USER MOD reduce.3.24.130724 H: found=0, std=0, add=1005, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1005 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 121 SER OG : rot -30:sc= 0.218 USER MOD Set 1.2: A 122 GLN : amide:sc= -8.48! C(o=-8.3!,f=-19!) USER MOD Set 2.1: A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 100 GLN : amide:sc=-0.00559 X(o=-0.0056,f=-0.11) USER MOD Set 3.1: A 7 GLN : amide:sc= -0.9 K(o=1.7,f=2.5) USER MOD Set 3.2: A 26 TYR OH : rot -64:sc= 2.58 USER MOD Single : A 1 ARG N :NH3+ 153:sc= 0.00467 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot 53:sc= -0.0617 USER MOD Single : A 12 LYS NZ :NH3+ 176:sc= -0.265 (180deg=-0.347) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= -0.29 K(o=-0.29,f=-2.7!) USER MOD Single : A 17 SER OG : rot 180:sc= 0.0508 USER MOD Single : A 19 ASN : amide:sc= -0.0295 X(o=-0.03,f=0) USER MOD Single : A 20 LYS NZ :NH3+ 160:sc= -0.569 (180deg=-1) USER MOD Single : A 23 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.156) USER MOD Single : A 24 LYS NZ :NH3+ -161:sc= 0.0263 (180deg=0.00435) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 170:sc= -1.63 USER MOD Single : A 30 SER OG : rot 180:sc= 0.0373 USER MOD Single : A 31 SER OG : rot -46:sc= 6.9e-05 USER MOD Single : A 32 ASN : amide:sc= -0.0234 K(o=-0.023,f=-2.9!) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 HIS : no HD1:sc= -3.05! C(o=-3!,f=-3.5!) USER MOD Single : A 40 SER OG : rot 180:sc= 0.00112 USER MOD Single : A 42 ASN : amide:sc= -0.52 K(o=-0.52,f=-2.8!) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= -7.01! K(o=-7!,f=-1.5) USER MOD Single : A 47 SER OG : rot 180:sc= -0.198 USER MOD Single : A 48 THR OG1 : rot 112:sc= -1.47 USER MOD Single : A 49 HIS : no HD1:sc= -0.184 X(o=-0.18,f=-0.0013) USER MOD Single : A 53 MET CE :methyl 159:sc= -11.4! (180deg=-12.5!) USER MOD Single : A 58 THR OG1 : rot 178:sc= -3 USER MOD Single : A 59 THR OG1 : rot 141:sc= -0.945 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ -150:sc= -1.06 (180deg=-2.13!) USER MOD Single : A 72 SER OG : rot 65:sc= 0.793 USER MOD Single : A 77 SER OG : rot 180:sc= -0.0592 USER MOD Single : A 79 SER OG : rot -64:sc= 0.478 USER MOD Single : A 81 SER OG : rot -132:sc= 0.00379 USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 ASN : amide:sc= -2.29 K(o=-2.3,f=0.31) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot -59:sc= 1.22 USER MOD Single : A 101 THR OG1 : rot 180:sc= -0.0525 USER MOD Single : A 103 HIS : no HD1:sc= -5.63! C(o=-5.6!,f=-7.8!) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 SER OG : rot -171:sc= -1.04 USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 1 -14.228 -18.161 14.564 1.00 0.00 N ATOM 2 CA ARG A 1 -14.753 -16.900 13.981 1.00 0.00 C ATOM 3 C ARG A 1 -13.632 -16.069 13.363 1.00 0.00 C ATOM 4 O ARG A 1 -12.468 -16.467 13.385 1.00 0.00 O ATOM 5 CB ARG A 1 -15.452 -16.106 15.088 1.00 0.00 C ATOM 6 CG ARG A 1 -16.969 -16.140 14.995 1.00 0.00 C ATOM 7 CD ARG A 1 -17.593 -14.892 15.597 1.00 0.00 C ATOM 8 NE ARG A 1 -18.858 -15.180 16.266 1.00 0.00 N ATOM 9 CZ ARG A 1 -18.965 -15.932 17.358 1.00 0.00 C ATOM 10 NH1 ARG A 1 -17.885 -16.473 17.908 1.00 0.00 N ATOM 11 NH2 ARG A 1 -20.155 -16.145 17.902 1.00 0.00 N ATOM 0 H1 ARG A 1 -14.851 -18.472 15.336 1.00 0.00 H new ATOM 0 H2 ARG A 1 -14.194 -18.896 13.829 1.00 0.00 H new ATOM 0 H3 ARG A 1 -13.270 -17.999 14.936 1.00 0.00 H new ATOM 0 HA ARG A 1 -15.459 -17.139 13.186 1.00 0.00 H new ATOM 0 HB2 ARG A 1 -15.147 -16.502 16.056 1.00 0.00 H new ATOM 0 HB3 ARG A 1 -15.117 -15.070 15.048 1.00 0.00 H new ATOM 0 HG2 ARG A 1 -17.268 -16.230 13.951 1.00 0.00 H new ATOM 0 HG3 ARG A 1 -17.346 -17.022 15.512 1.00 0.00 H new ATOM 0 HD2 ARG A 1 -16.899 -14.448 16.310 1.00 0.00 H new ATOM 0 HD3 ARG A 1 -17.758 -14.155 14.812 1.00 0.00 H new ATOM 0 HE ARG A 1 -19.710 -14.781 15.873 1.00 0.00 H new ATOM 0 HH11 ARG A 1 -16.967 -16.313 17.493 1.00 0.00 H new ATOM 0 HH12 ARG A 1 -17.973 -17.049 18.745 1.00 0.00 H new ATOM 0 HH21 ARG A 1 -20.988 -15.732 17.483 1.00 0.00 H new ATOM 0 HH22 ARG A 1 -20.237 -16.722 18.739 1.00 0.00 H new ATOM 27 N ALA A 2 -13.993 -14.915 12.811 1.00 0.00 N ATOM 28 CA ALA A 2 -13.019 -14.028 12.188 1.00 0.00 C ATOM 29 C ALA A 2 -13.007 -12.661 12.863 1.00 0.00 C ATOM 30 O ALA A 2 -13.859 -12.363 13.702 1.00 0.00 O ATOM 31 CB ALA A 2 -13.314 -13.884 10.703 1.00 0.00 C ATOM 0 H ALA A 2 -14.953 -14.573 12.783 1.00 0.00 H new ATOM 0 HA ALA A 2 -12.031 -14.471 12.311 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -12.579 -13.219 10.249 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -13.262 -14.862 10.225 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -14.312 -13.467 10.569 1.00 0.00 H new ATOM 37 N ILE A 3 -12.039 -11.831 12.489 1.00 0.00 N ATOM 38 CA ILE A 3 -11.914 -10.494 13.053 1.00 0.00 C ATOM 39 C ILE A 3 -11.763 -9.451 11.948 1.00 0.00 C ATOM 40 O ILE A 3 -11.031 -9.665 10.982 1.00 0.00 O ATOM 41 CB ILE A 3 -10.708 -10.395 14.006 1.00 0.00 C ATOM 42 CG1 ILE A 3 -10.704 -11.568 14.988 1.00 0.00 C ATOM 43 CG2 ILE A 3 -10.732 -9.070 14.755 1.00 0.00 C ATOM 44 CD1 ILE A 3 -11.872 -11.558 15.950 1.00 0.00 C ATOM 0 H ILE A 3 -11.328 -12.063 11.795 1.00 0.00 H new ATOM 0 HA ILE A 3 -12.826 -10.298 13.617 1.00 0.00 H new ATOM 0 HB ILE A 3 -9.794 -10.440 13.414 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -10.716 -12.502 14.426 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -9.775 -11.551 15.558 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -9.874 -9.015 15.424 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -10.689 -8.248 14.041 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -11.651 -8.997 15.337 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -11.803 -12.419 16.615 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -11.850 -10.641 16.539 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -12.806 -11.607 15.389 1.00 0.00 H new ATOM 56 N PRO A 4 -12.453 -8.305 12.068 1.00 0.00 N ATOM 57 CA PRO A 4 -12.382 -7.240 11.064 1.00 0.00 C ATOM 58 C PRO A 4 -10.953 -6.781 10.806 1.00 0.00 C ATOM 59 O PRO A 4 -10.224 -6.422 11.730 1.00 0.00 O ATOM 60 CB PRO A 4 -13.206 -6.105 11.679 1.00 0.00 C ATOM 61 CG PRO A 4 -14.115 -6.772 12.653 1.00 0.00 C ATOM 62 CD PRO A 4 -13.355 -7.958 13.182 1.00 0.00 C ATOM 0 HA PRO A 4 -12.754 -7.573 10.095 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -12.565 -5.375 12.173 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -13.770 -5.569 10.916 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -14.389 -6.092 13.460 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -15.041 -7.085 12.171 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -12.800 -7.710 14.087 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -14.021 -8.784 13.433 1.00 0.00 H new ATOM 70 N ILE A 5 -10.565 -6.795 9.537 1.00 0.00 N ATOM 71 CA ILE A 5 -9.224 -6.378 9.138 1.00 0.00 C ATOM 72 C ILE A 5 -9.200 -4.907 8.721 1.00 0.00 C ATOM 73 O ILE A 5 -8.149 -4.269 8.723 1.00 0.00 O ATOM 74 CB ILE A 5 -8.691 -7.246 7.981 1.00 0.00 C ATOM 75 CG1 ILE A 5 -8.824 -8.730 8.328 1.00 0.00 C ATOM 76 CG2 ILE A 5 -7.243 -6.896 7.673 1.00 0.00 C ATOM 77 CD1 ILE A 5 -8.146 -9.111 9.628 1.00 0.00 C ATOM 0 H ILE A 5 -11.161 -7.091 8.764 1.00 0.00 H new ATOM 0 HA ILE A 5 -8.579 -6.509 10.007 1.00 0.00 H new ATOM 0 HB ILE A 5 -9.287 -7.043 7.091 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -9.881 -8.987 8.390 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -8.399 -9.324 7.519 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -6.884 -7.519 6.854 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.175 -5.846 7.387 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -6.630 -7.071 8.557 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -8.281 -10.177 9.810 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -7.081 -8.886 9.563 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -8.587 -8.544 10.448 1.00 0.00 H new ATOM 89 N LYS A 6 -10.372 -4.373 8.383 1.00 0.00 N ATOM 90 CA LYS A 6 -10.508 -2.975 7.984 1.00 0.00 C ATOM 91 C LYS A 6 -11.949 -2.694 7.627 1.00 0.00 C ATOM 92 O LYS A 6 -12.442 -3.173 6.623 1.00 0.00 O ATOM 93 CB LYS A 6 -9.626 -2.643 6.768 1.00 0.00 C ATOM 94 CG LYS A 6 -8.689 -1.464 6.973 1.00 0.00 C ATOM 95 CD LYS A 6 -7.851 -1.601 8.236 1.00 0.00 C ATOM 96 CE LYS A 6 -7.443 -0.242 8.783 1.00 0.00 C ATOM 97 NZ LYS A 6 -7.105 -0.305 10.231 1.00 0.00 N ATOM 0 H LYS A 6 -11.249 -4.894 8.378 1.00 0.00 H new ATOM 0 HA LYS A 6 -10.188 -2.357 8.823 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -9.034 -3.522 6.514 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -10.270 -2.435 5.914 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -8.029 -1.374 6.110 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -9.272 -0.545 7.025 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -8.417 -2.144 8.993 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -6.960 -2.190 8.021 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -6.584 0.131 8.226 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -8.255 0.469 8.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -6.832 0.641 10.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -7.933 -0.636 10.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -6.314 -0.964 10.374 1.00 0.00 H new ATOM 111 N GLN A 7 -12.622 -1.913 8.440 1.00 0.00 N ATOM 112 CA GLN A 7 -14.011 -1.581 8.171 1.00 0.00 C ATOM 113 C GLN A 7 -14.220 -0.075 8.247 1.00 0.00 C ATOM 114 O GLN A 7 -14.136 0.520 9.322 1.00 0.00 O ATOM 115 CB GLN A 7 -14.932 -2.298 9.165 1.00 0.00 C ATOM 116 CG GLN A 7 -16.389 -1.873 9.073 1.00 0.00 C ATOM 117 CD GLN A 7 -16.830 -1.039 10.261 1.00 0.00 C ATOM 118 OE1 GLN A 7 -17.271 -1.573 11.278 1.00 0.00 O ATOM 119 NE2 GLN A 7 -16.713 0.279 10.136 1.00 0.00 N ATOM 0 H GLN A 7 -12.238 -1.496 9.288 1.00 0.00 H new ATOM 0 HA GLN A 7 -14.259 -1.915 7.164 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -14.866 -3.373 8.996 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -14.573 -2.112 10.177 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -16.540 -1.302 8.157 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -17.019 -2.760 9.003 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -16.342 0.679 9.274 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -16.994 0.891 10.902 1.00 0.00 H new ATOM 128 N SER A 8 -14.486 0.539 7.102 1.00 0.00 N ATOM 129 CA SER A 8 -14.696 1.981 7.046 1.00 0.00 C ATOM 130 C SER A 8 -15.353 2.394 5.733 1.00 0.00 C ATOM 131 O SER A 8 -15.721 1.549 4.917 1.00 0.00 O ATOM 132 CB SER A 8 -13.368 2.719 7.218 1.00 0.00 C ATOM 133 OG SER A 8 -13.559 4.124 7.218 1.00 0.00 O ATOM 0 H SER A 8 -14.561 0.064 6.202 1.00 0.00 H new ATOM 0 HA SER A 8 -15.365 2.252 7.863 1.00 0.00 H new ATOM 0 HB2 SER A 8 -12.897 2.413 8.152 1.00 0.00 H new ATOM 0 HB3 SER A 8 -12.688 2.442 6.413 1.00 0.00 H new ATOM 0 HG SER A 8 -14.239 4.362 7.882 1.00 0.00 H new ATOM 139 N PHE A 9 -15.497 3.700 5.541 1.00 0.00 N ATOM 140 CA PHE A 9 -16.112 4.234 4.332 1.00 0.00 C ATOM 141 C PHE A 9 -15.077 4.417 3.227 1.00 0.00 C ATOM 142 O PHE A 9 -14.029 5.027 3.437 1.00 0.00 O ATOM 143 CB PHE A 9 -16.795 5.571 4.626 1.00 0.00 C ATOM 144 CG PHE A 9 -17.555 5.589 5.922 1.00 0.00 C ATOM 145 CD1 PHE A 9 -18.350 4.515 6.288 1.00 0.00 C ATOM 146 CD2 PHE A 9 -17.474 6.680 6.772 1.00 0.00 C ATOM 147 CE1 PHE A 9 -19.050 4.529 7.480 1.00 0.00 C ATOM 148 CE2 PHE A 9 -18.174 6.700 7.964 1.00 0.00 C ATOM 149 CZ PHE A 9 -18.962 5.623 8.319 1.00 0.00 C ATOM 0 H PHE A 9 -15.196 4.410 6.209 1.00 0.00 H new ATOM 0 HA PHE A 9 -16.859 3.517 3.993 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -16.041 6.357 4.647 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -17.479 5.807 3.811 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -18.424 3.658 5.635 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -16.857 7.524 6.500 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -19.665 3.685 7.755 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -18.105 7.557 8.617 1.00 0.00 H new ATOM 0 HZ PHE A 9 -19.508 5.636 9.251 1.00 0.00 H new ATOM 159 N LEU A 10 -15.386 3.892 2.047 1.00 0.00 N ATOM 160 CA LEU A 10 -14.494 4.004 0.901 1.00 0.00 C ATOM 161 C LEU A 10 -15.187 4.717 -0.247 1.00 0.00 C ATOM 162 O LEU A 10 -16.414 4.742 -0.321 1.00 0.00 O ATOM 163 CB LEU A 10 -14.041 2.618 0.435 1.00 0.00 C ATOM 164 CG LEU A 10 -12.793 2.073 1.125 1.00 0.00 C ATOM 165 CD1 LEU A 10 -13.139 1.546 2.510 1.00 0.00 C ATOM 166 CD2 LEU A 10 -12.154 0.977 0.283 1.00 0.00 C ATOM 0 H LEU A 10 -16.250 3.383 1.859 1.00 0.00 H new ATOM 0 HA LEU A 10 -13.623 4.582 1.209 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -14.859 1.915 0.592 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -13.855 2.657 -0.638 1.00 0.00 H new ATOM 0 HG LEU A 10 -12.076 2.887 1.234 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -12.238 1.161 2.988 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -13.554 2.354 3.113 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -13.873 0.745 2.422 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -11.266 0.600 0.790 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -12.866 0.163 0.144 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -11.873 1.382 -0.689 1.00 0.00 H new ATOM 178 N LEU A 11 -14.403 5.282 -1.151 1.00 0.00 N ATOM 179 CA LEU A 11 -14.964 5.976 -2.303 1.00 0.00 C ATOM 180 C LEU A 11 -15.020 5.036 -3.502 1.00 0.00 C ATOM 181 O LEU A 11 -14.077 4.287 -3.752 1.00 0.00 O ATOM 182 CB LEU A 11 -14.140 7.223 -2.637 1.00 0.00 C ATOM 183 CG LEU A 11 -14.940 8.528 -2.684 1.00 0.00 C ATOM 184 CD1 LEU A 11 -15.661 8.764 -1.368 1.00 0.00 C ATOM 185 CD2 LEU A 11 -14.026 9.700 -3.014 1.00 0.00 C ATOM 0 H LEU A 11 -13.384 5.275 -1.112 1.00 0.00 H new ATOM 0 HA LEU A 11 -15.977 6.295 -2.058 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -13.347 7.326 -1.897 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -13.657 7.074 -3.603 1.00 0.00 H new ATOM 0 HG LEU A 11 -15.690 8.444 -3.471 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -16.223 9.696 -1.423 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -16.346 7.938 -1.175 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -14.932 8.827 -0.560 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -14.610 10.620 -3.044 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -13.253 9.785 -2.250 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -13.559 9.535 -3.985 1.00 0.00 H new ATOM 197 N LYS A 12 -16.129 5.068 -4.233 1.00 0.00 N ATOM 198 CA LYS A 12 -16.296 4.204 -5.397 1.00 0.00 C ATOM 199 C LYS A 12 -16.695 5.006 -6.631 1.00 0.00 C ATOM 200 O LYS A 12 -17.761 5.623 -6.666 1.00 0.00 O ATOM 201 CB LYS A 12 -17.346 3.129 -5.113 1.00 0.00 C ATOM 202 CG LYS A 12 -17.021 1.782 -5.741 1.00 0.00 C ATOM 203 CD LYS A 12 -17.169 1.818 -7.254 1.00 0.00 C ATOM 204 CE LYS A 12 -15.870 1.440 -7.952 1.00 0.00 C ATOM 205 NZ LYS A 12 -16.096 1.041 -9.369 1.00 0.00 N ATOM 0 H LYS A 12 -16.923 5.680 -4.042 1.00 0.00 H new ATOM 0 HA LYS A 12 -15.337 3.726 -5.597 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -17.444 3.004 -4.035 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -18.313 3.470 -5.483 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -16.002 1.496 -5.482 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -17.681 1.019 -5.329 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -17.960 1.133 -7.559 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -17.474 2.817 -7.567 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -15.181 2.284 -7.918 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -15.395 0.619 -7.