A 152 10.825 -12.380 2.958 1.00 0.00 N ATOM 2325 CA GLU A 152 9.980 -13.154 3.868 1.00 0.00 C ATOM 2326 C GLU A 152 8.504 -12.984 3.506 1.00 0.00 C ATOM 2327 O GLU A 152 7.898 -11.952 3.794 1.00 0.00 O ATOM 2328 CB GLU A 152 10.213 -12.697 5.310 1.00 0.00 C ATOM 2329 CG GLU A 152 11.691 -12.875 5.667 1.00 0.00 C ATOM 2330 CD GLU A 152 11.889 -12.724 7.171 1.00 0.00 C ATOM 2331 OE1 GLU A 152 12.035 -11.598 7.619 1.00 0.00 O ATOM 2332 OE2 GLU A 152 11.895 -13.735 7.853 1.00 0.00 O ATOM 0 H GLU A 152 10.737 -11.369 3.058 1.00 0.00 H new ATOM 0 HA GLU A 152 10.244 -14.207 3.774 1.00 0.00 H new ATOM 0 HB2 GLU A 152 9.923 -11.652 5.423 1.00 0.00 H new ATOM 0 HB3 GLU A 152 9.590 -13.276 5.992 1.00 0.00 H new ATOM 0 HG2 GLU A 152 12.035 -13.857 5.344 1.00 0.00 H new ATOM 0 HG3 GLU A 152 12.293 -12.136 5.137 1.00 0.00 H new ATOM 2339 N ASN A 153 7.937 -14.005 2.866 1.00 0.00 N ATOM 2340 CA ASN A 153 6.533 -13.968 2.457 1.00 0.00 C ATOM 2341 C ASN A 153 5.605 -13.919 3.664 1.00 0.00 C ATOM 2342 O ASN A 153 4.700 -13.089 3.723 1.00 0.00 O ATOM 2343 CB ASN A 153 6.211 -15.205 1.617 1.00 0.00 C ATOM 2344 CG ASN A 153 7.165 -16.338 1.978 1.00 0.00 C ATOM 2345 OD1 ASN A 153 7.070 -16.908 3.065 1.00 0.00 O ATOM 2346 ND2 ASN A 153 8.085 -16.700 1.127 1.00 0.00 N ATOM 0 H ASN A 153 8.426 -14.866 2.620 1.00 0.00 H new ATOM 0 HA ASN A 153 6.375 -13.065 1.868 1.00 0.00 H new ATOM 0 HB2 ASN A 153 5.181 -15.516 1.791 1.00 0.00 H new ATOM 0 HB3 ASN A 153 6.298 -14.968 0.557 1.00 0.00 H new ATOM 0 HD21 ASN A 153 8.727 -17.457 1.362 1.00 0.00 H new ATOM 0 HD22 ASN A 153 8.162 -16.226 0.227 1.00 0.00 H new ATOM 2353 N GLN A 154 5.832 -14.814 4.617 1.00 0.00 N ATOM 2354 CA GLN A 154 5.006 -14.868 5.820 1.00 0.00 C ATOM 2355 C GLN A 154 4.617 -13.471 6.273 1.00 0.00 C ATOM 2356 O GLN A 154 3.436 -13.171 6.458 1.00 0.00 O ATOM 2357 CB GLN A 154 5.765 -15.573 6.936 1.00 0.00 C ATOM 2358 CG GLN A 154 6.574 -16.721 6.338 1.00 0.00 C ATOM 2359 CD GLN A 154 7.082 -17.636 7.446 1.00 0.00 C ATOM 2360 OE1 GLN A 154 6.822 -17.345 8.691 1.00 0.00 O flip ATOM 2361 NE2 GLN A 154 7.732 -18.645 7.170 1.00 0.00 N flip ATOM 0 H GLN A 154 6.577 -15.510 4.583 1.00 0.00 H new ATOM 0 HA GLN A 154 4.097 -15.423 5.587 1.00 0.00 H new ATOM 0 HB2 GLN A 154 6.426 -14.871 7.444 1.00 0.00 H new ATOM 0 HB3 GLN A 154 5.069 -15.953 7.684 1.00 0.00 H new ATOM 0 HG2 GLN A 154 5.956 -17.288 5.642 1.00 0.00 H new ATOM 0 HG3 GLN A 154 7.415 -16.326 5.768 1.00 0.00 H new ATOM 0 HE21 GLN A 154 7.934 -18.871 6.196 1.00 0.00 H new ATOM 0 HE22 GLN A 154 8.068 -19.255 7.915 1.00 0.00 H new ATOM 