USER MOD reduce.3.24.130724 H: found=0, std=0, add=932, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 930 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 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 11:sc= 1.21 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 17 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 28 GLN : amide:sc= -0.723 K(o=-0.72,f=-1.9!) USER MOD Single : A 29 GLN : amide:sc= -7.54! C(o=-7.5!,f=-13!) USER MOD Single : A 32 LYS NZ :NH3+ 158:sc= -0.0469 (180deg=-0.319) USER MOD Single : A 33 HIS : no HD1:sc= -3.12! C(o=-3.1!,f=-4.9!) USER MOD Single : A 38 MET CE :methyl -165:sc=-0.00572 (180deg=-0.28) USER MOD Single : A 40 ASN : amide:sc= -1.32 K(o=-1.3,f=-3.2!) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -0.802 K(o=-0.8,f=-4.2!) USER MOD Single : A 49 GLN : amide:sc= -1.21 X(o=-1.2,f=-0.97) USER MOD Single : A 50 SER OG : rot 170:sc= 0 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc=-0.00674 K(o=-0.0067,f=-0.75) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot -150:sc= 0.0588 USER MOD Single : A 67 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0218) USER MOD Single : A 71 ASN : amide:sc= -1.23 K(o=-1.2,f=-2.6!) USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=-0.066) USER MOD Single : A 76 MET CE :methyl 162:sc= -1.09 (180deg=-1.88!) USER MOD Single : A 79 TYR OH : rot 30:sc= -0.142 USER MOD Single : A 81 GLN : amide:sc= -0.369 K(o=-0.37,f=-1) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 166:sc=-0.00758 (180deg=-0.122) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 LYS NZ :NH3+ 160:sc= -0.0376 (180deg=-0.25) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= -0.161 K(o=-0.16,f=-1) USER MOD Single : A 101 GLN : amide:sc= -1.63 X(o=-1.6,f=-1.6) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 157:sc= -0.0565 (180deg=-0.34) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 117:sc= 0.00121 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ -161:sc= -0.0314 (180deg=-0.276) USER MOD Single : A 111 ASN : amide:sc= -0.0429 K(o=-0.043,f=-1.7!) USER MOD Single : A 113 SER OG : rot 22:sc= 0.0044 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -7.752 -46.488 -13.641 1.00 0.00 N ATOM 2 CA GLY A 1 -6.352 -46.107 -13.604 1.00 0.00 C ATOM 3 C GLY A 1 -6.158 -44.605 -13.672 1.00 0.00 C ATOM 4 O GLY A 1 -6.429 -43.984 -14.700 1.00 0.00 O ATOM 0 H1 GLY A 1 -7.831 -47.524 -13.592 1.00 0.00 H new ATOM 0 H2 GLY A 1 -8.249 -46.064 -12.832 1.00 0.00 H new ATOM 0 H3 GLY A 1 -8.181 -46.150 -14.526 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -5.899 -46.488 -12.689 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -5.829 -46.576 -14.437 1.00 0.00 H new ATOM 8 N SER A 2 -5.689 -44.020 -12.575 1.00 0.00 N ATOM 9 CA SER A 2 -5.463 -42.580 -12.513 1.00 0.00 C ATOM 10 C SER A 2 -4.595 -42.218 -11.312 1.00 0.00 C ATOM 11 O SER A 2 -5.043 -42.279 -10.167 1.00 0.00 O ATOM 12 CB SER A 2 -6.798 -41.837 -12.435 1.00 0.00 C ATOM 13 OG SER A 2 -7.421 -41.770 -13.706 1.00 0.00 O ATOM 0 H SER A 2 -5.458 -44.520 -11.717 1.00 0.00 H new ATOM 0 HA SER A 2 -4.940 -42.279 -13.421 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.458 -42.342 -11.730 1.00 0.00 H new ATOM 0 HB3 SER A 2 -6.635 -40.829 -12.053 1.00 0.00 H new ATOM 0 HG SER A 2 -6.953 -42.362 -14.331 1.00 0.00 H new ATOM 19 N SER A 3 -3.350 -41.840 -11.583 1.00 0.00 N ATOM 20 CA SER A 3 -2.416 -41.471 -10.526 1.00 0.00 C ATOM 21 C SER A 3 -1.218 -40.717 -11.098 1.00 0.00 C ATOM 22 O SER A 3 -0.830 -40.926 -12.246 1.00 0.00 O ATOM 23 CB SER A 3 -1.939 -42.718 -9.779 1.00 0.00 C ATOM 24 OG SER A 3 -1.372 -43.661 -10.672 1.00 0.00 O ATOM 0 H SER A 3 -2.965 -41.781 -12.526 1.00 0.00 H new ATOM 0 HA SER A 3 -2.936 -40.815 -9.828 1.00 0.00 H new ATOM 0 HB2 SER A 3 -1.202 -42.436 -9.027 1.00 0.00 H new ATOM 0 HB3 SER A 3 -2.777 -43.172 -9.250 1.00 0.00 H new ATOM 0 HG SER A 3 -1.073 -44.448 -10.170 1.00 0.00 H new ATOM 30 N GLY A 4 -0.637 -39.839 -10.286 1.00 0.00 N ATOM 31 CA GLY A 4 0.510 -39.067 -10.727 1.00 0.00 C ATOM 32 C GLY A 4 1.700 -39.941 -11.070 1.00 0.00 C ATOM 33 O GLY A 4 1.612 -41.168 -11.019 1.00 0.00 O ATOM 0 H GLY A 4 -0.940 -39.649 -9.331 1.00 0.00 H new ATOM 0 HA2 GLY A 4 0.233 -38.477 -11.601 1.00 0.00 H new ATOM 0 HA3 GLY A 4 0.793 -38.364 -9.944 1.00 0.00 H new ATOM 37 N SER A 5 2.815 -39.309 -11.421 1.00 0.00 N ATOM 38 CA SER A 5 4.026 -40.038 -11.778 1.00 0.00 C ATOM 39 C SER A 5 5.113 -39.836 -10.726 1.00 0.00 C ATOM 40 O SER A 5 5.570 -40.791 -10.099 1.00 0.00 O ATOM 41 CB SER A 5 4.536 -39.582 -13.147 1.00 0.00 C ATOM 42 OG SER A 5 5.589 -40.414 -13.602 1.00 0.00 O ATOM 0 H SER A 5 2.905 -38.294 -11.466 1.00 0.00 H new ATOM 0 HA SER A 5 3.781 -41.099 -11.823 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.718 -39.599 -13.867 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.884 -38.551 -13.084 1.00 0.00 H new ATOM 0 HG SER A 5 5.896 -40.103 -14.479 1.00 0.00 H new ATOM 48 N SER A 6 5.520 -38.585 -10.538 1.00 0.00 N ATOM 49 CA SER A 6 6.555 -38.256 -9.565 1.00 0.00 C ATOM 50 C SER A 6 6.642 -36.748 -9.352 1.00 0.00 C ATOM 51 O SER A 6 6.024 -35.971 -10.078 1.00 0.00 O ATOM 52 CB SER A 6 7.910 -38.796 -10.027 1.00 0.00 C ATOM 53 OG SER A 6 8.212 -38.358 -11.341 1.00 0.00 O ATOM 0 H SER A 6 5.149 -37.783 -11.047 1.00 0.00 H new ATOM 0 HA SER A 6 6.289 -38.724 -8.617 1.00 0.00 H new ATOM 0 HB2 SER A 6 8.690 -38.465 -9.341 1.00 0.00 H new ATOM 0 HB3 SER A 6 7.900 -39.886 -9.997 1.00 0.00 H new ATOM 0 HG SER A 6 9.083 -38.715 -11.613 1.00 0.00 H new ATOM 59 N GLY A 7 7.414 -36.341 -8.349 1.00 0.00 N ATOM 60 CA GLY A 7 7.568 -34.928 -8.057 1.00 0.00 C ATOM 61 C GLY A 7 9.011 -34.544 -7.796 1.00 0.00 C ATOM 62 O GLY A 7 9.931 -35.291 -8.132 1.00 0.00 O ATOM 0 H GLY A 7 7.936 -36.965 -7.733 1.00 0.00 H new ATOM 0 HA2 GLY A 7 7.185 -34.343 -8.894 1.00 0.00 H new ATOM 0 HA3 GLY A 7 6.964 -34.672 -7.187 1.00 0.00 H new ATOM 66 N LEU A 8 9.212 -33.375 -7.198 1.00 0.00 N ATOM 67 CA LEU A 8 10.554 -32.891 -6.894 1.00 0.00 C ATOM 68 C LEU A 8 10.549 -32.028 -5.636 1.00 0.00 C ATOM 69 O LEU A 8 9.990 -30.932 -5.626 1.00 0.00 O ATOM 70 CB LEU A 8 11.109 -32.091 -8.073 1.00 0.00 C ATOM 71 CG LEU A 8 11.330 -32.872 -9.369 1.00 0.00 C ATOM 72 CD1 LEU A 8 10.060 -32.887 -10.206 1.00 0.00 C ATOM 73 CD2 LEU A 8 12.485 -32.276 -10.160 1.00 0.00 C ATOM 0 H LEU A 8 8.462 -32.744 -6.914 1.00 0.00 H new ATOM 0 HA LEU A 8 11.194 -33.756 -6.717 1.00 0.00 H new ATOM 0 HB2 LEU A 8 10.426 -31.267 -8.281 1.00 0.00 H new ATOM 0 HB3 LEU A 8 12.059 -31.650 -7.772 1.00 0.00 H new ATOM 0 HG LEU A 8 11.584 -33.901 -9.112 1.00 0.00 H new ATOM 0 HD11 LEU A 8 10.236 -33.447 -11.124 1.00 0.00 H new ATOM 0 HD12 LEU A 8 9.257 -33.360 -9.641 1.00 0.00 H new ATOM 0 HD13 LEU A 8 9.775 -31.864 -10.454 1.00 0.00 H new ATOM 0 HD21 LEU A 8 12.628 -32.844 -11.079 1.00 0.00 H new ATOM 0 HD22 LEU A 8 12.260 -31.238 -10.406 1.00 0.00 H new ATOM 0 HD23 LEU A 8 13.395 -32.318 -9.562 1.00 0.00 H new ATOM 85 N ARG A 9 11.179 -32.529 -4.578 1.00 0.00 N ATOM 86 CA ARG A 9 11.248 -31.804 -3.316 1.00 0.00 C ATOM 87 C ARG A 9 12.650 -31.245 -3.086 1.00 0.00 C ATOM 88 O ARG A 9 13.415 -31.773 -2.279 1.00 0.00 O ATOM 89 CB ARG A 9 10.856 -32.719 -2.155 1.00 0.00 C ATOM 90 CG ARG A 9 11.739 -33.949 -2.024 1.00 0.00 C ATOM 91 CD ARG A 9 10.989 -35.108 -1.386 1.00 0.00 C ATOM 92 NE ARG A 9 11.894 -36.147 -0.904 1.00 0.00 N ATOM 93 CZ ARG A 9 12.576 -36.958 -1.706 1.00 0.00 C ATOM 94 NH1 ARG A 9 12.455 -36.850 -3.022 1.00 0.00 N ATOM 95 NH2 ARG A 9 13.380 -37.879 -1.192 1.00 0.00 N ATOM 0 H ARG A 9 11.649 -33.434 -4.570 1.00 0.00 H new ATOM 0 HA ARG A 9 10.547 -30.971 -3.366 1.00 0.00 H new ATOM 0 HB2 ARG A 9 10.898 -32.151 -1.226 1.00 0.00 H new ATOM 0 HB3 ARG A 9 9.822 -33.037 -2.287 1.00 0.00 H new ATOM 0 HG2 ARG A 9 12.100 -34.246 -3.009 1.00 0.00 H new ATOM 0 HG3 ARG A 9 12.616 -33.707 -1.423 1.00 0.00 H new ATOM 0 HD2 ARG A 9 10.388 -34.737 -0.556 1.00 0.00 H new ATOM 0 HD3 ARG A 9 10.299 -35.537 -2.113 1.00 0.00 H new ATOM 0 HE ARG A 9 12.009 -36.257 0.104 1.00 0.00 H new ATOM 0 HH11 ARG A 9 11.837 -36.143 -3.421 1.00 0.00 H new ATOM 0 HH12 ARG A 9 12.980 -37.474 -3.635 1.00 0.00 H new ATOM 0 HH21 ARG A 9 13.475 -37.965 -0.180 1.00 0.00 H new ATOM 0 HH22 ARG A 9 13.903 -38.501 -1.809 1.00 0.00 H new ATOM 109 N ARG A 10 12.979 -30.174 -3.802 1.00 0.00 N ATOM 110 CA ARG A 10 14.288 -29.545 -3.677 1.00 0.00 C ATOM 111 C ARG A 10 14.157 -28.111 -3.174 1.00 0.00 C ATOM 112 O ARG A 10 13.388 -27.320 -3.720 1.00 0.00 O ATOM 113 CB ARG A 10 15.015 -29.560 -5.024 1.00 0.00 C ATOM 114 CG ARG A 10 15.577 -30.922 -5.398 1.00 0.00 C ATOM 115 CD ARG A 10 14.529 -31.790 -6.076 1.00 0.00 C ATOM 116 NE ARG A 10 14.860 -33.210 -5.998 1.00 0.00 N ATOM 117 CZ ARG A 10 15.856 -33.771 -6.675 1.00 0.00 C ATOM 118 NH1 ARG A 10 16.614 -33.035 -7.477 1.00 0.00 N ATOM 119 NH2 ARG A 10 16.096 -35.070 -6.551 1.00 0.00 N ATOM 0 H ARG A 10 12.357 -29.724 -4.474 1.00 0.00 H new ATOM 0 HA ARG A 10 14.869 -30.114 -2.951 1.00 0.00 H new ATOM 0 HB2 ARG A 10 14.326 -29.235 -5.803 1.00 0.00 H new ATOM 0 HB3 ARG A 10 15.829 -28.836 -4.996 1.00 0.00 H new ATOM 0 HG2 ARG A 10 16.431 -30.794 -6.063 1.00 0.00 H new ATOM 0 HG3 ARG A 10 15.943 -31.424 -4.502 1.00 0.00 H new ATOM 0 HD2 ARG A 10 13.559 -31.618 -5.610 1.00 0.00 H new ATOM 0 HD3 ARG A 10 14.437 -31.496 -7.122 1.00 0.00 H new ATOM 0 HE ARG A 10 14.296 -33.804 -5.390 1.00 0.00 H new ATOM 0 HH11 ARG A 10 16.433 -32.036 -7.575 1.00 0.00 H new ATOM 0 HH12 ARG A 10 17.378 -33.468 -7.996 1.00 0.00 H new ATOM 0 HH21 ARG A 10 15.515 -35.639 -5.935 1.00 0.00 H new ATOM 0 HH22 ARG A 10 16.861 -35.499 -7.071 1.00 0.00 H new ATOM 133 N GLN A 11 14.912 -27.785 -2.130 1.00 0.00 N ATOM 134 CA GLN A 11 14.878 -26.446 -1.552 1.00 0.00 C ATOM 135 C GLN A 11 16.290 -25.915 -1.326 1.00 0.00 C ATOM 136 O GLN A 11 17.264 -26.664 -1.397 1.00 0.00 O ATOM 137 CB GLN A 11 14.107 -26.457 -0.231 1.00 0.00 C ATOM 138 CG GLN A 11 12.608 -26.267 -0.400 1.00 0.00 C ATOM 139 CD GLN A 11 11.834 -26.578 0.866 1.00 0.00 C ATOM 140 OE1 GLN A 11 12.419 -26.815 1.923 1.00 0.00 O ATOM 141 NE2 GLN A 11 10.510 -26.577 0.766 1.00 0.00 N ATOM 0 H GLN A 11 15.554 -28.429 -1.667 1.00 0.00 H new ATOM 0 HA GLN A 11 14.370 -25.787 -2.255 1.00 0.00 H new ATOM 0 HB2 GLN A 11 14.290 -27.403 0.279 1.00 0.00 H new ATOM 0 HB3 GLN A 11 14.495 -25.668 0.413 1.00 0.00 H new ATOM 0 HG2 GLN A 11 12.408 -25.239 -0.700 1.00 0.00 H new ATOM 0 HG3 GLN A 11 12.253 -26.909 -1.206 1.00 0.00 H new ATOM 0 HE21 GLN A 11 10.066 -26.375 -0.130 1.00 0.00 H new ATOM 0 HE22 GLN A 11 9.937 -26.778 1.585 1.00 0.00 H new ATOM 150 N ARG A 12 16.392 -24.618 -1.053 1.00 0.00 N ATOM 151 CA ARG A 12 17.685 -23.987 -0.818 1.00 0.00 C ATOM 152 C ARG A 12 17.822 -23.555 0.639 1.00 0.00 C ATOM 153 O ARG A 12 17.151 -22.625 1.087 1.00 0.00 O ATOM 154 CB ARG A 12 17.861 -22.778 -1.739 1.00 0.00 C ATOM 155 CG ARG A 12 18.308 -23.143 -3.145 1.00 0.00 C ATOM 156 CD ARG A 12 17.155 -23.690 -3.971 1.00 0.00 C ATOM 157 NE ARG A 12 17.603 -24.205 -5.262 1.00 0.00 N ATOM 158 CZ ARG A 12 18.031 -23.431 -6.254 1.00 0.00 C ATOM 159 NH1 ARG A 12 18.068 -22.114 -6.103 1.00 0.00 N ATOM 160 NH2 ARG A 12 18.422 -23.974 -7.400 1.00 0.00 N ATOM 0 H ARG A 12 15.595 -23.984 -0.989 1.00 0.00 H new ATOM 0 HA ARG A 12 18.463 -24.718 -1.037 1.00 0.00 H new ATOM 0 HB2 ARG A 12 16.917 -22.235 -1.796 1.00 0.00 H new ATOM 0 HB3 ARG A 12 18.592 -22.100 -1.299 1.00 0.00 H new ATOM 0 HG2 ARG A 12 18.723 -22.263 -3.636 1.00 0.00 H new ATOM 0 HG3 ARG A 12 19.105 -23.885 -3.094 1.00 0.00 H new ATOM 0 HD2 ARG A 12 16.657 -24.485 -3.416 1.00 0.00 H new ATOM 0 HD3 ARG A 12 16.418 -22.903 -4.131 1.00 0.00 H new ATOM 0 HE ARG A 12 17.587 -25.214 -5.411 1.00 0.00 H new ATOM 0 HH11 ARG A 12 17.768 -21.693 -5.224 1.00 0.00 H new ATOM 0 HH12 ARG A 12 18.397 -21.522 -6.866 1.00 0.00 H new ATOM 0 HH21 ARG A 12 18.394 -24.987 -7.520 1.00 0.00 H new ATOM 0 HH22 ARG A 12 18.750 -23.379 -8.161 1.00 0.00 H new ATOM 174 N LEU A 13 18.695 -24.236 1.373 1.00 0.00 N ATOM 175 CA LEU A 13 18.920 -23.924 2.780 1.00 0.00 C ATOM 176 C LEU A 13 20.375 -24.172 3.166 1.00 0.00 C ATOM 177 O LEU A 13 21.052 -25.009 2.570 1.00 0.00 O ATOM 178 CB LEU A 13 17.996 -24.763 3.664 1.00 0.00 C ATOM 179 CG LEU A 13 18.127 -24.543 5.171 1.00 0.00 C ATOM 180 CD1 LEU A 13 17.487 -23.225 5.576 1.00 0.00 C ATOM 181 CD2 LEU A 13 17.499 -25.700 5.935 1.00 0.00 C ATOM 0 H LEU A 13 19.259 -25.008 1.017 1.00 0.00 H new ATOM 0 HA LEU A 13 18.697 -22.868 2.933 1.00 0.00 H new ATOM 0 HB2 LEU A 13 16.965 -24.558 3.375 1.00 0.00 H new ATOM 0 HB3 LEU A 13 18.182 -25.816 3.453 1.00 0.00 H new ATOM 0 HG LEU A 13 19.187 -24.500 5.422 1.00 0.00 H new ATOM 0 HD11 LEU A 13 17.590 -23.086 6.652 1.00 0.00 H new ATOM 0 HD12 LEU A 13 17.982 -22.405 5.055 1.00 0.00 H new ATOM 0 HD13 LEU A 13 16.430 -23.238 5.312 1.00 0.00 H new ATOM 0 HD21 LEU A 13 17.601 -25.527 7.006 1.00 0.00 H new ATOM 0 HD22 LEU A 13 16.442 -25.774 5.679 1.00 0.00 H new ATOM 0 HD23 LEU A 13 18.003 -26.629 5.668 1.00 0.00 H new ATOM 193 N ALA A 14 20.848 -23.439 4.169 1.00 0.00 N ATOM 194 CA ALA A 14 22.221 -23.583 4.638 1.00 0.00 C ATOM 195 C ALA A 14 22.407 -22.922 6.000 1.00 0.00 C ATOM 196 O ALA A 14 21.489 -22.293 6.525 1.00 0.00 O ATOM 197 CB ALA A 14 23.189 -22.990 3.625 1.00 