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -15.181 0.857 -9.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -16.678 0.180 -9.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -16.587 1.808 -9.871 1.00 0.00 H new ATOM 219 N ARG A 13 -15.835 4.986 -7.643 1.00 0.00 N ATOM 220 CA ARG A 13 -16.094 5.705 -8.887 1.00 0.00 C ATOM 221 C ARG A 13 -17.382 5.214 -9.540 1.00 0.00 C ATOM 222 O ARG A 13 -17.741 4.042 -9.422 1.00 0.00 O ATOM 223 CB ARG A 13 -14.921 5.531 -9.853 1.00 0.00 C ATOM 224 CG ARG A 13 -14.410 4.102 -9.935 1.00 0.00 C ATOM 225 CD ARG A 13 -13.588 3.874 -11.192 1.00 0.00 C ATOM 226 NE ARG A 13 -13.608 2.474 -11.612 1.00 0.00 N ATOM 227 CZ ARG A 13 -13.306 2.064 -12.842 1.00 0.00 C ATOM 228 NH1 ARG A 13 -12.953 2.941 -13.774 1.00 0.00 N ATOM 229 NH2 ARG A 13 -13.353 0.773 -13.139 1.00 0.00 N ATOM 0 H ARG A 13 -14.950 4.479 -7.627 1.00 0.00 H new ATOM 0 HA ARG A 13 -16.208 6.763 -8.650 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -15.228 5.856 -10.847 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -14.105 6.183 -9.542 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -13.803 3.881 -9.057 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -15.254 3.412 -9.921 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -13.975 4.500 -11.997 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -12.559 4.184 -11.013 1.00 0.00 H new ATOM 0 HE ARG A 13 -13.869 1.770 -10.922 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -12.912 3.935 -13.549 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -12.723 2.621 -14.715 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -13.620 0.095 -12.425 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -13.122 0.458 -14.081 1.00 0.00 H new ATOM 243 N SER A 14 -18.072 6.116 -10.230 1.00 0.00 N ATOM 244 CA SER A 14 -19.320 5.773 -10.902 1.00 0.00 C ATOM 245 C SER A 14 -19.049 5.066 -12.227 1.00 0.00 C ATOM 246 O SER A 14 -19.370 3.890 -12.391 1.00 0.00 O ATOM 247 CB SER A 14 -20.158 7.031 -11.142 1.00 0.00 C ATOM 248 OG SER A 14 -21.380 6.716 -11.786 1.00 0.00 O ATOM 0 H SER A 14 -17.788 7.090 -10.339 1.00 0.00 H new ATOM 0 HA SER A 14 -19.876 5.093 -10.256 1.00 0.00 H new ATOM 0 HB2 SER A 14 -20.361 7.523 -10.191 1.00 0.00 H new ATOM 0 HB3 SER A 14 -19.594 7.737 -11.752 1.00 0.00 H new ATOM 0 HG SER A 14 -21.897 7.537 -11.926 1.00 0.00 H new ATOM 254 N GLY A 15 -18.456 5.792 -13.170 1.00 0.00 N ATOM 255 CA GLY A 15 -18.152 5.215 -14.467 1.00 0.00 C ATOM 256 C GLY A 15 -17.954 6.269 -15.539 1.00 0.00 C ATOM 257 O GLY A 15 -18.663 6.280 -16.545 1.00 0.00 O ATOM 0 H GLY A 15 -18.181 6.768 -13.059 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -17.251 4.607 -14.389 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -18.961 4.548 -14.763 1.00 0.00 H new ATOM 261 N ASN A 16 -16.987 7.154 -15.324 1.00 0.00 N ATOM 262 CA ASN A 16 -16.697 8.216 -16.282 1.00 0.00 C ATOM 263 C ASN A 16 -15.193 8.375 -16.475 1.00 0.00 C ATOM 264 O ASN A 16 -14.500 8.925 -15.618 1.00 0.00 O ATOM 265 CB ASN A 16 -17.307 9.538 -15.813 1.00 0.00 C ATOM 266 CG ASN A 16 -18.638 9.828 -16.478 1.00 0.00 C ATOM 267 OD1 ASN A 16 -18.999 9.197 -17.473 1.00 0.00 O ATOM 268 ND2 ASN A 16 -19.378 10.787 -15.932 1.00 0.00 N ATOM 0 H ASN A 16 -16.391 7.158 -14.496 1.00 0.00 H new ATOM 0 HA ASN A 16 -17.142 7.941 -17.238 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -17.443 9.509 -14.732 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -16.613 10.351 -16.026 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -20.283 11.026 -16.337 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -19.041 11.285 -15.108 1.00 0.00 H new ATOM 275 N SER A 17 -14.692 7.888 -17.607 1.00 0.00 N ATOM 276 CA SER A 17 -13.269 7.977 -17.913 1.00 0.00 C ATOM 277 C SER A 17 -12.834 9.430 -18.076 1.00 0.00 C ATOM 278 O SER A 17 -11.789 9.836 -17.569 1.00 0.00 O ATOM 279 CB SER A 17 -12.952 7.191 -19.186 1.00 0.00 C ATOM 280 OG SER A 17 -14.008 7.295 -20.126 1.00 0.00 O ATOM 0 H SER A 17 -15.250 7.428 -18.326 1.00 0.00 H new ATOM 0 HA SER A 17 -12.716 7.545 -17.079 1.00 0.00 H new ATOM 0 HB2 SER A 17 -12.029 7.566 -19.628 1.00 0.00 H new ATOM 0 HB3 SER A 17 -12.784 6.143 -18.938 1.00 0.00 H new ATOM 0 HG SER A 17 -13.780 6.785 -20.932 1.00 0.00 H new ATOM 286 N LEU A 18 -13.644 10.209 -18.786 1.00 0.00 N ATOM 287 CA LEU A 18 -13.343 11.618 -19.014 1.00 0.00 C ATOM 288 C LEU A 18 -13.219 12.369 -17.694 1.00 0.00 C ATOM 289 O LEU A 18 -12.389 13.268 -17.556 1.00 0.00 O ATOM 290 CB LEU A 18 -14.432 12.258 -19.879 1.00 0.00 C ATOM 291 CG LEU A 18 -14.174 13.715 -20.269 1.00 0.00 C ATOM 292 CD1 LEU A 18 -13.203 13.791 -21.437 1.00 0.00 C ATOM 293 CD2 LEU A 18 -15.481 14.411 -20.613 1.00 0.00 C ATOM 0 H LEU A 18 -14.513 9.889 -19.213 1.00 0.00 H new ATOM 0 HA LEU A 18 -12.388 11.681 -19.536 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -14.546 11.669 -20.789 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -15.380 12.203 -19.343 1.00 0.00 H new ATOM 0 HG LEU A 18 -13.725 14.227 -19.418 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -13.032 14.835 -21.700 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -12.257 13.328 -21.155 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -13.623 13.265 -22.294 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -15.280 15.446 -20.888 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -15.957 13.899 -21.449 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -16.144 14.387 -19.748 1.00 0.00 H new ATOM 305 N ASN A 19 -14.047 11.994 -16.728 1.00 0.00 N ATOM 306 CA ASN A 19 -14.030 12.628 -15.414 1.00 0.00 C ATOM 307 C ASN A 19 -14.557 11.676 -14.345 1.00 0.00 C ATOM 308 O ASN A 19 -15.756 11.407 -14.277 1.00 0.00 O ATOM 309 CB ASN A 19 -14.867 13.908 -15.432 1.00 0.00 C ATOM 310 CG ASN A 19 -14.253 15.014 -14.597 1.00 0.00 C ATOM 311 OD1 ASN A 19 -13.885 16.068 -15.115 1.00 0.00 O ATOM 312 ND2 ASN A 19 -14.138 14.777 -13.295 1.00 0.00 N ATOM 0 H ASN A 19 -14.740 11.253 -16.829 1.00 0.00 H new ATOM 0 HA ASN A 19 -12.998 12.881 -15.173 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -14.977 14.252 -16.460 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -15.868 13.689 -15.060 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -13.731 15.483 -12.682 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -14.457 13.889 -12.908 1.00 0.00 H new ATOM 319 N LYS A 20 -13.651 11.169 -13.515 1.00 0.00 N ATOM 320 CA LYS A 20 -14.025 10.244 -12.450 1.00 0.00 C ATOM 321 C LYS A 20 -15.092 10.850 -11.542 1.00 0.00 C ATOM 322 O LYS A 20 -15.342 12.056 -11.575 1.00 0.00 O ATOM 323 CB LYS A 20 -12.794 9.856 -11.625 1.00 0.00 C ATOM 324 CG LYS A 20 -12.225 8.486 -11.972 1.00 0.00 C ATOM 325 CD LYS A 20 -13.293 7.402 -11.937 1.00 0.00 C ATOM 326 CE LYS A 20 -13.490 6.768 -13.304 1.00 0.00 C ATOM 327 NZ LYS A 20 -12.239 6.141 -13.813 1.00 0.00 N ATOM 0 H LYS A 20 -12.655 11.382 -13.559 1.00 0.00 H new ATOM 0 HA LYS A 20 -14.440 9.350 -12.914 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -12.019 10.608 -11.771 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -13.058 9.872 -10.568 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -11.775 8.521 -12.964 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -11.430 8.235 -11.270 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -13.010 6.635 -11.216 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -14.235 7.829 -11.594 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -14.275 6.014 -13.244 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -13.829 7.526 -14.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -12.474 5.448 -14.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -11.620 6.875 -14.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -11.748 5.661 -13.032 1.00 0.00 H new ATOM 341 N GLU A 21 -15.712 10.000 -10.733 1.00 0.00 N ATOM 342 CA GLU A 21 -16.749 10.431 -9.806 1.00 0.00 C ATOM 343 C GLU A 21 -17.000 9.344 -8.772 1.00 0.00 C ATOM 344 O GLU A 21 -17.714 8.375 -9.030 1.00 0.00 O ATOM 345 CB GLU A 21 -18.042 10.754 -10.558 1.00 0.00 C ATOM 346 CG GLU A 21 -18.985 11.660 -9.784 1.00 0.00 C ATOM 347 CD GLU A 21 -19.053 13.061 -10.359 1.00 0.00 C ATOM 348 OE1 GLU A 21 -19.226 13.189 -11.590 1.00 0.00 O ATOM 349 OE2 GLU A 21 -18.933 14.029 -9.580 1.00 0.00 O ATOM 0 H GLU A 21 -15.512 9.000 -10.701 1.00 0.00 H new ATOM 0 HA GLU A 21 -16.412 11.335 -9.299 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -17.792 11.229 -11.507 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -18.558 9.823 -10.794 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -19.984 11.223 -9.784 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -18.660 11.713 -8.745 1.00 0.00 H new ATOM 356 N TRP A 22 -16.385 9.503 -7.609 1.00 0.00 N ATOM 357 CA TRP A 22 -16.514 8.531 -6.535 1.00 0.00 C ATOM 358 C TRP A 22 -17.561 8.966 -5.517 1.00 0.00 C ATOM 359 O TRP A 22 -17.674 10.148 -5.190 1.00 0.00 O ATOM 360 CB TRP A 22 -15.163 8.334 -5.841 1.00 0.00 C ATOM 361 CG TRP A 22 -14.009 8.206 -6.790 1.00 0.00 C ATOM 362 CD1 TRP A 22 -13.628 9.104 -7.748 1.00 0.00 C ATOM 363 CD2 TRP A 22 -13.080 7.119 -6.869 1.00 0.00 C ATOM 364 NE1 TRP A 22 -12.525 8.637 -8.418 1.00 0.00 N ATOM 365 CE2 TRP A 22 -12.170 7.423 -7.898 1.00 0.00 C ATOM 366 CE3 TRP A 22 -12.928 5.915 -6.172 1.00 0.00 C ATOM 367 CZ2 TRP A 22 -11.128 6.572 -8.244 1.00 0.00 C ATOM 368 CZ3 TRP A 22 -11.889 5.072 -6.520 1.00 0.00 C ATOM 369 CH2 TRP A 22 -11.007 5.406 -7.544 1.00 0.00 C ATOM 0 H TRP A 22 -15.789 10.300 -7.385 1.00 0.00 H new ATOM 0 HA TRP A 22 -16.839 7.587 -6.973 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -14.981 9.177 -5.174 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -15.211 7.440 -5.219 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -14.122 10.043 -7.948 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -12.047 9.118 -9.180 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -13.609 5.649 -5.377 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 -10.439 6.823 -9.037 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -11.760 4.140 -5.989 1.00 0.00 H new ATOM 0 HH2 TRP A 22 -10.206 4.725 -7.791 1.00 0.00 H new ATOM 380 N LYS A 23 -18.318 7.997 -5.014 1.00 0.00 N ATOM 381 CA LYS A 23 -19.353 8.269 -4.025 1.00 0.00 C ATOM 382 C LYS A 23 -19.014 7.591 -2.701 1.00 0.00 C ATOM 383 O LYS A 23 -18.212 6.659 -2.659 1.00 0.00 O ATOM 384 CB LYS A 23 -20.714 7.783 -4.535 1.00 0.00 C ATOM 385 CG LYS A 23 -21.693 8.908 -4.822 1.00 0.00 C ATOM 386 CD LYS A 23 -21.262 9.730 -6.025 1.00 0.00 C ATOM 387 CE LYS A 23 -21.996 9.297 -7.284 1.00 0.00 C ATOM 388 NZ LYS A 23 -22.341 10.457 -8.153 1.00 0.00 N ATOM 0 H LYS A 23 -18.234 7.015 -5.276 1.00 0.00 H new ATOM 0 HA LYS A 23 -19.403 9.346 -3.862 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -20.565 7.201 -5.445 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -21.151 7.112 -3.796 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -22.684 8.492 -5.001 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -21.772 9.555 -3.948 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -21.455 10.786 -5.834 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -20.187 9.624 -6.174 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -21.376 8.596 -7.843 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -22.907 8.766 -7.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -22.621 10.115 -9.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -23.129 10.986 -7.