2370 N THR A 155 5.614 -12.617 6.441 1.00 0.00 N ATOM 2371 CA THR A 155 5.362 -11.250 6.863 1.00 0.00 C ATOM 2372 C THR A 155 4.432 -10.566 5.865 1.00 0.00 C ATOM 2373 O THR A 155 3.523 -9.832 6.251 1.00 0.00 O ATOM 2374 CB THR A 155 6.678 -10.479 6.964 1.00 0.00 C ATOM 2375 OG1 THR A 155 7.304 -10.437 5.690 1.00 0.00 O ATOM 2376 CG2 THR A 155 7.604 -11.163 7.965 1.00 0.00 C ATOM 0 H THR A 155 6.597 -12.844 6.293 1.00 0.00 H new ATOM 0 HA THR A 155 4.887 -11.263 7.844 1.00 0.00 H new ATOM 0 HB THR A 155 6.472 -9.463 7.302 1.00 0.00 H new ATOM 0 HG1 THR A 155 7.520 -11.348 5.402 1.00 0.00 H new ATOM 0 HG21 THR A 155 8.540 -10.609 8.032 1.00 0.00 H new ATOM 0 HG22 THR A 155 7.126 -11.188 8.944 1.00 0.00 H new ATOM 0 HG23 THR A 155 7.808 -12.181 7.635 1.00 0.00 H new ATOM 2384 N ALA A 156 4.658 -10.827 4.580 1.00 0.00 N ATOM 2385 CA ALA A 156 3.826 -10.245 3.531 1.00 0.00 C ATOM 2386 C ALA A 156 2.377 -10.637 3.742 1.00 0.00 C ATOM 2387 O ALA A 156 1.506 -9.791 3.946 1.00 0.00 O ATOM 2388 CB ALA A 156 4.272 -10.760 2.163 1.00 0.00 C ATOM 0 H ALA A 156 5.405 -11.434 4.242 1.00 0.00 H new ATOM 0 HA ALA A 156 3.929 -9.161 3.572 1.00 0.00 H new ATOM 0 HB1 ALA A 156 3.646 -10.320 1.387 1.00 0.00 H new ATOM 0 HB2 ALA A 156 5.312 -10.482 1.991 1.00 0.00 H new ATOM 0 HB3 ALA A 156 4.177 -11.845 2.134 1.00 0.00 H new ATOM 2394 N VAL A 157 2.139 -11.936 3.686 1.00 0.00 N ATOM 2395 CA VAL A 157 0.798 -12.473 3.866 1.00 0.00 C ATOM 2396 C VAL A 157 0.074 -11.748 4.993 1.00 0.00 C ATOM 2397 O VAL A 157 -1.114 -11.433 4.885 1.00 0.00 O ATOM 2398 CB VAL A 157 0.883 -13.964 4.188 1.00 0.00 C ATOM 2399 CG1 VAL A 157 -0.525 -14.544 4.328 1.00 0.00 C ATOM 2400 CG2 VAL A 157 1.619 -14.686 3.060 1.00 0.00 C ATOM 0 H VAL A 157 2.857 -12.641 3.517 1.00 0.00 H new ATOM 0 HA VAL A 157 0.238 -12.327 2.942 1.00 0.00 H new ATOM 0 HB VAL A 157 1.424 -14.100 5.125 1.00 0.00 H new ATOM 0 HG11 VAL A 157 -0.459 -15.608 4.558 1.00 0.00 H new ATOM 0 HG12 VAL A 157 -1.052 -14.031 5.133 1.00 0.00 H new ATOM 0 HG13 VAL A 157 -1.069 -14.408 3.394 1.00 0.00 H new ATOM 0 HG21 VAL A 157 1.681 -15.750 3.288 1.00 0.00 H new ATOM 0 HG22 VAL A 157 1.078 -14.546 2.124 1.00 0.00 H new ATOM 0 HG23 VAL A 157 2.625 -14.277 2.962 1.00 0.00 H new ATOM 2410 N ASP A 158 0.796 -11.487 6.076 1.00 0.00 N ATOM 2411 CA ASP A 158 0.206 -10.801 7.220 1.00 0.00 C ATOM 2412 C ASP A 158 -0.200 -9.382 6.841 1.00 0.00 C ATOM 2413 O ASP A 158 -1.249 -8.887 7.262 1.00 0.00 O ATOM 2414 CB ASP A 158 1.209 -10.755 8.375 1.00 0.00 C ATOM 2415 CG ASP A 158 0.473 -10.816 9.709 1.00 0.00 C ATOM 2416 OD1 