0.00 C ATOM 0 H ALA A 14 20.301 -22.740 4.672 1.00 0.00 H new ATOM 0 HA ALA A 14 22.433 -24.647 4.747 1.00 0.00 H new ATOM 0 HB1 ALA A 14 24.210 -23.104 3.988 1.00 0.00 H new ATOM 0 HB2 ALA A 14 23.082 -23.509 2.672 1.00 0.00 H new ATOM 0 HB3 ALA A 14 22.969 -21.931 3.488 1.00 0.00 H new ATOM 203 N GLU A 15 23.601 -23.070 6.566 1.00 0.00 N ATOM 204 CA GLU A 15 23.906 -22.489 7.868 1.00 0.00 C ATOM 205 C GLU A 15 25.257 -21.780 7.845 1.00 0.00 C ATOM 206 O GLU A 15 25.731 -21.288 8.870 1.00 0.00 O ATOM 207 CB GLU A 15 23.905 -23.572 8.949 1.00 0.00 C ATOM 208 CG GLU A 15 25.232 -24.300 9.082 1.00 0.00 C ATOM 209 CD GLU A 15 25.260 -25.251 10.263 1.00 0.00 C ATOM 210 OE1 GLU A 15 24.789 -26.398 10.113 1.00 0.00 O ATOM 211 OE2 GLU A 15 25.753 -24.848 11.337 1.00 0.00 O ATOM 0 H GLU A 15 24.372 -23.587 6.143 1.00 0.00 H new ATOM 0 HA GLU A 15 23.134 -21.755 8.099 1.00 0.00 H new ATOM 0 HB2 GLU A 15 23.652 -23.117 9.907 1.00 0.00 H new ATOM 0 HB3 GLU A 15 23.123 -24.297 8.724 1.00 0.00 H new ATOM 0 HG2 GLU A 15 25.430 -24.858 8.167 1.00 0.00 H new ATOM 0 HG3 GLU A 15 26.034 -23.569 9.190 1.00 0.00 H new ATOM 218 N LEU A 16 25.872 -21.732 6.669 1.00 0.00 N ATOM 219 CA LEU A 16 27.170 -21.084 6.510 1.00 0.00 C ATOM 220 C LEU A 16 27.226 -19.779 7.297 1.00 0.00 C ATOM 221 O LEU A 16 26.497 -18.833 7.001 1.00 0.00 O ATOM 222 CB LEU A 16 27.449 -20.813 5.031 1.00 0.00 C ATOM 223 CG LEU A 16 27.830 -22.029 4.186 1.00 0.00 C ATOM 224 CD1 LEU A 16 29.150 -22.618 4.662 1.00 0.00 C ATOM 225 CD2 LEU A 16 26.729 -23.078 4.233 1.00 0.00 C ATOM 0 H LEU A 16 25.493 -22.134 5.811 1.00 0.00 H new ATOM 0 HA LEU A 16 27.935 -21.756 6.900 1.00 0.00 H new ATOM 0 HB2 LEU A 16 26.563 -20.354 4.593 1.00 0.00 H new ATOM 0 HB3 LEU A 16 28.254 -20.081 4.962 1.00 0.00 H new ATOM 0 HG LEU A 16 27.952 -21.705 3.152 1.00 0.00 H new ATOM 0 HD11 LEU A 16 29.405 -23.482 4.049 1.00 0.00 H new ATOM 0 HD12 LEU A 16 29.936 -21.867 4.575 1.00 0.00 H new ATOM 0 HD13 LEU A 16 29.056 -22.927 5.703 1.00 0.00 H new ATOM 0 HD21 LEU A 16 27.018 -23.936 3.626 1.00 0.00 H new ATOM 0 HD22 LEU A 16 26.575 -23.398 5.264 1.00 0.00 H new ATOM 0 HD23 LEU A 16 25.804 -22.653 3.843 1.00 0.00 H new ATOM 237 N GLN A 17 28.099 -19.735 8.299 1.00 0.00 N ATOM 238 CA GLN A 17 28.252 -18.545 9.127 1.00 0.00 C ATOM 239 C GLN A 17 29.721 -18.289 9.447 1.00 0.00 C ATOM 240 O GLN A 17 30.424 -19.175 9.931 1.00 0.00 O ATOM 241 CB GLN A 17 27.454 -18.695 10.424 1.00 0.00 C ATOM 242 CG GLN A 17 25.989 -18.315 10.285 1.00 0.00 C ATOM 243 CD GLN A 17 25.183 -18.635 11.528 1.00 0.00 C ATOM 244 OE1 GLN A 17 25.582 -19.466 12.344 1.00 0.00 O ATOM 245 NE2 GLN A 17 24.040 -17.975 11.679 1.00 0.00 N ATOM 0 H GLN A 17 28.711 -20.510 8.557 1.00 0.00 H new ATOM 0 HA GLN A 17 27.867 -17.692 8.568 1.00 0.00 H new ATOM 0 HB2 GLN A 17 27.522 -19.728 10.765 1.00 0.00 H new ATOM 0 HB3 GLN A 17 27.910 -18.074 11.195 1.00 0.00 H new ATOM 0 HG2 GLN A 17 25.913 -17.249 10.072 1.00 0.00 H new ATOM 0 HG3 GLN A 17 25.560 -18.842 9.433 1.00 0.00 H new ATOM 0 HE21 GLN A 17 23.748 -17.295 10.978 1.00 0.00 H new ATOM 0 HE22 GLN A 17 23.455 -18.149 12.496 1.00 0.00 H new ATOM 254 N ALA A 18 30.177 -17.071 9.171 1.00 0.00 N ATOM 255 CA ALA A 18 31.562 -16.698 9.431 1.00 0.00 C ATOM 256 C ALA A 18 31.733 -15.183 9.421 1.00 0.00 C ATOM 257 O ALA A 18 30.898 -14.457 8.881 1.00 0.00 O ATOM 258 CB ALA A 18 32.483 -17.342 8.405 1.00 0.00 C ATOM 0 H ALA A 18 29.608 -16.327 8.768 1.00 0.00 H new ATOM 0 HA ALA A 18 31.831 -17.061 10.423 1.00 0.00 H new ATOM 0 HB1 ALA A 18 33.514 -17.055 8.611 1.00 0.00 H new ATOM 0 HB2 ALA A 18 32.390 -18.426 8.462 1.00 0.00 H new ATOM 0 HB3 ALA A 18 32.206 -17.006 7.406 1.00 0.00 H new ATOM 264 N LYS A 19 32.821 -14.711 10.020 1.00 0.00 N ATOM 265 CA LYS A 19 33.103 -13.282 10.080 1.00 0.00 C ATOM 266 C LYS A 19 34.110 -12.880 9.007 1.00 0.00 C ATOM 267 O LYS A 19 35.121 -13.555 8.807 1.00 0.00 O ATOM 268 CB LYS A 19 33.638 -12.904 11.464 1.00 0.00 C ATOM 269 CG LYS A 19 35.023 -13.456 11.752 1.00 0.00 C ATOM 270 CD LYS A 19 35.323 -13.462 13.241 1.00 0.00 C ATOM 271 CE LYS A 19 35.799 -12.099 13.720 1.00 0.00 C ATOM 272 NZ LYS A 19 36.426 -12.173 15.068 1.00 0.00 N ATOM 0 H LYS A 19 33.523 -15.298 10.471 1.00 0.00 H new ATOM 0 HA LYS A 19 32.172 -12.746 9.898 1.00 0.00 H new ATOM 0 HB2 LYS A 19 33.664 -11.818 11.550 1.00 0.00 H new ATOM 0 HB3 LYS A 19 32.946 -13.268 12.224 1.00 0.00 H new ATOM 0 HG2 LYS A 19 35.100 -14.470 11.361 1.00 0.00 H new ATOM 0 HG3 LYS A 19 35.770 -12.856 11.232 1.00 0.00 H new ATOM 0 HD2 LYS A 19 34.428 -13.750 13.792 1.00 0.00 H new ATOM 0 HD3 LYS A 19 36.085 -14.211 13.457 1.00 0.00 H new ATOM 0 HE2 LYS A 19 36.517 -11.694 13.007 1.00 0.00 H new ATOM 0 HE3 LYS A 19 34.955 -11.409 13.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 36.737 -11.224 15.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 35.733 -12.535 15.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 37.246 -12.811 15.035 1.00 0.00 H new ATOM 286 N HIS A 20 33.829 -11.777 8.321 1.00 0.00 N ATOM 287 CA HIS A 20 34.712 -11.285 7.269 1.00 0.00 C ATOM 288 C HIS A 20 35.976 -10.671 7.864 1.00 0.00 C ATOM 289 O HIS A 20 37.089 -11.080 7.538 1.00 0.00 O ATOM 290 CB HIS A 20 33.987 -10.252 6.407 1.00 0.00 C ATOM 291 CG HIS A 20 33.089 -10.859 5.373 1.00 0.00 C ATOM 292 ND1 HIS A 20 31.716 -10.898 5.498 1.00 0.00 N ATOM 293 CD2 HIS A 20 33.375 -11.452 4.190 1.00 0.00 C ATOM 294 CE1 HIS A 20 31.197 -11.491 4.437 1.00 0.00 C ATOM 295 NE2 HIS A 20 32.182 -11.836 3.628 1.00 0.00 N ATOM 0 H HIS A 20 32.997 -11.207 8.474 1.00 0.00 H new ATOM 0 HA HIS A 20 34.999 -12.131 6.645 1.00 0.00 H new ATOM 0 HB2 HIS A 20 33.397 -9.602 7.053 1.00 0.00 H new ATOM 0 HB3 HIS A 20 34.725 -9.622 5.911 1.00 0.00 H new ATOM 0 HD2 HIS A 20 34.358 -11.596 3.767 1.00 0.00 H new ATOM 0 HE1 HIS A 20 30.146 -11.664 4.261 1.00 0.00 H new ATOM 0 HE2 HIS A 20 32.074 -12.310 2.732 1.00 0.00 H new ATOM 304 N GLY A 21 35.795 -9.686 8.739 1.00 0.00 N ATOM 305 CA GLY A 21 36.929 -9.031 9.364 1.00 0.00 C ATOM 306 C GLY A 21 37.719 -8.182 8.388 1.00 0.00 C ATOM 307 O GLY A 21 38.940 -8.305 8.296 1.00 0.00 O ATOM 0 H GLY A 21 34.883 -9.330 9.026 1.00 0.00 H new ATOM 0 HA2 GLY A 21 36.576 -8.404 10.183 1.00 0.00 H new ATOM 0 HA3 GLY A 21 37.585 -9.785 9.799 1.00 0.00 H new ATOM 311 N ASP A 22 37.021 -7.321 7.657 1.00 0.00 N ATOM 312 CA ASP A 22 37.665 -6.448 6.681 1.00 0.00 C ATOM 313 C ASP A 22 37.028 -5.063 6.687 1.00 0.00 C ATOM 314 O ASP A 22 35.864 -4.889 7.050 1.00 0.00 O ATOM 315 CB ASP A 22 37.576 -7.059 5.282 1.00 0.00 C ATOM 316 CG ASP A 22 38.385 -8.334 5.154 1.00 0.00 C ATOM 317 OD1 ASP A 22 38.278 -9.197 6.051 1.00 0.00 O ATOM 318 OD2 ASP A 22 39.126 -8.470 4.158 1.00 0.00 O ATOM 0 H ASP A 22 36.009 -7.208 7.721 1.00 0.00 H new ATOM 0 HA ASP A 22 38.714 -6.346 6.958 1.00 0.00 H new ATOM 0 HB2 ASP A 22 36.533 -7.269 5.046 1.00 0.00 H new ATOM 0 HB3 ASP A 22 37.929 -6.333 4.549 1.00 0.00 H new ATOM 323 N PRO A 23 37.806 -4.051 6.276 1.00 0.00 N ATOM 324 CA PRO A 23 37.339 -2.662 6.225 1.00 0.00 C ATOM 325 C PRO A 23 36.302 -2.439 5.129 1.00 0.00 C ATOM 326 O PRO A 23 35.613 -1.421 5.111 1.00 0.00 O ATOM 327 CB PRO A 23 38.613 -1.869 5.926 1.00 0.00 C ATOM 328 CG PRO A 23 39.507 -2.838 5.232 1.00 0.00 C ATOM 329 CD PRO A 23 39.203 -4.184 5.829 1.00 0.00 C ATOM 0 HA PRO A 23 36.844 -2.365 7.149 1.00 0.00 H new ATOM 0 HB2 PRO A 23 38.403 -1.004 5.297 1.00 0.00 H new ATOM 0 HB3 PRO A 23 39.070 -1.494 6.842 1.00 0.00 H new ATOM 0 HG2 PRO A 23 39.324 -2.837 4.158 1.00 0.00 H new ATOM 0 HG3 PRO A 23 40.555 -2.575 5.377 1.00 0.00 H new ATOM 0 HD2 PRO A 23 39.316 -4.983 5.097 1.00 0.00 H new ATOM 0 HD3 PRO A 23 39.870 -4.415 6.659 1.00 0.00 H new ATOM 337 N GLY A 24 36.197 -3.400 4.216 1.00 0.00 N ATOM 338 CA GLY A 24 35.242 -3.289 3.129 1.00 0.00 C ATOM 339 C GLY A 24 33.844 -3.706 3.541 1.00 0.00 C ATOM 340 O GLY A 24 32.888 -2.949 3.372 1.00 0.00 O ATOM 0 H GLY A 24 36.756 -4.253 4.210 1.00 0.00 H new ATOM 0 HA2 GLY A 24 35.220 -2.259 2.772 1.00 0.00 H new ATOM 0 HA3 GLY A 24 35.572 -3.909 2.295 1.00 0.00 H new ATOM 344 N ASP A 25 33.724 -4.913 4.081 1.00 0.00 N ATOM 345 CA ASP A 25 32.432 -5.430 4.518 1.00 0.00 C ATOM 346 C ASP A 25 31.639 -4.357 5.258 1.00 0.00 C ATOM 347 O ASP A 25 30.469 -4.119 4.959 1.00 0.00 O ATOM 348 CB ASP A 25 32.625 -6.651 5.419 1.00 0.00 C ATOM 349 CG ASP A 25 33.635 -6.403 6.522 1.00 0.00 C ATOM 350 OD1 ASP A 25 33.299 -5.680 7.482 1.00 0.00 O ATOM 351 OD2 ASP A 25 34.763 -6.931 6.424 1.00 0.00 O ATOM 0 H ASP A 25 34.505 -5.552 4.227 1.00 0.00 H new ATOM 0 HA ASP A 25 31.869 -5.727 3.633 1.00 0.00 H new ATOM 0 HB2 ASP A 25 31.668 -6.927 5.862 1.00 0.00 H new ATOM 0 HB3 ASP A 25 32.952 -7.497 4.814 1.00 0.00 H new ATOM 356 N ALA A 26 32.285 -3.713 6.225 1.00 0.00 N ATOM 357 CA ALA A 26 31.640 -2.665 7.006 1.00 0.00 C ATOM 358 C ALA A 26 30.840 -1.725 6.111 1.00 0.00 C ATOM 359 O ALA A 26 29.754 -1.277 6.478 1.00 0.00 O ATOM 360 CB ALA A 26 32.678 -1.884 7.799 1.00 0.00 C ATOM 0 H ALA A 26 33.253 -3.899 6.486 1.00 0.00 H new ATOM 0 HA ALA A 26 30.947 -3.139 7.701 1.00 0.00 H new ATOM 0 HB1 ALA A 26 32.183 -1.104 8.378 1.00 0.00 H new ATOM 0 HB2 ALA A 26 33.203 -2.559 8.475 1.00 0.00 H new ATOM 0 HB3 ALA A 26 33.392 -1.428 7.113 1.00 0.00 H new ATOM 366 N ALA A 27 31.384 -1.431 4.934 1.00 0.00 N ATOM 367 CA ALA A 27 30.719 -0.545 3.986 1.00 0.00 C ATOM 368 C ALA A 27 29.387 -1.130 3.530 1.00 0.00 C ATOM 369 O ALA A 27 28.380 -0.426 3.463 1.00 0.00 O ATOM 370 CB ALA A 27 31.620 -0.283 2.788 1.00 0.00 C ATOM 0 H ALA A 27 32.282 -1.793 4.615 1.00 0.00 H new ATOM 0 HA ALA A 27 30.518 0.401 4.489 1.00 0.00 H new ATOM 0 HB1 ALA A 27 31.111 0.380 2.088 1.00 0.00 H new ATOM 0 HB2 ALA A 27 32.545 0.185 3.124 1.00 0.00 H new ATOM 0 HB3 ALA A 27 31.850 -1.226 2.292 1.00 0.00 H new ATOM 376 N GLN A 28 29.389 -2.422 3.216 1.00 0.00 N ATOM 377 CA GLN A 28 28.180 -3.100 2.764 1.00 0.00 C ATOM 378 C GLN A 28 27.126 -3.125 3.866 1.00 0.00 C ATOM 379 O GLN A 28 25.963 -2.797 3.632 1.00 0.00 O ATOM 380 CB GLN A 28 28.506 -4.528 2.321 1.00 0.00 C ATOM 381 CG GLN A 28 27.278 -5.348 1.961 1.00 0.00 C ATOM 382 CD GLN A 28 26.419 -4.681 0.906 1.00 0.00 C ATOM 383 OE1 GLN A 28 25.773 -3.665 1.166 1.00 0.00 O ATOM 384 NE2 GLN A 28 26.407 -5.249 -0.295 1.00 0.00 N ATOM 0 H GLN A 28 30.214 -3.020 3.266 1.00 0.00 H new ATOM 0 HA GLN A 28 27.779 -2.546 1.915 1.00 0.00 H new ATOM 0 HB2 GLN A 28 29.172 -4.489 1.459 1.00 0.00 H new ATOM 0 HB3 GLN A 28 29.048 -5.033 3.121 1.00 0.00 H new ATOM 0 HG2 GLN A 28 27.593 -6.328 1.601 1.00 0.00 H new ATOM 0 HG3 GLN A 28 26.681 -5.514 2.858 1.00 0.00 H new ATOM 0 HE21 GLN A 28 26.957 -6.090 -0.467 1.00 0.00 H new ATOM 0 HE22 GLN A 28 25.847 -4.844 -1.045 1.00 0.00 H new ATOM 393 N GLN A 29 27.541 -3.517 5.066 1.00 0.00 N ATOM 394 CA GLN A 29 26.632 -3.585 6.204 1.00 0.00 C ATOM 395 C GLN A 29 26.057 -2.210 6.525 1.00 0.00 C ATOM 396 O GLN A 29 24.843 -2.046 6.644 1.00 0.00 O ATOM 397 CB GLN A 29 27.355 -4.148 7.429 1.00 0.00 C ATOM 398 CG GLN A 29 27.794 -5.594 7.265 1.00 0.00 C ATOM 399 CD GLN A 29 29.136 -5.721 6.573 1.00 0.00 C ATOM 400 OE1 GLN A 29 30.173 -5.364 7.133 1.00 0.00 O ATOM 401 NE2 GLN A 29 29.125 -6.233 5.348 1.00 0.00 N ATOM 0 H GLN A 29 28.501 -3.792 5.275 1.00 0.00 H new ATOM 0 HA GLN A 29 25.809 -4.249 5.940 1.00 0.00 H new ATOM 0 HB2 GLN A 29 28.230 -3.533 7.639 1.00 0.00 H new ATOM 0 HB3 GLN A 29 26.698 -4.073 8.295 1.00 0.00 H new ATOM 0 HG2 GLN A 29 27.849 -6.067 8.246 1.00 0.00 H new ATOM 0 HG3 GLN A 29 27.041 -6.136 6.692 1.00 0.00 H new ATOM 0 HE21 GLN A 29 28.243 -6.516 4.921 1.00 0.00 H new ATOM 0 HE22 GLN A 29 29.999 -6.343 4.834 1.00 0.00 H new ATOM 410 N GLU A 30 26.938 -1.224 6.665 1.00 0.00 N ATOM 411 CA GLU A 30 26.517 0.138 6.974 1.00 0.00 C ATOM 412 C GLU A 30 25.440 0.608 6.001 1.00 0.00 C ATOM 413 O GLU A 30 24.480 1.271 6.393 1.00 0.00 O ATOM 414 CB GLU A 30 27.714 1.089 6.926 1.00 0.00 C ATOM 415 CG GLU A 30 28.554 1.075 8.193 1.00 0.00 C ATOM 416 CD GLU A 30 27.716 1.207 9.449 1.00 0.00 C ATOM 417 OE1 GLU A 30 27.325 2.345 9.785 1.00 0.00 O ATOM 418 OE2 GLU A 30 27.450 0.173 10.097 1.00 0.00 O ATOM 0 H GLU A 30 27.947 -1.343 6.569 1.00 0.00 H new ATOM 0 HA GLU A 30 26.100 0.142 7.981 1.00 0.00 H new ATOM 0 HB2 GLU A 30 28.345 0.822 6.079 1.00 0.00 H new ATOM 0 HB3 GLU A 30 27.355 2.103 6.749 1.00 0.00 H new ATOM 0 HG2 GLU A 30 29.124 0.147 8.237 1.00 0.00 H new ATOM 0 HG3 GLU A 30 29.276 1.891 8.155 1.00 0.00 H new ATOM 425 N ALA A 31 25.608 0.261 4.729 1.00 0.00 N ATOM 426 CA ALA A 31 24.651 0.646 3.699 1.00 0.00 C ATOM 427 C ALA A 31 23.406 -0.232 3.751 1.00 0.00 C ATOM 428 O ALA A 31 22.324 0.228 4.117 1.00 0.00 O ATOM 429 CB ALA A 31 25.297 0.570 2.323 1.00 0.00 C ATOM 0 H ALA A 31 26.398 -0.286 4.387 1.00 0.00 H new ATOM 0 HA ALA A 31 24.346 1.675 3.888 1.00 0.00 H new ATOM 0 HB1 ALA A 31 24.571 0.860 1.564 1.00 0.00 H new ATOM 0 HB2 ALA A 31 26.152 1.245 2.285 1.00 0.00 H new ATOM 0 HB3 ALA A 31 25.632 -0.450 2.134 1.00 0.00 H new ATOM 435 N LYS A 32 23.565 -1.499 3.382 1.00 0.00 N ATOM 436 CA LYS A 32 22.454 -2.443 3.387 1.00 0.00 C ATOM 437 C LYS A 32 21.600 -2.272 4.639 1.00 0.00 C ATOM 438 O LYS A 32 20.395 -2.523 4.620 1.00 0.00 O ATOM 439 CB LYS A 32 22.978 -3.878 3.305 1.00 0.00 C ATOM 440 CG LYS A 32 23.705 -4.333 4.559 1.00 0.00 C ATOM 441 CD LYS A 32 22.751 -4.966 5.558 1.00 0.00 C ATOM 442 CE LYS A 32 22.583 -6.456 5.302 1.00 0.00 C ATOM 443 NZ LYS A 32 23.824 -7.216 5.620 1.00 0.00 N ATOM 0 H LYS A 32 24.453 -1.896 3.076 1.00 0.00 H new ATOM 0 HA LYS A 32 21.832 -2.239 2.515 1.00 0.00 H new ATOM 0 HB2 LYS A 32 22.142 -4.551 3.116 1.00 0.00 H new ATOM 0 HB3 LYS A 32 23.653 -3.961 2.453 1.00 0.00 H new ATOM 0 HG2 LYS A 32 24.481 -5.050 4.291 1.00 0.00 H new ATOM 0 HG3 LYS A 32 24.204 -3.481 5.021 1.00 0.00 H new ATOM 0 HD2 LYS A 32 23.126 -4.810 6.570 1.00 0.00 H new ATOM 0 HD3 LYS A 32 21.780 -4.474 5.498 1.00 0.00 H new ATOM 0 HE2 LYS A 32 21.759 -6.838 5.905 1.00 0.00 H new ATOM 0 HE3 LYS A 32 22.316 -6.617 4.