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -21.514 11.081 -8.243 1.00 0.00 H new ATOM 402 N LYS A 24 -19.627 8.065 -1.622 1.00 0.00 N ATOM 403 CA LYS A 24 -19.384 7.500 -0.301 1.00 0.00 C ATOM 404 C LYS A 24 -19.829 6.042 -0.246 1.00 0.00 C ATOM 405 O LYS A 24 -20.999 5.730 -0.468 1.00 0.00 O ATOM 406 CB LYS A 24 -20.114 8.315 0.766 1.00 0.00 C ATOM 407 CG LYS A 24 -19.294 9.470 1.316 1.00 0.00 C ATOM 408 CD LYS A 24 -18.205 8.984 2.258 1.00 0.00 C ATOM 409 CE LYS A 24 -18.055 9.904 3.459 1.00 0.00 C ATOM 410 NZ LYS A 24 -18.760 9.372 4.659 1.00 0.00 N ATOM 0 H LYS A 24 -20.294 8.837 -1.636 1.00 0.00 H new ATOM 0 HA LYS A 24 -18.313 7.540 -0.104 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -21.039 8.706 0.343 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -20.393 7.655 1.587 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -18.843 10.022 0.491 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -19.949 10.164 1.843 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -18.440 7.976 2.598 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -17.258 8.927 1.722 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -16.997 10.033 3.687 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -18.451 10.889 3.213 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -18.914 10.142 5.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -19.677 8.973 4.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -18.182 8.629 5.101 1.00 0.00 H new ATOM 424 N LYS A 25 -18.885 5.153 0.047 1.00 0.00 N ATOM 425 CA LYS A 25 -19.173 3.726 0.127 1.00 0.00 C ATOM 426 C LYS A 25 -18.856 3.179 1.517 1.00 0.00 C ATOM 427 O LYS A 25 -18.351 3.898 2.380 1.00 0.00 O ATOM 428 CB LYS A 25 -18.367 2.965 -0.929 1.00 0.00 C ATOM 429 CG LYS A 25 -19.177 1.925 -1.683 1.00 0.00 C ATOM 430 CD LYS A 25 -20.376 2.548 -2.379 1.00 0.00 C ATOM 431 CE LYS A 25 -20.699 1.835 -3.681 1.00 0.00 C ATOM 432 NZ LYS A 25 -21.504 2.688 -4.599 1.00 0.00 N ATOM 0 H LYS A 25 -17.912 5.397 0.233 1.00 0.00 H new ATOM 0 HA LYS A 25 -20.237 3.585 -0.062 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -17.955 3.679 -1.642 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -17.523 2.474 -0.445 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -18.543 1.433 -2.420 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -19.517 1.155 -0.990 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -21.242 2.510 -1.718 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -20.175 3.600 -2.580 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -19.772 1.545 -4.175 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -21.246 0.917 -3.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -21.702 2.164 -5.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -22.400 2.944 -4.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -20.972 3.552 -4.826 1.00 0.00 H new ATOM 446 N TYR A 26 -19.163 1.903 1.724 1.00 0.00 N ATOM 447 CA TYR A 26 -18.920 1.248 3.004 1.00 0.00 C ATOM 448 C TYR A 26 -18.312 -0.136 2.785 1.00 0.00 C ATOM 449 O TYR A 26 -18.949 -1.011 2.208 1.00 0.00 O ATOM 450 CB TYR A 26 -20.238 1.130 3.774 1.00 0.00 C ATOM 451 CG TYR A 26 -20.090 0.590 5.178 1.00 0.00 C ATOM 452 CD1 TYR A 26 -20.088 -0.777 5.418 1.00 0.00 C ATOM 453 CD2 TYR A 26 -19.966 1.447 6.261 1.00 0.00 C ATOM 454 CE1 TYR A 26 -19.963 -1.275 6.701 1.00 0.00 C ATOM 455 CE2 TYR A 26 -19.843 0.959 7.547 1.00 0.00 C ATOM 456 CZ TYR A 26 -19.842 -0.402 7.762 1.00 0.00 C ATOM 457 OH TYR A 26 -19.720 -0.894 9.042 1.00 0.00 O ATOM 0 H TYR A 26 -19.583 1.299 1.017 1.00 0.00 H new ATOM 0 HA TYR A 26 -18.216 1.845 3.584 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -20.707 2.113 3.822 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -20.914 0.482 3.217 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -20.186 -1.462 4.589 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -19.966 2.514 6.096 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -19.960 -2.341 6.872 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -19.748 1.640 8.380 1.00 0.00 H new ATOM 0 HH TYR A 26 -20.538 -1.375 9.287 1.00 0.00 H new ATOM 467 N VAL A 27 -17.073 -0.325 3.233 1.00 0.00 N ATOM 468 CA VAL A 27 -16.394 -1.609 3.056 1.00 0.00 C ATOM 469 C VAL A 27 -15.923 -2.193 4.374 1.00 0.00 C ATOM 470 O VAL A 27 -15.521 -1.466 5.282 1.00 0.00 O ATOM 471 CB VAL A 27 -15.160 -1.489 2.136 1.00 0.00 C ATOM 472 CG1 VAL A 27 -14.883 -2.816 1.446 1.00 0.00 C ATOM 473 CG2 VAL A 27 -15.348 -0.381 1.114 1.00 0.00 C ATOM 0 H VAL A 27 -16.523 0.385 3.716 1.00 0.00 H new ATOM 0 HA VAL A 27 -17.137 -2.265 2.603 1.00 0.00 H new ATOM 0 HB VAL A 27 -14.299 -1.232 2.753 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -14.010 -2.715 0.801 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -14.693 -3.584 2.196 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -15.747 -3.101 0.846 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -14.464 -0.318 0.479 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -16.222 -0.597 0.499 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -15.493 0.569 1.629 1.00 0.00 H new ATOM 483 N THR A 28 -15.933 -3.518 4.452 1.00 0.00 N ATOM 484 CA THR A 28 -15.458 -4.208 5.638 1.00 0.00 C ATOM 485 C THR A 28 -14.638 -5.435 5.263 1.00 0.00 C ATOM 486 O THR A 28 -15.175 -6.437 4.781 1.00 0.00 O ATOM 487 CB THR A 28 -16.605 -4.626 6.555 1.00 0.00 C ATOM 488 OG1 THR A 28 -17.360 -3.500 6.967 1.00 0.00 O ATOM 489 CG2 THR A 28 -16.119 -5.344 7.801 1.00 0.00 C ATOM 0 H THR A 28 -16.265 -4.132 3.708 1.00 0.00 H new ATOM 0 HA THR A 28 -14.827 -3.502 6.178 1.00 0.00 H new ATOM 0 HB THR A 28 -17.222 -5.308 5.970 1.00 0.00 H new ATOM 0 HG1 THR A 28 -18.177 -3.801 7.417 1.00 0.00 H new ATOM 0 HG21 THR A 28 -16.974 -5.620 8.419 1.00 0.00 H new ATOM 0 HG22 THR A 28 -15.574 -6.243 7.514 1.00 0.00 H new ATOM 0 HG23 THR A 28 -15.460 -4.685 8.367 1.00 0.00 H new ATOM 497 N LEU A 29 -13.345 -5.357 5.518 1.00 0.00 N ATOM 498 CA LEU A 29 -12.438 -6.453 5.257 1.00 0.00 C ATOM 499 C LEU A 29 -12.381 -7.332 6.493 1.00 0.00 C ATOM 500 O LEU A 29 -11.948 -6.882 7.553 1.00 0.00 O ATOM 501 CB LEU A 29 -11.041 -5.931 4.926 1.00 0.00 C ATOM 502 CG LEU A 29 -10.408 -6.535 3.678 1.00 0.00 C ATOM 503 CD1 LEU A 29 -10.281 -8.043 3.826 1.00 0.00 C ATOM 504 CD2 LEU A 29 -11.220 -6.186 2.442 1.00 0.00 C ATOM 0 H LEU A 29 -12.896 -4.530 5.912 1.00 0.00 H new ATOM 0 HA LEU A 29 -12.795 -7.025 4.401 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -11.093 -4.849 4.802 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -10.387 -6.123 5.776 1.00 0.00 H new ATOM 0 HG LEU A 29 -9.410 -6.113 3.560 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -9.827 -8.460 2.927 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -9.655 -8.273 4.688 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -11.270 -8.479 3.969 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -10.751 -6.627 1.562 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -12.232 -6.578 2.549 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -11.261 -5.103 2.327 1.00 0.00 H new ATOM 516 N SER A 30 -12.837 -8.566 6.362 1.00 0.00 N ATOM 517 CA SER A 30 -12.851 -9.487 7.489 1.00 0.00 C ATOM 518 C SER A 30 -11.744 -10.521 7.362 1.00 0.00 C ATOM 519 O SER A 30 -11.251 -10.789 6.266 1.00 0.00 O ATOM 520 CB SER A 30 -14.208 -10.184 7.588 1.00 0.00 C ATOM 521 OG SER A 30 -14.141 -11.313 8.443 1.00 0.00 O ATOM 0 H SER A 30 -13.201 -8.953 5.492 1.00 0.00 H new ATOM 0 HA SER A 30 -12.679 -8.910 8.398 1.00 0.00 H new ATOM 0 HB2 SER A 30 -14.954 -9.483 7.964 1.00 0.00 H new ATOM 0 HB3 SER A 30 -14.534 -10.495 6.595 1.00 0.00 H new ATOM 0 HG SER A 30 -15.022 -11.740 8.491 1.00 0.00 H new ATOM 527 N SER A 31 -11.364 -11.107 8.491 1.00 0.00 N ATOM 528 CA SER A 31 -10.317 -12.121 8.502 1.00 0.00 C ATOM 529 C SER A 31 -10.820 -13.447 7.921 1.00 0.00 C ATOM 530 O SER A 31 -10.080 -14.429 7.868 1.00 0.00 O ATOM 531 CB SER A 31 -9.799 -12.343 9.924 1.00 0.00 C ATOM 532 OG SER A 31 -8.455 -12.794 9.912 1.00 0.00 O ATOM 0 H SER A 31 -11.763 -10.899 9.406 1.00 0.00 H new ATOM 0 HA SER A 31 -9.501 -11.758 7.876 1.00 0.00 H new ATOM 0 HB2 SER A 31 -9.869 -11.414 10.489 1.00 0.00 H new ATOM 0 HB3 SER A 31 -10.427 -13.074 10.433 1.00 0.00 H new ATOM 0 HG SER A 31 -8.355 -13.508 9.248 1.00 0.00 H new ATOM 538 N ASN A 32 -12.082 -13.471 7.487 1.00 0.00 N ATOM 539 CA ASN A 32 -12.680 -14.672 6.913 1.00 0.00 C ATOM 540 C ASN A 32 -12.448 -14.745 5.410 1.00 0.00 C ATOM 541 O ASN A 32 -13.226 -15.359 4.681 1.00 0.00 O ATOM 542 CB ASN A 32 -14.180 -14.714 7.214 1.00 0.00 C ATOM 543 CG ASN A 32 -14.650 -16.098 7.619 1.00 0.00 C ATOM 544 OD1 ASN A 32 -14.394 -16.552 8.734 1.00 0.00 O ATOM 545 ND2 ASN A 32 -15.342 -16.778 6.711 1.00 0.00 N ATOM 0 H ASN A 32 -12.709 -12.668 7.524 1.00 0.00 H new ATOM 0 HA ASN A 32 -12.197 -15.535 7.372 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -14.407 -14.008 8.013 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -14.734 -14.388 6.333 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -15.684 -17.715 6.926 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -15.532 -16.363 5.799 1.00 0.00 H new ATOM 552 N GLY A 33 -11.376 -14.111 4.951 1.00 0.00 N ATOM 553 CA GLY A 33 -11.068 -14.113 3.535 1.00 0.00 C ATOM 554 C GLY A 33 -12.247 -13.655 2.706 1.00 0.00 C ATOM 555 O GLY A 33 -12.520 -14.203 1.638 1.00 0.00 O ATOM 0 H GLY A 33 -10.716 -13.596 5.534 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -10.215 -13.460 3.347 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -10.775 -15.117 3.228 1.00 0.00 H new ATOM 559 N PHE A 34 -12.955 -12.652 3.211 1.00 0.00 N ATOM 560 CA PHE A 34 -14.120 -12.122 2.522 1.00 0.00 C ATOM 561 C PHE A 34 -14.139 -10.600 2.560 1.00 0.00 C ATOM 562 O PHE A 34 -14.118 -9.994 3.629 1.00 0.00 O ATOM 563 CB PHE A 34 -15.399 -12.672 3.155 1.00 0.00 C ATOM 564 CG PHE A 34 -16.305 -13.337 2.166 1.00 0.00 C ATOM 565 CD1 PHE A 34 -15.842 -14.378 1.380 1.00 0.00 C ATOM 566 CD2 PHE A 34 -17.616 -12.920 2.020 1.00 0.00 C ATOM 567 CE1 PHE A 34 -16.671 -14.994 0.463 1.00 0.00 C ATOM 568 CE2 PHE A 34 -18.452 -13.532 1.106 1.00 0.00 C ATOM 569 CZ PHE A 34 -17.979 -14.570 0.326 1.00 0.00 C ATOM 0 H PHE A 34 -12.741 -12.191 4.095 1.00 0.00 H new ATOM 0 HA PHE A 34 -14.066 -12.436 1.480 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -15.133 -13.387 3.934 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -15.936 -11.857 3.640 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -14.820 -14.713 1.485 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -17.990 -12.108 2.626 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -16.298 -15.805 -0.145 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -19.474 -13.199 1.001 1.00 0.00 H new ATOM 0 HZ PHE A 34 -18.631 -15.049 -0.390 1.00 0.00 H new ATOM 579 N LEU A 35 -14.194 -9.990 1.383 1.00 0.00 N ATOM 580 CA LEU A 35 -14.236 -8.540 1.277 1.00 0.00 C ATOM 581 C LEU A 35 -15.661 -8.087 0.977 1.00 0.00 C ATOM 582 O LEU A 35 -16.224 -8.435 -0.059 1.00 0.00 O ATOM 583 CB LEU A 35 -13.271 -8.065 0.182 1.00 0.00 C ATOM 584 CG LEU A 35 -13.594 -6.703 -0.439 1.00 0.00 C ATOM 585 CD1 LEU A 35 -13.798 -5.649 0.640 1.00 0.00 C ATOM 586 CD2 LEU A 35 -12.489 -6.280 -1.397 1.00 0.00 C ATOM 0 H LEU A 35 -14.211 -10.479 0.488 1.00 0.00 H new ATOM 0 HA LEU A 35 -13.923 -8.099 2.223 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -12.266 -8.024 0.601 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -13.255 -8.812 -0.612 1.00 0.00 H new ATOM 0 HG LEU A 35 -14.523 -6.797 -1.001 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -14.026 -4.690 0.174 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -14.625 -5.945 1.286 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -12.889 -5.556 1.234 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -12.734 -5.310 -1.830 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -11.546 -6.208 -0.855 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.395 -7.019 -2.193 1.00 0.00 H new ATOM 598 N LEU A 36 -16.249 -7.326 1.894 1.00 0.00 N ATOM 599 CA LEU A 36 -17.618 -6.855 1.716 1.00 0.00 C ATOM 600 C LEU A 36 -17.671 -5.345 1.520 1.00 0.00 C ATOM 601 O LEU A 36 -16.890 -4.602 2.113 1.00 0.00 O ATOM 602 CB LEU A 36 -18.477 -7.253 2.918 1.00 0.00 C ATOM 603 CG LEU A 36 -18.125 -8.603 3.550 1.00 0.00 C ATOM 604 CD1 LEU A 36 -17.497 -8.404 4.921 1.00 0.00 C ATOM 605 CD2 LEU A 36 -19.358 -9.491 3.646 1.00 0.00 C ATOM 0 H LEU A 36 -15.804 -7.024 2.761 1.00 0.00 H new ATOM 0 HA LEU A 36 -18.013 -7.326 0.816 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -18.389 -6.479 3.680 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -19.521 -7.276 2.607 1.00 0.00 H new ATOM 0 HG LEU A 36 -17.397 -9.101 2.909 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -17.254 -9.374 5.354 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -16.587 -7.812 4.822 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -18.200 -7.882 5.571 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -19.085 -10.445 4.098 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -20.112 -9.001 4.261 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -19.760 -9.664 2.648 1.00 0.00 H new ATOM 617 N TYR A 37 -18.607 -4.902 0.687 1.00 0.00 N ATOM 618 CA TYR A 37 -18.779 -3.481 0.417 1.00 0.00 C ATOM 619 C TYR A 37 -20.222 -3.186 0.007 1.00 0.00 C ATOM 620 O TYR A 37 -20.793 -3.875 -0.840 1.00 0.00 O ATOM 621 CB TYR A 37 -17.779 -3.013 -0.654 1.00 0.00 C ATOM 622 CG TYR A 37 -18.352 -2.860 -2.048 1.00 0.00 C ATOM 623 CD1 TYR A 37 -18.745 -3.969 -2.786 1.00 0.00 C ATOM 624 CD2 TYR A 37 -18.487 -1.604 -2.628 1.00 0.00 C ATOM 625 CE1 TYR A 37 -19.258 -3.832 -4.062 1.00 0.00 C ATOM 626 CE2 TYR A 37 -19.000 -1.458 -3.902 1.00 0.00 C ATOM 627 CZ TYR A 37 -19.384 -2.574 -4.615 1.00 0.00 C ATOM 628 OH TYR A 37 -19.896 -2.433 -5.885 1.00 0.00 O ATOM 0 H TYR A 37 -19.258 -5.508 0.187 1.00 0.00 H new ATOM 0 HA TYR A 37 -18.573 -2.921 1.329 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -17.360 -2.056 -0.344 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -16.954 -3.724 -0.694 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -18.648 -4.955 -2.356 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -18.186 -0.728 -2.073 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -19.559 -4.704 -4.623 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -19.100 -0.475 -4.338 1.00 0.00 H new ATOM 0 HH TYR A 37 -19.919 -1.483 -6.125 1.00 0.00 H new ATOM 638 N HIS A 38 -20.806 -2.166 0.626 1.00 0.00 N ATOM 639 CA HIS A 38 -22.184 -1.783 0.344 1.00 0.00 C ATOM 640 C HIS A 38 -22.256 -0.339 -0.151 1.00 0.00 C ATOM 641 O HIS A 38 -21.337 0.449 0.072 1.00 0.00 O ATOM 642 CB HIS A 38 -23.053 -1.942 1.595 1.00 0.00 C ATOM 643 CG HIS A 38 -22.659 -3.090 2.476 1.00 0.00 C ATOM 644 ND1 HIS A 38 -21.407 -3.216 3.040 1.00 0.00 N ATOM 645 CD2 HIS A 38 -23.368 -4.165 2.896 1.00 0.00 C ATOM 646 CE1 HIS A 38 -21.361 -4.319 3.766 1.00 0.00 C ATOM 647 NE2 HIS A 38 -22.537 -4.913 3.696 1.00 0.00 N ATOM 0 H HIS A 38 -20.345 -1.588 1.328 1.00 0.00 H new ATOM 0 HA HIS A 38 -22.561 -2.442 -0.438 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -23.006 -1.021 2.175 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -24.091 -2.073 1.288 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -24.394 -4.392 2.649 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -20.506 -4.674 4.322 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -22.789 -5.786 4.160 1.00 0.00 H new ATOM 656 N PRO A 39 -23.357 0.026 -0.829 1.00 0.00 N ATOM 657 CA PRO A 39 -23.551 1.381 -1.356 1.00 0.00 C ATOM 658 C PRO A 39 -23.284 2.463 -0.312 1.00 0.00 C ATOM 659 O PRO A 39 -22.866 3.571 -0.649 1.00 0.00 O ATOM 660 CB PRO A 39 -25.023 1.389 -1.773 1.00 0.00 C ATOM 661 CG PRO A 39 -25.330 -0.034 -2.086 1.00 0.00 C ATOM 662 CD PRO A 39 -24.500 -0.856 -1.137 1.00 0.00 C ATOM 0 HA PRO A 39 -22.860 1.603 -2.169 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -25.660 1.766 -0.973 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -25.187 2.030 -2.639 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -26.392 -0.242 -1.956 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -25.084 -0.267 -3.122 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -25.059 -1.118 -0.238 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -24.175 -1.791 -1.594 1.00 0.00 H new ATOM 670 N SER A 40 -23.531 2.139 0.954 1.00 0.00 N ATOM 671 CA SER A 40 -23.315 3.092 2.040 1.00 0.00 C ATOM 672 C SER A 40 -23.591 2.450 3.398 1.00 0.00 C ATOM 673 O SER A 40 -23.852 1.250 3.487 1.00 0.00 O ATOM 674 CB SER A 40 -24.210 4.319 1.855 1.00 0.00 C ATOM 675 OG SER A 40 -23.590 5.485 2.368 1.00 0.00 O ATOM 0 H SER A 40 -23.879 1.228 1.253 1.00 0.00 H new ATOM 0 HA SER A 40 -22.270 3.402 2.012 1.00 0.00 H new ATOM 0 HB2 SER A 40 -24.430 4.456 0.796 1.00 0.00 H new ATOM 0 HB3 SER A 40 -25.162 4.158 2.360 1.00 0.00 H new ATOM 0 HG SER A 40 -24.182 6.255 2.236 1.00 0.00 H new ATOM 681 N ILE A 41 -23.532 3.260 4.453 1.00 0.00 N ATOM 682 CA ILE A 41 -23.775 2.773 5.806 1.00 0.00 C ATOM 683 C ILE A 41 -25.170 2.167 5.927 1.00 0.00 C ATOM 684 O ILE A 41 -25.331 1.066 6.451 1.00 0.00 O ATOM 685 CB ILE A 41 -23.598 3.899 6.850 1.00 0.00 C ATOM 686 CG1 ILE A 41 -22.124 4.293 6.949 1.00 0.00 C ATOM 687 CG2 ILE A 41 -24.124 3.468 8.213 1.00 0.00 C ATOM 688 CD1 ILE A 41 -21.682 5.263 5.877 1.00 0.00 C ATOM 0 H ILE A 41 -23.318 4.256 4.395 1.00 0.00 H new ATOM 0 HA ILE A 41 -23.037 1.997 6.008 1.00 0.00 H new ATOM 0 HB ILE A 41 -24.176 4.764 6.524 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -21.941 4.738 7.927 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -21.511 3.393 6.888 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -23.987 4.279 8.929 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -25.184 3.228 8.135 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -23.577 2.588 8.552 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -20.626 5.497 6.011 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -21.833 4.814 4.895 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -22.268 6.179 5.951 1.00 0.00 H new ATOM 700 N ASN A 42 -26.176 2.882 5.429 1.00 0.00 N ATOM 701 CA ASN A 42 -27.552 2.393 5.476 1.00 0.00 C ATOM 702 C ASN A 42 -27.630 0.981 4.898 1.00 0.00 C ATOM 703 O ASN A 42 -28.486 0.182 5.273 1.00 0.00 O ATOM 704 CB ASN A 42 -28.474 3.329 4.693 1.00 0.00 C ATOM 705 CG ASN A 42 -28.260 4.786 5.052 1.00 0.00 C ATOM 706 OD1 ASN A 42 -27.550 5.104 6.007 1.00 0.00 O ATOM 707 ND2 ASN A 42 -28.876 5.682 4.288 1.00 0.00 N ATOM 0 H ASN A 42 -26.066 3.796 4.991 1.00 0.00 H new ATOM 0 HA ASN A 42 -27.877 2.368 6.516 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -28.304 3.192 3.625 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -29.512 3.059 4.888 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -28.770 6.678 4.483 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -29.455 5.374 3.507 1.00 0.00 H new ATOM 714 N ASP A 43 -26.719 0.675 3.981 1.00 0.00 N ATOM 715 CA ASP A 43 -26.678 -0.638 3.359 1.00 0.00 C ATOM 716 C ASP A 43 -26.060 -1.666 4.305 1.00 0.00 C ATOM 717 O ASP A 43 -26.530 -2.798 4.392 1.00 0.00 O ATOM 718 CB ASP A 43 -25.889 -0.578 2.052 1.00 0.00 C ATOM 719 CG ASP A 43 -26.384 0.521 1.129 1.00 0.00 C ATOM 720 OD1 ASP A 43 -26.073 1.701 1.394 1.00 0.00 O ATOM 721 OD2 ASP A 43 -27.083 0.201 0.146 1.00 0.00 O ATOM 0 H ASP A 43 -26.000 1.320 3.654 1.00 0.00 H new ATOM 0 HA ASP A 43 -27.700 -0.947 3.139 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -24.834 -0.415 2.274 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -25.962 -1.538 1.542 1.00 0.00 H new ATOM 726 N TYR A 44 -25.011 -1.263 5.015 1.00 0.00 N ATOM 727 CA TYR A 44 -24.338 -2.150 5.963 1.00 0.00 C ATOM 728 C TYR A 44 -25.234 -2.406 7.172 1.00 0.00 C ATOM 729 O TYR A 44 -25.471 -3.551 7.559 1.00 0.00 O ATOM 730 CB TYR A 44 -22.999 -1.533 6.399 1.00 0.00 C ATOM 731 CG TYR A 44 -22.687 -1.686 7.874 1.00 0.00 C ATOM 732 CD1 TYR A 44 -22.155 -2.869 8.372 1.00 0.00 C ATOM 733 CD2 TYR A 44 -22.923 -0.647 8.766 1.00 0.00 C ATOM 734 CE1 TYR A 44 -21.868 -3.012 9.717 1.00 0.00 C ATOM 735 CE2 TYR A 44 -22.638 -0.782 10.111 1.00 0.00 C ATOM 736 CZ TYR A 44 -22.111 -1.966 10.582 1.00 0.00 C ATOM 737 OH TYR A 44 -21.825 -2.105 11.920 1.00 0.00 O ATOM 0 H TYR A 44 -24.607 -0.328 4.953 1.00 0.00 H new ATOM 0 HA TYR A 44 -24.138 -3.105 5.477 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -22.197 -1.992 5.821 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -23.004 -0.472 6.150 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -21.963 -3.690 7.698 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -23.336 0.282 8.402 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -21.455 -3.938 10.088 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -22.827 0.036 10.790 1.00 0.00 H new ATOM 0 HH TYR A 44 -22.054 -1.277 12.391 1.00 0.00 H new ATOM 747 N ILE A 45 -25.727 -1.323 7.754 1.00 0.00 N ATOM 748 CA ILE A 45 -26.603 -1.389 8.916 1.00 0.00 C ATOM 749 C ILE A 45 -27.859 -2.198 8.611 1.00 0.00 C ATOM 750 O ILE A 45 -28.131 -3.223 9.237 1.00 0.00 O ATOM 751 CB ILE A 45 -27.013 0.040 9.353 1.00 0.00 C ATOM 752 CG1 ILE A 45 -25.896 0.685 10.172 1.00 0.00 C ATOM 753 CG2 ILE A 45 -28.325 0.043 10.136 1.00 0.00 C ATOM 754 CD1 ILE A 45 -26.032 2.187 10.292 1.00 0.00 C ATOM 0 H ILE A 45 -25.532 -0.374 7.435 1.00 0.00 H new ATOM 0 HA ILE A 45 -26.056 -1.880 9.721 1.00 0.00 H new ATOM 0 HB ILE A 45 -27.175 0.627 8.449 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -25.888 0.247 11.170 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -24.936 0.450 9.713 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -28.575 1.064 10.423 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -29.121 -0.364 9.513 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -28.216 -0.569 11.031 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -25.207 2.581 10.886 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -26.010 2.635 9.298 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -26.977 2.429 10.779 1.00 0.00 H new ATOM 766 N HIS A 46 -28.625 -1.695 7.662 1.00 0.00 N ATOM 767 CA HIS A 46 -29.879 -2.308 7.254 1.00 0.00 C ATOM 768 C HIS A 46 -29.663 -3.583 6.440 1.00 0.00 C ATOM 769 O HIS A 46 -30.531 -4.453 6.401 1.00 0.00 O ATOM 770 CB HIS A 46 -30.701 -1.276 6.484 1.00 0.00 C ATOM 771 CG HIS A 46 -30.761 0.043 7.202 1.00 0.00 C ATOM 772 ND1 HIS A 46 -31.894 0.519 7.822 1.00 0.00 N ATOM 773 CD2 HIS A 46 -29.797 0.970 7.437 1.00 0.00 C ATOM 774 CE1 HIS A 46 -31.619 1.673 8.406 1.00 0.00 C ATOM 775 NE2 HIS A 46 -30.358 1.966 8.183 1.00 0.00 N ATOM 0 H HIS A 46 -28.395 -0.844 7.148 1.00 0.00 H new ATOM 0 HA HIS A 46 -30.427 -2.617 8.144 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -30.267 -1.131 5.495 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -31.712 -1.655 6.336 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -28.773 0.927 7.096 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -32.315 2.274 8.972 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -29.876 2.802 8.514 1.00 0.00 H new ATOM 784 N SER A 47 -28.501 -3.692 5.796 1.00 0.00 N ATOM 785 CA SER A 47 -28.174 -4.870 4.990 1.00 0.00 C ATOM 786 C SER A 47 -28.898 -4.838 3.648 1.00 0.00 C ATOM 787 O SER A 47 -29.856 -5.580 3.428 1.00 0.00 O ATOM 788 CB SER A 47 -28.527 -6.157 5.743 1.00 0.00 C ATOM 789 OG SER A 47 -28.260 -6.027 7.128 1.00 0.00 O ATOM 0 H SER A 47 -27.771 -2.980 5.816 1.00 0.00 H new ATOM 0 HA SER A 47 -27.100 -4.853 4.803 1.00 0.00 H new ATOM 0 HB2 SER A 47 -29.581 -6.392 5.593 1.00 0.00 H new ATOM 0 HB3 SER A 47 -27.953 -6.989 5.335 1.00 0.00 H new ATOM 0 HG SER A 47 -28.495 -6.861 7.586 1.00 0.00 H new ATOM 795 N THR A 48 -28.428 -3.977 2.751 1.00 0.00 N ATOM 796 CA THR A 48 -29.024 -3.852 1.427 1.00 0.00 C ATOM 797 C THR A 48 -27.998 -4.150 0.337 1.00 0.00 C ATOM 798 O THR A 48 -26.980 -3.468 0.225 1.00 0.00 O ATOM 799 CB THR A 48 -29.603 -2.451 1.231 1.00 0.00 C ATOM 800 OG1 THR A 48 -28.572 -1.482 1.190 1.00 0.00 O ATOM 801 CG2 THR A 48 -30.571 -2.048 2.321 1.00 0.00 C ATOM 0 H THR A 48 -27.636 -3.356 2.918 1.00 0.00 H new ATOM 0 HA THR A 48 -29.830 -4.582 1.351 1.00 0.00 H new ATOM 0 HB THR A 48 -30.142 -2.491 0.285 1.00 0.00 H new ATOM 0 HG1 THR A 48 -28.514 -1.104 0.288 1.00 0.00 H new ATOM 0 HG21 THR A 48 -30.945 -1.044 2.122 1.00 0.00 H new ATOM 0 HG22 THR A 48 -31.406 -2.749 2.343 1.00 0.00 H new ATOM 0 HG23 THR A 48 -30.061 -2.061 3.284 1.00 0.00 H new ATOM 809 N HIS A 49 -28.275 -5.181 -0.458 1.00 0.00 N ATOM 810 CA HIS A 49 -27.388 -5.592 -1.545 1.00 0.00 C ATOM 811 C HIS A 49 -26.202 -6.374 -0.999 1.00 0.00 C ATOM 812 O HIS A 49 -25.993 -7.537 -1.346 1.00 0.00 O ATOM 813 CB HIS A 49 -26.896 -4.377 -2.337 1.00 0.00 C ATOM 814 CG HIS A 49 -26.378 -4.721 -3.699 1.00 0.00 C ATOM 815 ND1 HIS A 49 -26.358 -3.823 -4.746 1.00 0.00 N ATOM 816 CD2 HIS A 49 -25.857 -5.872 -4.185 1.00 0.00 C ATOM 817 CE1 HIS A 49 -25.848 -4.407 -5.817 1.00 0.00 C ATOM 818 NE2 HIS A 49 -25.536 -5.651 -5.502 1.00 0.00 N ATOM 0 H HIS A 49 -29.115 -5.752 -0.368 1.00 0.00 H new ATOM 0 HA HIS A 49 -27.955 -6.236 -2.217 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -27.714 -3.664 -2.438 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -26.107 -3.880 -1.772 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -25.719 -6.793 -3.638 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -25.710 -3.946 -6.784 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -25.123 -6.337 -6.134 1.00 0.00 H new ATOM 827 N GLY A 50 -25.433 -5.723 -0.139 1.00 0.00 N ATOM 828 CA GLY A 50 -24.272 -6.354 0.464 1.00 0.00 C ATOM 829 C GLY A 50 -23.420 -7.110 -0.535 1.00 0.00 C ATOM 830 O GLY A 50 -23.626 -8.304 -0.759 1.00 0.00 O ATOM 0 H GLY A 50 -25.593 -4.760 0.156 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -23.662 -5.591 0.949 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -24.603 -7.041 1.243 1.00 0.00 H new ATOM 834 N LYS A 51 -22.460 -6.418 -1.137 1.00 0.00 N ATOM 835 CA LYS A 51 -21.574 -7.037 -2.115 1.00 0.00 C ATOM 836 C LYS A 51 -20.372 -7.680 -1.428 1.00 0.00 C ATOM 837 O LYS A 51 -19.717 -7.060 -0.591 1.00 0.00 O ATOM 838 CB LYS A 51 -21.103 -6.000 -3.138 1.00 0.00 C ATOM 839 CG LYS A 51 -21.719 -6.182 -4.515 1.00 0.00 C ATOM 840 CD LYS A 51 -20.899 -7.137 -5.371 1.00 0.00 C ATOM 841 CE LYS A 51 -21.788 -8.100 -6.145 1.00 0.00 C ATOM 842 NZ LYS A 51 -21.495 -9.520 -5.806 1.00 0.00 N ATOM 0 H LYS A 51 -22.275 -5.430 -0.965 1.00 0.00 H new ATOM 0 HA LYS A 51 -22.132 -7.817 -2.634 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -21.344 -5.003 -2.770 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -20.018 -6.054 -3.224 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -22.735 -6.564 -4.413 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -21.791 -5.215 -5.013 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -20.286 -6.566 -6.069 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -20.217 -7.702 -4.736 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -22.834 -7.883 -5.928 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -21.646 -7.945 -7.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -22.121 -10.144 -6.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -20.504 -9.735 -6.