ASP A 158 0.062 -9.771 10.185 1.00 0.00 O ATOM 2417 OD2 ASP A 158 0.329 -11.907 10.234 1.00 0.00 O ATOM 0 H ASP A 158 1.779 -11.736 6.187 1.00 0.00 H new ATOM 0 HA ASP A 158 -0.682 -11.351 7.532 1.00 0.00 H new ATOM 0 HB2 ASP A 158 1.905 -11.590 8.296 1.00 0.00 H new ATOM 0 HB3 ASP A 158 1.800 -9.841 8.318 1.00 0.00 H new ATOM 2422 N VAL A 159 0.640 -8.734 6.044 1.00 0.00 N ATOM 2423 CA VAL A 159 0.379 -7.382 5.613 1.00 0.00 C ATOM 2424 C VAL A 159 -0.891 -7.338 4.777 1.00 0.00 C ATOM 2425 O VAL A 159 -1.680 -6.397 4.871 1.00 0.00 O ATOM 2426 CB VAL A 159 1.589 -6.867 4.818 1.00 0.00 C ATOM 2427 CG1 VAL A 159 1.399 -5.397 4.488 1.00 0.00 C ATOM 2428 CG2 VAL A 159 2.863 -7.012 5.656 1.00 0.00 C ATOM 0 H VAL A 159 1.509 -9.131 5.686 1.00 0.00 H new ATOM 0 HA VAL A 159 0.229 -6.737 6.478 1.00 0.00 H new ATOM 0 HB VAL A 159 1.676 -7.450 3.901 1.00 0.00 H new ATOM 0 HG11 VAL A 159 2.259 -5.036 3.924 1.00 0.00 H new ATOM 0 HG12 VAL A 159 0.496 -5.272 3.891 1.00 0.00 H new ATOM 0 HG13 VAL A 159 1.305 -4.826 5.412 1.00 0.00 H new ATOM 0 HG21 VAL A 159 3.717 -6.645 5.086 1.00 0.00 H new ATOM 0 HG22 VAL A 159 2.763 -6.432 6.574 1.00 0.00 H new ATOM 0 HG23 VAL A 159 3.017 -8.062 5.905 1.00 0.00 H new ATOM 2438 N PHE A 160 -1.086 -8.366 3.974 1.00 0.00 N ATOM 2439 CA PHE A 160 -2.269 -8.445 3.133 1.00 0.00 C ATOM 2440 C PHE A 160 -3.537 -8.475 3.984 1.00 0.00 C ATOM 2441 O PHE A 160 -4.342 -7.555 3.936 1.00 0.00 O ATOM 2442 CB PHE A 160 -2.211 -9.703 2.271 1.00 0.00 C ATOM 2443 CG PHE A 160 -3.520 -9.859 1.537 1.00 0.00 C ATOM 2444 CD1 PHE A 160 -3.903 -8.907 0.586 1.00 0.00 C ATOM 2445 CD2 PHE A 160 -4.353 -10.951 1.808 1.00 0.00 C ATOM 2446 CE1 PHE A 160 -5.116 -9.046 -0.095 1.00 0.00 C ATOM 2447 CE2 PHE A 160 -5.567 -11.091 1.126 1.00 0.00 C ATOM 2448 CZ PHE A 160 -5.950 -10.137 0.175 1.00 0.00 C ATOM 0 H PHE A 160 -0.446 -9.155 3.885 1.00 0.00 H new ATOM 0 HA PHE A 160 -2.293 -7.562 2.495 1.00 0.00 H new ATOM 0 HB2 PHE A 160 -1.387 -9.634 1.560 1.00 0.00 H new ATOM 0 HB3 PHE A 160 -2.023 -10.577 2.894 1.00 0.00 H new ATOM 0 HD1 PHE A 160 -3.261 -8.064 0.378 1.00 0.00 H new ATOM 0 HD2 PHE A 160 -4.059 -11.685 2.543 1.00 0.00 H new ATOM 0 HE1 PHE A 160 -5.410 -8.311 -0.830 1.00 0.00 H new ATOM 0 HE2 PHE A 160 -6.209 -11.935 1.333 1.00 0.00 H new ATOM 0 HZ PHE A 160 -6.888 -10.243 -0.350 1.00 0.00 H new ATOM 2458 N ARG A 161 -3.713 -9.534 4.765 1.00 0.00 N ATOM 2459 CA ARG A 161 -4.897 -9.652 5.603 1.00 0.00 C ATOM 2460 C ARG A 161 -5.242 -8.315 6.253 1.00 0.00 C ATOM 2461 O ARG A 161 -6.366 -7.826 6.132 1.00 0.00 O ATOM 2462 CB ARG A 