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 23.585 -8.213 5.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 24.484 -7.155 4.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 24.271 -6.812 6.467 1.00 0.00 H new ATOM 457 N HIS A 33 22.233 -1.844 5.727 1.00 0.00 N ATOM 458 CA HIS A 33 21.530 -1.638 6.989 1.00 0.00 C ATOM 459 C HIS A 33 20.387 -0.642 6.817 1.00 0.00 C ATOM 460 O HIS A 33 19.255 -0.905 7.224 1.00 0.00 O ATOM 461 CB HIS A 33 22.499 -1.140 8.061 1.00 0.00 C ATOM 462 CG HIS A 33 21.852 -0.908 9.392 1.00 0.00 C ATOM 463 ND1 HIS A 33 20.743 -0.106 9.560 1.00 0.00 N ATOM 464 CD2 HIS A 33 22.164 -1.380 10.622 1.00 0.00 C ATOM 465 CE1 HIS A 33 20.401 -0.094 10.836 1.00 0.00 C ATOM 466 NE2 HIS A 33 21.247 -0.859 11.502 1.00 0.00 N ATOM 0 H HIS A 33 23.230 -1.633 5.760 1.00 0.00 H new ATOM 0 HA HIS A 33 21.112 -2.594 7.304 1.00 0.00 H new ATOM 0 HB2 HIS A 33 23.303 -1.867 8.179 1.00 0.00 H new ATOM 0 HB3 HIS A 33 22.957 -0.211 7.722 1.00 0.00 H new ATOM 0 HD2 HIS A 33 22.981 -2.043 10.866 1.00 0.00 H new ATOM 0 HE1 HIS A 33 19.571 0.449 11.262 1.00 0.00 H new ATOM 0 HE2 HIS A 33 21.223 -1.034 12.507 1.00 0.00 H new ATOM 475 N ARG A 34 20.691 0.503 6.214 1.00 0.00 N ATOM 476 CA ARG A 34 19.689 1.538 5.991 1.00 0.00 C ATOM 477 C ARG A 34 18.465 0.967 5.282 1.00 0.00 C ATOM 478 O ARG A 34 17.329 1.265 5.648 1.00 0.00 O ATOM 479 CB ARG A 34 20.282 2.682 5.166 1.00 0.00 C ATOM 480 CG ARG A 34 21.250 3.557 5.946 1.00 0.00 C ATOM 481 CD ARG A 34 20.514 4.511 6.874 1.00 0.00 C ATOM 482 NE ARG A 34 20.034 5.698 6.172 1.00 0.00 N ATOM 483 CZ ARG A 34 20.837 6.633 5.677 1.00 0.00 C ATOM 484 NH1 ARG A 34 22.152 6.520 5.807 1.00 0.00 N ATOM 485 NH2 ARG A 34 20.325 7.685 5.051 1.00 0.00 N ATOM 0 H ARG A 34 21.623 0.737 5.871 1.00 0.00 H new ATOM 0 HA ARG A 34 19.378 1.922 6.962 1.00 0.00 H new ATOM 0 HB2 ARG A 34 20.798 2.265 4.301 1.00 0.00 H new ATOM 0 HB3 ARG A 34 19.471 3.302 4.785 1.00 0.00 H new ATOM 0 HG2 ARG A 34 21.923 2.928 6.528 1.00 0.00 H new ATOM 0 HG3 ARG A 34 21.868 4.127 5.252 1.00 0.00 H new ATOM 0 HD2 ARG A 34 19.670 3.994 7.330 1.00 0.00 H new ATOM 0 HD3 ARG A 34 21.178 4.813 7.684 1.00 0.00 H new ATOM 0 HE ARG A 34 19.028 5.815 6.055 1.00 0.00 H new ATOM 0 HH11 ARG A 34 22.549 5.713 6.288 1.00 0.00 H new ATOM 0 HH12 ARG A 34 22.766 7.240 5.426 1.00 0.00 H new ATOM 0 HH21 ARG A 34 19.314 7.776 4.950 1.00 0.00 H new ATOM 0 HH22 ARG A 34 20.942 8.403 4.671 1.00 0.00 H new ATOM 499 N GLU A 35 18.706 0.145 4.265 1.00 0.00 N ATOM 500 CA GLU A 35 17.623 -0.466 3.504 1.00 0.00 C ATOM 501 C GLU A 35 16.562 -1.045 4.436 1.00 0.00 C ATOM 502 O GLU A 35 15.370 -1.011 4.134 1.00 0.00 O ATOM 503 CB GLU A 35 18.168 -1.565 2.590 1.00 0.00 C ATOM 504 CG GLU A 35 17.128 -2.143 1.645 1.00 0.00 C ATOM 505 CD GLU A 35 17.747 -2.782 0.417 1.00 0.00 C ATOM 506 OE1 GLU A 35 18.164 -3.956 0.506 1.00 0.00 O ATOM 507 OE2 GLU A 35 17.815 -2.109 -0.633 1.00 0.00 O ATOM 0 H GLU A 35 19.641 -0.113 3.950 1.00 0.00 H new ATOM 0 HA GLU A 35 17.161 0.309 2.893 1.00 0.00 H new ATOM 0 HB2 GLU A 35 18.994 -1.162 2.005 1.00 0.00 H new ATOM 0 HB3 GLU A 35 18.575 -2.368 3.204 1.00 0.00 H new ATOM 0 HG2 GLU A 35 16.533 -2.886 2.176 1.00 0.00 H new ATOM 0 HG3 GLU A 35 16.446 -1.352 1.334 1.00 0.00 H new ATOM 514 N ALA A 36 17.007 -1.576 5.571 1.00 0.00 N ATOM 515 CA ALA A 36 16.097 -2.161 6.548 1.00 0.00 C ATOM 516 C ALA A 36 15.407 -1.079 7.372 1.00 0.00 C ATOM 517 O ALA A 36 14.316 -1.291 7.900 1.00 0.00 O ATOM 518 CB ALA A 36 16.847 -3.123 7.458 1.00 0.00 C ATOM 0 H ALA A 36 17.991 -1.613 5.836 1.00 0.00 H new ATOM 0 HA ALA A 36 15.329 -2.714 6.007 1.00 0.00 H new ATOM 0 HB1 ALA A 36 16.155 -3.552 8.183 1.00 0.00 H new ATOM 0 HB2 ALA A 36 17.288 -3.921 6.860 1.00 0.00 H new ATOM 0 HB3 ALA A 36 17.636 -2.586 7.984 1.00 0.00 H new ATOM 524 N GLU A 37 16.051 0.079 7.478 1.00 0.00 N ATOM 525 CA GLU A 37 15.499 1.192 8.240 1.00 0.00 C ATOM 526 C GLU A 37 14.395 1.895 7.454 1.00 0.00 C ATOM 527 O GLU A 37 13.276 2.051 7.941 1.00 0.00 O ATOM 528 CB GLU A 37 16.601 2.192 8.596 1.00 0.00 C ATOM 529 CG GLU A 37 17.678 1.615 9.500 1.00 0.00 C ATOM 530 CD GLU A 37 18.605 2.678 10.056 1.00 0.00 C ATOM 531 OE1 GLU A 37 18.099 3.704 10.556 1.00 0.00 O ATOM 532 OE2 GLU A 37 19.837 2.483 9.990 1.00 0.00 O ATOM 0 H GLU A 37 16.955 0.270 7.046 1.00 0.00 H new ATOM 0 HA GLU A 37 15.070 0.792 9.159 1.00 0.00 H new ATOM 0 HB2 GLU A 37 17.064 2.552 7.677 1.00 0.00 H new ATOM 0 HB3 GLU A 37 16.152 3.056 9.086 1.00 0.00 H new ATOM 0 HG2 GLU A 37 17.207 1.082 10.326 1.00 0.00 H new ATOM 0 HG3 GLU A 37 18.263 0.884 8.941 1.00 0.00 H new ATOM 539 N MET A 38 14.720 2.316 6.236 1.00 0.00 N ATOM 540 CA MET A 38 13.756 3.001 5.383 1.00 0.00 C ATOM 541 C MET A 38 12.516 2.140 5.163 1.00 0.00 C ATOM 542 O MET A 38 11.390 2.591 5.377 1.00 0.00 O ATOM 543 CB MET A 38 14.393 3.350 4.036 1.00 0.00 C ATOM 544 CG MET A 38 15.018 2.157 3.332 1.00 0.00 C ATOM 545 SD MET A 38 16.249 2.641 2.107 1.00 0.00 S ATOM 546 CE MET A 38 15.334 3.863 1.171 1.00 0.00 C ATOM 0 H MET A 38 15.643 2.195 5.818 1.00 0.00 H new ATOM 0 HA MET A 38 13.454 3.921 5.884 1.00 0.00 H new ATOM 0 HB2 MET A 38 13.634 3.788 3.387 1.00 0.00 H new ATOM 0 HB3 MET A 38 15.157 4.111 4.191 1.00 0.00 H new ATOM 0 HG2 MET A 38 15.484 1.506 4.072 1.00 0.00 H new ATOM 0 HG3 MET A 38 14.235 1.576 2.845 1.00 0.00 H new ATOM 0 HE1 MET A 38 15.848 4.061 0.231 1.00 0.00 H new ATOM 0 HE2 MET A 38 14.332 3.487 0.964 1.00 0.00 H new ATOM 0 HE3 MET A 38 15.264 4.785 1.748 1.00 0.00 H new ATOM 556 N ARG A 39 12.730 0.900 4.736 1.00 0.00 N ATOM 557 CA ARG A 39 11.629 -0.023 4.487 1.00 0.00 C ATOM 558 C ARG A 39 10.752 -0.171 5.727 1.00 0.00 C ATOM 559 O ARG A 39 9.525 -0.175 5.635 1.00 0.00 O ATOM 560 CB ARG A 39 12.168 -1.391 4.064 1.00 0.00 C ATOM 561 CG ARG A 39 12.473 -2.313 5.232 1.00 0.00 C ATOM 562 CD ARG A 39 12.871 -3.702 4.757 1.00 0.00 C ATOM 563 NE ARG A 39 12.770 -4.695 5.823 1.00 0.00 N ATOM 564 CZ ARG A 39 13.259 -5.927 5.728 1.00 0.00 C ATOM 565 NH1 ARG A 39 13.881 -6.313 4.623 1.00 0.00 N ATOM 566 NH2 ARG A 39 13.128 -6.773 6.741 1.00 0.00 N ATOM 0 H ARG A 39 13.656 0.511 4.555 1.00 0.00 H new ATOM 0 HA ARG A 39 11.021 0.386 3.680 1.00 0.00 H new ATOM 0 HB2 ARG A 39 11.440 -1.873 3.412 1.00 0.00 H new ATOM 0 HB3 ARG A 39 13.076 -1.249 3.478 1.00 0.00 H new ATOM 0 HG2 ARG A 39 13.278 -1.888 5.832 1.00 0.00 H new ATOM 0 HG3 ARG A 39 11.598 -2.385 5.878 1.00 0.00 H new ATOM 0 HD2 ARG A 39 12.232 -3.997 3.925 1.00 0.00 H new ATOM 0 HD3 ARG A 39 13.894 -3.677 4.381 1.00 0.00 H new ATOM 0 HE ARG A 39 12.299 -4.428 6.687 1.00 0.00 H new ATOM 0 HH11 ARG A 39 13.985 -5.664 3.843 1.00 0.00 H new ATOM 0 HH12 ARG A 39 14.255 -7.259 4.553 1.00 0.00 H new ATOM 0 HH21 ARG A 39 12.652 -6.478 7.593 1.00 0.00 H new ATOM 0 HH22 ARG A 39 13.503 -7.719 6.668 1.00 0.00 H new ATOM 580 N ASN A 40 11.391 -0.294 6.886 1.00 0.00 N ATOM 581 CA ASN A 40 10.670 -0.444 8.144 1.00 0.00 C ATOM 582 C ASN A 40 9.590 0.626 8.283 1.00 0.00 C ATOM 583 O ASN A 40 8.418 0.315 8.493 1.00 0.00 O ATOM 584 CB ASN A 40 11.639 -0.361 9.325 1.00 0.00 C ATOM 585 CG ASN A 40 12.241 -1.709 9.674 1.00 0.00 C ATOM 586 OD1 ASN A 40 11.915 -2.725 9.059 1.00 0.00 O ATOM 587 ND2 ASN A 40 13.124 -1.724 10.665 1.00 0.00 N ATOM 0 H ASN A 40 12.407 -0.293 6.980 1.00 0.00 H new ATOM 0 HA ASN A 40 10.190 -1.423 8.144 1.00 0.00 H new ATOM 0 HB2 ASN A 40 12.439 0.340 9.087 1.00 0.00 H new ATOM 0 HB3 ASN A 40 11.115 0.036 10.194 1.00 0.00 H new ATOM 0 HD21 ASN A 40 13.562 -2.602 10.944 1.00 0.00 H new ATOM 0 HD22 ASN A 40 13.364 -0.858 11.147 1.00 0.00 H new ATOM 594 N SER A 41 9.995 1.886 8.164 1.00 0.00 N ATOM 595 CA SER A 41 9.063 3.002 8.279 1.00 0.00 C ATOM 596 C SER A 41 7.991 2.928 7.196 1.00 0.00 C ATOM 597 O SER A 41 6.856 3.361 7.400 1.00 0.00 O ATOM 598 CB SER A 41 9.813 4.332 8.181 1.00 0.00 C ATOM 599 OG SER A 41 10.449 4.650 9.406 1.00 0.00 O ATOM 0 H SER A 41 10.962 2.160 7.988 1.00 0.00 H new ATOM 0 HA SER A 41 8.576 2.939 9.252 1.00 0.00 H new ATOM 0 HB2 SER A 41 10.556 4.276 7.386 1.00 0.00 H new ATOM 0 HB3 SER A 41 9.117 5.127 7.912 1.00 0.00 H new ATOM 0 HG SER A 41 10.923 5.503 9.317 1.00 0.00 H new ATOM 605 N ILE A 42 8.359 2.377 6.044 1.00 0.00 N ATOM 606 CA ILE A 42 7.429 2.246 4.929 1.00 0.00 C ATOM 607 C ILE A 42 6.391 1.163 5.204 1.00 0.00 C ATOM 608 O ILE A 42 5.222 1.301 4.839 1.00 0.00 O ATOM 609 CB ILE A 42 8.166 1.913 3.618 1.00 0.00 C ATOM 610 CG1 ILE A 42 9.078 3.073 3.213 1.00 0.00 C ATOM 611 CG2 ILE A 42 7.167 1.606 2.513 1.00 0.00 C ATOM 612 CD1 ILE A 42 10.249 2.648 2.354 1.00 0.00 C ATOM 0 H ILE A 42 9.294 2.014 5.858 1.00 0.00 H new ATOM 0 HA ILE A 42 6.928 3.208 4.821 1.00 0.00 H new ATOM 0 HB ILE A 42 8.783 1.029 3.778 1.00 0.00 H new ATOM 0 HG12 ILE A 42 8.491 3.815 2.672 1.00 0.00 H new ATOM 0 HG13 ILE A 42 9.455 3.560 4.113 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.703 1.373 1.593 1.00 0.00 H new ATOM 0 HG22 ILE A 42 6.555 0.752 2.803 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.527 2.473 2.350 1.00 0.00 H new ATOM 0 HD11 ILE A 42 10.853 3.521 2.104 1.00 0.00 H new ATOM 0 HD12 ILE A 42 10.859 1.929 2.901 1.00 0.00 H new ATOM 0 HD13 ILE A 42 9.880 2.188 1.437 1.00 0.00 H new ATOM 624 N LEU A 43 6.823 0.087 5.852 1.00 0.00 N ATOM 625 CA LEU A 43 5.931 -1.019 6.178 1.00 0.00 C ATOM 626 C LEU A 43 5.081 -0.691 7.402 1.00 0.00 C ATOM 627 O LEU A 43 3.969 -1.195 7.551 1.00 0.00 O ATOM 628 CB LEU A 43 6.738 -2.294 6.431 1.00 0.00 C ATOM 629 CG LEU A 43 7.566 -2.808 5.253 1.00 0.00 C ATOM 630 CD1 LEU A 43 8.605 -3.812 5.729 1.00 0.00 C ATOM 631 CD2 LEU A 43 6.664 -3.431 4.198 1.00 0.00 C ATOM 0 H LEU A 43 7.786 -0.043 6.162 1.00 0.00 H new ATOM 0 HA LEU A 43 5.266 -1.179 5.329 1.00 0.00 H new ATOM 0 HB2 LEU A 43 7.410 -2.115 7.271 1.00 0.00 H new ATOM 0 HB3 LEU A 43 6.049 -3.082 6.736 1.00 0.00 H new ATOM 0 HG LEU A 43 8.087 -1.962 4.803 1.00 0.00 H new ATOM 0 HD11 LEU A 43 9.185 -4.167 4.877 1.00 0.00 H new ATOM 0 HD12 LEU A 43 9.271 -3.334 6.447 1.00 0.00 H new ATOM 0 HD13 LEU A 43 8.105 -4.656 6.204 1.00 0.00 H new ATOM 0 HD21 LEU A 43 7.271 -3.791 3.367 1.00 0.00 H new ATOM 0 HD22 LEU A 43 6.115 -4.265 4.635 1.00 0.00 H new ATOM 0 HD23 LEU A 43 5.959 -2.683 3.835 1.00 0.00 H new ATOM 643 N ALA A 44 5.613 0.160 8.274 1.00 0.00 N ATOM 644 CA ALA A 44 4.902 0.559 9.482 1.00 0.00 C ATOM 645 C ALA A 44 3.805 1.569 9.165 1.00 0.00 C ATOM 646 O ALA A 44 2.782 1.623 9.848 1.00 0.00 O ATOM 647 CB ALA A 44 5.875 1.136 10.500 1.00 0.00 C ATOM 0 H ALA A 44 6.534 0.586 8.166 1.00 0.00 H new ATOM 0 HA ALA A 44 4.431 -0.328 9.907 1.00 0.00 H new ATOM 0 HB1 ALA A 44 5.331 1.430 11.397 1.00 0.00 H new ATOM 0 HB2 ALA A 44 6.620 0.384 10.758 1.00 0.00 H new ATOM 0 HB3 ALA A 44 6.372 2.008 10.075 1.00 0.00 H new ATOM 653 N GLN A 45 4.024 2.368 8.126 1.00 0.00 N ATOM 654 CA GLN A 45 3.054 3.378 7.720 1.00 0.00 C ATOM 655 C GLN A 45 1.964 2.765 6.846 1.00 0.00 C ATOM 656 O GLN A 45 0.792 3.125 6.954 1.00 0.00 O ATOM 657 CB GLN A 45 3.751 4.512 6.966 1.00 0.00 C ATOM 658 CG GLN A 45 4.261 4.106 5.593 1.00 0.00 C ATOM 659 CD GLN A 45 4.884 5.263 4.837 1.00 0.00 C ATOM 660 OE1 GLN A 45 6.100 5.314 4.650 1.00 0.00 O ATOM 661 NE2 GLN A 45 4.052 6.200 4.397 1.00 0.00 N ATOM 0 H GLN A 45 4.865 2.336 7.550 1.00 0.00 H new ATOM 0 HA GLN A 45 2.589 3.782 8.620 1.00 0.00 H new ATOM 0 HB2 GLN A 45 3.056 5.344 6.855 1.00 0.00 H new ATOM 0 HB3 GLN A 45 4.588 4.874 7.563 1.00 0.00 H new ATOM 0 HG2 GLN A 45 4.998 3.310 5.704 1.00 0.00 H new ATOM 0 HG3 GLN A 45 3.436 3.697 5.009 1.00 0.00 H new ATOM 0 HE21 GLN A 45 3.051 6.117 4.575 1.00 0.00 H new ATOM 0 HE22 GLN A 45 4.414 7.002 3.881 1.00 0.00 H new ATOM 670 N VAL A 46 2.359 1.836 5.981 1.00 0.00 N ATOM 671 CA VAL A 46 1.415 1.173 5.089 1.00 0.00 C ATOM 672 C VAL A 46 0.665 0.060 5.812 1.00 0.00 C ATOM 673 O VAL A 46 -0.372 -0.412 5.343 1.00 0.00 O ATOM 674 CB VAL A 46 2.128 0.581 3.858 1.00 0.00 C ATOM 675 CG1 VAL A 46 2.847 1.672 3.081 1.00 0.00 C ATOM 676 CG2 VAL A 46 3.099 -0.512 4.280 1.00 0.00 C ATOM 0 H VAL A 46 3.325 1.526 5.879 1.00 0.00 H new ATOM 0 HA VAL A 46 0.705 1.931 4.759 1.00 0.00 H new ATOM 0 HB VAL A 46 1.378 0.137 3.204 1.00 0.00 H new ATOM 0 HG11 VAL A 46 3.345 1.235 2.215 1.00 0.00 H new ATOM 0 HG12 VAL A 46 2.125 2.417 2.747 1.00 0.00 H new ATOM 0 HG13 VAL A 46 3.588 2.148 3.723 1.00 0.00 H new ATOM 0 HG21 VAL A 46 3.594 -0.919 3.398 1.00 0.00 H new ATOM 0 HG22 VAL A 46 3.846 -0.094 4.955 1.00 0.00 H new ATOM 0 HG23 VAL A 46 2.554 -1.306 4.789 1.00 0.00 H new ATOM 686 N LEU A 47 1.195 -0.356 6.957 1.00 0.00 N ATOM 687 CA LEU A 47 0.575 -1.414 7.747 1.00 