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -21.655 -9.674 -4.790 1.00 0.00 H new ATOM 856 N GLU A 52 -20.090 -8.930 -1.786 1.00 0.00 N ATOM 857 CA GLU A 52 -18.968 -9.658 -1.201 1.00 0.00 C ATOM 858 C GLU A 52 -18.104 -10.288 -2.285 1.00 0.00 C ATOM 859 O GLU A 52 -18.609 -10.918 -3.215 1.00 0.00 O ATOM 860 CB GLU A 52 -19.473 -10.740 -0.242 1.00 0.00 C ATOM 861 CG GLU A 52 -20.656 -10.299 0.607 1.00 0.00 C ATOM 862 CD GLU A 52 -21.305 -11.454 1.344 1.00 0.00 C ATOM 863 OE1 GLU A 52 -22.038 -12.234 0.698 1.00 0.00 O ATOM 864 OE2 GLU A 52 -21.083 -11.579 2.566 1.00 0.00 O ATOM 0 H GLU A 52 -20.622 -9.459 -2.477 1.00 0.00 H new ATOM 0 HA GLU A 52 -18.360 -8.946 -0.644 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -19.758 -11.620 -0.819 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -18.657 -11.041 0.415 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -20.323 -9.553 1.329 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -21.397 -9.817 -0.031 1.00 0.00 H new ATOM 871 N MET A 53 -16.796 -10.111 -2.153 1.00 0.00 N ATOM 872 CA MET A 53 -15.845 -10.652 -3.109 1.00 0.00 C ATOM 873 C MET A 53 -14.951 -11.690 -2.436 1.00 0.00 C ATOM 874 O MET A 53 -14.233 -11.381 -1.484 1.00 0.00 O ATOM 875 CB MET A 53 -15.004 -9.517 -3.706 1.00 0.00 C ATOM 876 CG MET A 53 -13.617 -9.940 -4.172 1.00 0.00 C ATOM 877 SD MET A 53 -13.080 -9.078 -5.661 1.00 0.00 S ATOM 878 CE MET A 53 -13.876 -7.494 -5.431 1.00 0.00 C ATOM 0 H MET A 53 -16.369 -9.592 -1.386 1.00 0.00 H new ATOM 0 HA MET A 53 -16.390 -11.143 -3.915 1.00 0.00 H new ATOM 0 HB2 MET A 53 -15.543 -9.088 -4.551 1.00 0.00 H new ATOM 0 HB3 MET A 53 -14.899 -8.728 -2.961 1.00 0.00 H new ATOM 0 HG2 MET A 53 -12.899 -9.755 -3.373 1.00 0.00 H new ATOM 0 HG3 MET A 53 -13.615 -11.014 -4.360 1.00 0.00 H new ATOM 0 HE1 MET A 53 -13.370 -6.741 -6.035 1.00 0.00 H new ATOM 0 HE2 MET A 53 -14.920 -7.563 -5.738 1.00 0.00 H new ATOM 0 HE3 MET A 53 -13.825 -7.210 -4.380 1.00 0.00 H new ATOM 888 N ASP A 54 -14.996 -12.920 -2.938 1.00 0.00 N ATOM 889 CA ASP A 54 -14.183 -13.996 -2.386 1.00 0.00 C ATOM 890 C ASP A 54 -12.703 -13.651 -2.488 1.00 0.00 C ATOM 891 O ASP A 54 -12.200 -13.350 -3.571 1.00 0.00 O ATOM 892 CB ASP A 54 -14.470 -15.310 -3.115 1.00 0.00 C ATOM 893 CG ASP A 54 -14.447 -16.505 -2.184 1.00 0.00 C ATOM 894 OD1 ASP A 54 -13.469 -16.644 -1.418 1.00 0.00 O ATOM 895 OD2 ASP A 54 -15.408 -17.303 -2.219 1.00 0.00 O ATOM 0 H ASP A 54 -15.585 -13.195 -3.724 1.00 0.00 H new ATOM 0 HA ASP A 54 -14.441 -14.117 -1.334 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -15.445 -15.248 -3.598 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -13.732 -15.453 -3.904 1.00 0.00 H new ATOM 900 N LEU A 55 -12.011 -13.687 -1.356 1.00 0.00 N ATOM 901 CA LEU A 55 -10.590 -13.368 -1.321 1.00 0.00 C ATOM 902 C LEU A 55 -9.732 -14.620 -1.485 1.00 0.00 C ATOM 903 O LEU A 55 -8.724 -14.783 -0.801 1.00 0.00 O ATOM 904 CB LEU A 55 -10.241 -12.667 -0.006 1.00 0.00 C ATOM 905 CG LEU A 55 -10.487 -11.158 0.012 1.00 0.00 C ATOM 906 CD1 LEU A 55 -11.188 -10.746 1.296 1.00 0.00 C ATOM 907 CD2 LEU A 55 -9.178 -10.402 -0.145 1.00 0.00 C ATOM 0 H LEU A 55 -12.411 -13.934 -0.451 1.00 0.00 H new ATOM 0 HA LEU A 55 -10.377 -12.701 -2.156 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -10.822 -13.123 0.796 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -9.190 -12.850 0.217 1.00 0.00 H new ATOM 0 HG LEU A 55 -11.133 -10.906 -0.829 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -11.354 -9.669 1.290 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -12.146 -11.261 1.369 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -10.567 -11.013 2.151 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -9.373 -9.330 -0.130 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.508 -10.661 0.675 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -8.713 -10.673 -1.093 1.00 0.00 H new ATOM 919 N LEU A 56 -10.132 -15.501 -2.394 1.00 0.00 N ATOM 920 CA LEU A 56 -9.384 -16.729 -2.637 1.00 0.00 C ATOM 921 C LEU A 56 -8.224 -16.477 -3.595 1.00 0.00 C ATOM 922 O LEU A 56 -7.062 -16.660 -3.238 1.00 0.00 O ATOM 923 CB LEU A 56 -10.305 -17.813 -3.201 1.00 0.00 C ATOM 924 CG LEU A 56 -9.914 -19.246 -2.840 1.00 0.00 C ATOM 925 CD1 LEU A 56 -10.023 -19.469 -1.339 1.00 0.00 C ATOM 926 CD2 LEU A 56 -10.785 -20.241 -3.593 1.00 0.00 C ATOM 0 H LEU A 56 -10.965 -15.390 -2.972 1.00 0.00 H new ATOM 0 HA LEU A 56 -8.978 -17.072 -1.685 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -11.319 -17.628 -2.845 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -10.327 -17.721 -4.287 1.00 0.00 H new ATOM 0 HG LEU A 56 -8.877 -19.404 -3.135 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -9.741 -20.495 -1.102 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -9.357 -18.780 -0.819 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -11.050 -19.292 -1.018 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -10.493 -21.256 -3.324 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -11.831 -20.082 -3.329 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -10.656 -20.098 -4.666 1.00 0.00 H new ATOM 938 N ARG A 57 -8.551 -16.053 -4.811 1.00 0.00 N ATOM 939 CA ARG A 57 -7.536 -15.773 -5.819 1.00 0.00 C ATOM 940 C ARG A 57 -7.687 -14.354 -6.356 1.00 0.00 C ATOM 941 O ARG A 57 -7.470 -14.101 -7.541 1.00 0.00 O ATOM 942 CB ARG A 57 -7.633 -16.781 -6.965 1.00 0.00 C ATOM 943 CG ARG A 57 -7.058 -18.146 -6.625 1.00 0.00 C ATOM 944 CD ARG A 57 -7.652 -19.237 -7.502 1.00 0.00 C ATOM 945 NE ARG A 57 -7.117 -20.556 -7.173 1.00 0.00 N ATOM 946 CZ ARG A 57 -7.315 -21.642 -7.917 1.00 0.00 C ATOM 947 NH1 ARG A 57 -8.034 -21.571 -9.029 1.00 0.00 N ATOM 948 NH2 ARG A 57 -6.792 -22.804 -7.546 1.00 0.00 N ATOM 0 H ARG A 57 -9.510 -15.896 -5.122 1.00 0.00 H new ATOM 0 HA ARG A 57 -6.556 -15.864 -5.351 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -8.679 -16.897 -7.248 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -7.110 -16.382 -7.834 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -5.975 -18.127 -6.750 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -7.254 -18.373 -5.577 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -8.736 -19.246 -7.385 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -7.446 -19.013 -8.549 1.00 0.00 H new ATOM 0 HE ARG A 57 -6.559 -20.650 -6.324 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -8.439 -20.681 -9.319 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -8.182 -22.407 -9.595 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -6.239 -22.865 -6.691 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -6.943 -23.636 -8.116 1.00 0.00 H new ATOM 962 N THR A 58 -8.061 -13.432 -5.475 1.00 0.00 N ATOM 963 CA THR A 58 -8.243 -12.038 -5.861 1.00 0.00 C ATOM 964 C THR A 58 -6.897 -11.346 -6.044 1.00 0.00 C ATOM 965 O THR A 58 -5.871 -11.817 -5.554 1.00 0.00 O ATOM 966 CB THR A 58 -9.065 -11.295 -4.805 1.00 0.00 C ATOM 967 OG1 THR A 58 -8.887 -11.880 -3.530 1.00 0.00 O ATOM 968 CG2 THR A 58 -10.548 -11.280 -5.098 1.00 0.00 C ATOM 0 H THR A 58 -8.244 -13.625 -4.490 1.00 0.00 H new ATOM 0 HA THR A 58 -8.778 -12.019 -6.810 1.00 0.00 H new ATOM 0 HB THR A 58 -8.698 -10.269 -4.826 1.00 0.00 H new ATOM 0 HG1 THR A 58 -9.393 -11.371 -2.863 1.00 0.00 H new ATOM 0 HG21 THR A 58 -11.069 -10.737 -4.309 1.00 0.00 H new ATOM 0 HG22 THR A 58 -10.725 -10.789 -6.055 1.00 0.00 H new ATOM 0 HG23 THR A 58 -10.921 -12.303 -5.141 1.00 0.00 H new ATOM 976 N THR A 59 -6.913 -10.221 -6.749 1.00 0.00 N ATOM 977 CA THR A 59 -5.699 -9.456 -6.995 1.00 0.00 C ATOM 978 C THR A 59 -5.914 -7.987 -6.648 1.00 0.00 C ATOM 979 O THR A 59 -7.030 -7.478 -6.726 1.00 0.00 O ATOM 980 CB THR A 59 -5.272 -9.592 -8.457 1.00 0.00 C ATOM 981 OG1 THR A 59 -6.353 -10.040 -9.257 1.00 0.00 O ATOM 982 CG2 THR A 59 -4.123 -10.554 -8.659 1.00 0.00 C ATOM 0 H THR A 59 -7.755 -9.819 -7.160 1.00 0.00 H new ATOM 0 HA THR A 59 -4.908 -9.853 -6.359 1.00 0.00 H new ATOM 0 HB THR A 59 -4.946 -8.595 -8.755 1.00 0.00 H new ATOM 0 HG1 THR A 59 -6.338 -9.573 -10.118 1.00 0.00 H new ATOM 0 HG21 THR A 59 -3.871 -10.603 -9.718 1.00 0.00 H new ATOM 0 HG22 THR A 59 -3.256 -10.209 -8.095 1.00 0.00 H new ATOM 0 HG23 THR A 59 -4.412 -11.545 -8.309 1.00 0.00 H new ATOM 990 N VAL A 60 -4.837 -7.313 -6.263 1.00 0.00 N ATOM 991 CA VAL A 60 -4.911 -5.902 -5.906 1.00 0.00 C ATOM 992 C VAL A 60 -4.019 -5.063 -6.813 1.00 0.00 C ATOM 993 O VAL A 60 -2.831 -5.351 -6.966 1.00 0.00 O ATOM 994 CB VAL A 60 -4.501 -5.668 -4.440 1.00 0.00 C ATOM 995 CG1 VAL A 60 -5.608 -6.116 -3.498 1.00 0.00 C ATOM 996 CG2 VAL A 60 -3.200 -6.391 -4.128 1.00 0.00 C ATOM 0 H VAL A 60 -3.904 -7.720 -6.190 1.00 0.00 H new ATOM 0 HA VAL A 60 -5.949 -5.596 -6.035 1.00 0.00 H new ATOM 0 HB VAL A 60 -4.341 -4.600 -4.292 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -5.300 -5.943 -2.467 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -6.515 -5.548 -3.706 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -5.803 -7.178 -3.645 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.926 -6.214 -3.088 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -3.330 -7.461 -4.292 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -2.411 -6.017 -4.780 1.00 0.00 H new ATOM 1006 N LYS A 61 -4.596 -4.030 -7.418 1.00 0.00 N ATOM 1007 CA LYS A 61 -3.840 -3.159 -8.314 1.00 0.00 C ATOM 1008 C LYS A 61 -4.345 -1.723 -8.250 1.00 0.00 C ATOM 1009 O LYS A 61 -5.438 -1.460 -7.750 1.00 0.00 O ATOM 1010 CB LYS A 61 -3.926 -3.678 -9.751 1.00 0.00 C ATOM 1011 CG LYS A 61 -5.349 -3.802 -10.269 1.00 0.00 C ATOM 1012 CD LYS A 61 -5.444 -4.829 -11.386 1.00 0.00 C ATOM 1013 CE LYS A 61 -5.336 -6.249 -10.853 1.00 0.00 C ATOM 1014 NZ LYS A 61 -4.222 -7.000 -11.495 1.00 0.00 N ATOM 0 H LYS A 61 -5.577 -3.776 -7.306 1.00 0.00 H new ATOM 0 HA LYS A 61 -2.800 -3.167 -7.988 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -3.368 -3.008 -10.404 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -3.442 -4.653 -9.806 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -6.012 -4.088 -9.452 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -5.691 -2.833 -10.633 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -6.391 -4.708 -11.912 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -4.651 -4.651 -12.112 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -5.181 -6.221 -9.774 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -6.275 -6.774 -11.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -4.182 -7.963 -11.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -4.383 -7.049 -12.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -3.322 -6.513 -11.308 1.00 0.00 H new ATOM 1028 N VAL A 62 -3.540 -0.799 -8.763 1.00 0.00 N ATOM 1029 CA VAL A 62 -3.901 0.613 -8.770 1.00 0.00 C ATOM 1030 C VAL A 62 -4.060 1.129 -10.196 1.00 0.00 C ATOM 1031 O VAL A 62 -3.471 0.585 -11.130 1.00 0.00 O ATOM 1032 CB VAL A 62 -2.842 1.471 -8.048 1.00 0.00 C ATOM 1033 CG1 VAL A 62 -2.735 1.069 -6.588 1.00 0.00 C ATOM 1034 CG2 VAL A 62 -1.493 1.355 -8.745 1.00 0.00 C ATOM 0 H VAL A 62 -2.632 -1.003 -9.180 1.00 0.00 H new ATOM 0 HA VAL A 62 -4.850 0.698 -8.241 1.00 0.00 H new ATOM 0 HB VAL A 62 -3.156 2.514 -8.090 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -1.983 1.685 -6.095 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -3.699 1.213 -6.100 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -2.446 0.020 -6.520 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -0.759 1.967 -8.221 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -1.168 0.314 -8.739 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -1.585 1.700 -9.775 1.00 0.00 H new ATOM 1044 N PRO A 63 -4.853 2.196 -10.384 1.00 0.00 N ATOM 1045 CA PRO A 63 -5.078 2.788 -11.703 1.00 0.00 C ATOM 1046 C PRO A 63 -3.772 3.197 -12.377 1.00 0.00 C ATOM 1047 O PRO A 63 -2.691 2.768 -11.972 1.00 0.00 O ATOM 1048 CB PRO A 63 -5.948 4.022 -11.415 1.00 0.00 C ATOM 1049 CG PRO A 63 -5.825 4.258 -9.947 1.00 0.00 C ATOM 1050 CD PRO A 63 -5.589 2.912 -9.329 1.00 0.00 C ATOM 0 HA PRO A 63 -5.548 2.082 -12.388 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -5.604 4.887 -11.982 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -6.986 3.847 -11.699 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -5.001 4.937 -9.729 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -6.730 4.717 -9.549 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -5.009 2.985 -8.409 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -6.524 2.412 -9.077 1.00 0.00 H new ATOM 1058 N GLY A 64 -3.879 4.030 -13.405 1.00 0.00 N ATOM 1059 CA GLY A 64 -2.702 4.484 -14.121 1.00 0.00 C ATOM 1060 C GLY A 64 -2.189 5.815 -13.608 1.00 0.00 C ATOM 1061 O GLY A 64 -2.139 6.796 -14.350 1.00 0.00 O ATOM 0 H GLY A 64 -4.762 4.400 -13.756 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -1.915 3.736 -14.031 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -2.938 4.573 -15.182 1.00 0.00 H new ATOM 1065 N LYS A 65 -1.806 5.846 -12.338 1.00 0.00 N ATOM 1066 CA LYS A 65 -1.294 7.064 -11.723 1.00 0.00 C ATOM 1067 C LYS A 65 0.111 6.845 -11.169 1.00 0.00 C ATOM 1068 O LYS A 65 0.606 5.720 -11.130 1.00 0.00 O ATOM 1069 CB LYS A 65 -2.231 7.539 -10.610 1.00 0.00 C ATOM 1070 CG LYS A 65 -2.605 6.452 -9.617 1.00 0.00 C ATOM 1071 CD LYS A 65 -1.585 6.345 -8.495 1.00 0.00 C ATOM 1072 CE LYS A 65 -2.208 5.791 -7.224 1.00 0.00 C ATOM 1073 NZ LYS A 65 -1.782 4.388 -6.964 1.00 0.00 N ATOM 0 H LYS A 65 -1.840 5.041 -11.713 1.00 0.00 H new ATOM 0 HA LYS A 65 -1.245 7.834 -12.493 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -1.756 8.360 -10.073 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -3.141 7.936 -11.059 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -3.588 6.665 -9.197 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -2.680 5.496 -10.134 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -0.764 5.701 -8.809 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.160 7.328 -8.294 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -1.927 6.419 -6.378 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -3.294 5.832 -7.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -2.537 3.884 -6.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -1.593 3.910 -7.