161 -4.663 -10.713 6.674 1.00 0.00 C ATOM 2463 CG ARG A 161 -5.915 -11.580 6.840 1.00 0.00 C ATOM 2464 CD ARG A 161 -7.104 -10.710 7.254 1.00 0.00 C ATOM 2465 NE ARG A 161 -7.974 -11.455 8.162 1.00 0.00 N ATOM 2466 CZ ARG A 161 -9.301 -11.323 8.134 1.00 0.00 C ATOM 2467 NH1 ARG A 161 -9.871 -10.497 7.299 1.00 0.00 N ATOM 2468 NH2 ARG A 161 -10.037 -12.022 8.955 1.00 0.00 N ATOM 0 H ARG A 161 -3.059 -10.314 4.835 1.00 0.00 H new ATOM 0 HA ARG A 161 -5.738 -9.949 4.976 1.00 0.00 H new ATOM 0 HB2 ARG A 161 -3.813 -11.337 6.399 1.00 0.00 H new ATOM 0 HB3 ARG A 161 -4.414 -10.235 7.622 1.00 0.00 H new ATOM 0 HG2 ARG A 161 -6.138 -12.094 5.905 1.00 0.00 H new ATOM 0 HG3 ARG A 161 -5.738 -12.349 7.592 1.00 0.00 H new ATOM 0 HD2 ARG A 161 -6.749 -9.801 7.740 1.00 0.00 H new ATOM 0 HD3 ARG A 161 -7.664 -10.401 6.372 1.00 0.00 H new ATOM 0 HE ARG A 161 -7.554 -12.094 8.837 1.00 0.00 H new ATOM 0 HH11 ARG A 161 -9.301 -9.944 6.659 1.00 0.00 H new ATOM 0 HH12 ARG A 161 -10.887 -10.404 7.287 1.00 0.00 H new ATOM 0 HH21 ARG A 161 -9.597 -12.665 9.613 1.00 0.00 H new ATOM 0 HH22 ARG A 161 -11.052 -11.925 8.938 1.00 0.00 H new ATOM 2482 N ARG A 162 -4.272 -7.724 6.936 1.00 0.00 N ATOM 2483 CA ARG A 162 -4.487 -6.446 7.590 1.00 0.00 C ATOM 2484 C ARG A 162 -4.925 -5.388 6.583 1.00 0.00 C ATOM 2485 O ARG A 162 -5.647 -4.454 6.934 1.00 0.00 O ATOM 2486 CB ARG A 162 -3.199 -5.990 8.274 1.00 0.00 C ATOM 2487 CG ARG A 162 -3.200 -6.448 9.735 1.00 0.00 C ATOM 2488 CD ARG A 162 -3.334 -7.970 9.798 1.00 0.00 C ATOM 2489 NE ARG A 162 -4.725 -8.345 10.024 1.00 0.00 N ATOM 2490 CZ ARG A 162 -5.042 -9.492 10.617 1.00 0.00 C ATOM 2491 NH1 ARG A 162 -4.103 -10.314 10.998 1.00 0.00 N ATOM 2492 NH2 ARG A 162 -6.296 -9.799 10.815 1.00 0.00 N ATOM 0 H ARG A 162 -3.334 -8.108 7.050 1.00 0.00 H new ATOM 0 HA ARG A 162 -5.275 -6.571 8.333 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -2.334 -6.402 7.754 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -3.114 -4.905 8.223 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -2.279 -6.134 10.225 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -4.023 -5.978 10.273 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -2.977 -8.412 8.868 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -2.709 -8.364 10.599 1.00 0.00 H new ATOM 0 HE ARG A 162 -5.469 -7.716 9.722 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -3.123 -10.077 10.841 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -4.349 -11.193 11.453 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -7.031 -9.159 10.515 