0.00 C ATOM 688 C LEU A 47 0.217 -0.913 9.143 1.00 0.00 C ATOM 689 O LEU A 47 1.073 -0.414 9.873 1.00 0.00 O ATOM 690 CB LEU A 47 1.513 -2.617 7.850 1.00 0.00 C ATOM 691 CG LEU A 47 2.091 -3.133 6.532 1.00 0.00 C ATOM 692 CD1 LEU A 47 3.228 -4.108 6.792 1.00 0.00 C ATOM 693 CD2 LEU A 47 1.004 -3.790 5.694 1.00 0.00 C ATOM 0 H LEU A 47 2.052 0.023 7.359 1.00 0.00 H new ATOM 0 HA LEU A 47 -0.343 -1.719 7.244 1.00 0.00 H new ATOM 0 HB2 LEU A 47 2.341 -2.351 8.507 1.00 0.00 H new ATOM 0 HB3 LEU A 47 0.973 -3.433 8.331 1.00 0.00 H new ATOM 0 HG LEU A 47 2.488 -2.284 5.975 1.00 0.00 H new ATOM 0 HD11 LEU A 47 3.626 -4.464 5.842 1.00 0.00 H new ATOM 0 HD12 LEU A 47 4.017 -3.606 7.351 1.00 0.00 H new ATOM 0 HD13 LEU A 47 2.857 -4.954 7.370 1.00 0.00 H new ATOM 0 HD21 LEU A 47 1.433 -4.151 4.760 1.00 0.00 H new ATOM 0 HD22 LEU A 47 0.576 -4.628 6.245 1.00 0.00 H new ATOM 0 HD23 LEU A 47 0.222 -3.062 5.476 1.00 0.00 H new ATOM 705 N ASP A 48 -1.053 -1.051 9.508 1.00 0.00 N ATOM 706 CA ASP A 48 -1.524 -0.616 10.817 1.00 0.00 C ATOM 707 C ASP A 48 -1.047 -1.567 11.910 1.00 0.00 C ATOM 708 O ASP A 48 -0.583 -2.671 11.626 1.00 0.00 O ATOM 709 CB ASP A 48 -3.051 -0.529 10.831 1.00 0.00 C ATOM 710 CG ASP A 48 -3.577 0.234 12.031 1.00 0.00 C ATOM 711 OD1 ASP A 48 -3.416 1.472 12.065 1.00 0.00 O ATOM 712 OD2 ASP A 48 -4.150 -0.408 12.936 1.00 0.00 O ATOM 0 H ASP A 48 -1.775 -1.461 8.915 1.00 0.00 H new ATOM 0 HA ASP A 48 -1.110 0.373 11.014 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -3.393 -0.043 9.917 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -3.469 -1.536 10.832 1.00 0.00 H new ATOM 717 N GLN A 49 -1.163 -1.130 13.160 1.00 0.00 N ATOM 718 CA GLN A 49 -0.741 -1.942 14.295 1.00 0.00 C ATOM 719 C GLN A 49 -1.307 -3.355 14.194 1.00 0.00 C ATOM 720 O GLN A 49 -0.619 -4.332 14.487 1.00 0.00 O ATOM 721 CB GLN A 49 -1.187 -1.294 15.607 1.00 0.00 C ATOM 722 CG GLN A 49 -0.625 -1.975 16.844 1.00 0.00 C ATOM 723 CD GLN A 49 -1.450 -3.171 17.278 1.00 0.00 C ATOM 724 OE1 GLN A 49 -2.628 -3.039 17.612 1.00 0.00 O ATOM 725 NE2 GLN A 49 -0.835 -4.347 17.276 1.00 0.00 N ATOM 0 H GLN A 49 -1.546 -0.219 13.412 1.00 0.00 H new ATOM 0 HA GLN A 49 0.347 -2.004 14.280 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -0.881 -0.248 15.608 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -2.276 -1.308 15.658 1.00 0.00 H new ATOM 0 HG2 GLN A 49 0.397 -2.297 16.644 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -0.578 -1.255 17.661 1.00 0.00 H new ATOM 0 HE21 GLN A 49 0.142 -4.411 16.992 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -1.340 -5.187 17.559 1.00 0.00 H new ATOM 734 N SER A 50 -2.566 -3.454 13.778 1.00 0.00 N ATOM 735 CA SER A 50 -3.226 -4.747 13.642 1.00 0.00 C ATOM 736 C SER A 50 -2.484 -5.634 12.647 1.00 0.00 C ATOM 737 O SER A 50 -1.918 -6.662 13.017 1.00 0.00 O ATOM 738 CB SER A 50 -4.676 -4.558 13.192 1.00 0.00 C ATOM 739 OG SER A 50 -5.443 -5.724 13.440 1.00 0.00 O ATOM 0 H SER A 50 -3.149 -2.655 13.530 1.00 0.00 H new ATOM 0 HA SER A 50 -3.216 -5.237 14.616 1.00 0.00 H new ATOM 0 HB2 SER A 50 -5.116 -3.711 13.718 1.00 0.00 H new ATOM 0 HB3 SER A 50 -4.702 -4.321 12.128 1.00 0.00 H new ATOM 0 HG SER A 50 -6.392 -5.528 13.296 1.00 0.00 H new ATOM 745 N ALA A 51 -2.491 -5.228 11.381 1.00 0.00 N ATOM 746 CA ALA A 51 -1.818 -5.983 10.332 1.00 0.00 C ATOM 747 C ALA A 51 -0.387 -6.326 10.735 1.00 0.00 C ATOM 748 O ALA A 51 0.025 -7.484 10.669 1.00 0.00 O ATOM 749 CB ALA A 51 -1.828 -5.200 9.028 1.00 0.00 C ATOM 0 H ALA A 51 -2.956 -4.380 11.058 1.00 0.00 H new ATOM 0 HA ALA A 51 -2.361 -6.917 10.186 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -1.322 -5.776 8.254 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -2.858 -5.011 8.725 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.312 -4.251 9.170 1.00 0.00 H new ATOM 755 N ARG A 52 0.365 -5.312 11.151 1.00 0.00 N ATOM 756 CA ARG A 52 1.750 -5.507 11.562 1.00 0.00 C ATOM 757 C ARG A 52 1.916 -6.830 12.304 1.00 0.00 C ATOM 758 O ARG A 52 2.738 -7.665 11.927 1.00 0.00 O ATOM 759 CB ARG A 52 2.207 -4.350 12.452 1.00 0.00 C ATOM 760 CG ARG A 52 2.640 -3.117 11.674 1.00 0.00 C ATOM 761 CD ARG A 52 4.092 -3.219 11.233 1.00 0.00 C ATOM 762 NE ARG A 52 4.383 -4.502 10.599 1.00 0.00 N ATOM 763 CZ ARG A 52 4.866 -5.552 11.253 1.00 0.00 C ATOM 764 NH1 ARG A 52 5.110 -5.472 12.553 1.00 0.00 N ATOM 765 NH2 ARG A 52 5.105 -6.686 10.606 1.00 0.00 N ATOM 0 H ARG A 52 0.038 -4.348 11.212 1.00 0.00 H new ATOM 0 HA ARG A 52 2.369 -5.533 10.665 1.00 0.00 H new ATOM 0 HB2 ARG A 52 1.394 -4.078 13.125 1.00 0.00 H new ATOM 0 HB3 ARG A 52 3.036 -4.687 13.074 1.00 0.00 H new ATOM 0 HG2 ARG A 52 2.001 -2.994 10.800 1.00 0.00 H new ATOM 0 HG3 ARG A 52 2.508 -2.230 12.293 1.00 0.00 H new ATOM 0 HD2 ARG A 52 4.317 -2.411 10.536 1.00 0.00 H new ATOM 0 HD3 ARG A 52 4.743 -3.086 12.097 1.00 0.00 H new ATOM 0 HE ARG A 52 4.206 -4.597 9.599 1.00 0.00 H new ATOM 0 HH11 ARG A 52 4.927 -4.602 13.054 1.00 0.00 H new ATOM 0 HH12 ARG A 52 5.481 -6.280 13.053 1.00 0.00 H new ATOM 0 HH21 ARG A 52 4.918 -6.752 9.605 1.00 0.00 H new ATOM 0 HH22 ARG A 52 5.476 -7.492 11.109 1.00 0.00 H new ATOM 779 N ALA A 53 1.131 -7.012 13.360 1.00 0.00 N ATOM 780 CA ALA A 53 1.190 -8.233 14.154 1.00 0.00 C ATOM 781 C ALA A 53 1.037 -9.469 13.273 1.00 0.00 C ATOM 782 O ALA A 53 1.852 -10.390 13.333 1.00 0.00 O ATOM 783 CB ALA A 53 0.116 -8.215 15.232 1.00 0.00 C ATOM 0 H ALA A 53 0.447 -6.330 13.686 1.00 0.00 H new ATOM 0 HA ALA A 53 2.168 -8.278 14.632 1.00 0.00 H new ATOM 0 HB1 ALA A 53 0.172 -9.133 15.817 1.00 0.00 H new ATOM 0 HB2 ALA A 53 0.272 -7.358 15.887 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -0.866 -8.142 14.766 1.00 0.00 H new ATOM 789 N ARG A 54 -0.012 -9.482 12.457 1.00 0.00 N ATOM 790 CA ARG A 54 -0.272 -10.606 11.566 1.00 0.00 C ATOM 791 C ARG A 54 0.976 -10.963 10.764 1.00 0.00 C ATOM 792 O ARG A 54 1.351 -12.132 10.668 1.00 0.00 O ATOM 793 CB ARG A 54 -1.425 -10.274 10.616 1.00 0.00 C ATOM 794 CG ARG A 54 -1.879 -11.455 9.774 1.00 0.00 C ATOM 795 CD ARG A 54 -2.913 -12.297 10.507 1.00 0.00 C ATOM 796 NE ARG A 54 -3.037 -13.634 9.932 1.00 0.00 N ATOM 797 CZ ARG A 54 -2.143 -14.599 10.117 1.00 0.00 C ATOM 798 NH1 ARG A 54 -1.065 -14.376 10.856 1.00 0.00 N ATOM 799 NH2 ARG A 54 -2.326 -15.789 9.561 1.00 0.00 N ATOM 0 H ARG A 54 -0.695 -8.727 12.395 1.00 0.00 H new ATOM 0 HA ARG A 54 -0.549 -11.466 12.176 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -2.270 -9.907 11.198 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -1.118 -9.464 9.955 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -2.301 -11.094 8.836 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -1.019 -12.074 9.519 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -2.635 -12.379 11.558 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -3.880 -11.796 10.471 1.00 0.00 H new ATOM 0 HE ARG A 54 -3.855 -13.838 9.357 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -0.920 -13.462 11.284 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -0.380 -15.119 10.996 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -3.154 -15.964 8.991 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -1.639 -16.530 9.703 1.00 0.00 H new ATOM 813 N LEU A 55 1.614 -9.950 10.189 1.00 0.00 N ATOM 814 CA LEU A 55 2.819 -10.157 9.394 1.00 0.00 C ATOM 815 C LEU A 55 3.922 -10.795 10.233 1.00 0.00 C ATOM 816 O LEU A 55 4.416 -11.875 9.908 1.00 0.00 O ATOM 817 CB LEU A 55 3.308 -8.827 8.816 1.00 0.00 C ATOM 818 CG LEU A 55 4.366 -8.921 7.717 1.00 0.00 C ATOM 819 CD1 LEU A 55 3.759 -9.476 6.438 1.00 0.00 C ATOM 820 CD2 LEU A 55 4.995 -7.558 7.464 1.00 0.00 C ATOM 0 H LEU A 55 1.317 -8.977 10.258 1.00 0.00 H new ATOM 0 HA LEU A 55 2.572 -10.833 8.576 1.00 0.00 H new ATOM 0 HB2 LEU A 55 2.448 -8.288 8.419 1.00 0.00 H new ATOM 0 HB3 LEU A 55 3.712 -8.226 9.631 1.00 0.00 H new ATOM 0 HG LEU A 55 5.148 -9.604 8.049 1.00 0.00 H new ATOM 0 HD11 LEU A 55 4.527 -9.536 5.667 1.00 0.00 H new ATOM 0 HD12 LEU A 55 3.357 -10.471 6.628 1.00 0.00 H new ATOM 0 HD13 LEU A 55 2.957 -8.819 6.101 1.00 0.00 H new ATOM 0 HD21 LEU A 55 5.746 -7.644 6.679 1.00 0.00 H new ATOM 0 HD22 LEU A 55 4.224 -6.853 7.153 1.00 0.00 H new ATOM 0 HD23 LEU A 55 5.466 -7.199 8.379 1.00 0.00 H new ATOM 832 N SER A 56 4.300 -10.122 11.314 1.00 0.00 N ATOM 833 CA SER A 56 5.345 -10.623 12.199 1.00 0.00 C ATOM 834 C SER A 56 5.066 -12.066 12.608 1.00 0.00 C ATOM 835 O SER A 56 5.983 -12.876 12.731 1.00 0.00 O ATOM 836 CB SER A 56 5.454 -9.740 13.445 1.00 0.00 C ATOM 837 OG SER A 56 6.614 -10.058 14.194 1.00 0.00 O ATOM 0 H SER A 56 3.899 -9.229 11.599 1.00 0.00 H new ATOM 0 HA SER A 56 6.290 -10.594 11.657 1.00 0.00 H new ATOM 0 HB2 SER A 56 5.484 -8.691 13.150 1.00 0.00 H new ATOM 0 HB3 SER A 56 4.568 -9.871 14.067 1.00 0.00 H new ATOM 0 HG SER A 56 6.662 -9.480 14.984 1.00 0.00 H new ATOM 843 N ASN A 57 3.791 -12.379 12.816 1.00 0.00 N ATOM 844 CA ASN A 57 3.389 -13.724 13.211 1.00 0.00 C ATOM 845 C ASN A 57 3.846 -14.753 12.181 1.00 0.00 C ATOM 846 O ASN A 57 4.216 -15.875 12.529 1.00 0.00 O ATOM 847 CB ASN A 57 1.870 -13.796 13.381 1.00 0.00 C ATOM 848 CG ASN A 57 1.423 -13.378 14.768 1.00 0.00 C ATOM 849 OD1 ASN A 57 2.179 -12.755 15.514 1.00 0.00 O ATOM 850 ND2 ASN A 57 0.189 -13.720 15.120 1.00 0.00 N ATOM 0 H ASN A 57 3.019 -11.720 12.718 1.00 0.00 H new ATOM 0 HA ASN A 57 3.866 -13.953 14.164 1.00 0.00 H new ATOM 0 HB2 ASN A 57 1.393 -13.154 12.640 1.00 0.00 H new ATOM 0 HB3 ASN A 57 1.533 -14.814 13.185 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -0.167 -13.466 16.041 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -0.402 -14.236 14.469 1.00 0.00 H new ATOM 857 N LEU A 58 3.819 -14.363 10.911 1.00 0.00 N ATOM 858 CA LEU A 58 4.231 -15.251 9.829 1.00 0.00 C ATOM 859 C LEU A 58 5.749 -15.396 9.792 1.00 0.00 C ATOM 860 O LEU A 58 6.275 -16.392 9.296 1.00 0.00 O ATOM 861 CB LEU A 58 3.725 -14.719 8.487 1.00 0.00 C ATOM 862 CG LEU A 58 3.552 -15.757 7.377 1.00 0.00 C ATOM 863 CD1 LEU A 58 2.290 -16.575 7.603 1.00 0.00 C ATOM 864 CD2 LEU A 58 3.513 -15.079 6.015 1.00 0.00 C ATOM 0 H LEU A 58 3.516 -13.438 10.605 1.00 0.00 H new ATOM 0 HA LEU A 58 3.795 -16.233 10.011 1.00 0.00 H new ATOM 0 HB2 LEU A 58 2.766 -14.229 8.651 1.00 0.00 H new ATOM 0 HB3 LEU A 58 4.418 -13.954 8.137 1.00 0.00 H new ATOM 0 HG LEU A 58 4.407 -16.432 7.401 1.00 0.00 H new ATOM 0 HD11 LEU A 58 2.184 -17.308 6.803 1.00 0.00 H new ATOM 0 HD12 LEU A 58 2.357 -17.090 8.561 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.424 -15.914 7.606 1.00 0.00 H new ATOM 0 HD21 LEU A 58 3.389 -15.832 5.237 1.00 0.00 H new ATOM 0 HD22 LEU A 58 2.677 -14.381 5.980 1.00 0.00 H new ATOM 0 HD23 LEU A 58 4.445 -14.538 5.851 1.00 0.00 H new ATOM 876 N ALA A 59 6.447 -14.397 10.323 1.00 0.00 N ATOM 877 CA ALA A 59 7.904 -14.416 10.355 1.00 0.00 C ATOM 878 C ALA A 59 8.423 -15.702 10.989 1.00 0.00 C ATOM 879 O ALA A 59 9.459 -16.231 10.585 1.00 0.00 O ATOM 880 CB ALA A 59 8.431 -13.204 11.108 1.00 0.00 C ATOM 0 H ALA A 59 6.027 -13.565 10.737 1.00 0.00 H new ATOM 0 HA ALA A 59 8.266 -14.377 9.327 1.00 0.00 H new ATOM 0 HB1 ALA A 59 9.521 -13.231 11.124 1.00 0.00 H new ATOM 0 HB2 ALA A 59 8.098 -12.293 10.610 1.00 0.00 H new ATOM 0 HB3 ALA A 59 8.053 -13.218 12.130 1.00 0.00 H new ATOM 886 N LEU A 60 7.697 -16.200 11.984 1.00 0.00 N ATOM 887 CA LEU A 60 8.085 -17.425 12.675 1.00 0.00 C ATOM 888 C LEU A 60 7.742 -18.654 11.839 1.00 0.00 C ATOM 889 O LEU A 60 8.629 -19.333 11.322 1.00 0.00 O ATOM 890 CB LEU A 60 7.389 -17.509 14.034 1.00 0.00 C ATOM 891 CG LEU A 60 7.544 -16.290 14.945 1.00 0.00 C ATOM 892 CD1 LEU A 60 6.454 -16.273 16.005 1.00 0.00 C ATOM 893 CD2 LEU A 60 8.921 -16.280 15.592 1.00 0.00 C ATOM 0 H LEU A 60 6.837 -15.775 12.330 1.00 0.00 H new ATOM 0 HA LEU A 60 9.164 -17.401 12.827 1.00 0.00 H new ATOM 0 HB2 LEU A 60 6.326 -17.678 13.865 1.00 0.00 H new ATOM 0 HB3 LEU A 60 7.771 -18.383 14.562 1.00 0.00 H new ATOM 0 HG LEU A 60 7.444 -15.391 14.337 1.00 0.00 H new ATOM 0 HD11 LEU A 60 6.581 -15.399 16.643 1.00 0.00 H new ATOM 0 HD12 LEU A 60 5.478 -16.231 15.522 1.00 0.00 H new ATOM 0 HD13 LEU A 60 6.521 -17.177 16.610 1.00 0.00 H new ATOM 0 HD21 LEU A 60 9.014 -15.406 16.237 1.00 0.00 H new ATOM 0 HD22 LEU A 60 9.050 -17.185 16.186 1.00 0.00 H new ATOM 0 HD23 LEU A 60 9.687 -16.242 14.817 1.00 0.00 H new ATOM 905 N VAL A 61 6.449 -18.932 11.708 1.00 0.00 N ATOM 906 CA VAL A 61 5.988 -20.077 10.931 1.00 0.00 C ATOM 907 C VAL A 61 6.720 -20.166 9.597 1.00 0.00 C ATOM 908 O VAL A 61 7.356 -21.175 9.290 1.00 0.00 O ATOM 909 CB VAL A 61 4.472 -20.004 10.669 1.00 0.00 C ATOM 910 CG1 VAL A 61 3.696 -20.469 11.892 1.00 0.00 C ATOM 911 CG2 VAL A 61 4.067 -18.592 10.276 1.00 0.00 C ATOM 0 H VAL A 61 5.702 -18.380 12.130 1.00 0.00 H new ATOM 0 HA VAL A 61 6.204 -20.968 11.521 1.00 0.00 H new ATOM 0 HB VAL A 61 4.231 -20.670 9.841 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.627 -20.411 11.688 1.00 0.00 H new ATOM 0 HG12 VAL A 61 3.965 -21.499 12.124 1.00 0.00 H new ATOM 0 HG13 VAL A 61 3.939 -19.831 12.741 1.00 0.00 H new ATOM 0 HG21 VAL A 61 2.993 -18.559 10.095 1.00 0.00 H new ATOM 0 HG22 VAL A 61 4.320 -17.903 11.082 1.00 0.00 H new ATOM 0 HG23 VAL A 61 4.597 -18.300 9.369 1.00 0.00 H new ATOM 921 N LYS A 62 6.626 -19.103 8.805 1.00 0.00 N ATOM 922 CA LYS A 62 7.281 -19.059 7.503 1.00 0.00 C ATOM 923 C LYS A 62 7.686 -17.632 7.146 1.00 0.00 C ATOM 924 O LYS A 62 6.857 -16.798 6.783 1.00 0.00 O ATOM 925 CB LYS A 62 6.353 -19.622 6.423 1.00 0.00 C ATOM 926 CG LYS A 62 4.878 -19.408 6.717 1.00 0.00 C ATOM 927 CD LYS A 62 3.999 -20.071 5.670 1.00 0.00 C ATOM 928 CE LYS A 62 2.548 -20.139 6.122 1.00 0.00 C ATOM 929 NZ LYS A 62 1.607 -20.132 4.968 1.00 0.00 N ATOM 0 H LYS A 62 6.102 -18.260 9.042 1.00 0.00 H new ATOM 0 HA LYS A 62 8.181 -19.671 7.556 1.00 0.00 H new ATOM 0 HB2 LYS A 62 6.596 -19.156 5.468 1.00 0.00 H new ATOM 0 HB3 LYS A 62 6.542 -20.690 6.314 1.00 0.00 H new ATOM 0 HG2 LYS A 62 4.640 -19.811 7.701 1.00 0.00 H new ATOM 0 HG3 LYS A 62 4.664 -18.340 6.750 1.00 0.00 H new ATOM 0 HD2 LYS A 62 4.064 -19.516 4.734 1.00 0.00 H new ATOM 0 HD3 LYS A 62 4.366 -21.077 5.470 1.00 0.00 H new ATOM 0 HE2 LYS A 62 2.393 -21.043 6.711 1.00 0.00 H new ATOM 0 HE3 LYS A 62 2.330 -19.292 6.