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -6.540 -10.679 11.270 1.00 0.00 H new ATOM 2506 N ILE A 163 -4.483 -5.524 5.331 1.00 0.00 N ATOM 2507 CA ILE A 163 -4.853 -4.543 4.312 1.00 0.00 C ATOM 2508 C ILE A 163 -6.349 -4.631 4.006 1.00 0.00 C ATOM 2509 O ILE A 163 -6.993 -3.616 3.737 1.00 0.00 O ATOM 2510 CB ILE A 163 -3.997 -4.717 3.033 1.00 0.00 C ATOM 2511 CG1 ILE A 163 -3.612 -3.326 2.482 1.00 0.00 C ATOM 2512 CG2 ILE A 163 -4.779 -5.480 1.946 1.00 0.00 C ATOM 2513 CD1 ILE A 163 -3.377 -3.386 0.965 1.00 0.00 C ATOM 0 H ILE A 163 -3.884 -6.283 5.005 1.00 0.00 H new ATOM 0 HA ILE A 163 -4.649 -3.546 4.702 1.00 0.00 H new ATOM 0 HB ILE A 163 -3.105 -5.287 3.293 1.00 0.00 H new ATOM 0 HG12 ILE A 163 -4.404 -2.610 2.704 1.00 0.00 H new ATOM 0 HG13 ILE A 163 -2.711 -2.969 2.980 1.00 0.00 H new ATOM 0 HG21 ILE A 163 -4.156 -5.589 1.058 1.00 0.00 H new ATOM 0 HG22 ILE A 163 -5.053 -6.466 2.320 1.00 0.00 H new ATOM 0 HG23 ILE A 163 -5.682 -4.925 1.690 1.00 0.00 H new ATOM 0 HD11 ILE A 163 -3.107 -2.395 0.599 1.00 0.00 H new ATOM 0 HD12 ILE A 163 -2.569 -4.085 0.749 1.00 0.00 H new ATOM 0 HD13 ILE A 163 -4.288 -3.720 0.469 1.00 0.00 H new ATOM 2525 N ILE A 164 -6.903 -5.844 4.073 1.00 0.00 N ATOM 2526 CA ILE A 164 -8.330 -6.036 3.823 1.00 0.00 C ATOM 2527 C ILE A 164 -9.140 -5.430 4.964 1.00 0.00 C ATOM 2528 O ILE A 164 -10.226 -4.882 4.765 1.00 0.00 O ATOM 2529 CB ILE A 164 -8.664 -7.517 3.716 1.00 0.00 C ATOM 2530 CG1 ILE A 164 -7.732 -8.167 2.689 1.00 0.00 C ATOM 2531 CG2 ILE A 164 -10.121 -7.663 3.265 1.00 0.00 C ATOM 2532 CD1 ILE A 164 -8.052 -9.654 2.575 1.00 0.00 C ATOM 0 H ILE A 164 -6.391 -6.698 4.296 1.00 0.00 H new ATOM 0 HA ILE A 164 -8.580 -5.544 2.883 1.00 0.00 H new ATOM 0 HB ILE A 164 -8.531 -8.006 4.681 1.00 0.00 H new ATOM 0 HG12 ILE A 164 -7.850 -7.684 1.719 1.00 0.00 H new ATOM 0 HG13 ILE A 164 -6.693 -8.030 2.988 1.00 0.00 H new ATOM 0 HG21 ILE A 164 -10.373 -8.720 3.184 1.00 0.00 H new ATOM 0 HG22 ILE A 164 -10.777 -7.188 3.995 1.00 0.00 H new ATOM 0 HG23 ILE A 164 -10.251 -7.184 2.295 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -7.388 -10.114 1.844 1.00 0.00 H new ATOM 0 HD12 ILE A 164 -7.911 -10.132 3.544 1.00 0.00 H new ATOM 0 HD13 ILE A 164 -9.086 -9.780 2.255 1.00 0.00 H new ATOM 2544 N LEU A 165 -8.594 -5.561 6.165 1.00 0.00 N ATOM 2545 CA LEU A 165 -9.245 -5.062 7.369 1.00 0.00 C ATOM 2546 C LEU A 165 -9.424 -3.544 7.332 1.00 0.00 C ATOM 2547 O LEU A 165 -10.554 -3.046 7.296 1.00 0.00 O ATOM 2548 CB LEU A 165 -8.393 -5.474 8.579 1.00 0.00 C ATOM 2549 CG LEU A 165 -9.190 -6.381 9.515 1.00 0.00 C ATOM 2550 