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 0.629 -20.179 5.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 1.737 -19.258 4.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 1.797 -20.954 4.360 1.00 0.00 H new ATOM 943 N PRO A 63 8.992 -17.344 7.249 1.00 0.00 N ATOM 944 CA PRO A 63 9.537 -16.019 6.940 1.00 0.00 C ATOM 945 C PRO A 63 9.485 -15.705 5.448 1.00 0.00 C ATOM 946 O PRO A 63 9.295 -14.555 5.054 1.00 0.00 O ATOM 947 CB PRO A 63 10.988 -16.112 7.417 1.00 0.00 C ATOM 948 CG PRO A 63 11.315 -17.564 7.355 1.00 0.00 C ATOM 949 CD PRO A 63 10.037 -18.290 7.676 1.00 0.00 C ATOM 0 HA PRO A 63 8.968 -15.222 7.418 1.00 0.00 H new ATOM 0 HB2 PRO A 63 11.652 -15.529 6.779 1.00 0.00 H new ATOM 0 HB3 PRO A 63 11.097 -15.725 8.430 1.00 0.00 H new ATOM 0 HG2 PRO A 63 11.683 -17.839 6.367 1.00 0.00 H new ATOM 0 HG3 PRO A 63 12.098 -17.819 8.069 1.00 0.00 H new ATOM 0 HD2 PRO A 63 9.966 -19.236 7.139 1.00 0.00 H new ATOM 0 HD3 PRO A 63 9.961 -18.520 8.739 1.00 0.00 H new ATOM 957 N GLU A 64 9.655 -16.735 4.625 1.00 0.00 N ATOM 958 CA GLU A 64 9.628 -16.566 3.177 1.00 0.00 C ATOM 959 C GLU A 64 8.489 -15.642 2.758 1.00 0.00 C ATOM 960 O GLU A 64 8.716 -14.501 2.354 1.00 0.00 O ATOM 961 CB GLU A 64 9.478 -17.924 2.486 1.00 0.00 C ATOM 962 CG GLU A 64 10.672 -18.842 2.685 1.00 0.00 C ATOM 963 CD GLU A 64 11.857 -18.454 1.822 1.00 0.00 C ATOM 964 OE1 GLU A 64 11.669 -18.280 0.600 1.00 0.00 O ATOM 965 OE2 GLU A 64 12.972 -18.324 2.369 1.00 0.00 O ATOM 0 H GLU A 64 9.813 -17.694 4.936 1.00 0.00 H new ATOM 0 HA GLU A 64 10.571 -16.113 2.872 1.00 0.00 H new ATOM 0 HB2 GLU A 64 8.583 -18.418 2.864 1.00 0.00 H new ATOM 0 HB3 GLU A 64 9.327 -17.764 1.418 1.00 0.00 H new ATOM 0 HG2 GLU A 64 10.969 -18.823 3.733 1.00 0.00 H new ATOM 0 HG3 GLU A 64 10.380 -19.867 2.455 1.00 0.00 H new ATOM 972 N LYS A 65 7.262 -16.142 2.856 1.00 0.00 N ATOM 973 CA LYS A 65 6.085 -15.363 2.488 1.00 0.00 C ATOM 974 C LYS A 65 6.196 -13.933 3.008 1.00 0.00 C ATOM 975 O LYS A 65 5.914 -12.976 2.286 1.00 0.00 O ATOM 976 CB LYS A 65 4.819 -16.022 3.041 1.00 0.00 C ATOM 977 CG LYS A 65 4.190 -17.025 2.090 1.00 0.00 C ATOM 978 CD LYS A 65 3.716 -16.357 0.810 1.00 0.00 C ATOM 979 CE LYS A 65 2.577 -17.133 0.166 1.00 0.00 C ATOM 980 NZ LYS A 65 3.007 -18.491 -0.270 1.00 0.00 N ATOM 0 H LYS A 65 7.056 -17.084 3.188 1.00 0.00 H new ATOM 0 HA LYS A 65 6.025 -15.332 1.400 1.00 0.00 H new ATOM 0 HB2 LYS A 65 5.061 -16.524 3.978 1.00 0.00 H new ATOM 0 HB3 LYS A 65 4.088 -15.247 3.274 1.00 0.00 H new ATOM 0 HG2 LYS A 65 4.914 -17.803 1.849 1.00 0.00 H new ATOM 0 HG3 LYS A 65 3.348 -17.514 2.580 1.00 0.00 H new ATOM 0 HD2 LYS A 65 3.388 -15.341 1.028 1.00 0.00 H new ATOM 0 HD3 LYS A 65 4.547 -16.280 0.109 1.00 0.00 H new ATOM 0 HE2 LYS A 65 1.753 -17.223 0.874 1.00 0.00 H new ATOM 0 HE3 LYS A 65 2.200 -16.578 -0.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 2.202 -18.987 -0.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 3.776 -18.405 -0.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 3.343 -19.030 0.554 1.00 0.00 H new ATOM 994 N THR A 66 6.609 -13.795 4.264 1.00 0.00 N ATOM 995 CA THR A 66 6.757 -12.482 4.879 1.00 0.00 C ATOM 996 C THR A 66 7.681 -11.591 4.058 1.00 0.00 C ATOM 997 O THR A 66 7.381 -10.422 3.817 1.00 0.00 O ATOM 998 CB THR A 66 7.309 -12.593 6.313 1.00 0.00 C ATOM 999 OG1 THR A 66 6.847 -13.803 6.924 1.00 0.00 O ATOM 1000 CG2 THR A 66 6.879 -11.399 7.152 1.00 0.00 C ATOM 0 H THR A 66 6.847 -14.576 4.875 1.00 0.00 H new ATOM 0 HA THR A 66 5.763 -12.035 4.914 1.00 0.00 H new ATOM 0 HB THR A 66 8.398 -12.607 6.260 1.00 0.00 H new ATOM 0 HG1 THR A 66 6.771 -13.672 7.892 1.00 0.00 H new ATOM 0 HG21 THR A 66 7.280 -11.499 8.160 1.00 0.00 H new ATOM 0 HG22 THR A 66 7.257 -10.482 6.700 1.00 0.00 H new ATOM 0 HG23 THR A 66 5.791 -11.359 7.197 1.00 0.00 H new ATOM 1008 N LYS A 67 8.808 -12.150 3.630 1.00 0.00 N ATOM 1009 CA LYS A 67 9.777 -11.407 2.833 1.00 0.00 C ATOM 1010 C LYS A 67 9.117 -10.804 1.598 1.00 0.00 C ATOM 1011 O LYS A 67 9.058 -9.584 1.447 1.00 0.00 O ATOM 1012 CB LYS A 67 10.930 -12.321 2.413 1.00 0.00 C ATOM 1013 CG LYS A 67 11.908 -12.621 3.536 1.00 0.00 C ATOM 1014 CD LYS A 67 13.279 -12.995 2.997 1.00 0.00 C ATOM 1015 CE LYS A 67 14.211 -13.447 4.110 1.00 0.00 C ATOM 1016 NZ LYS A 67 14.528 -12.339 5.053 1.00 0.00 N ATOM 0 H LYS A 67 9.073 -13.116 3.822 1.00 0.00 H new ATOM 0 HA LYS A 67 10.169 -10.596 3.446 1.00 0.00 H new ATOM 0 HB2 LYS A 67 10.521 -13.259 2.038 1.00 0.00 H new ATOM 0 HB3 LYS A 67 11.469 -11.856 1.587 1.00 0.00 H new ATOM 0 HG2 LYS A 67 11.997 -11.750 4.185 1.00 0.00 H new ATOM 0 HG3 LYS A 67 11.522 -13.436 4.148 1.00 0.00 H new ATOM 0 HD2 LYS A 67 13.177 -13.792 2.261 1.00 0.00 H new ATOM 0 HD3 LYS A 67 13.714 -12.139 2.482 1.00 0.00 H new ATOM 0 HE2 LYS A 67 13.750 -14.269 4.658 1.00 0.00 H new ATOM 0 HE3 LYS A 67 15.135 -13.830 3.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 15.218 -12.669 5.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 14.928 -11.538 4.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 13.659 -12.035 5.536 1.00 0.00 H new ATOM 1030 N ALA A 68 8.620 -11.666 0.717 1.00 0.00 N ATOM 1031 CA ALA A 68 7.961 -11.217 -0.503 1.00 0.00 C ATOM 1032 C ALA A 68 6.930 -10.135 -0.204 1.00 0.00 C ATOM 1033 O ALA A 68 7.041 -9.007 -0.685 1.00 0.00 O ATOM 1034 CB ALA A 68 7.304 -12.393 -1.212 1.00 0.00 C ATOM 0 H ALA A 68 8.661 -12.679 0.826 1.00 0.00 H new ATOM 0 HA ALA A 68 8.719 -10.789 -1.159 1.00 0.00 H new ATOM 0 HB1 ALA A 68 6.816 -12.043 -2.121 1.00 0.00 H new ATOM 0 HB2 ALA A 68 8.062 -13.133 -1.469 1.00 0.00 H new ATOM 0 HB3 ALA A 68 6.563 -12.847 -0.554 1.00 0.00 H new ATOM 1040 N VAL A 69 5.925 -10.485 0.592 1.00 0.00 N ATOM 1041 CA VAL A 69 4.873 -9.543 0.956 1.00 0.00 C ATOM 1042 C VAL A 69 5.450 -8.163 1.251 1.00 0.00 C ATOM 1043 O VAL A 69 5.019 -7.164 0.677 1.00 0.00 O ATOM 1044 CB VAL A 69 4.083 -10.030 2.185 1.00 0.00 C ATOM 1045 CG1 VAL A 69 3.006 -9.024 2.561 1.00 0.00 C ATOM 1046 CG2 VAL A 69 3.475 -11.399 1.917 1.00 0.00 C ATOM 0 H VAL A 69 5.817 -11.415 0.998 1.00 0.00 H new ATOM 0 HA VAL A 69 4.198 -9.477 0.103 1.00 0.00 H new ATOM 0 HB VAL A 69 4.771 -10.120 3.026 1.00 0.00 H new ATOM 0 HG11 VAL A 69 2.458 -9.385 3.431 1.00 0.00 H new ATOM 0 HG12 VAL A 69 3.469 -8.066 2.796 1.00 0.00 H new ATOM 0 HG13 VAL A 69 2.317 -8.899 1.725 1.00 0.00 H new ATOM 0 HG21 VAL A 69 2.920 -11.729 2.795 1.00 0.00 H new ATOM 0 HG22 VAL A 69 2.800 -11.337 1.064 1.00 0.00 H new ATOM 0 HG23 VAL A 69 4.269 -12.114 1.700 1.00 0.00 H new ATOM 1056 N GLU A 70 6.428 -8.116 2.151 1.00 0.00 N ATOM 1057 CA GLU A 70 7.064 -6.858 2.522 1.00 0.00 C ATOM 1058 C GLU A 70 7.431 -6.047 1.283 1.00 0.00 C ATOM 1059 O GLU A 70 7.075 -4.874 1.168 1.00 0.00 O ATOM 1060 CB GLU A 70 8.316 -7.122 3.361 1.00 0.00 C ATOM 1061 CG GLU A 70 8.023 -7.360 4.833 1.00 0.00 C ATOM 1062 CD GLU A 70 9.281 -7.586 5.649 1.00 0.00 C ATOM 1063 OE1 GLU A 70 10.087 -6.640 5.773 1.00 0.00 O ATOM 1064 OE2 GLU A 70 9.459 -8.709 6.165 1.00 0.00 O ATOM 0 H GLU A 70 6.796 -8.934 2.636 1.00 0.00 H new ATOM 0 HA GLU A 70 6.353 -6.282 3.114 1.00 0.00 H new ATOM 0 HB2 GLU A 70 8.837 -7.990 2.958 1.00 0.00 H new ATOM 0 HB3 GLU A 70 8.992 -6.272 3.267 1.00 0.00 H new ATOM 0 HG2 GLU A 70 7.483 -6.503 5.235 1.00 0.00 H new ATOM 0 HG3 GLU A 70 7.368 -8.226 4.934 1.00 0.00 H new ATOM 1071 N ASN A 71 8.144 -6.680 0.358 1.00 0.00 N ATOM 1072 CA ASN A 71 8.561 -6.018 -0.873 1.00 0.00 C ATOM 1073 C ASN A 71 7.350 -5.580 -1.691 1.00 0.00 C ATOM 1074 O ASN A 71 7.445 -4.680 -2.526 1.00 0.00 O ATOM 1075 CB ASN A 71 9.443 -6.951 -1.705 1.00 0.00 C ATOM 1076 CG ASN A 71 9.706 -6.408 -3.097 1.00 0.00 C ATOM 1077 OD1 ASN A 71 9.688 -5.197 -3.316 1.00 0.00 O ATOM 1078 ND2 ASN A 71 9.952 -7.305 -4.044 1.00 0.00 N ATOM 0 H ASN A 71 8.445 -7.651 0.437 1.00 0.00 H new ATOM 0 HA ASN A 71 9.135 -5.132 -0.604 1.00 0.00 H new ATOM 0 HB2 ASN A 71 10.392 -7.103 -1.192 1.00 0.00 H new ATOM 0 HB3 ASN A 71 8.963 -7.927 -1.783 1.00 0.00 H new ATOM 0 HD21 ASN A 71 10.136 -7.000 -5.000 1.00 0.00 H new ATOM 0 HD22 ASN A 71 9.957 -8.299 -3.816 1.00 0.00 H new ATOM 1085 N TYR A 72 6.213 -6.221 -1.445 1.00 0.00 N ATOM 1086 CA TYR A 72 4.984 -5.899 -2.160 1.00 0.00 C ATOM 1087 C TYR A 72 4.313 -4.666 -1.562 1.00 0.00 C ATOM 1088 O TYR A 72 4.015 -3.703 -2.269 1.00 0.00 O ATOM 1089 CB TYR A 72 4.021 -7.087 -2.121 1.00 0.00 C ATOM 1090 CG TYR A 72 2.783 -6.891 -2.968 1.00 0.00 C ATOM 1091 CD1 TYR A 72 1.803 -5.978 -2.599 1.00 0.00 C ATOM 1092 CD2 TYR A 72 2.594 -7.620 -4.136 1.00 0.00 C ATOM 1093 CE1 TYR A 72 0.671 -5.796 -3.370 1.00 0.00 C ATOM 1094 CE2 TYR A 72 1.466 -7.443 -4.913 1.00 0.00 C ATOM 1095 CZ TYR A 72 0.507 -6.531 -4.525 1.00 0.00 C ATOM 1096 OH TYR A 72 -0.619 -6.353 -5.296 1.00 0.00 O ATOM 0 H TYR A 72 6.117 -6.967 -0.756 1.00 0.00 H new ATOM 0 HA TYR A 72 5.242 -5.683 -3.197 1.00 0.00 H new ATOM 0 HB2 TYR A 72 4.545 -7.980 -2.460 1.00 0.00 H new ATOM 0 HB3 TYR A 72 3.720 -7.266 -1.089 1.00 0.00 H new ATOM 0 HD1 TYR A 72 1.928 -5.401 -1.695 1.00 0.00 H new ATOM 0 HD2 TYR A 72 3.342 -8.337 -4.441 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -0.081 -5.082 -3.070 1.00 0.00 H new ATOM 0 HE2 TYR A 72 1.336 -8.016 -5.819 1.00 0.00 H new ATOM 0 HH TYR A 72 -0.579 -6.946 -6.075 1.00 0.00 H new ATOM 1106 N LEU A 73 4.078 -4.704 -0.255 1.00 0.00 N ATOM 1107 CA LEU A 73 3.443 -3.590 0.441 1.00 0.00 C ATOM 1108 C LEU A 73 4.236 -2.302 0.244 1.00 0.00 C ATOM 1109 O LEU A 73 3.745 -1.210 0.533 1.00 0.00 O ATOM 1110 CB LEU A 73 3.316 -3.901 1.933 1.00 0.00 C ATOM 1111 CG LEU A 73 2.614 -5.213 2.288 1.00 0.00 C ATOM 1112 CD1 LEU A 73 2.708 -5.481 3.782 1.00 0.00 C ATOM 1113 CD2 LEU A 73 1.160 -5.177 1.841 1.00 0.00 C ATOM 0 H LEU A 73 4.318 -5.494 0.344 1.00 0.00 H new ATOM 0 HA LEU A 73 2.448 -3.450 0.019 1.00 0.00 H new ATOM 0 HB2 LEU A 73 4.316 -3.918 2.366 1.00 0.00 H new ATOM 0 HB3 LEU A 73 2.776 -3.083 2.410 1.00 0.00 H new ATOM 0 HG LEU A 73 3.115 -6.025 1.762 1.00 0.00 H new ATOM 0 HD11 LEU A 73 2.203 -6.418 4.016 1.00 0.00 H new ATOM 0 HD12 LEU A 73 3.756 -5.550 4.074 1.00 0.00 H new ATOM 0 HD13 LEU A 73 2.232 -4.667 4.328 1.00 0.00 H new ATOM 0 HD21 LEU A 73 0.676 -6.118 2.101 1.00 0.00 H new ATOM 0 HD22 LEU A 73 0.646 -4.355 2.339 1.00 0.00 H new ATOM 0 HD23 LEU A 73 1.115 -5.032 0.762 1.00 0.00 H new ATOM 1125 N ILE A 74 5.461 -2.437 -0.251 1.00 0.00 N ATOM 1126 CA ILE A 74 6.320 -1.284 -0.490 1.00 0.00 C ATOM 1127 C ILE A 74 6.048 -0.670 -1.859 1.00 0.00 C ATOM 1128 O ILE A 74 5.744 0.517 -1.968 1.00 0.00 O ATOM 1129 CB ILE A 74 7.810 -1.662 -0.395 1.00 0.00 C ATOM 1130 CG1 ILE A 74 8.171 -2.045 1.042 1.00 0.00 C ATOM 1131 CG2 ILE A 74 8.680 -0.511 -0.877 1.00 0.00 C ATOM 1132 CD1 ILE A 74 9.492 -2.772 1.159 1.00 0.00 C ATOM 0 H ILE A 74 5.881 -3.334 -0.495 1.00 0.00 H new ATOM 0 HA ILE A 74 6.090 -0.553 0.285 1.00 0.00 H new ATOM 0 HB ILE A 74 7.993 -2.523 -1.037 1.00 0.00 H new ATOM 0 HG12 ILE A 74 8.207 -1.142 1.652 1.00 0.00 H new ATOM 0 HG13 ILE A 74 7.381 -2.675 1.451 1.00 0.00 H new ATOM 0 HG21 ILE A 74 9.730 -0.793 -0.804 1.00 0.00 H new ATOM 0 HG22 ILE A 74 8.437 -0.281 -1.915 1.00 0.00 H new ATOM 0 HG23 ILE A 74 8.497 0.368 -0.258 1.00 0.00 H new ATOM 0 HD11 ILE A 74 9.684 -3.012 2.205 1.00 0.00 H new ATOM 0 HD12 ILE A 74 9.454 -3.692 0.576 1.00 0.00 H new ATOM 0 HD13 ILE A 74 10.292 -2.136 0.780 1.00 0.00 H new ATOM 1144 N GLN A 75 6.159 -1.489 -2.900 1.00 0.00 N ATOM 1145 CA GLN A 75 5.925 -1.026 -4.263 1.00 0.00 C ATOM 1146 C GLN A 75 4.640 -0.209 -4.347 1.00 0.00 C ATOM 1147 O GLN A 75 4.596 0.832 -5.002 1.00 0.00 O ATOM 1148 CB GLN A 75 5.850 -2.215 -5.222 1.00 0.00 C ATOM 1149 CG GLN A 75 5.005 -3.366 -4.700 1.00 0.00 C ATOM 1150 CD GLN A 75 4.736 -4.419 -5.758 1.00 0.00 C ATOM 1151 OE1 GLN A 75 5.421 -5.440 -5.822 1.00 0.00 O ATOM 1152 NE2 GLN A 75 3.733 -4.175 -6.594 1.00 0.00 N ATOM 0 H GLN A 75 6.409 -2.475 -2.826 1.00 0.00 H new ATOM 0 HA GLN A 75 6.760 -0.387 -4.551 1.00 0.00 H new ATOM 0 HB2 GLN A 75 5.441 -1.878 -6.174 1.00 0.00 H new ATOM 0 HB3 GLN A 75 6.859 -2.576 -5.419 1.00 0.00 H new ATOM 0 HG2 GLN A 75 5.511 -3.829 -3.853 1.00 0.00 H new ATOM 0 HG3 GLN A 75 4.056 -2.977 -4.330 1.00 0.00 H new ATOM 0 HE21 GLN A 75 3.192 -3.315 -6.504 1.00 0.00 H new ATOM 0 HE22 GLN A 75 3.504 -4.847 -7.326 1.00 0.00 H new ATOM 1161 N MET A 76 3.595 -0.688 -3.679 1.00 0.00 N ATOM 1162 CA MET A 76 2.309 -0.001 -3.678 1.00 0.00 C ATOM 1163 C MET A 76 2.432 1.382 -3.045 1.00 0.00 C ATOM 1164 O MET A 76 1.842 2.349 -3.526 1.00 0.00 O ATOM 1165 CB MET A 76 1.265 -0.828 -2.925 1.00 0.00 C ATOM 1166 CG MET A 76 1.781 -1.418 -1.623 1.00 0.00 C ATOM 1167 SD MET A 76 0.453 -1.876 -0.493 1.00 0.00 S ATOM 1168 CE MET A 76 -0.915 -2.060 -1.636 1.00 0.00 C ATOM 0 H MET A 76 3.614 -1.549 -3.132 1.00 0.00 H new ATOM 0 HA MET A 76 1.989 0.119 -4.713 1.00 0.00 H new ATOM 0 HB2 MET A 76 0.400 -0.200 -2.712 1.00 0.00 H new ATOM 0 HB3 MET A 76 0.920 -1.637 -3.569 1.00 0.00 H new ATOM 0 HG2 MET A 76 2.386 -2.298 -1.842 1.00 0.00 H new ATOM 0 HG3 MET A 76 2.435 -0.695 -1.135 1.00 0.00 H new ATOM 0 HE1 MET A 76 -1.709 -2.637 -1.163 1.00 0.00 H new ATOM 0 HE2 MET A 76 -1.295 -1.076 -1.910 1.00 0.00 H new ATOM 0 HE3 MET A 76 -0.573 -2.579 -2.532 1.00 0.00 H new ATOM 1178 N ALA A 77 3.201 1.467 -1.965 1.00 0.00 N ATOM 1179 CA ALA A 77 3.402 2.731 -1.268 1.00 0.00 C ATOM 1180 C ALA A 77 4.062 3.761 -2.178 1.00 0.00 C ATOM 1181 O ALA A 77 3.595 4.895 -2.289 1.00 0.00 O ATOM 1182 CB ALA A 77 4.240 2.516 -0.016 1.00 0.00 C ATOM 0 H ALA A 77 3.695 0.675 -1.554 1.00 0.00 H new ATOM 0 HA ALA A 77 2.425 3.116 -0.976 1.00 0.00 H new ATOM 0 HB1 ALA A 77 4.382 3.468 0.495 1.00 0.00 H new ATOM 0 HB2 ALA A 77 3.728 1.820 0.649 1.00 0.00 H new ATOM 0 HB3 ALA A 77 5.210 2.105 -0.294 1.00 0.00 H new ATOM 1188 N ARG A 78 5.150 3.359 -2.827 1.00 0.00 N ATOM 1189 CA ARG A 78 5.875 4.249 -3.727 1.00 0.00 C ATOM 1190 C ARG A 78 4.951 4.796 -4.811 1.00 0.00 C ATOM 1191 O ARG A 78 4.940 5.997 -5.083 1.00 0.00 O ATOM 1192 CB ARG A 78 7.052 3.511 -4.368 1.00 0.00 C ATOM 1193 CG ARG A 78 7.982 2.856 -3.361 1.00 0.00 C ATOM 1194 CD ARG A 78 8.952 1.900 -4.038 1.00 0.00 C ATOM 1195 NE ARG A 78 10.107 2.598 -4.597 1.00 0.00 N ATOM 1196 CZ ARG A 78 11.199 1.980 -5.033 1.00 0.00 C ATOM 1197 NH1 ARG A 78 11.284 0.658 -4.975 1.00 0.00 N ATOM 1198 NH2 ARG A 78 12.208 2.684 -5.528 1.00 0.00 N ATOM 0 H ARG A 78 5.549 2.424 -2.747 1.00 0.00 H new ATOM 0 HA ARG A 78 6.255 5.087 -3.142 1.00 0.00 H new ATOM 0 HB2 ARG A 78 6.666 2.748 -5.044 1.00 0.00 H new ATOM 0 HB3 ARG A 78 7.624 4.214 -4.974 1.00 0.00 H new ATOM 0 HG2 ARG A 78 8.540 3.624 -2.826 1.00 0.00 H new ATOM 0 HG3 ARG A 78 7.394 2.315 -2.619 1.00 0.00 H new ATOM 0 HD2 ARG A 78 9.292 1.157 -3.317 1.00 0.00 H new ATOM 0 HD3 ARG A 78 8.435 1.361 -4.832 1.00 0.00 H new ATOM 0 HE ARG A 78 10.073 3.616 -4.656 1.00 0.00 H new ATOM 0 HH11 ARG A 78 10.510 0.113 -4.595 1.00 0.00 H new ATOM 0 HH12 ARG A 78 12.124 0.186 -5.310 1.00 0.00 H new ATOM 0 HH21 ARG A 78 12.146 3.701 -5.574 1.00 0.00 H new ATOM 0 HH22 ARG A 78 13.046 2.208 -5.862 1.00 0.00 H new ATOM 1212 N TYR A 79 4.179 3.908 -5.427 1.00 0.00 N ATOM 1213 CA TYR A 79 3.255 4.301 -6.484 1.00 0.00 C ATOM 1214 C TYR A 79 2.268 5.351 -5.982 1.00 0.00 C ATOM 1215 O TYR A 79 1.920 6.286 -6.701 1.00 0.00 O ATOM 1216 CB TYR A 79 2.495 3.080 -7.006 1.00 0.00 C ATOM 1217 CG TYR A 79 3.395 1.928 -7.394 1.00 0.00 C ATOM 1218 CD1 TYR A 79 4.623 2.155 -8.002 1.00 0.00 C ATOM 1219 CD2 TYR A 79 3.015 0.613 -7.155 1.00 0.00 C ATOM 1220 CE1 TYR A 79 5.448 1.106 -8.360 1.00 0.00 C ATOM 1221 CE2 TYR A 79 3.834 -0.442 -7.508 1.00 0.00 C ATOM 1222 CZ TYR A 79 5.049 -0.190 -8.110 1.00 0.00 C ATOM 1223 OH TYR A 79 5.867 -1.239 -8.464 1.00 0.00 O ATOM 0 H TYR A 79 4.175 2.911 -5.212 1.00 0.00 H new ATOM 0 HA TYR A 79 3.837 4.734 -7.298 1.00 0.00 H new ATOM 0 HB2 TYR A 79 1.796 2.743 -6.240 1.00 0.00 H new ATOM 0 HB3 TYR A 79 1.902 3.374 -7.872 1.00 0.00 H new ATOM 0 HD1 TYR A 79 4.938 3.169 -8.198 1.00 0.00 H new ATOM 0 HD2 TYR A 79 2.063 0.412 -6.685 1.00 0.00 H new ATOM 0 HE1 TYR A 79 6.399 1.300 -8.833 1.00 0.00 H new ATOM 0 HE2 TYR A 79 3.525 -1.458 -7.314 1.00 0.00 H new ATOM 0 HH TYR A 79 6.803 -0.953 -8.420 1.00 0.00 H new ATOM 1233 N GLY A 80 1.822 5.189 -4.740 1.00 0.00 N ATOM 1234 CA GLY A 80 0.881 6.129 -4.161 1.00 0.00 C ATOM 1235 C GLY A 80 -0.557 5.669 -4.299 1.00 0.00 C ATOM 1236 O GLY A 80 -1.471 6.489 -4.384 1.00 0.00 O ATOM 0 H GLY A 80 2.096 4.423 -4.125 1.00 0.00 H new ATOM 0 HA2 GLY A 80 1.115 6.269 -3.106 1.00 0.00 H new ATOM 0 HA3 GLY A 80 0.997 7.099 -4.645 1.00 0.00 H new ATOM 1240 N GLN A 81 -0.757 4.356 -4.323 1.00 0.00 N ATOM 1241 CA GLN A 81 -2.094 3.789 -4.454 1.00 0.00 C ATOM 1242 C GLN A 81 -2.741 3.599 -3.086 1.00 0.00 C ATOM 1243 O GLN A 81 -3.962 3.685 -2.948 1.00 0.00 O ATOM 1244 CB GLN A 81 -2.034 2.451 -5.194 1.00 0.00 C ATOM 1245 CG GLN A 81 -1.590 2.577 -6.642 1.00 0.00 C ATOM 1246 CD GLN A 81 -2.358 3.643 -7.398 1.00 0.00 C ATOM 1247 OE1 GLN A 81 -3.555 3.835 -7.179 1.00 0.00 O ATOM 1248 NE2 GLN A 81 -1.673 4.343 -8.294 1.00 0.00 N ATOM 0 H GLN A 81 -0.010 3.664 -4.253 1.00 0.00 H new ATOM 0 HA GLN A 81 -2.702 4.487 -5.029 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -1.349 1.785 -4.669 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -3.018 1.984 -5.164 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -0.526 2.811 -6.673 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -1.720 1.617 -7.143 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -0.683 4.150 -8.443 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -2.137 5.074 -8.834 1.00 0.00 H new ATOM 1257 N LEU A 82 -1.916 3.339 -2.078 1.00 0.00 N ATOM 1258 CA LEU A 82 -2.408 3.136 -0.720 1.00 0.00 C ATOM 1259 C LEU A 82 -3.123 4.382 -0.207 1.00 0.00 C ATOM 1260 O LEU A 82 -2.509 5.435 -0.036 1.00 0.00 O ATOM 1261 CB LEU A 82 -1.252 2.777 0.214 1.00 0.00 C ATOM 1262 CG LEU A 82 -0.614 1.404 -0.004 1.00 0.00 C ATOM 1263 CD1 LEU A 82 0.855 1.429 0.389 1.00 0.00 C ATOM 1264 CD2 LEU A 82 -1.361 0.338 0.785 1.00 0.00 C ATOM 0 H LEU A 82 -0.903 3.264 -2.175 1.00 0.00 H new ATOM 0 HA LEU A 82 -3.122 2.312 -0.738 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -0.477 3.536 0.109 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -1.612 2.829 1.242 1.00 0.00 H new ATOM 0 HG LEU A 82 -0.681 1.158 -1.064 1.00 0.00 H new ATOM 0 HD11 LEU A 82 1.292 0.444 0.227 1.00 0.00 H new ATOM 0 HD12 LEU A 82 1.382 2.164 -0.219 1.00 0.00 H new ATOM 0 HD13 LEU A 82 0.946 1.697 1.442 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -0.894 -0.632 0.618 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -1.326 0.580 1.847 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -2.399 0.302 0.455 1.00 0.00 H new ATOM 1276 N SER A 83 -4.423 4.254 0.038 1.00 0.00 N ATOM 1277 CA SER A 83 -5.222 5.371 0.530 1.00 0.00 C ATOM 1278 C SER A 83 -4.975 5.601 2.018 1.00 0.00 C ATOM 1279 O SER A 83 -4.703 6.722 2.446 1.00 0.00 O ATOM 1280 CB SER A 83 -6.708 5.110 0.282 1.00 0.00 C ATOM 1281 OG SER A 83 -7.475 6.281 0.503 1.00 0.00 O ATOM 0 H SER A 83 -4.946 3.388 -0.096 1.00 0.00 H new ATOM 0 HA SER A 83 -4.923 6.268 -0.013 1.00 0.00 H new ATOM 0 HB2 SER A 83 -6.854 4.764 -0.741 1.00 0.00 H new ATOM 0 HB3 SER A 83 -7.056 4.314 0.941 1.00 0.00 H new ATOM 0 HG SER A 83 -8.421 6.089 0.336 1.00 0.00 H new ATOM 1287 N GLU A 84 -5.073 4.531 2.800 1.00 0.00 N ATOM 1288 CA GLU A 84 -4.862 4.616 4.241 1.00 0.00 C ATOM 1289 C GLU A 84 -4.236 3.331 4.776 1.00 0.00 C ATOM 1290 O GLU A 84 -4.104 2.343 4.053 1.00 0.00 O ATOM 1291 CB GLU A 84 -6.186 4.888 4.957 1.00 0.00 C ATOM 1292 CG GLU A 84 -7.152 3.716 4.917 1.00 0.00 C ATOM 1293 CD GLU A 84 -8.300 3.872 5.895 1.00 0.00 C ATOM 1294 OE1 GLU A 84 -9.279 4.569 5.553 1.00 0.00 O ATOM 1295 OE2 GLU A 84 -8.221 3.299 7.001 1.00 0.00 O ATOM 0 H GLU A 84 -5.297 3.596 2.461 1.00 0.00 H new ATOM 0 HA GLU A 84 -4.177 5.441 4.434 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -5.981 5.144 5.997 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -6.663 5.757 4.503 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -7.551 3.613 3.908 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -6.611 2.797 5.141 1.00 0.00 H new ATOM 1302 N LYS A 85 -3.852 3.352 6.047 1.00 0.00 N ATOM 1303 CA LYS A 85 -3.240 2.191 6.682 1.00 0.00 C ATOM 1304 C LYS A 85 -4.030 0.923 6.373 1.00 0.00 C ATOM 1305 O LYS A 85 -5.244 0.873 6.569 1.00 0.00 O ATOM 1306 CB LYS A 85 -3.156 2.396 8.196 1.00 0.00 C ATOM 1307 CG LYS A 85 -2.146 3.452 8.612 1.00 0.00 C ATOM 1308 CD LYS A 85 -2.291 3.815 10.080 1.00 0.00 C ATOM 1309 CE LYS A 85 -1.724 5.196 10.371 1.00 0.00 C ATOM 1310 NZ LYS A 85 -2.602 6.278 9.848 1.00 0.00 N ATOM 0 H LYS A 85 -3.954 4.162 6.659 1.00 0.00 H new ATOM 0 HA LYS A 85 -2.233 2.078 6.281 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -4.140 2.678 8.571 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -2.895 1.449 8.668 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -1.137 3.085 8.425 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -2.279 4.345 8.001 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -3.344 3.786 10.361 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -1.777 3.073 10.692 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -1.599 5.318 11.447 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -0.734 5.284 9.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -2.316 7.188 10.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -2.514 6.326 8.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -3.590 6.077 10.103 1.00 0.00 H new ATOM 1324 N VAL A 86 -3.333 -0.101 5.891 1.00 0.00 N ATOM 1325 CA VAL A 86 -3.969 -1.370 5.558 1.00 0.00 C ATOM 1326 C VAL A 86 -4.506 -2.060 6.807 1.00 0.00 C ATOM 1327 O VAL A 86 -3.768 -2.299 7.762 1.00 0.00 O ATOM 1328 CB VAL A 86 -2.989 -2.318 4.842 1.00 0.00 C ATOM 1329 CG1 VAL A 86 -3.632 -3.677 4.613 1.00 0.00 C ATOM 1330 CG2 VAL A 86 -2.524 -1.710 3.527 1.00 0.00 C ATOM 0 H VAL A 86 -2.327 -0.076 5.722 1.00 0.00 H new ATOM 0 HA VAL A 86 -4.798 -1.142 4.888 1.00 0.00 H new ATOM 0 HB VAL A 86 -2.116 -2.459 5.479 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -2.925 -4.333 4.106 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.910 -4.114 5.572 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -4.523 -3.559 3.997 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -1.832 -2.393 3.035 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -3.385 -1.538 2.881 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -2.021 -0.763 3.722 1.00 0.00 H new ATOM 1340 N SER A 87 -5.797 -2.377 6.792 1.00 0.00 N ATOM 1341 CA SER A 87 -6.434 -3.037 7.925 1.00 0.00 C ATOM 1342 C SER A 87 -6.181 -4.541 7.890 1.00 0.00 C ATOM 1343 O SER A 87 -5.875 -5.106 6.841 1.00 0.00 O ATOM 1344 CB SER A 87 -7.939 -2.762 7.921 1.00 0.00 C ATOM 1345 OG SER A 87 -8.526 -3.121 9.160 1.00 0.00 O ATOM 0 H SER A 87 -6.422 -2.187 6.008 1.00 0.00 H new ATOM 0 HA SER A 87 -6.000 -2.634 8.840 1.00 0.00 H new ATOM 0 HB2 SER A 87 -8.118 -1.705 7.723 1.00 0.00 H new ATOM 0 HB3 SER A 87 -8.412 -3.322 7.115 1.00 0.00 H new ATOM 0 HG SER A 87 -9.488 -2.934 9.133 1.00 0.00 H new ATOM 1351 N GLU A 88 -6.310 -5.183 9.047 1.00 0.00 N ATOM 1352 CA GLU A 88 -6.094 -6.622 9.150 1.00 0.00 C ATOM 1353 C GLU A 88 -6.661 -7.345 7.932 1.00 0.00 C ATOM 1354 O GLU A 88 -5.948 -8.077 7.246 1.00 0.00 O ATOM 1355 CB GLU A 88 -6.739 -7.167 10.426 1.00 0.00 C ATOM 1356 CG GLU A 88 -6.027 -8.382 10.997 1.00 0.00 C ATOM 1357 CD GLU A 88 -6.527 -9.684 10.401 1.00 0.00 C ATOM 1358 OE1 GLU A 88 -7.625 -9.680 9.807 1.00 0.00 O ATOM 1359 OE2 GLU A 88 -5.820 -10.706 10.530 1.00 0.00 O ATOM 0 H GLU A 88 -6.563 -4.730 9.925 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.019 -6.801 9.190 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -6.756 -6.379 11.179 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -7.776 -7.430 10.215 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.956 -8.290 10.814 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -6.165 -8.405 12.078 1.00 0.00 H new ATOM 1366 N GLN A 89 -7.947 -7.135 7.671 1.00 0.00 N ATOM 1367 CA GLN A 89 -8.610 -7.768 6.537 1.00 0.00 C ATOM 1368 C GLN A 89 -7.819 -7.547 5.252 1.00 0.00 C ATOM 1369 O GLN A 89 -7.426 -8.501 4.581 1.00 0.00 O ATOM 1370 CB GLN A 89 -10.029 -7.219 6.377 1.00 0.00 C ATOM 1371 CG GLN A 89 -10.997 -7.716 7.439 1.00 0.00 C ATOM 1372 CD GLN A 89 -12.321 -6.980 7.412 1.00 0.00 C ATOM 1373 OE1 GLN A 89 -13.191 -7.273 6.591 1.00 0.00 O ATOM 1374 NE2 GLN A 89 -12.481 -6.017 8.312 1.00 0.00 N ATOM 0 H GLN A 89 -8.551 -6.531 8.229 1.00 0.00 H new ATOM 0 HA GLN A 89 -8.662 -8.839 6.731 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -9.994 -6.130 6.410 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -10.408 -7.496 5.393 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -11.175 -8.781 7.293 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -10.542 -7.601 8.423 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -11.733 -5.808 8.974 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -13.352 -5.486 8.342 1.00 0.00 H new ATOM 1383 N GLY A 90 -7.589 -6.282 4.914 1.00 0.00 N ATOM 1384 CA GLY A 90 -6.846 -5.959 3.710 1.00 0.00 C ATOM 1385 C GLY A 90 -5.537 -6.718 3.615 1.00 0.00 C ATOM 1386 O GLY A 90 -5.226 -7.306 2.578 1.00 0.00 O ATOM 0 H GLY A 90 -7.904 -5.475 5.453 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -7.458 -6.186 2.837 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -6.644 -4.888 3.688 1.00 0.00 H new ATOM 1390 N LEU A 91 -4.768 -6.706 4.697 1.00 0.00 N ATOM 1391 CA LEU A 91 -3.484 -7.397 4.731 1.00 