CD1 LEU A 165 -10.422 -5.639 10.001 1.00 0.00 C ATOM 2551 CD2 LEU A 165 -9.599 -7.648 8.762 1.00 0.00 C ATOM 0 H LEU A 165 -7.695 -6.012 6.332 1.00 0.00 H new ATOM 0 HA LEU A 165 -10.243 -5.493 7.440 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -7.496 -5.992 8.239 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -8.064 -4.586 9.118 1.00 0.00 H new ATOM 0 HG LEU A 165 -8.580 -6.659 10.374 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -10.994 -6.282 10.669 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -10.118 -4.739 10.536 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -11.040 -5.362 9.147 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -10.168 -8.298 9.426 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -10.214 -7.378 7.903 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -8.707 -8.171 8.419 1.00 0.00 H new ATOM 2563 N GLU A 166 -8.320 -2.808 7.336 1.00 0.00 N ATOM 2564 CA GLU A 166 -8.408 -1.355 7.296 1.00 0.00 C ATOM 2565 C GLU A 166 -9.166 -0.928 6.058 1.00 0.00 C ATOM 2566 O GLU A 166 -9.907 0.055 6.075 1.00 0.00 O ATOM 2567 CB GLU A 166 -7.011 -0.732 7.297 1.00 0.00 C ATOM 2568 CG GLU A 166 -7.100 0.715 7.783 1.00 0.00 C ATOM 2569 CD GLU A 166 -7.129 0.754 9.307 1.00 0.00 C ATOM 2570 OE1 GLU A 166 -7.438 -0.267 9.901 1.00 0.00 O ATOM 2571 OE2 GLU A 166 -6.843 1.803 9.859 1.00 0.00 O ATOM 0 H GLU A 166 -7.372 -3.183 7.366 1.00 0.00 H new ATOM 0 HA GLU A 166 -8.939 -1.009 8.183 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -6.346 -1.304 7.944 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -6.586 -0.765 6.294 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -6.247 1.284 7.413 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -7.997 1.187 7.382 1.00 0.00 H new ATOM 2578 N ALA A 167 -9.002 -1.693 4.993 1.00 0.00 N ATOM 2579 CA ALA A 167 -9.704 -1.403 3.761 1.00 0.00 C ATOM 2580 C ALA A 167 -11.197 -1.409 4.032 1.00 0.00 C ATOM 2581 O ALA A 167 -11.961 -0.678 3.404 1.00 0.00 O ATOM 2582 CB ALA A 167 -9.372 -2.461 2.725 1.00 0.00 C ATOM 0 H ALA A 167 -8.394 -2.512 4.958 1.00 0.00 H new ATOM 0 HA ALA A 167 -9.400 -0.426 3.385 1.00 0.00 H new ATOM 0 HB1 ALA A 167 -9.901 -2.241 1.798 1.00 0.00 H new ATOM 0 HB2 ALA A 167 -8.298 -2.463 2.538 1.00 0.00 H new ATOM 0 HB3 ALA A 167 -9.678 -3.440 3.094 1.00 0.00 H new ATOM 2588 N GLU A 168 -11.595 -2.244 4.985 1.00 0.00 N ATOM 2589 CA GLU A 168 -13.000 -2.359 5.359 1.00 0.00 C ATOM 2590 C GLU A 168 -13.479 -1.085 6.043 1.00 0.00 C ATOM 2591 O GLU A 168 -14.443 -0.457 5.606 1.00 0.00 O ATOM 2592 CB GLU A 168 -13.195 -3.549 