0.00 C ATOM 1392 C LEU A 91 -3.649 -8.870 4.369 1.00 0.00 C ATOM 1393 O LEU A 91 -3.019 -9.363 3.433 1.00 0.00 O ATOM 1394 CB LEU A 91 -2.850 -7.269 6.118 1.00 0.00 C ATOM 1395 CG LEU A 91 -1.453 -7.870 6.275 1.00 0.00 C ATOM 1396 CD1 LEU A 91 -0.387 -6.834 5.952 1.00 0.00 C ATOM 1397 CD2 LEU A 91 -1.261 -8.413 7.683 1.00 0.00 C ATOM 0 H LEU A 91 -5.011 -6.225 5.563 1.00 0.00 H new ATOM 0 HA LEU A 91 -2.829 -6.932 3.994 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -2.800 -6.211 6.376 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -3.511 -7.743 6.843 1.00 0.00 H new ATOM 0 HG LEU A 91 -1.353 -8.696 5.571 1.00 0.00 H new ATOM 0 HD11 LEU A 91 0.601 -7.280 6.069 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -0.511 -6.492 4.924 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -0.486 -5.987 6.631 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -0.261 -8.837 7.776 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -1.381 -7.605 8.404 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -2.003 -9.187 7.879 1.00 0.00 H new ATOM 1409 N ILE A 92 -4.500 -9.565 5.116 1.00 0.00 N ATOM 1410 CA ILE A 92 -4.750 -10.980 4.871 1.00 0.00 C ATOM 1411 C ILE A 92 -4.913 -11.260 3.381 1.00 0.00 C ATOM 1412 O ILE A 92 -4.389 -12.246 2.864 1.00 0.00 O ATOM 1413 CB ILE A 92 -6.008 -11.467 5.614 1.00 0.00 C ATOM 1414 CG1 ILE A 92 -5.782 -11.423 7.127 1.00 0.00 C ATOM 1415 CG2 ILE A 92 -6.376 -12.874 5.168 1.00 0.00 C ATOM 1416 CD1 ILE A 92 -7.034 -11.689 7.933 1.00 0.00 C ATOM 0 H ILE A 92 -5.028 -9.172 5.895 1.00 0.00 H new ATOM 0 HA ILE A 92 -3.883 -11.523 5.247 1.00 0.00 H new ATOM 0 HB ILE A 92 -6.836 -10.802 5.370 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -5.024 -12.159 7.395 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -5.386 -10.445 7.399 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -7.267 -13.204 5.702 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -6.574 -12.876 4.096 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -5.551 -13.552 5.386 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -6.799 -11.642 8.996 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -7.787 -10.938 7.694 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -7.420 -12.679 7.690 1.00 0.00 H new ATOM 1428 N GLU A 93 -5.642 -10.384 2.696 1.00 0.00 N ATOM 1429 CA GLU A 93 -5.873 -10.537 1.265 1.00 0.00 C ATOM 1430 C GLU A 93 -4.560 -10.457 0.490 1.00 0.00 C ATOM 1431 O GLU A 93 -4.220 -11.364 -0.270 1.00 0.00 O ATOM 1432 CB GLU A 93 -6.839 -9.462 0.764 1.00 0.00 C ATOM 1433 CG GLU A 93 -8.246 -9.599 1.323 1.00 0.00 C ATOM 1434 CD GLU A 93 -9.157 -8.465 0.895 1.00 0.00 C ATOM 1435 OE1 GLU A 93 -8.858 -7.302 1.236 1.00 0.00 O ATOM 1436 OE2 GLU A 93 -10.170 -8.742 0.219 1.00 0.00 O ATOM 0 H GLU A 93 -6.082 -9.562 3.109 1.00 0.00 H new ATOM 0 HA GLU A 93 -6.315 -11.519 1.098 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -6.446 -8.480 1.029 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -6.884 -9.504 -0.324 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -8.673 -10.547 0.994 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -8.199 -9.631 2.412 1.00 0.00 H new ATOM 1443 N ILE A 94 -3.829 -9.367 0.689 1.00 0.00 N ATOM 1444 CA ILE A 94 -2.554 -9.168 0.010 1.00 0.00 C ATOM 1445 C ILE A 94 -1.659 -10.395 0.152 1.00 0.00 C ATOM 1446 O ILE A 94 -1.087 -10.877 -0.827 1.00 0.00 O ATOM 1447 CB ILE A 94 -1.809 -7.937 0.559 1.00 0.00 C ATOM 1448 CG1 ILE A 94 -2.680 -6.686 0.427 1.00 0.00 C ATOM 1449 CG2 ILE A 94 -0.488 -7.748 -0.171 1.00 0.00 C ATOM 1450 CD1 ILE A 94 -2.057 -5.449 1.034 1.00 0.00 C ATOM 0 H ILE A 94 -4.097 -8.607 1.315 1.00 0.00 H new ATOM 0 HA ILE A 94 -2.780 -9.005 -1.044 1.00 0.00 H new ATOM 0 HB ILE A 94 -1.598 -8.100 1.616 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -2.879 -6.502 -0.629 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -3.642 -6.871 0.906 1.00 0.00 H new ATOM 0 HG21 ILE A 94 0.027 -6.874 0.228 1.00 0.00 H new ATOM 0 HG22 ILE A 94 0.135 -8.631 -0.031 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -0.678 -7.603 -1.235 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -2.730 -4.601 0.903 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -1.883 -5.614 2.097 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -1.109 -5.239 0.539 1.00 0.00 H new ATOM 1462 N LEU A 95 -1.543 -10.897 1.377 1.00 0.00 N ATOM 1463 CA LEU A 95 -0.719 -12.070 1.648 1.00 0.00 C ATOM 1464 C LEU A 95 -0.935 -13.144 0.587 1.00 0.00 C ATOM 1465 O LEU A 95 0.003 -13.835 0.187 1.00 0.00 O ATOM 1466 CB LEU A 95 -1.039 -12.633 3.033 1.00 0.00 C ATOM 1467 CG LEU A 95 -0.226 -12.060 4.195 1.00 0.00 C ATOM 1468 CD1 LEU A 95 -0.895 -12.379 5.523 1.00 0.00 C ATOM 1469 CD2 LEU A 95 1.196 -12.601 4.169 1.00 0.00 C ATOM 0 H LEU A 95 -2.009 -10.510 2.198 1.00 0.00 H new ATOM 0 HA LEU A 95 0.327 -11.763 1.620 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -2.096 -12.463 3.237 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -0.889 -13.712 3.008 1.00 0.00 H new ATOM 0 HG LEU A 95 -0.183 -10.977 4.084 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -0.302 -11.963 6.338 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -1.894 -11.943 5.541 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -0.969 -13.460 5.643 1.00 0.00 H new ATOM 0 HD21 LEU A 95 1.760 -12.183 5.003 1.00 0.00 H new ATOM 0 HD22 LEU A 95 1.174 -13.687 4.255 1.00 0.00 H new ATOM 0 HD23 LEU A 95 1.675 -12.321 3.231 1.00 0.00 H new ATOM 1481 N LYS A 96 -2.176 -13.278 0.133 1.00 0.00 N ATOM 1482 CA LYS A 96 -2.517 -14.266 -0.885 1.00 0.00 C ATOM 1483 C LYS A 96 -2.674 -13.607 -2.251 1.00 0.00 C ATOM 1484 O LYS A 96 -3.540 -13.987 -3.039 1.00 0.00 O ATOM 1485 CB LYS A 96 -3.808 -14.994 -0.506 1.00 0.00 C ATOM 1486 CG LYS A 96 -3.659 -15.910 0.697 1.00 0.00 C ATOM 1487 CD LYS A 96 -3.917 -15.169 1.997 1.00 0.00 C ATOM 1488 CE LYS A 96 -5.387 -15.220 2.387 1.00 0.00 C ATOM 1489 NZ LYS A 96 -5.801 -16.587 2.808 1.00 0.00 N ATOM 0 H LYS A 96 -2.964 -12.715 0.454 1.00 0.00 H new ATOM 0 HA LYS A 96 -1.703 -14.989 -0.942 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -4.583 -14.257 -0.297 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -4.148 -15.581 -1.359 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -4.355 -16.744 0.609 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -2.654 -16.333 0.711 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -3.313 -15.607 2.792 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -3.603 -14.130 1.893 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -5.572 -14.518 3.200 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -5.998 -14.899 1.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -6.672 -16.527 3.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -5.974 -17.172 1.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -5.046 -17.018 3.380 1.00 0.00 H new ATOM 1503 N LYS A 97 -1.831 -12.618 -2.527 1.00 0.00 N ATOM 1504 CA LYS A 97 -1.874 -11.907 -3.799 1.00 0.00 C ATOM 1505 C LYS A 97 -0.476 -11.766 -4.392 1.00 0.00 C ATOM 1506 O LYS A 97 -0.290 -11.876 -5.604 1.00 0.00 O ATOM 1507 CB LYS A 97 -2.502 -10.524 -3.613 1.00 0.00 C ATOM 1508 CG LYS A 97 -4.010 -10.560 -3.434 1.00 0.00 C ATOM 1509 CD LYS A 97 -4.645 -9.225 -3.788 1.00 0.00 C ATOM 1510 CE LYS A 97 -6.105 -9.390 -4.181 1.00 0.00 C ATOM 1511 NZ LYS A 97 -6.256 -9.738 -5.621 1.00 0.00 N ATOM 0 H LYS A 97 -1.109 -12.290 -1.886 1.00 0.00 H new ATOM 0 HA LYS A 97 -2.486 -12.487 -4.490 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -2.053 -10.044 -2.744 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -2.262 -9.906 -4.478 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -4.433 -11.344 -4.062 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -4.249 -10.815 -2.402 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -4.570 -8.548 -2.937 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -4.095 -8.766 -4.610 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -6.560 -10.169 -3.569 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -6.644 -8.466 -3.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -7.265 -9.842 -5.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -5.845 -8.983 -6.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -5.763 -10.633 -5.815 1.00 0.00 H new ATOM 1525 N VAL A 98 0.506 -11.524 -3.529 1.00 0.00 N ATOM 1526 CA VAL A 98 1.888 -11.371 -3.967 1.00 0.00 C ATOM 1527 C VAL A 98 2.402 -12.650 -4.620 1.00 0.00 C ATOM 1528 O VAL A 98 3.200 -12.603 -5.557 1.00 0.00 O ATOM 1529 CB VAL A 98 2.812 -11.001 -2.791 1.00 0.00 C ATOM 1530 CG1 VAL A 98 2.669 -12.009 -1.662 1.00 0.00 C ATOM 1531 CG2 VAL A 98 4.257 -10.912 -3.257 1.00 0.00 C ATOM 0 H VAL A 98 0.370 -11.430 -2.523 1.00 0.00 H new ATOM 0 HA VAL A 98 1.901 -10.562 -4.698 1.00 0.00 H new ATOM 0 HB VAL A 98 2.515 -10.023 -2.412 1.00 0.00 H new ATOM 0 HG11 VAL A 98 3.329 -11.731 -0.840 1.00 0.00 H new ATOM 0 HG12 VAL A 98 1.637 -12.018 -1.311 1.00 0.00 H new ATOM 0 HG13 VAL A 98 2.938 -13.001 -2.024 1.00 0.00 H new ATOM 0 HG21 VAL A 98 4.896 -10.650 -2.414 1.00 0.00 H new ATOM 0 HG22 VAL A 98 4.568 -11.875 -3.663 1.00 0.00 H new ATOM 0 HG23 VAL A 98 4.344 -10.148 -4.029 1.00 0.00 H new ATOM 1541 N SER A 99 1.940 -13.791 -4.119 1.00 0.00 N ATOM 1542 CA SER A 99 2.356 -15.083 -4.651 1.00 0.00 C ATOM 1543 C SER A 99 1.383 -15.569 -5.721 1.00 0.00 C ATOM 1544 O SER A 99 1.794 -16.058 -6.772 1.00 0.00 O ATOM 1545 CB SER A 99 2.451 -16.115 -3.525 1.00 0.00 C ATOM 1546 OG SER A 99 3.745 -16.122 -2.948 1.00 0.00 O ATOM 0 H SER A 99 1.277 -13.847 -3.345 1.00 0.00 H new ATOM 0 HA SER A 99 3.339 -14.961 -5.107 1.00 0.00 H new ATOM 0 HB2 SER A 99 1.709 -15.891 -2.759 1.00 0.00 H new ATOM 0 HB3 SER A 99 2.218 -17.106 -3.915 1.00 0.00 H new ATOM 0 HG SER A 99 3.779 -16.788 -2.230 1.00 0.00 H new ATOM 1552 N GLN A 100 0.090 -15.428 -5.443 1.00 0.00 N ATOM 1553 CA GLN A 100 -0.942 -15.853 -6.381 1.00 0.00 C ATOM 1554 C GLN A 100 -0.613 -15.394 -7.798 1.00 0.00 C ATOM 1555 O GLN A 100 -0.789 -16.142 -8.759 1.00 0.00 O ATOM 1556 CB GLN A 100 -2.304 -15.302 -5.957 1.00 0.00 C ATOM 1557 CG GLN A 100 -3.474 -16.168 -6.394 1.00 0.00 C ATOM 1558 CD GLN A 100 -3.468 -17.533 -5.734 1.00 0.00 C ATOM 1559 OE1 GLN A 100 -2.849 -17.727 -4.688 1.00 0.00 O ATOM 1560 NE2 GLN A 100 -4.160 -18.489 -6.344 1.00 0.00 N ATOM 0 H GLN A 100 -0.267 -15.023 -4.577 1.00 0.00 H new ATOM 0 HA GLN A 100 -0.980 -16.942 -6.372 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -2.324 -15.200 -4.872 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -2.428 -14.302 -6.373 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -4.407 -15.658 -6.156 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -3.445 -16.292 -7.477 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -4.659 -18.284 -7.210 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -4.193 -19.428 -5.946 1.00 0.00 H new ATOM 1569 N GLN A 101 -0.136 -14.159 -7.918 1.00 0.00 N ATOM 1570 CA GLN A 101 0.216 -13.600 -9.218 1.00 0.00 C ATOM 1571 C GLN A 101 0.881 -14.652 -10.101 1.00 0.00 C ATOM 1572 O GLN A 101 1.892 -15.245 -9.724 1.00 0.00 O ATOM 1573 CB GLN A 101 1.147 -12.399 -9.045 1.00 0.00 C ATOM 1574 CG GLN A 101 1.173 -11.471 -10.249 1.00 0.00 C ATOM 1575 CD GLN A 101 1.997 -12.024 -11.395 1.00 0.00 C ATOM 1576 OE1 GLN A 101 1.511 -12.155 -12.518 1.00 0.00 O ATOM 1577 NE2 GLN A 101 3.254 -12.352 -11.116 1.00 0.00 N ATOM 0 H GLN A 101 0.015 -13.527 -7.132 1.00 0.00 H new ATOM 0 HA GLN A 101 -0.702 -13.271 -9.705 1.00 0.00 H new ATOM 0 HB2 GLN A 101 0.837 -11.833 -8.167 1.00 0.00 H new ATOM 0 HB3 GLN A 101 2.158 -12.758 -8.852 1.00 0.00 H new ATOM 0 HG2 GLN A 101 0.153 -11.297 -10.591 1.00 0.00 H new ATOM 0 HG3 GLN A 101 1.578 -10.504 -9.949 1.00 0.00 H new ATOM 0 HE21 GLN A 101 3.616 -12.227 -10.171 1.00 0.00 H new ATOM 0 HE22 GLN A 101 3.857 -12.729 -11.847 1.00 0.00 H new ATOM 1586 N THR A 102 0.307 -14.878 -11.278 1.00 0.00 N ATOM 1587 CA THR A 102 0.843 -15.859 -12.213 1.00 0.00 C ATOM 1588 C THR A 102 2.320 -15.604 -12.491 1.00 0.00 C ATOM 1589 O THR A 102 2.714 -14.486 -12.821 1.00 0.00 O ATOM 1590 CB THR A 102 0.071 -15.844 -13.546 1.00 0.00 C ATOM 1591 OG1 THR A 102 0.749 -16.653 -14.514 1.00 0.00 O ATOM 1592 CG2 THR A 102 -0.070 -14.424 -14.074 1.00 0.00 C ATOM 0 H THR A 102 -0.529 -14.395 -11.607 1.00 0.00 H new ATOM 0 HA THR A 102 0.728 -16.837 -11.746 1.00 0.00 H new ATOM 0 HB THR A 102 -0.925 -16.249 -13.368 1.00 0.00 H new ATOM 0 HG1 THR A 102 0.251 -16.639 -15.358 1.00 0.00 H new ATOM 0 HG21 THR A 102 -0.618 -14.439 -15.016 1.00 0.00 H new ATOM 0 HG22 THR A 102 -0.612 -13.818 -13.348 1.00 0.00 H new ATOM 0 HG23 THR A 102 0.919 -13.996 -14.237 1.00 0.00 H new ATOM 1600 N GLU A 103 3.131 -16.648 -12.357 1.00 0.00 N ATOM 1601 CA GLU A 103 4.566 -16.535 -12.595 1.00 0.00 C ATOM 1602 C GLU A 103 5.025 -17.544 -13.643 1.00 0.00 C ATOM 1603 O GLU A 103 6.059 -18.193 -13.486 1.00 0.00 O ATOM 1604 CB GLU A 103 5.339 -16.749 -11.292 1.00 0.00 C ATOM 1605 CG GLU A 103 5.195 -18.149 -10.721 1.00 0.00 C ATOM 1606 CD GLU A 103 5.871 -18.302 -9.372 1.00 0.00 C ATOM 1607 OE1 GLU A 103 6.897 -17.630 -9.143 1.00 0.00 O ATOM 1608 OE2 GLU A 103 5.372 -19.095 -8.546 1.00 0.00 O ATOM 0 H GLU A 103 2.820 -17.581 -12.085 1.00 0.00 H new ATOM 0 HA GLU A 103 4.769 -15.532 -12.969 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.395 -16.545 -11.468 1.00 0.00 H new ATOM 0 HB3 GLU A 103 4.994 -16.027 -10.552 1.00 0.00 H new ATOM 0 HG2 GLU A 103 4.137 -18.390 -10.622 1.00 0.00 H new ATOM 0 HG3 GLU A 103 5.621 -18.868 -11.420 1.00 0.00 H new ATOM 1615 N LYS A 104 4.248 -17.672 -14.713 1.00 0.00 N ATOM 1616 CA LYS A 104 4.573 -18.601 -15.789 1.00 0.00 C ATOM 1617 C LYS A 104 6.072 -18.607 -16.068 1.00 0.00 C ATOM 1618 O LYS A 104 6.647 -19.641 -16.410 1.00 0.00 O ATOM 1619 CB LYS A 104 3.808 -18.228 -17.061 1.00 0.00 C ATOM 1620 CG LYS A 104 4.010 -16.785 -17.491 1.00 0.00 C ATOM 1621 CD LYS A 104 3.542 -16.559 -18.919 1.00 0.00 C ATOM 1622 CE LYS A 104 2.062 -16.211 -18.972 1.00 0.00 C ATOM 1623 NZ LYS A 104 1.786 -14.869 -18.390 1.00 0.00 N ATOM 0 H LYS A 104 3.388 -17.144 -14.858 1.00 0.00 H new ATOM 0 HA LYS A 104 4.276 -19.601 -15.474 1.00 0.00 H new ATOM 0 HB2 LYS A 104 4.122 -18.887 -17.870 1.00 0.00 H new ATOM 0 HB3 LYS A 104 2.745 -18.405 -16.901 1.00 0.00 H new ATOM 0 HG2 LYS A 104 3.463 -16.124 -16.819 1.00 0.00 H new ATOM 0 HG3 LYS A 104 5.065 -16.523 -17.407 1.00 0.00 H new ATOM 0 HD2 LYS A 104 4.122 -15.754 -19.370 1.00 0.00 H new ATOM 0 HD3 LYS A 104 3.727 -17.456 -19.510 1.00 0.00 H new ATOM 0 HE2 LYS A 104 1.720 -16.235 -20.007 1.00 0.00 H new ATOM 0 HE3 LYS A 104 1.492 -16.966 -18.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 0.893 -14.501 -18.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 1.711 -14.948 -17.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 2.561 -14.219 -18.633 1.00 0.00 H new ATOM 1637 N THR A 105 6.702 -17.445 -15.919 1.00 0.00 N ATOM 1638 CA THR A 105 8.135 -17.317 -16.155 1.00 0.00 C ATOM 1639 C THR A 105 8.689 -16.057 -15.501 1.00 0.00 C ATOM 1640 O THR A 105 8.215 -14.950 -15.760 1.00 0.00 O ATOM 1641 CB THR A 105 8.456 -17.284 -17.661 1.00 0.00 C ATOM 1642 OG1 THR A 105 9.860 -17.471 -17.867 1.00 0.00 O ATOM 1643 CG2 THR A 105 8.019 -15.963 -18.278 1.00 0.00 C ATOM 0 H THR A 105 6.242 -16.580 -15.636 1.00 0.00 H new ATOM 0 HA THR A 105 8.608 -18.192 -15.710 1.00 0.00 H new ATOM 0 HB THR A 105 7.908 -18.092 -18.145 1.00 0.00 H new ATOM 0 HG1 THR A 105 10.055 -17.450 -18.827 1.00 0.00 H new ATOM 0 HG21 THR A 105 8.256 -15.962 -19.342 1.00 0.00 H new ATOM 0 HG22 THR A 105 6.944 -15.837 -18.145 1.00 0.00 H new ATOM 0 HG23 THR A 105 8.543 -15.142 -17.789 1.00 0.00 H new ATOM 1651 N THR A 106 9.697 -16.231 -14.651 1.00 0.00 N ATOM 1652 CA THR A 106 10.316 -15.107 -13.959 1.00 0.00 C ATOM 1653 C THR A 106 10.951 -14.136 -14.947 1.00 0.00 C ATOM 1654 O THR A 106 11.252 -14.498 -16.085 1.00 0.00 O ATOM 1655 CB THR A 106 11.389 -15.584 -12.963 1.00 0.00 C ATOM 1656 OG1 THR A 106 12.342 -16.419 -13.630 1.00 0.00 O ATOM 1657 CG2 THR A 106 10.756 -16.349 -11.810 1.00 0.00 C ATOM 0 H THR A 106 10.102 -17.140 -14.426 1.00 0.00 H new ATOM 0 HA THR A 106 9.524 -14.597 -13.411 1.00 0.00 H new ATOM 0 HB THR A 106 11.895 -14.706 -12.561 1.00 0.00 H new ATOM 0 HG1 THR A 106 13.225 -15.995 -13.602 1.00 0.00 H new ATOM 0 HG21 THR A 106 11.534 -16.676 -11.120 1.00 0.00 H new ATOM 0 HG22 THR A 106 10.054 -15.701 -11.285 1.00 0.00 H new ATOM 0 HG23 THR A 106 10.226 -17.219 -12.198 1.00 0.00 H new ATOM 1665 N THR A 107 11.154 -12.898 -14.506 1.00 0.00 N ATOM 1666 CA THR A 107 11.753 -11.873 -15.351 1.00 0.00 C ATOM 1667 C THR A 107 13.096 -12.335 -15.907 1.00 0.00 C ATOM 1668 O THR A 107 13.387 -12.150 -17.089 1.00 0.00 O ATOM 1669 CB THR A 107 11.956 -10.556 -14.580 1.00 0.00 C ATOM 1670 OG1 THR A 107 12.551 -9.574 -15.435 1.00 0.00 O ATOM 1671 CG2 THR A 107 12.837 -10.774 -13.359 1.00 0.00 C ATOM 0 H THR A 107 10.912 -12.581 -13.567 1.00 0.00 H new ATOM 0 HA THR A 107 11.061 -11.699 -16.175 1.00 0.00 H new ATOM 0 HB THR A 107 10.981 -10.202 -14.246 1.00 0.00 H new ATOM 0 HG1 THR A 107 12.675 -8.739 -14.937 1.00 0.00 H new ATOM 0 HG21 THR A 107 12.966 -9.830 -12.830 1.00 0.00 H new ATOM 0 HG22 THR A 107 12.366 -11.500 -12.696 1.00 0.00 H new ATOM 0 HG23 THR A 107 13.810 -11.149 -13.675 1.00 0.00 H new ATOM 1679 N VAL A 108 13.911 -12.938 -15.047 1.00 0.00 N ATOM 1680 CA VAL A 108 15.223 -13.428 -15.453 1.00 0.00 C ATOM 1681 C VAL A 108 15.587 -14.706 -14.705 1.00 0.00 C ATOM 1682 O VAL A 108 15.315 -14.839 -13.511 1.00 0.00 O ATOM 1683 CB VAL A 108 16.317 -12.373 -15.208 1.00 0.00 C ATOM 1684 CG1 VAL A 108 16.051 -11.126 -16.037 1.00 0.00 C ATOM 1685 CG2 VAL A 108 16.404 -12.030 -13.728 1.00 0.00 C ATOM 0 H VAL A 108 13.686 -13.099 -14.065 1.00 0.00 H new ATOM 0 HA VAL A 108 15.166 -13.639 -16.521 1.00 0.00 H new ATOM 0 HB VAL A 108 17.275 -12.789 -15.518 1.00 0.00 H new ATOM 0 HG11 VAL A 108 16.834 -10.391 -15.851 1.00 0.00 H new ATOM 0 HG12 VAL A 108 16.043 -11.387 -17.095 1.00 0.00 H new ATOM 0 HG13 VAL A 108 15.085 -10.704 -15.760 1.00 0.00 H new ATOM 0 HG21 VAL A 108 17.182 -11.283 -13.573 1.00 0.00 H new ATOM 0 HG22 VAL A 108 15.447 -11.633 -13.390 1.00 0.00 H new ATOM 0 HG23 VAL A 108 16.645 -12.928 -13.160 1.00 0.00 H new ATOM 1695 N LYS A 109 16.206 -15.644 -15.413 1.00 0.00 N ATOM 1696 CA LYS A 109 16.611 -16.911 -14.817 1.00 0.00 C ATOM 1697 C LYS A 109 18.061 -16.853 -14.347 1.00 0.00 C ATOM 1698 O LYS A 109 18.363 -17.161 -13.194 1.00 0.00 O ATOM 1699 CB LYS A 109 16.437 -18.051 -15.824 1.00 0.00 C ATOM 1700 CG LYS A 109 14.985 -18.419 -16.079 1.00 0.00 C ATOM 1701 CD LYS A 109 14.383 -19.162 -14.899 1.00 0.00 C ATOM 1702 CE LYS A 109 14.837 -20.613 -14.863 1.00 0.00 C ATOM 1703 NZ LYS A 109 14.268 -21.401 -15.992 1.00 0.00 N ATOM 0 H LYS A 109 16.438 -15.550 -16.402 1.00 0.00 H new ATOM 0 HA LYS A 109 15.974 -17.096 -13.952 1.00 0.00 H new ATOM 0 HB2 LYS A 109 16.902 -17.766 -16.768 1.00 0.00 H new ATOM 0 HB3 LYS A 109 16.968 -18.931 -15.460 1.00 0.00 H new ATOM 0 HG2 LYS A 109 14.408 -17.515 -16.273 1.00 0.00 H new ATOM 0 HG3 LYS A 109 14.917 -19.039 -16.973 1.00 0.00 H new ATOM 0 HD2 LYS A 109 14.670 -18.667 -13.971 1.00 0.00 H new ATOM 0 HD3 LYS A 109 13.295 -19.121 -14.959 1.00 0.00 H new ATOM 0 HE2 LYS A 109 15.925 -20.654 -14.904 1.00 0.00 H new ATOM 0 HE3 LYS A 109 14.536 -21.064 -13.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 14.323 -22.415 -15.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 13.274 -21.132 -16.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 14.809 -21.207 -16.858 1.00 0.00 H new ATOM 1717 N PHE A 110 18.955 -16.453 -15.246 1.00 0.00 N ATOM 1718 CA PHE A 110 20.373 -16.353 -14.922 1.00 0.00 C ATOM 1719 C PHE A 110 20.845 -14.904 -14.988 1.00 0.00 C ATOM 1720 O PHE A 110 20.742 -14.253 -16.027 1.00 0.00 O ATOM 1721 CB PHE A 110 21.198 -17.215 -15.880 1.00 0.00 C ATOM 1722 CG PHE A 110 21.127 -18.684 -15.577 1.00 0.00 C ATOM 1723 CD1 PHE A 110 20.015 -19.427 -15.939 1.00 0.00 C ATOM 1724 CD2 PHE A 110 22.173 -19.323 -14.930 1.00 0.00 C ATOM 1725 CE1 PHE A 110 19.947 -20.779 -15.662 1.00 0.00 C ATOM 1726 CE2 PHE A 110 22.111 -20.675 -14.651 1.00 0.00 C ATOM 1727 CZ PHE A 110 20.996 -21.404 -15.016 1.00 0.00 C ATOM 0 H PHE A 110 18.722 -16.193 -16.204 1.00 0.00 H new ATOM 0 HA PHE A 110 20.515 -16.716 -13.904 1.00 0.00 H new ATOM 0 HB2 PHE A 110 20.851 -17.045 -16.899 1.00 0.00 H new ATOM 0 HB3 PHE A 110 22.239 -16.894 -15.840 1.00 0.00 H new ATOM 0 HD1 PHE A 110 19.192 -18.944 -16.444 1.00 0.00 H new ATOM 0 HD2 PHE A 110 23.047 -18.758 -14.641 1.00 0.00 H new ATOM 0 HE1 PHE A 110 19.075 -21.347 -15.950 1.00 0.00 H new ATOM 0 HE2 PHE A 110 22.934 -21.161 -14.148 1.00 0.00 H new ATOM 0 HZ PHE A 110 20.944 -22.460 -14.797 1.00 0.00 H new ATOM 1737 N ASN A 111 21.364 -14.405 -13.870 1.00 0.00 N ATOM 1738 CA ASN A 111 21.851 -13.033 -13.800 1.00 0.00 C ATOM 1739 C ASN A 111 23.259 -12.925 -14.379 1.00 0.00 C ATOM 1740 O ASN A 111 24.249 -13.034 -13.655 1.00 0.00 O ATOM 1741 CB ASN A 111 21.845 -12.540 -12.351 1.00 0.00 C ATOM 1742 CG ASN A 111 21.905 -11.028 -12.254 1.00 0.00 C ATOM 1743 OD1 ASN A 111 21.653 -10.322 -13.230 1.00 0.00 O ATOM 1744 ND2 ASN A 111 22.241 -10.525 -11.072 1.00 0.00 N ATOM 0 H ASN A 111 21.458 -14.931 -13.001 1.00 0.00 H new ATOM 0 HA ASN A 111 21.184 -12.407 -14.393 1.00 0.00 H new ATOM 0 HB2 ASN A 111 20.944 -12.898 -11.852 1.00 0.00 H new ATOM 0 HB3 ASN A 111 22.695 -12.969 -11.821 1.00 0.00 H new ATOM 0 HD21 ASN A 111 22.299 -9.515 -10.945 1.00 0.00 H new ATOM 0 HD22 ASN A 111 22.441 -11.149 -10.290 1.00 0.00 H new ATOM 1751 N ARG A 112 23.339 -12.710 -15.688 1.00 0.00 N ATOM 1752 CA ARG A 112 24.625 -12.588 -16.365 1.00 0.00 C ATOM 1753 C ARG A 112 25.198 -11.184 -16.193 1.00 0.00 C ATOM 1754 O ARG A 112 24.465 -10.196 -16.214 1.00 0.00 O ATOM 1755 CB ARG A 112 24.475 -12.911 -17.852 1.00 0.00 C ATOM 1756 CG ARG A 112 24.250 -14.387 -18.135 1.00 0.00 C ATOM 1757 CD ARG A 112 25.539 -15.183 -18.004 1.00 0.00 C ATOM 1758 NE ARG A 112 26.318 -15.170 -19.239 1.00 0.00 N ATOM 1759 CZ ARG A 112 27.534 -15.693 -19.346 1.00 0.00 C ATOM 1760 NH1 ARG A 112 28.107 -16.268 -18.298 1.00 0.00 N ATOM 1761 NH2 ARG A 112 28.180 -15.642 -20.504 1.00 0.00 N ATOM 0 H ARG A 112 22.529 -12.617 -16.301 1.00 0.00 H new ATOM 0 HA ARG A 112 25.315 -13.301 -15.914 1.00 0.00 H new ATOM 0 HB2 ARG A 112 23.639 -12.341 -18.256 1.00 0.00 H new ATOM 0 HB3 ARG A 112 25.370 -12.581 -18.379 1.00 0.00 H new ATOM 0 HG2 ARG A 112 23.506 -14.782 -17.443 1.00 0.00 H new ATOM 0 HG3 ARG A 112 23.847 -14.508 -19.140 1.00 0.00 H new ATOM 0 HD2 ARG A 112 26.139 -14.771 -17.193 1.00 0.00 H new ATOM 0 HD3 ARG A 112 25.303 -16.213 -17.735 1.00 0.00 H new ATOM 0 HE ARG A 112 25.906 -14.735 -20.065 1.00 0.00 H new ATOM 0 HH11 ARG A 112 27.614 -16.310 -17.406 1.00 0.00 H new ATOM 0 HH12 ARG A 112 29.041 -16.669 -18.384 1.00 0.00 H new ATOM 0 HH21 ARG A 112 27.743 -15.201 -21.313 1.00 0.00 H new ATOM 0 HH22 ARG A 112 29.114 -16.044 -20.585 1.00 0.00 H new ATOM 1775 N SER A 113 26.514 -11.105 -16.023 1.00 0.00 N ATOM 1776 CA SER A 113 27.186 -9.823 -15.844 1.00 0.00 C ATOM 1777 C SER A 113 28.525 -9.804 -16.575 1.00 0.00 C ATOM 1778 O SER A 113 29.195 -10.830 -16.693 1.00 0.00 O ATOM 1779 CB SER A 113 27.400 -9.539 -14.356 1.00 0.00 C ATOM 1780 OG SER A 113 26.238 -8.978 -13.771 1.00 0.00 O ATOM 0 H SER A 113 27.136 -11.913 -16.005 1.00 0.00 H new ATOM 0 HA SER A 113 26.550 -9.045 -16.267 1.00 0.00 H new ATOM 0 HB2 SER A 113 27.661 -10.463 -13.840 1.00 0.00 H new ATOM 0 HB3 SER A 113 28.240 -8.856 -14.230 1.00 0.00 H new ATOM 0 HG SER A 113 25.456 -9.202 -14.317 1.00 0.00 H new ATOM 1786 N GLY A 114 28.909 -8.629 -17.065 1.00 0.00 N ATOM 1787 CA GLY A 114 30.166 -8.498 -17.778 1.00 0.00 C ATOM 1788 C GLY A 114 30.195 -7.280 -18.681 1.00 0.00 C ATOM 1789 O GLY A 114 29.910 -7.360 -19.876 1.00 0.00 O ATOM 0 H GLY A 114 28.372 -7.766 -16.981 1.00 0.00 H new ATOM 0 HA2 GLY A 114 30.983 -8.434 -17.059 1.00 0.00 H new ATOM 0 HA3 GLY A 114 30.337 -9.394 -18.375 1.00 0.00 H new ATOM 1793 N PRO A 115 30.546 -6.121 -18.106 1.00 0.00 N ATOM 1794 CA PRO A 115 30.619 -4.859 -18.848 1.00 0.00 C ATOM 1795 C PRO A 115 31.781 -4.834 -19.836 1.00 0.00 C ATOM 1796 O PRO A 115 32.552 -5.789 -19.926 1.00 0.00 O ATOM 1797 CB PRO A 115 30.828 -3.813 -17.750 1.00 0.00 C ATOM 1798 CG PRO A 115 31.466 -4.560 -16.631 1.00 0.00 C ATOM 1799 CD PRO A 115 30.900 -5.952 -16.686 1.00 0.00 C ATOM 0 HA PRO A 115 29.728 -4.690 -19.453 1.00 0.00 H new ATOM 0 HB2 PRO A 115 31.464 -2.998 -18.096 1.00 0.00 H new ATOM 0 HB3 PRO A 115 29.882 -3.369 -17.441 1.00 0.00 H new ATOM 0 HG2 PRO A 115 32.550 -4.575 -16.740 1.00 0.00 H new ATOM 0 HG3 PRO A 115 31.249 -4.088 -15.673 1.00 0.00 H new ATOM 0 HD2 PRO A 115 31.629 -6.695 -16.362 1.00 0.00 H new ATOM 0 HD3 PRO A 115 30.029 -6.057 -16.039 1.00 0.00 H new ATOM 1807 N SER A 116 31.900 -3.735 -20.574 1.00 0.00 N ATOM 1808 CA SER A 116 32.966 -3.587 -21.558 1.00 0.00 C ATOM 1809 C SER A 116 33.201 -2.116 -21.887 1.00 0.00 C ATOM 1810 O SER A 116 32.512 -1.235 -21.372 1.00 0.00 O ATOM 1811 CB SER A 116 32.623 -4.358 -22.833 1.00 0.00 C ATOM 1812 OG SER A 116 31.385 -3.928 -23.372 1.00 0.00 O ATOM 0 H SER A 116 31.272 -2.934 -20.509 1.00 0.00 H new ATOM 0 HA SER A 116 33.881 -3.996 -21.130 1.00 0.00 H new ATOM 0 HB2 SER A 116 33.413 -4.217 -23.571 1.00 0.00 H new ATOM 0 HB3 SER A 116 32.577 -5.425 -22.615 1.00 0.00 H new ATOM 0 HG SER A 116 31.189 -4.435 -24.187 1.00 0.00 H new ATOM 1818 N SER A 117 34.179 -1.858 -22.749 1.00 0.00 N ATOM 1819 CA SER A 117 34.509 -0.494 -23.146 1.00 0.00 C ATOM 1820 C SER A 117 33.541 0.011 -24.211 1.00 0.00 C ATOM 1821 O SER A 117 33.012 -0.767 -25.004 1.00 0.00 O ATOM 1822 CB SER A 117 35.944 -0.425 -23.670 1.00 0.00 C ATOM 1823 OG SER A 117 36.295 0.901 -24.024 1.00 0.00 O ATOM 0 H SER A 117 34.757 -2.576 -23.186 1.00 0.00 H new ATOM 0 HA SER A 117 34.420 0.145 -22.267 1.00 0.00 H new ATOM 0 HB2 SER A 117 36.631 -0.795 -22.909 1.00 0.00 H new ATOM 0 HB3 SER A 117 36.049 -1.076 -24.538 1.00 0.00 H new ATOM 0 HG SER A 117 37.218 0.918 -24.354 1.00 0.00 H new ATOM 1829 N GLY A 118 33.315 1.321 -24.224 1.00 0.00 N ATOM 1830 CA GLY A 118 32.411 1.909 -25.195 1.00 0.00 C ATOM 1831 C GLY A 118 30.971 1.494 -24.973 1.00 0.00 C ATOM 1832 O GLY A 118 30.348 0.895 -25.850 1.00 0.00 O ATOM 0 H GLY A 118 33.742 1.986 -23.579 1.00 0.00 H new ATOM 0 HA2 GLY A 118 32.485 2.995 -25.144 1.00 0.00 H new ATOM 0 HA3 GLY A 118 32.720 1.615 -26.198 1.00 0.00 H new TER 1836 GLY A 118