6.298 1.00 0.00 C ATOM 2593 CG GLU A 168 -14.662 -3.981 6.274 1.00 0.00 C ATOM 2594 CD GLU A 168 -14.902 -4.951 5.123 1.00 0.00 C ATOM 2595 OE1 GLU A 168 -14.633 -4.576 3.993 1.00 0.00 O ATOM 2596 OE2 GLU A 168 -15.350 -6.054 5.387 1.00 0.00 O ATOM 0 H GLU A 168 -10.966 -2.850 5.512 1.00 0.00 H new ATOM 0 HA GLU A 168 -13.586 -2.512 4.453 1.00 0.00 H new ATOM 0 HB2 GLU A 168 -12.556 -4.377 5.991 1.00 0.00 H new ATOM 0 HB3 GLU A 168 -12.901 -3.278 7.312 1.00 0.00 H new ATOM 0 HG2 GLU A 168 -14.926 -4.454 7.220 1.00 0.00 H new ATOM 0 HG3 GLU A 168 -15.305 -3.108 6.164 1.00 0.00 H new ATOM 2603 N LYS A 169 -12.805 -0.715 7.126 1.00 0.00 N ATOM 2604 CA LYS A 169 -13.180 0.483 7.872 1.00 0.00 C ATOM 2605 C LYS A 169 -13.215 1.705 6.956 1.00 0.00 C ATOM 2606 O LYS A 169 -14.272 2.302 6.736 1.00 0.00 O ATOM 2607 CB LYS A 169 -12.179 0.725 9.004 1.00 0.00 C ATOM 2608 CG LYS A 169 -12.799 1.662 10.042 1.00 0.00 C ATOM 2609 CD LYS A 169 -11.727 2.614 10.576 1.00 0.00 C ATOM 2610 CE LYS A 169 -12.336 3.518 11.649 1.00 0.00 C ATOM 2611 NZ LYS A 169 -13.630 4.070 11.156 1.00 0.00 N ATOM 0 H LYS A 169 -12.004 -1.220 7.505 1.00 0.00 H new ATOM 0 HA LYS A 169 -14.176 0.329 8.288 1.00 0.00 H new ATOM 0 HB2 LYS A 169 -11.905 -0.221 9.470 1.00 0.00 H new ATOM 0 HB3 LYS A 169 -11.263 1.161 8.606 1.00 0.00 H new ATOM 0 HG2 LYS A 169 -13.614 2.230 9.594 1.00 0.00 H new ATOM 0 HG3 LYS A 169 -13.227 1.083 10.861 1.00 0.00 H new ATOM 0 HD2 LYS A 169 -10.896 2.045 10.993 1.00 0.00 H new ATOM 0 HD3 LYS A 169 -11.324 3.218 9.763 1.00 0.00 H new ATOM 0 HE2 LYS A 169 -12.495 2.954 12.568 1.00 0.00 H new ATOM 0 HE3 LYS A 169 -11.649 4.330 11.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 -13.860 4.938 11.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 -13.550 4.289 10.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 -14.384 3.369 11.300 1.00 0.00 H new ATOM 2625 N ILE A 170 -12.055 2.074 6.428 1.00 0.00 N ATOM 2626 CA ILE A 170 -11.960 3.229 5.538 1.00 0.00 C ATOM 2627 C ILE A 170 -13.003 3.149 4.423 1.00 0.00 C ATOM 2628 O ILE A 170 -13.543 4.175 3.991 1.00 0.00 O ATOM 2629 CB ILE A 170 -10.560 3.298 4.942 1.00 0.00 C ATOM 2630 CG1 ILE A 170 -9.556 3.608 6.056 1.00 0.00 C ATOM 2631 CG2 ILE A 170 -10.526 4.408 3.900 1.00 0.00 C ATOM 2632 CD1 ILE A 170 -8.132 3.432 5.531 1.00 0.00 C ATOM 0 H ILE A 170 -11.171 1.595 6.598 1.00 0.00 H new ATOM 0 HA ILE A 170 -12.155 4.132 6.117 1.00 0.00 H new ATOM 0 HB ILE A 170 -10.301 2.347 4.476 1.00 0.00 H new ATOM 0 HG12 ILE A 170 -9.698 4.628 6.413 1.00 0.00 H new ATOM 0 HG13 ILE A 170 -9.725 2.946 6.905 1.00 0.00 H new ATOM 0 HG21 ILE A 170 -9.528 4.468 3.465 1.00 0.00 H new ATOM 0 HG22 ILE A 170 -11.252 4.193 3.115 1.00 0.00 H new ATOM 0 HG23 ILE A 170 -10.774 5.358 4.373 1.00 0.00 H new ATOM 0 HD11 ILE A 170 -7.421 3.654 6.327 1.00 0.00 H new ATOM 0 HD12 ILE A 170 -7.992 2.404 5.195 1.00 0.00 H new ATOM 0 HD13 ILE A 170 -7.965 4.112 4.696 1.00 0.00 H new ATOM 2644 N ASP A 171 -13.297 1.934 3.965 1.00 0.00 N ATOM 2645 CA ASP A 171 -14.289 1.761 2.911 1.00 0.00 C ATOM 2646 C ASP A 171 -15.665 2.134 3.439 1.00 0.00 C ATOM 2647 O ASP A 171 -16.456 2.776 2.747 1.00 0.00 O ATOM 2648 CB ASP A 171 -14.306 0.320 2.419 1.00 0.00 C ATOM 2649 CG ASP A 171 -15.585 0.053 1.632 1.00 0.00 C ATOM 2650 OD1 ASP A 171 -16.596 -0.221 2.257 1.00 0.00 O ATOM 2651 OD2 ASP A 171 -15.533 0.127 0.415 1.00 0.00 O ATOM 0 H ASP A 171 -12.871 1.070 4.301 1.00 0.00 H new ATOM 0 HA ASP A 171 -14.026 2.411 2.077 1.00 0.00 H new ATOM 0 HB2 ASP A 171 -13.436 0.131 1.790 1.00 0.00 H new ATOM 0 HB3 ASP A 171 -14.241 -0.363 3.266 1.00 0.00 H new ATOM 2656 N GLY A 172 -15.938 1.745 4.681 1.00 0.00 N ATOM 2657 CA GLY A 172 -17.213 2.067 5.300 1.00 0.00 C ATOM 2658 C GLY A 172 -17.407 3.576 5.309 1.00 0.00 C ATOM 2659 O GLY A 172 -18.528 4.073 5.207 1.00 0.00 O ATOM 0 H GLY A 172 -15.299 1.212 5.271 1.00 0.00 H new ATOM 0 HA2 GLY A 172 -18.026 1.589 4.753 1.00 0.00 H new ATOM 0 HA3 GLY A 172 -17.243 1.680 6.319 1.00 0.00 H new ATOM 2663 N ALA A 173 -16.296 4.300 5.420 1.00 0.00 N ATOM 2664 CA ALA A 173 -16.342 5.756 5.428 1.00 0.00 C ATOM 2665 C ALA A 173 -16.759 6.276 4.055 1.00 0.00 C ATOM 2666 O ALA A 173 -17.916 6.639 3.848 1.00 0.00 O ATOM 2667 CB ALA A 173 -14.971 6.323 5.803 1.00 0.00 C ATOM 0 H ALA A 173 -15.360 3.904 5.505 1.00 0.00 H new ATOM 0 HA ALA A 173 -17.075 6.079 6.167 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -15.016 7.412 5.806 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -14.690 5.969 6.795 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -14.229 5.993 5.076 1.00 0.00 H new ATOM 2673 N ALA A 174 -15.814 6.306 3.115 1.00 0.00 N ATOM 2674 CA ALA A 174 -16.117 6.781 1.767 1.00 0.00 C ATOM 2675 C ALA A 174 -17.437 6.196 1.268 1.00 0.00 C ATOM 2676 O ALA A 174 -18.021 6.695 0.307 1.00 0.00 O ATOM 2677 CB ALA A 174 -14.995 6.386 0.807 1.00 0.00 C ATOM 0 H ALA A 174 -14.848 6.012 3.259 1.00 0.00 H new ATOM 0 HA ALA A 174 -16.204 7.867 1.803 1.00 0.00 H new ATOM 0 HB1 ALA A 174 -15.230 6.745 -0.195 1.00 0.00 H new ATOM 0 HB2 ALA A 174 -14.057 6.831 1.141 1.00 0.00 H new ATOM 0 HB3 ALA A 174 -14.896 5.301 0.790 1.00 0.00 H new