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -0.918 4.389 -6.385 1.00 0.00 H new ATOM 1087 N ARG A 66 0.749 7.932 -10.746 1.00 0.00 N ATOM 1088 CA ARG A 66 2.100 7.864 -10.199 1.00 0.00 C ATOM 1089 C ARG A 66 2.131 7.035 -8.917 1.00 0.00 C ATOM 1090 O ARG A 66 1.097 6.805 -8.291 1.00 0.00 O ATOM 1091 CB ARG A 66 2.632 9.273 -9.925 1.00 0.00 C ATOM 1092 CG ARG A 66 3.549 9.800 -11.015 1.00 0.00 C ATOM 1093 CD ARG A 66 3.559 11.320 -11.053 1.00 0.00 C ATOM 1094 NE ARG A 66 4.912 11.856 -11.184 1.00 0.00 N ATOM 1095 CZ ARG A 66 5.771 11.960 -10.171 1.00 0.00 C ATOM 1096 NH1 ARG A 66 5.421 11.567 -8.953 1.00 0.00 N ATOM 1097 NH2 ARG A 66 6.981 12.460 -10.378 1.00 0.00 N ATOM 0 H ARG A 66 0.352 8.871 -10.772 1.00 0.00 H new ATOM 0 HA ARG A 66 2.739 7.378 -10.936 1.00 0.00 H new ATOM 0 HB2 ARG A 66 1.789 9.954 -9.810 1.00 0.00 H new ATOM 0 HB3 ARG A 66 3.171 9.271 -8.978 1.00 0.00 H new ATOM 0 HG2 ARG A 66 4.562 9.433 -10.848 1.00 0.00 H new ATOM 0 HG3 ARG A 66 3.225 9.414 -11.982 1.00 0.00 H new ATOM 0 HD2 ARG A 66 2.950 11.666 -11.888 1.00 0.00 H new ATOM 0 HD3 ARG A 66 3.102 11.708 -10.143 1.00 0.00 H new ATOM 0 HE ARG A 66 5.217 12.169 -12.106 1.00 0.00 H new ATOM 0 HH11 ARG A 66 4.490 11.183 -8.789 1.00 0.00 H new ATOM 0 HH12 ARG A 66 6.083 11.649 -8.181 1.00 0.00 H new ATOM 0 HH21 ARG A 66 7.254 12.765 -11.312 1.00 0.00 H new ATOM 0 HH22 ARG A 66 7.639 12.540 -9.603 1.00 0.00 H new ATOM 1111 N PRO A 67 3.326 6.575 -8.507 1.00 0.00 N ATOM 1112 CA PRO A 67 3.487 5.768 -7.293 1.00 0.00 C ATOM 1113 C PRO A 67 3.281 6.588 -6.021 1.00 0.00 C ATOM 1114 O PRO A 67 4.015 7.544 -5.767 1.00 0.00 O ATOM 1115 CB PRO A 67 4.935 5.280 -7.384 1.00 0.00 C ATOM 1116 CG PRO A 67 5.630 6.307 -8.208 1.00 0.00 C ATOM 1117 CD PRO A 67 4.611 6.804 -9.196 1.00 0.00 C ATOM 0 HA PRO A 67 2.753 4.964 -7.236 1.00 0.00 H new ATOM 0 HB2 PRO A 67 5.386 5.194 -6.396 1.00 0.00 H new ATOM 0 HB3 PRO A 67 4.992 4.295 -7.848 1.00 0.00 H new ATOM 0 HG2 PRO A 67 6.000 7.122 -7.586 1.00 0.00 H new ATOM 0 HG3 PRO A 67 6.493 5.879 -8.719 1.00 0.00 H new ATOM 0 HD2 PRO A 67 4.759 7.858 -9.430 1.00 0.00 H new ATOM 0 HD3 PRO A 67 4.665 6.258 -10.138 1.00 0.00 H new ATOM 1125 N PRO A 68 2.278 6.230 -5.199 1.00 0.00 N ATOM 1126 CA PRO A 68 1.986 6.944 -3.952 1.00 0.00 C ATOM 1127 C PRO A 68 3.167 6.928 -2.986 1.00 0.00 C ATOM 1128 O PRO A 68 3.424 5.924 -2.322 1.00 0.00 O ATOM 1129 CB PRO A 68 0.802 6.174 -3.356 1.00 0.00 C ATOM 1130 CG PRO A 68 0.207 5.430 -4.502 1.00 0.00 C ATOM 1131 CD PRO A 68 1.351 5.107 -5.419 1.00 0.00 C ATOM 0 HA PRO A 68 1.774 7.998 -4.133 1.00 0.00 H new ATOM 0 HB2 PRO A 68 1.130 5.493 -2.571 1.00 0.00 H new ATOM 0 HB3 PRO A 68 0.076 6.852 -2.907 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -0.290 4.521 -4.162 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -0.544 6.033 -5.012 1.00 0.00 H new ATOM 0 HD2 PRO A 68 1.810 4.150 -5.170 1.00 0.00 H new ATOM 0 HD3 PRO A 68 1.030 5.046 -6.459 1.00 0.00 H new ATOM 1139 N ARG A 69 3.880 8.047 -2.913 1.00 0.00 N ATOM 1140 CA ARG A 69 5.032 8.160 -2.025 1.00 0.00 C ATOM 1141 C ARG A 69 4.587 8.414 -0.588 1.00 0.00 C ATOM 1142 O ARG A 69 4.243 9.539 -0.224 1.00 0.00 O ATOM 1143 CB ARG A 69 5.955 9.287 -2.496 1.00 0.00 C ATOM 1144 CG ARG A 69 7.146 8.800 -3.306 1.00 0.00 C ATOM 1145 CD ARG A 69 8.157 8.079 -2.428 1.00 0.00 C ATOM 1146 NE ARG A 69 7.842 6.659 -2.282 1.00 0.00 N ATOM 1147 CZ ARG A 69 8.335 5.888 -1.315 1.00 0.00 C ATOM 1148 NH1 ARG A 69 9.163 6.392 -0.410 1.00 0.00 N ATOM 1149 NH2 ARG A 69 7.997 4.606 -1.254 1.00 0.00 N ATOM 0 H ARG A 69 3.681 8.887 -3.457 1.00 0.00 H new ATOM 0 HA ARG A 69 5.579 7.217 -2.054 1.00 0.00 H new ATOM 0 HB2 ARG A 69 5.379 9.989 -3.099 1.00 0.00 H new ATOM 0 HB3 ARG A 69 6.317 9.836 -1.627 1.00 0.00 H new ATOM 0 HG2 ARG A 69 6.802 8.130 -4.094 1.00 0.00 H new ATOM 0 HG3 ARG A 69 7.626 9.647 -3.796 1.00 0.00 H new ATOM 0 HD2 ARG A 69 9.153 8.187 -2.858 1.00 0.00 H new ATOM 0 HD3 ARG A 69 8.182 8.548 -1.444 1.00 0.00 H new ATOM 0 HE ARG A 69 7.208 6.235 -2.960 1.00 0.00 H new ATOM 0 HH11 ARG A 69 9.426 7.377 -0.452 1.00 0.00 H new ATOM 0 HH12 ARG A 69 9.537 5.795 0.328 1.00 0.00 H new ATOM 0 HH21 ARG A 69 7.360 4.213 -1.947 1.00 0.00 H new ATOM 0 HH22 ARG A 69 8.374 4.014 -0.514 1.00 0.00 H new ATOM 1163 N ALA A 70 4.596 7.360 0.222 1.00 0.00 N ATOM 1164 CA ALA A 70 4.191 7.469 1.618 1.00 0.00 C ATOM 1165 C ALA A 70 5.074 8.456 2.373 1.00 0.00 C ATOM 1166 O ALA A 70 4.582 9.416 2.968 1.00 0.00 O ATOM 1167 CB ALA A 70 4.235 6.103 2.287 1.00 0.00 C ATOM 0 H ALA A 70 4.879 6.423 -0.064 1.00 0.00 H new ATOM 0 HA ALA A 70 3.168 7.844 1.644 1.00 0.00 H new ATOM 0 HB1 ALA A 70 3.930 6.198 3.329 1.00 0.00 H new ATOM 0 HB2 ALA A 70 3.557 5.423 1.771 1.00 0.00 H new ATOM 0 HB3 ALA A 70 5.250 5.708 2.240 1.00 0.00 H new ATOM 1173 N ILE A 71 6.381 8.216 2.346 1.00 0.00 N ATOM 1174 CA ILE A 71 7.332 9.086 3.029 1.00 0.00 C ATOM 1175 C ILE A 71 7.524 10.393 2.270 1.00 0.00 C ATOM 1176 O ILE A 71 7.635 11.463 2.869 1.00 0.00 O ATOM 1177 CB ILE A 71 8.700 8.398 3.203 1.00 0.00 C ATOM 1178 CG1 ILE A 71 8.526 7.011 3.825 1.00 0.00 C ATOM 1179 CG2 ILE A 71 9.621 9.255 4.061 1.00 0.00 C ATOM 1180 CD1 ILE A 71 9.430 5.960 3.219 1.00 0.00 C ATOM 0 H ILE A 71 6.806 7.427 1.859 1.00 0.00 H new ATOM 0 HA ILE A 71 6.915 9.299 4.013 1.00 0.00 H new ATOM 0 HB ILE A 71 9.155 8.280 2.220 1.00 0.00 H new ATOM 0 HG12 ILE A 71 8.722 7.074 4.895 1.00 0.00 H new ATOM 0 HG13 ILE A 71 7.489 6.697 3.709 1.00 0.00 H new ATOM 0 HG21 ILE A 71 10.583 8.755 4.174 1.00 0.00 H new ATOM 0 HG22 ILE A 71 9.769 10.222 3.581 1.00 0.00 H new ATOM 0 HG23 ILE A 71 9.171 9.402 5.043 1.00 0.00 H new ATOM 0 HD11 ILE A 71 9.253 5.002 3.708 1.00 0.00 H new ATOM 0 HD12 ILE A 71 9.218 5.868 2.154 1.00 0.00 H new ATOM 0 HD13 ILE A 71 10.471 6.251 3.358 1.00 0.00 H new ATOM 1192 N SER A 72 7.561 10.300 0.946 1.00 0.00 N ATOM 1193 CA SER A 72 7.738 11.474 0.098 1.00 0.00 C ATOM 1194 C SER A 72 9.036 12.202 0.438 1.00 0.00 C ATOM 1195 O SER A 72 9.067 13.428 0.528 1.00 0.00 O ATOM 1196 CB SER A 72 6.549 12.424 0.256 1.00 0.00 C ATOM 1197 OG SER A 72 5.509 12.095 -0.649 1.00 0.00 O ATOM 0 H SER A 72 7.471 9.422 0.435 1.00 0.00 H new ATOM 0 HA SER A 72 7.793 11.139 -0.938 1.00 0.00 H new ATOM 0 HB2 SER A 72 6.174 12.376 1.278 1.00 0.00 H new ATOM 0 HB3 SER A 72 6.874 13.450 0.084 1.00 0.00 H new ATOM 0 HG SER A 72 5.146 11.213 -0.424 1.00 0.00 H new ATOM 1203 N ALA A 73 10.107 11.436 0.626 1.00 0.00 N ATOM 1204 CA ALA A 73 11.408 12.008 0.956 1.00 0.00 C ATOM 1205 C ALA A 73 12.245 12.260 -0.290 1.00 0.00 C ATOM 1206 O ALA A 73 13.463 12.431 -0.212 1.00 0.00 O ATOM 1207 CB ALA A 73 12.154 11.110 1.932 1.00 0.00 C ATOM 0 H ALA A 73 10.099 10.418 0.555 1.00 0.00 H new ATOM 0 HA ALA A 73 11.233 12.973 1.432 1.00 0.00 H new ATOM 0 HB1 ALA A 73 13.122 11.553 2.167 1.00 0.00 H new ATOM 0 HB2 ALA A 73 11.572 11.005 2.847 1.00 0.00 H new ATOM 0 HB3 ALA A 73 12.303 10.128 1.482 1.00 0.00 H new ATOM 1213 N PHE A 74 11.585 12.284 -1.436 1.00 0.00 N ATOM 1214 CA PHE A 74 12.260 12.516 -2.708 1.00 0.00 C ATOM 1215 C PHE A 74 11.429 13.429 -3.605 1.00 0.00 C ATOM 1216 O PHE A 74 10.431 14.003 -3.168 1.00 0.00 O ATOM 1217 CB PHE A 74 12.530 11.187 -3.416 1.00 0.00 C ATOM 1218 CG PHE A 74 13.984 10.952 -3.716 1.00 0.00 C ATOM 1219 CD1 PHE A 74 14.873 10.642 -2.700 1.00 0.00 C ATOM 1220 CD2 PHE A 74 14.459 11.043 -5.014 1.00 0.00 C ATOM 1221 CE1 PHE A 74 16.211 10.427 -2.973 1.00 0.00 C ATOM 1222 CE2 PHE A 74 15.796 10.828 -5.292 1.00 0.00 C ATOM 1223 CZ PHE A 74 16.672 10.520 -4.271 1.00 0.00 C ATOM 0 H PHE A 74 10.578 12.145 -1.514 1.00 0.00 H new ATOM 0 HA PHE A 74 13.211 13.008 -2.504 1.00 0.00 H new ATOM 0 HB2 PHE A 74 12.159 10.372 -2.795 1.00 0.00 H new ATOM 0 HB3 PHE A 74 11.966 11.160 -4.348 1.00 0.00 H new ATOM 0 HD1 PHE A 74 14.517 10.567 -1.683 1.00 0.00 H new ATOM 0 HD2 PHE A 74 13.778 11.284 -5.817 1.00 0.00 H new ATOM 0 HE1 PHE A 74 16.895 10.187 -2.172 1.00 0.00 H new ATOM 0 HE2 PHE A 74 16.155 10.901 -6.308 1.00 0.00 H new ATOM 0 HZ PHE A 74 17.717 10.352 -4.487 1.00 0.00 H new ATOM 1233 N GLY A 75 11.846 13.557 -4.861 1.00 0.00 N ATOM 1234 CA GLY A 75 11.128 14.402 -5.796 1.00 0.00 C ATOM 1235 C GLY A 75 11.122 15.861 -5.374 1.00 0.00 C ATOM 1236 O GLY A 75 10.386 16.239 -4.464 1.00 0.00 O ATOM 0 H GLY A 75 12.667 13.091 -5.247 1.00 0.00 H new ATOM 0 HA2 GLY A 75 11.582 14.314 -6.783 1.00 0.00 H new ATOM 0 HA3 GLY A 75 10.101 14.049 -5.885 1.00 0.00 H new ATOM 1240 N PRO A 76 11.939 16.713 -6.020 1.00 0.00 N ATOM 1241 CA PRO A 76 12.011 18.139 -5.687 1.00 0.00 C ATOM 1242 C PRO A 76 10.726 18.881 -6.038 1.00 0.00 C ATOM 1243 O PRO A 76 10.216 18.769 -7.155 1.00 0.00 O ATOM 1244 CB PRO A 76 13.173 18.652 -6.542 1.00 0.00 C ATOM 1245 CG PRO A 76 13.265 17.690 -7.675 1.00 0.00 C ATOM 1246 CD PRO A 76 12.856 16.356 -7.119 1.00 0.00 C ATOM 0 HA PRO A 76 12.151 18.298 -4.618 1.00 0.00 H new ATOM 0 HB2 PRO A 76 12.985 19.665 -6.898 1.00 0.00 H new ATOM 0 HB3 PRO A 76 14.101 18.681 -5.971 1.00 0.00 H new ATOM 0 HG2 PRO A 76 12.611 17.988 -8.494 1.00 0.00 H new ATOM 0 HG3 PRO A 76 14.279 17.652 -8.074 1.00 0.00 H new ATOM 0 HD2 PRO A 76 12.362 15.741 -7.871 1.00 0.00 H new ATOM 0 HD3 PRO A 76 13.715 15.790 -6.758 1.00 0.00 H new ATOM 1254 N SER A 77 10.203 19.637 -5.078 1.00 0.00 N ATOM 1255 CA SER A 77 8.977 20.398 -5.283 1.00 0.00 C ATOM 1256 C SER A 77 8.953 21.642 -4.400 1.00 0.00 C ATOM 1257 O SER A 77 9.361 21.597 -3.238 1.00 0.00 O ATOM 1258 CB SER A 77 7.756 19.525 -4.989 1.00 0.00 C ATOM 1259 OG SER A 77 7.763 18.350 -5.780 1.00 0.00 O ATOM 0 H SER A 77 10.611 19.739 -4.149 1.00 0.00 H new ATOM 0 HA SER A 77 8.946 20.715 -6.325 1.00 0.00 H new ATOM 0 HB2 SER A 77 7.744 19.255 -3.933 1.00 0.00 H new ATOM 0 HB3 SER A 77 6.845 20.092 -5.183 1.00 0.00 H new ATOM 0 HG SER A 77 6.972 17.810 -5.571 1.00 0.00 H new ATOM 1265 N ALA A 78 8.477 22.749 -4.957 1.00 0.00 N ATOM 1266 CA ALA A 78 8.400 24.003 -4.219 1.00 0.00 C ATOM 1267 C ALA A 78 7.436 23.892 -3.044 1.00 0.00 C ATOM 1268 O ALA A 78 7.631 24.526 -2.006 1.00 0.00 O ATOM 1269 CB ALA A 78 7.980 25.134 -5.145 1.00 0.00 C ATOM 0 H ALA A 78 8.138 22.803 -5.918 1.00 0.00 H new ATOM 0 HA ALA A 78 9.391 24.223 -3.821 1.00 0.00 H new ATOM 0 HB1 ALA A 78 7.926 26.065 -4.581 1.00 0.00 H new ATOM 0 HB2 ALA A 78 8.710 25.237 -5.948 1.00 0.00 H new ATOM 0 HB3 ALA A 78 7.002 24.911 -5.571 1.00 0.00 H new ATOM 1275 N SER A 79 6.395 23.084 -3.213 1.00 0.00 N ATOM 1276 CA SER A 79 5.399 22.889 -2.166 1.00 0.00 C ATOM 1277 C SER A 79 4.426 21.777 -2.541 1.00 0.00 C ATOM 1278 O SER A 79 3.319 22.038 -3.012 1.00 0.00 O ATOM 1279 CB SER A 79 4.633 24.189 -1.914 1.00 0.00 C ATOM 1280 OG SER A 79 3.449 23.948 -1.174 1.00 0.00 O ATOM 0 H SER A 79 6.219 22.553 -4.066 1.00 0.00 H new ATOM 0 HA SER A 79 5.920 22.599 -1.253 1.00 0.00 H new ATOM 0 HB2 SER A 79 5.268 24.890 -1.372 1.00 0.00 H new ATOM 0 HB3 SER A 79 4.382 24.657 -2.866 1.00 0.00 H new ATOM 0 HG SER A 79 2.839 23.394 -1.704 1.00 0.00 H new ATOM 1286 N GLY A 80 4.846 20.533 -2.328 1.00 0.00 N ATOM 1287 CA GLY A 80 3.999 19.400 -2.650 1.00 0.00 C ATOM 1288 C GLY A 80 3.781 19.244 -4.142 1.00 0.00 C ATOM 1289 O GLY A 80 4.731 19.036 -4.897 1.00 0.00 O ATOM 0 H GLY A 80 5.757 20.290 -1.939 1.00 0.00 H new ATOM 0 HA2 GLY A 80 4.450 18.490 -2.255 1.00 0.00 H new ATOM 0 HA3 GLY A 80 3.035 19.519 -2.156 1.00 0.00 H new ATOM 1293 N SER A 81 2.526 19.345 -4.569 1.00 0.00 N ATOM 1294 CA SER A 81 2.186 19.213 -5.981 1.00 0.00 C ATOM 1295 C SER A 81 1.314 20.378 -6.441 1.00 0.00 C ATOM 1296 O SER A 81 0.775 21.123 -5.622 1.00 0.00 O ATOM 1297 CB SER A 81 1.464 17.887 -6.231 1.00 0.00 C ATOM 1298 OG SER A 81 2.326 16.945 -6.845 1.00 0.00 O ATOM 0 H SER A 81 1.728 19.518 -3.957 1.00 0.00 H new ATOM 0 HA SER A 81 3.112 19.227 -6.556 1.00 0.00 H new ATOM 0 HB2 SER A 81 1.096 17.486 -5.287 1.00 0.00 H new ATOM 0 HB3 SER A 81 0.594 18.057 -6.866 1.00 0.00 H new ATOM 0 HG SER A 81 1.872 16.538 -7.612 1.00 0.00 H new ATOM 1304 N ALA A 82 1.184 20.528 -7.754 1.00 0.00 N ATOM 1305 CA ALA A 82 0.378 21.602 -8.324 1.00 0.00 C ATOM 1306 C ALA A 82 -1.104 21.392 -8.030 1.00 0.00 C ATOM 1307 O ALA A 82 -1.477 20.479 -7.293 1.00 0.00 O ATOM 1308 CB ALA A 82 0.612 21.698 -9.824 1.00 0.00 C ATOM 0 H ALA A 82 1.626 19.920 -8.444 1.00 0.00 H new ATOM 0 HA ALA A 82 0.684 22.539 -7.859 1.00 0.00 H new ATOM 0 HB1 ALA A 82 0.004 22.503 -10.236 1.00 0.00 H new ATOM 0 HB2 ALA A 82 1.665 21.904 -10.016 1.00 0.00 H new ATOM 0 HB3 ALA A 82 0.334 20.756 -10.297 1.00 0.00 H new ATOM 1314 N GLY A 83 -1.942 22.241 -8.610 1.00 0.00 N ATOM 1315 CA GLY A 83 -3.374 22.132 -8.397 1.00 0.00 C ATOM 1316 C GLY A 83 -4.107 21.634 -9.628 1.00 0.00 C ATOM 1317 O GLY A 83 -5.225 22.064 -9.910 1.00 0.00 O ATOM 0 H GLY A 83 -1.657 23.004 -9.224 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -3.564 21.453 -7.565 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -3.771 23.106 -8.111 1.00 0.00 H new ATOM 1321 N GLN A 84 -3.473 20.725 -10.363 1.00 0.00 N ATOM 1322 CA GLN A 84 -4.071 20.167 -11.571 1.00 0.00 C ATOM 1323 C GLN A 84 -4.446 18.702 -11.364 1.00 0.00 C ATOM 1324 O GLN A 84 -5.437 18.222 -11.914 1.00 0.00 O ATOM 1325 CB GLN A 84 -3.106 20.299 -12.750 1.00 0.00 C ATOM 1326 CG GLN A 84 -3.664 19.755 -14.056 1.00 0.00 C ATOM 1327 CD GLN A 84 -3.262 20.595 -15.254 1.00 0.00 C ATOM 1328 OE1 GLN A 84 -2.085 20.665 -15.610 1.00 0.00 O ATOM 1329 NE2 GLN A 84 -4.239 21.237 -15.882 1.00 0.00 N ATOM 0 H GLN A 84 -2.546 20.360 -10.143 1.00 0.00 H new ATOM 0 HA GLN A 84 -4.979 20.728 -11.791 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -2.850 21.350 -12.884 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -2.181 19.773 -12.513 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -3.314 18.733 -14.199 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -4.751 19.714 -13.994 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -5.200 21.150 -15.552 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -4.029 21.817 -16.694 1.00 0.00 H new ATOM 1338 N ALA A 85 -3.645 17.999 -10.571 1.00 0.00 N ATOM 1339 CA ALA A 85 -3.892 16.591 -10.292 1.00 0.00 C ATOM 1340 C ALA A 85 -3.311 16.188 -8.942 1.00 0.00 C ATOM 1341 O ALA A 85 -2.194 16.575 -8.595 1.00 0.00 O ATOM 1342 CB ALA A 85 -3.310 15.724 -11.399 1.00 0.00 C ATOM 0 H ALA A 85 -2.819 18.382 -10.110 1.00 0.00 H new ATOM 0 HA ALA A 85 -4.971 16.438 -10.254 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -3.502 14.674 -11.178 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -3.776 15.986 -12.349 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -2.235 15.890 -11.464 1.00 0.00 H new ATOM 1348 N GLU A 86 -4.074 15.409 -8.182 1.00 0.00 N ATOM 1349 CA GLU A 86 -3.634 14.954 -6.869 1.00 0.00 C ATOM 1350 C GLU A 86 -2.700 13.753 -6.994 1.00 0.00 C ATOM 1351 O GLU A 86 -3.146 12.628 -7.221 1.00 0.00 O ATOM 1352 CB GLU A 86 -4.841 14.594 -6.001 1.00 0.00 C ATOM 1353 CG GLU A 86 -4.918 15.386 -4.705 1.00 0.00 C ATOM 1354 CD GLU A 86 -3.915 14.913 -3.672 1.00 0.00 C ATOM 1355 OE1 GLU A 86 -2.935 14.240 -4.059 1.00 0.00 O ATOM 1356 OE2 GLU A 86 -4.109 15.212 -2.475 1.00 0.00 O ATOM 0 H GLU A 86 -5.000 15.080 -8.453 1.00 0.00 H new ATOM 0 HA GLU A 86 -3.085 15.767 -6.393 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -5.753 14.762 -6.574 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -4.804 13.530 -5.765 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -4.745 16.441 -4.918 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -5.924 15.305 -4.293 1.00 0.00 H new ATOM 1363 N GLU A 87 -1.403 14.003 -6.846 1.00 0.00 N ATOM 1364 CA GLU A 87 -0.404 12.944 -6.943 1.00 0.00 C ATOM 1365 C GLU A 87 -0.508 11.977 -5.765 1.00 0.00 C ATOM 1366 O GLU A 87 -0.088 10.824 -5.861 1.00 0.00 O ATOM 1367 CB GLU A 87 1.001 13.547 -7.000 1.00 0.00 C ATOM 1368 CG GLU A 87 1.891 12.910 -8.057 1.00 0.00 C ATOM 1369 CD GLU A 87 2.055 13.784 -9.285 1.00 0.00 C ATOM 1370 OE1 GLU A 87 2.607 14.896 -9.154 1.00 0.00 O ATOM 1371 OE2 GLU A 87 1.630 13.356 -10.378 1.00 0.00 O ATOM 0 H GLU A 87 -1.019 14.929 -6.659 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.594 12.386 -7.860 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.922 14.616 -7.199 1.00 0.00 H new ATOM 0 HB3 GLU A 87 1.474 13.439 -6.024 1.00 0.00 H new ATOM 0 HG2 GLU A 87 2.872 12.707 -7.627 1.00 0.00 H new ATOM 0 HG3 GLU A 87 1.468 11.950 -8.353 1.00 0.00 H new ATOM 1378 N GLU A 88 -1.064 12.455 -4.656 1.00 0.00 N ATOM 1379 CA GLU A 88 -1.213 11.629 -3.461 1.00 0.00 C ATOM 1380 C GLU A 88 -2.566 10.918 -3.437 1.00 0.00 C ATOM 1381 O GLU A 88 -3.065 10.558 -2.371 1.00 0.00 O ATOM 1382 CB GLU A 88 -1.056 12.486 -2.205 1.00 0.00 C ATOM 1383 CG GLU A 88 0.342 13.057 -2.029 1.00 0.00 C ATOM 1384 CD GLU A 88 0.626 14.206 -2.976 1.00 0.00 C ATOM 1385 OE1 GLU A 88 -0.315 14.967 -3.285 1.00 0.00 O ATOM 1386 OE2 GLU A 88 1.789 14.344 -3.410 1.00 0.00 O ATOM 0 H GLU A 88 -1.418 13.407 -4.559 1.00 0.00 H new ATOM 0 HA GLU A 88 -0.431 10.870 -3.483 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -1.772 13.307 -2.243 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -1.307 11.885 -1.331 1.00 0.00 H new ATOM 0 HG2 GLU A 88 0.464 13.399 -1.001 1.00 0.00 H new ATOM 0 HG3 GLU A 88 1.076 12.268 -2.191 1.00 0.00 H new ATOM 1393 N ASN A 89 -3.153 10.709 -4.613 1.00 0.00 N ATOM 1394 CA ASN A 89 -4.441 10.034 -4.710 1.00 0.00 C ATOM 1395 C ASN A 89 -4.293 8.551 -4.386 1.00 0.00 C ATOM 1396 O ASN A 89 -3.703 7.793 -5.157 1.00 0.00 O ATOM 1397 CB ASN A 89 -5.032 10.212 -6.111 1.00 0.00 C ATOM 1398 CG ASN A 89 -6.405 10.858 -6.083 1.00 0.00 C ATOM 1399 OD1 ASN A 89 -7.318 10.435 -6.792 1.00 0.00 O ATOM 1400 ND2 ASN A 89 -6.557 11.892 -5.261 1.00 0.00 N ATOM 0 H ASN A 89 -2.758 10.997 -5.508 1.00 0.00 H new ATOM 0 HA ASN A 89 -5.120 10.482 -3.984 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -4.358 10.823 -6.711 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -5.101 9.240 -6.599 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -7.457 12.367 -5.201 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -5.773 12.210 -4.691 1.00 0.00 H new ATOM 1407 N PHE A 90 -4.819 8.146 -3.236 1.00 0.00 N ATOM 1408 CA PHE A 90 -4.733 6.755 -2.804 1.00 0.00 C ATOM 1409 C PHE A 90 -5.973 5.968 -3.225 1.00 0.00 C ATOM 1410 O PHE A 90 -7.037 6.097 -2.621 1.00 0.00 O ATOM 1411 CB PHE A 90 -4.557 6.689 -1.284 1.00 0.00 C ATOM 1412 CG PHE A 90 -3.163 7.013 -0.813 1.00 0.00 C ATOM 1413 CD1 PHE A 90 -2.329 7.835 -1.560 1.00 0.00 C ATOM 1414 CD2 PHE A 90 -2.688 6.496 0.383 1.00 0.00 C ATOM 1415 CE1 PHE A 90 -1.053 8.132 -1.122 1.00 0.00 C ATOM 1416 CE2 PHE A 90 -1.413 6.791 0.824 1.00 0.00 C ATOM 1417 CZ PHE A 90 -0.594 7.609 0.069 1.00 0.00 C ATOM 0 H PHE A 90 -5.309 8.760 -2.586 1.00 0.00 H new ATOM 0 HA PHE A 90 -3.867 6.302 -3.286 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -5.257 7.382 -0.817 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -4.822 5.689 -0.941 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -2.682 8.247 -2.494 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -3.323 5.855 0.977 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.415 8.773 -1.712 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -1.056 6.383 1.758 1.00 0.00 H new ATOM 0 HZ PHE A 90 0.404 7.839 0.411 1.00 0.00 H new ATOM 1427 N GLU A 91 -5.821 5.148 -4.263 1.00 0.00 N ATOM 1428 CA GLU A 91 -6.924 4.332 -4.768 1.00 0.00 C ATOM 1429 C GLU A 91 -6.433 2.937 -5.150 1.00 0.00 C ATOM 1430 O GLU A 91 -5.448 2.794 -5.874 1.00 0.00 O ATOM 1431 CB GLU A 91 -7.579 4.999 -5.983 1.00 0.00 C ATOM 1432 CG GLU A 91 -7.605 6.519 -5.923 1.00 0.00 C ATOM 1433 CD GLU A 91 -6.509 7.153 -6.756 1.00 0.00 C ATOM 1434 OE1 GLU A 91 -5.350 6.695 -6.660 1.00 0.00 O ATOM 1435 OE2 GLU A 91 -6.809 8.105 -7.508 1.00 0.00 O ATOM 0 H GLU A 91 -4.944 5.031 -4.771 1.00 0.00 H new ATOM 0 HA GLU A 91 -7.664 4.241 -3.973 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -7.046 4.691 -6.883 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -8.601 4.633 -6.077 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -8.574 6.876 -6.271 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -7.501 6.840 -4.887 1.00 0.00 H new ATOM 1442 N PHE A 92 -7.124 1.909 -4.659 1.00 0.00 N ATOM 1443 CA PHE A 92 -6.750 0.528 -4.956 1.00 0.00 C ATOM 1444 C PHE A 92 -7.913 -0.224 -5.600 1.00 0.00 C ATOM 1445 O PHE A 92 -9.074 0.153 -5.441 1.00 0.00 O ATOM 1446 CB PHE A 92 -6.289 -0.190 -3.685 1.00 0.00 C ATOM 1447 CG PHE A 92 -7.364 -0.347 -2.645 1.00 0.00 C ATOM 1448 CD1 PHE A 92 -8.287 -1.375 -2.737 1.00 0.00 C ATOM 1449 CD2 PHE A 92 -7.447 0.533 -1.577 1.00 0.00 C ATOM 1450 CE1 PHE A 92 -9.276 -1.524 -1.780 1.00 0.00 C ATOM 1451 CE2 PHE A 92 -8.434 0.388 -0.618 1.00 0.00 C ATOM 1452 CZ PHE A 92 -9.350 -0.641 -0.721 1.00 0.00 C ATOM 0 H PHE A 92 -7.942 2.006 -4.057 1.00 0.00 H new ATOM 0 HA PHE A 92 -5.921 0.547 -5.664 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -5.912 -1.177 -3.954 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -5.456 0.362 -3.250 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -8.235 -2.068 -3.564 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -6.734 1.340 -1.493 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -9.990 -2.331 -1.862 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -8.488 1.079 0.210 1.00 0.00 H new ATOM 0 HZ PHE A 92 -10.122 -0.755 0.025 1.00 0.00 H new ATOM 1462 N LEU A 93 -7.592 -1.286 -6.336 1.00 0.00 N ATOM 1463 CA LEU A 93 -8.608 -2.085 -7.015 1.00 0.00 C ATOM 1464 C LEU A 93 -8.600 -3.530 -6.522 1.00 0.00 C ATOM 1465 O LEU A 93 -7.541 -4.100 -6.257 1.00 0.00 O ATOM 1466 CB LEU A 93 -8.383 -2.055 -8.527 1.00 0.00 C ATOM 1467 CG LEU A 93 -8.866 -0.782 -9.232 1.00 0.00 C ATOM 1468 CD1 LEU A 93 -7.719 -0.112 -9.972 1.00 0.00 C ATOM 1469 CD2 LEU A 93 -10.006 -1.102 -10.187 1.00 0.00 C ATOM 0 H LEU A 93 -6.636 -1.613 -6.477 1.00 0.00 H new ATOM 0 HA LEU A 93 -9.580 -1.650 -6.785 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -7.318 -2.178 -8.723 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -8.890 -2.912 -8.971 1.00 0.00 H new ATOM 0 HG LEU A 93 -9.235 -0.089 -8.476 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -8.082 0.789 -10.466 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -6.934 0.153 -9.263 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -7.317 -0.798 -10.718 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -10.336 -0.187 -10.679 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -9.663 -1.814 -10.938 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -10.837 -1.535 -9.630 1.00 0.00 H new ATOM 1481 N ILE A 94 -9.792 -4.114 -6.417 1.00 0.00 N ATOM 1482 CA ILE A 94 -9.946 -5.495 -5.966 1.00 0.00 C ATOM 1483 C ILE A 94 -10.481 -6.366 -7.099 1.00 0.00 C ATOM 1484 O ILE A 94 -11.643 -6.248 -7.477 1.00 0.00 O ATOM 1485 CB ILE A 94 -10.919 -5.578 -4.771 1.00 0.00 C ATOM 1486 CG1 ILE A 94 -10.632 -4.460 -3.765 1.00 0.00 C ATOM 1487 CG2 ILE A 94 -10.838 -6.939 -4.097 1.00 0.00 C ATOM 1488 CD1 ILE A 94 -9.282 -4.583 -3.092 1.00 0.00 C ATOM 0 H ILE A 94 -10.671 -3.648 -6.640 1.00 0.00 H new ATOM 0 HA ILE A 94 -8.965 -5.854 -5.656 1.00 0.00 H new ATOM 0 HB ILE A 94 -11.933 -5.449 -5.150 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -10.687 -3.499 -4.277 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -11.410 -4.460 -3.002 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -11.533 -6.972 -3.258 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -11.099 -7.717 -4.815 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -9.824 -7.106 -3.734 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -9.147 -3.758 -2.393 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -9.230 -5.528 -2.552 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -8.495 -4.552 -3.846 1.00 0.00 H new ATOM 1500 N VAL A 95 -9.637 -7.236 -7.644 1.00 0.00 N ATOM 1501 CA VAL A 95 -10.056 -8.104 -8.740 1.00 0.00 C ATOM 1502 C VAL A 95 -10.400 -9.505 -8.250 1.00 0.00 C ATOM 1503 O VAL A 95 -9.624 -10.133 -7.535 1.00 0.00 O ATOM 1504 CB VAL A 95 -8.969 -8.208 -9.831 1.00 0.00 C ATOM 1505 CG1 VAL A 95 -9.388 -9.184 -10.924 1.00 0.00 C ATOM 1506 CG2 VAL A 95 -8.678 -6.838 -10.422 1.00 0.00 C ATOM 0 H VAL A 95 -8.668 -7.359 -7.349 1.00 0.00 H new ATOM 0 HA VAL A 95 -10.949 -7.647 -9.167 1.00 0.00 H new ATOM 0 HB VAL A 95 -8.058 -8.588 -9.369 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -8.606 -9.240 -11.681 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -9.544 -10.171 -10.490 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -10.314 -8.839 -11.384 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -7.909 -6.929 -11.190 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -9.587 -6.432 -10.865 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -8.328 -6.169 -9.636 1.00 0.00 H new ATOM 1516 N SER A 96 -11.568 -9.988 -8.659 1.00 0.00 N ATOM 1517 CA SER A 96 -12.022 -11.319 -8.283 1.00 0.00 C ATOM 1518 C SER A 96 -11.623 -12.333 -9.349 1.00 0.00 C ATOM 1519 O SER A 96 -10.913 -12.000 -10.298 1.00 0.00 O ATOM 1520 CB SER A 96 -13.538 -11.333 -8.090 1.00 0.00 C ATOM 1521 OG SER A 96 -13.908 -12.168 -7.006 1.00 0.00 O ATOM 0 H SER A 96 -12.219 -9.474 -9.253 1.00 0.00 H new ATOM 0 HA SER A 96 -11.548 -11.591 -7.340 1.00 0.00 H new ATOM 0 HB2 SER A 96 -13.894 -10.319 -7.909 1.00 0.00 H new ATOM 0 HB3 SER A 96 -14.020 -11.682 -9.003 1.00 0.00 H new ATOM 0 HG SER A 96 -14.883 -12.158 -6.903 1.00 0.00 H new ATOM 1527 N SER A 97 -12.078 -13.567 -9.190 1.00 0.00 N ATOM 1528 CA SER A 97 -11.761 -14.620 -10.146 1.00 0.00 C ATOM 1529 C SER A 97 -12.714 -14.594 -11.336 1.00 0.00 C ATOM 1530 O SER A 97 -12.419 -15.158 -12.390 1.00 0.00 O ATOM 1531 CB SER A 97 -11.809 -15.990 -9.467 1.00 0.00 C ATOM 1532 OG SER A 97 -10.967 -16.918 -10.127 1.00 0.00 O ATOM 0 H SER A 97 -12.666 -13.864 -8.411 1.00 0.00 H new ATOM 0 HA SER A 97 -10.751 -14.440 -10.515 1.00 0.00 H new ATOM 0 HB2 SER A 97 -11.503 -15.894 -8.425 1.00 0.00 H new ATOM 0 HB3 SER A 97 -12.834 -16.362 -9.465 1.00 0.00 H new ATOM 0 HG SER A 97 -11.015 -17.785 -9.672 1.00 0.00 H new ATOM 1538 N THR A 98 -13.858 -13.937 -11.168 1.00 0.00 N ATOM 1539 CA THR A 98 -14.839 -13.848 -12.241 1.00 0.00 C ATOM 1540 C THR A 98 -14.761 -12.500 -12.946 1.00 0.00 C ATOM 1541 O THR A 98 -15.727 -12.054 -13.564 1.00 0.00 O ATOM 1542 CB THR A 98 -16.251 -14.074 -11.697 1.00 0.00 C ATOM 1543 OG1 THR A 98 -17.219 -13.869 -12.711 1.00 0.00 O ATOM 1544 CG2 THR A 98 -16.599 -13.163 -10.539 1.00 0.00 C ATOM 0 H THR A 98 -14.126 -13.462 -10.306 1.00 0.00 H new ATOM 0 HA THR A 98 -14.610 -14.628 -12.967 1.00 0.00 H new ATOM 0 HB THR A 98 -16.262 -15.105 -11.344 1.00 0.00 H new ATOM 0 HG1 THR A 98 -17.139 -12.957 -13.060 1.00 0.00 H new ATOM 0 HG21 THR A 98 -17.613 -13.375 -10.201 1.00 0.00 H new ATOM 0 HG22 THR A 98 -15.901 -13.333 -9.720 1.00 0.00 H new ATOM 0 HG23 THR A 98 -16.534 -12.124 -10.861 1.00 0.00 H new ATOM 1552 N GLY A 99 -13.602 -11.861 -12.855 1.00 0.00 N ATOM 1553 CA GLY A 99 -13.415 -10.571 -13.498 1.00 0.00 C ATOM 1554 C GLY A 99 -13.902 -9.405 -12.655 1.00 0.00 C ATOM 1555 O GLY A 99 -13.471 -8.270 -12.857 1.00 0.00 O ATOM 0 H GLY A 99 -12.788 -12.210 -12.349 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -12.357 -10.433 -13.720 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -13.944 -10.567 -14.451 1.00 0.00 H new ATOM 1559 N GLN A 100 -14.802 -9.677 -11.711 1.00 0.00 N ATOM 1560 CA GLN A 100 -15.340 -8.632 -10.842 1.00 0.00 C ATOM 1561 C GLN A 100 -14.219 -7.772 -10.269 1.00 0.00 C ATOM 1562 O GLN A 100 -13.276 -8.287 -9.670 1.00 0.00 O ATOM 1563 CB GLN A 100 -16.155 -9.253 -9.706 1.00 0.00 C ATOM 1564 CG GLN A 100 -17.378 -8.439 -9.318 1.00 0.00 C ATOM 1565 CD GLN A 100 -18.362 -9.229 -8.477 1.00 0.00 C ATOM 1566 OE1 GLN A 100 -17.970 -10.038 -7.637 1.00 0.00 O ATOM 1567 NE2 GLN A 100 -19.651 -8.998 -8.701 1.00 0.00 N ATOM 0 H GLN A 100 -15.173 -10.610 -11.529 1.00 0.00 H new ATOM 0 HA GLN A 100 -15.992 -7.996 -11.441 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -16.473 -10.252 -10.003 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -15.514 -9.369 -8.832 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -17.061 -7.555 -8.765 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -17.877 -8.088 -10.221 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -19.932 -8.318 -9.408 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -20.360 -9.500 -8.166 1.00 0.00 H new ATOM 1576 N THR A 101 -14.318 -6.460 -10.465 1.00 0.00 N ATOM 1577 CA THR A 101 -13.297 -5.545 -9.972 1.00 0.00 C ATOM 1578 C THR A 101 -13.900 -4.419 -9.136 1.00 0.00 C ATOM 1579 O THR A 101 -14.634 -3.575 -9.647 1.00 0.00 O ATOM 1580 CB THR A 101 -12.511 -4.952 -11.143 1.00 0.00 C ATOM 1581 OG1 THR A 101 -12.266 -5.936 -12.132 1.00 0.00 O ATOM 1582 CG2 THR A 101 -11.174 -4.371 -10.734 1.00 0.00 C ATOM 0 H THR A 101 -15.089 -6.011 -10.958 1.00 0.00 H new ATOM 0 HA THR A 101 -12.626 -6.118 -9.331 1.00 0.00 H new ATOM 0 HB THR A 101 -13.135 -4.148 -11.531 1.00 0.00 H new ATOM 0 HG1 THR A 101 -11.764 -5.537 -12.873 1.00 0.00 H new ATOM 0 HG21 THR A 101 -10.669 -3.968 -11.612 1.00 0.00 H new ATOM 0 HG22 THR A 101 -11.331 -3.574 -10.007 1.00 0.00 H new ATOM 0 HG23 THR A 101 -10.559 -5.153 -10.288 1.00 0.00 H new ATOM 1590 N TRP A 102 -13.563 -4.403 -7.850 1.00 0.00 N ATOM 1591 CA TRP A 102 -14.044 -3.373 -6.941 1.00 0.00 C ATOM 1592 C TRP A 102 -13.002 -2.274 -6.795 1.00 0.00 C ATOM 1593 O TRP A 102 -11.992 -2.463 -6.116 1.00 0.00 O ATOM 1594 CB TRP A 102 -14.324 -3.950 -5.557 1.00 0.00 C ATOM 1595 CG TRP A 102 -15.387 -4.999 -5.514 1.00 0.00 C ATOM 1596 CD1 TRP A 102 -16.024 -5.588 -6.567 1.00 0.00 C ATOM 1597 CD2 TRP A 102 -15.931 -5.588 -4.332 1.00 0.00 C ATOM 1598 NE1 TRP A 102 -16.933 -6.513 -6.106 1.00 0.00 N ATOM 1599 CE2 TRP A 102 -16.897 -6.527 -4.735 1.00 0.00 C ATOM 1600 CE3 TRP A 102 -15.692 -5.407 -2.970 1.00 0.00 C ATOM 1601 CZ2 TRP A 102 -17.623 -7.282 -3.814 1.00 0.00 C ATOM 1602 CZ3 TRP A 102 -16.415 -6.160 -2.066 1.00 0.00 C ATOM 1603 CH2 TRP A 102 -17.364 -7.079 -2.491 1.00 0.00 C ATOM 0 H TRP A 102 -12.955 -5.097 -7.414 1.00 0.00 H new ATOM 0 HA TRP A 102 -14.966 -2.970 -7.361 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -13.400 -4.374 -5.163 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -14.611 -3.136 -4.892 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -15.842 -5.362 -7.607 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -17.536 -7.094 -6.689 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -14.957 -4.693 -2.629 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -18.362 -8.000 -4.137 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -16.239 -6.031 -1.008 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -17.912 -7.648 -1.754 1.00 0.00 H new ATOM 1614 N HIS A 103 -13.240 -1.129 -7.415 1.00 0.00 N ATOM 1615 CA HIS A 103 -12.299 -0.026 -7.314 1.00 0.00 C ATOM 1616 C HIS A 103 -12.712 0.928 -6.200 1.00 0.00 C ATOM 1617 O HIS A 103 -13.773 1.547 -6.264 1.00 0.00 O ATOM 1618 CB HIS A 103 -12.195 0.729 -8.640 1.00 0.00 C ATOM 1619 CG HIS A 103 -11.028 1.661 -8.675 1.00 0.00 C ATOM 1620 ND1 HIS A 103 -10.204 1.854 -7.590 1.00 0.00 N ATOM 1621 CD2 HIS A 103 -10.548 2.460 -9.660 1.00 0.00 C ATOM 1622 CE1 HIS A 103 -9.273 2.730 -7.896 1.00 0.00 C ATOM 1623 NE2 HIS A 103 -9.453 3.112 -9.148 1.00 0.00 N ATOM 0 H HIS A 103 -14.064 -0.941 -7.985 1.00 0.00 H new ATOM 0 HA HIS A 103 -11.319 -0.442 -7.077 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -12.109 0.013 -9.457 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -13.112 1.294 -8.806 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -10.950 2.564 -10.657 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -8.493 3.079 -7.236 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -8.873 3.782 -9.652 1.00 0.00 H new ATOM 1632 N PHE A 104 -11.873 1.042 -5.177 1.00 0.00 N ATOM 1633 CA PHE A 104 -12.169 1.919 -4.055 1.00 0.00 C ATOM 1634 C PHE A 104 -11.067 2.950 -3.838 1.00 0.00 C ATOM 1635 O PHE A 104 -9.963 2.826 -4.366 1.00 0.00 O ATOM 1636 CB PHE A 104 -12.353 1.111 -2.769 1.00 0.00 C ATOM 1637 CG PHE A 104 -13.393 0.030 -2.854 1.00 0.00 C ATOM 1638 CD1 PHE A 104 -14.603 0.255 -3.490 1.00 0.00 C ATOM 1639 CD2 PHE A 104 -13.161 -1.213 -2.284 1.00 0.00 C ATOM 1640 CE1 PHE A 104 -15.561 -0.739 -3.557 1.00 0.00 C ATOM 1641 CE2 PHE A 104 -14.115 -2.210 -2.347 1.00 0.00 C ATOM 1642 CZ PHE A 104 -15.318 -1.972 -2.984 1.00 0.00 C ATOM 0 H PHE A 104 -10.988 0.541 -5.103 1.00 0.00 H new ATOM 0 HA PHE A 104 -13.094 2.441 -4.298 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -11.399 0.659 -2.500 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -12.621 1.793 -1.962 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -14.800 1.218 -3.938 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -12.223 -1.404 -1.785 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -16.500 -0.552 -4.057 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -13.921 -3.174 -1.899 1.00 0.00 H new ATOM 0 HZ PHE A 104 -16.067 -2.749 -3.034 1.00 0.00 H new ATOM 1652 N GLU A 105 -11.385 3.960 -3.035 1.00 0.00 N ATOM 1653 CA GLU A 105 -10.443 5.018 -2.709 1.00 0.00 C ATOM 1654 C GLU A 105 -10.449 5.272 -1.205 1.00 0.00 C ATOM 1655 O GLU A 105 -11.351 5.924 -0.678 1.00 0.00 O ATOM 1656 CB GLU A 105 -10.798 6.303 -3.460 1.00 0.00 C ATOM 1657 CG GLU A 105 -9.859 7.461 -3.162 1.00 0.00 C ATOM 1658 CD GLU A 105 -10.310 8.757 -3.805 1.00 0.00 C ATOM 1659 OE1 GLU A 105 -10.296 8.838 -5.052 1.00 0.00 O ATOM 1660 OE2 GLU A 105 -10.681 9.692 -3.064 1.00 0.00 O ATOM 0 H GLU A 105 -12.299 4.066 -2.595 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.445 4.704 -3.015 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -10.786 6.103 -4.531 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -11.816 6.596 -3.202 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -9.790 7.600 -2.083 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -8.858 7.213 -3.516 1.00 0.00 H new ATOM 1667 N ALA A 106 -9.443 4.735 -0.518 1.00 0.00 N ATOM 1668 CA ALA A 106 -9.333 4.885 0.930 1.00 0.00 C ATOM 1669 C ALA A 106 -9.470 6.343 1.358 1.00 0.00 C ATOM 1670 O ALA A 106 -8.756 7.217 0.863 1.00 0.00 O ATOM 1671 CB ALA A 106 -8.011 4.311 1.415 1.00 0.00 C ATOM 0 H ALA A 106 -8.691 4.191 -0.942 1.00 0.00 H new ATOM 0 HA ALA A 106 -10.153 4.331 1.387 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -7.938 4.428 2.496 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -7.958 3.253 1.160 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -7.187 4.841 0.937 1.00 0.00 H new ATOM 1677 N ALA A 107 -10.388 6.596 2.287 1.00 0.00 N ATOM 1678 CA ALA A 107 -10.614 7.945 2.790 1.00 0.00 C ATOM 1679 C ALA A 107 -9.349 8.497 3.441 1.00 0.00 C ATOM 1680 O ALA A 107 -9.105 9.703 3.421 1.00 0.00 O ATOM 1681 CB ALA A 107 -11.770 7.953 3.780 1.00 0.00 C ATOM 0 H ALA A 107 -10.986 5.884 2.706 1.00 0.00 H new ATOM 0 HA ALA A 107 -10.872 8.588 1.948 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -11.927 8.967 4.147 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -12.675 7.602 3.285 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -11.536 7.296 4.618 1.00 0.00 H new ATOM 1687 N SER A 108 -8.550 7.603 4.012 1.00 0.00 N ATOM 1688 CA SER A 108 -7.307 7.990 4.665 1.00 0.00 C ATOM 1689 C SER A 108 -6.113 7.320 3.992 1.00 0.00 C ATOM 1690 O SER A 108 -6.251 6.261 3.377 1.00 0.00 O ATOM 1691 CB SER A 108 -7.347 7.620 6.149 1.00 0.00 C ATOM 1692 OG SER A 108 -7.727 8.731 6.943 1.00 0.00 O ATOM 0 H SER A 108 -8.743 6.602 4.035 1.00 0.00 H new ATOM 0 HA SER A 108 -7.196 9.070 4.573 1.00 0.00 H new ATOM 0 HB2 SER A 108 -8.050 6.801 6.304 1.00 0.00 H new ATOM 0 HB3 SER A 108 -6.367 7.262 6.464 1.00 0.00 H new ATOM 0 HG SER A 108 -7.746 8.467 7.887 1.00 0.00 H new ATOM 1698 N PHE A 109 -4.947 7.944 4.105 1.00 0.00 N ATOM 1699 CA PHE A 109 -3.732 7.406 3.502 1.00 0.00 C ATOM 1700 C PHE A 109 -3.339 6.083 4.149 1.00 0.00 C ATOM 1701 O PHE A 109 -3.179 5.071 3.466 1.00 0.00 O ATOM 1702 CB PHE A 109 -2.588 8.414 3.630 1.00 0.00 C ATOM 1703 CG PHE A 109 -2.634 9.500 2.594 1.00 0.00 C ATOM 1704 CD1 PHE A 109 -3.811 10.188 2.345 1.00 0.00 C ATOM 1705 CD2 PHE A 109 -1.502 9.830 1.866 1.00 0.00 C ATOM 1706 CE1 PHE A 109 -3.858 11.185 1.391 1.00 0.00 C ATOM 1707 CE2 PHE A 109 -1.543 10.828 0.911 1.00 0.00 C ATOM 1708 CZ PHE A 109 -2.723 11.506 0.673 1.00 0.00 C ATOM 0 H PHE A 109 -4.816 8.822 4.608 1.00 0.00 H new ATOM 0 HA PHE A 109 -3.930 7.223 2.446 1.00 0.00 H new ATOM 0 HB2 PHE A 109 -2.620 8.866 4.621 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -1.638 7.886 3.551 1.00 0.00 H new ATOM 0 HD1 PHE A 109 -4.702 9.941 2.904 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -0.578 9.301 2.047 1.00 0.00 H new ATOM 0 HE1 PHE A 109 -4.782 11.713 1.206 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -0.654 11.078 0.351 1.00 0.00 H new ATOM 0 HZ PHE A 109 -2.758 12.286 -0.073 1.00 0.00 H new ATOM 1718 N GLU A 110 -3.186 6.093 5.468 1.00 0.00 N ATOM 1719 CA GLU A 110 -2.813 4.890 6.205 1.00 0.00 C ATOM 1720 C GLU A 110 -3.847 3.787 5.998 1.00 0.00 C ATOM 1721 O GLU A 110 -3.511 2.602 5.985 1.00 0.00 O ATOM 1722 CB GLU A 110 -2.668 5.205 7.697 1.00 0.00 C ATOM 1723 CG GLU A 110 -1.255 5.018 8.224 1.00 0.00 C ATOM 1724 CD GLU A 110 -0.870 6.071 9.244 1.00 0.00 C ATOM 1725 OE1 GLU A 110 -0.612 7.224 8.840 1.00 0.00 O ATOM 1726 OE2 GLU A 110 -0.825 5.741 10.448 1.00 0.00 O ATOM 0 H GLU A 110 -3.314 6.921 6.050 1.00 0.00 H new ATOM 0 HA GLU A 110 -1.854 4.539 5.824 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -2.980 6.234 7.874 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -3.345 4.565 8.262 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -1.167 4.030 8.676 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -0.553 5.051 7.391 1.00 0.00 H new ATOM 1733 N GLU A 111 -5.104 4.185 5.839 1.00 0.00 N ATOM 1734 CA GLU A 111 -6.190 3.232 5.634 1.00 0.00 C ATOM 1735 C GLU A 111 -6.049 2.518 4.293 1.00 0.00 C ATOM 1736 O GLU A 111 -6.311 1.320 4.188 1.00 0.00 O ATOM 1737 CB GLU A 111 -7.542 3.948 5.710 1.00 0.00 C ATOM 1738 CG GLU A 111 -8.504 3.327 6.710 1.00 0.00 C ATOM 1739 CD GLU A 111 -8.512 4.057 8.038 1.00 0.00 C ATOM 1740 OE1 GLU A 111 -8.683 5.294 8.036 1.00 0.00 O ATOM 1741 OE2 GLU A 111 -8.348 3.391 9.083 1.00 0.00 O ATOM 0 H GLU A 111 -5.397 5.162 5.848 1.00 0.00 H new ATOM 0 HA GLU A 111 -6.137 2.483 6.424 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -7.377 4.992 5.978 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -8.003 3.941 4.722 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -9.510 3.330 6.291 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -8.230 2.285 6.874 1.00 0.00 H new ATOM 1748 N ARG A 112 -5.636 3.257 3.268 1.00 0.00 N ATOM 1749 CA ARG A 112 -5.470 2.684 1.937 1.00 0.00 C ATOM 1750 C ARG A 112 -4.513 1.500 1.967 1.00 0.00 C ATOM 1751 O ARG A 112 -4.820 0.430 1.437 1.00 0.00 O ATOM 1752 CB ARG A 112 -4.952 3.739 0.959 1.00 0.00 C ATOM 1753 CG ARG A 112 -4.946 3.270 -0.487 1.00 0.00 C ATOM 1754 CD ARG A 112 -3.553 3.335 -1.093 1.00 0.00 C ATOM 1755 NE ARG A 112 -3.318 2.248 -2.041 1.00 0.00 N ATOM 1756 CZ ARG A 112 -2.107 1.841 -2.418 1.00 0.00 C ATOM 1757 NH1 ARG A 112 -1.020 2.428 -1.933 1.00 0.00 N ATOM 1758 NH2 ARG A 112 -1.984 0.843 -3.282 1.00 0.00 N ATOM 0 H ARG A 112 -5.411 4.250 3.333 1.00 0.00 H new ATOM 0 HA ARG A 112 -6.447 2.335 1.602 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -5.569 4.634 1.041 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -3.939 4.023 1.245 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -5.318 2.247 -0.539 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -5.627 3.887 -1.073 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -3.422 4.292 -1.598 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -2.809 3.290 -0.298 1.00 0.00 H new ATOM 0 HE ARG A 112 -4.129 1.773 -2.437 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -1.109 3.196 -1.267 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -0.096 2.111 -2.226 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -2.816 0.388 -3.657 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -1.057 0.530 -3.572 1.00 0.00 H new ATOM 1772 N ASP A 113 -3.356 1.690 2.589 1.00 0.00 N ATOM 1773 CA ASP A 113 -2.364 0.628 2.684 1.00 0.00 C ATOM 1774 C ASP A 113 -2.909 -0.546 3.487 1.00 0.00 C ATOM 1775 O ASP A 113 -2.776 -1.700 3.079 1.00 0.00 O ATOM 1776 CB ASP A 113 -1.077 1.153 3.323 1.00 0.00 C ATOM 1777 CG ASP A 113 -0.530 2.370 2.605 1.00 0.00 C ATOM 1778 OD1 ASP A 113 0.205 2.191 1.610 1.00 0.00 O ATOM 1779 OD2 ASP A 113 -0.836 3.501 3.035 1.00 0.00 O ATOM 0 H ASP A 113 -3.083 2.566 3.033 1.00 0.00 H new ATOM 0 HA ASP A 113 -2.137 0.282 1.675 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -1.269 1.406 4.366 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -0.325 0.364 3.320 1.00 0.00 H new ATOM 1784 N ALA A 114 -3.532 -0.248 4.624 1.00 0.00 N ATOM 1785 CA ALA A 114 -4.104 -1.289 5.467 1.00 0.00 C ATOM 1786 C ALA A 114 -5.053 -2.160 4.658 1.00 0.00 C ATOM 1787 O ALA A 114 -4.934 -3.382 4.650 1.00 0.00 O ATOM 1788 CB ALA A 114 -4.820 -0.678 6.661 1.00 0.00 C ATOM 0 H ALA A 114 -3.652 0.700 4.980 1.00 0.00 H new ATOM 0 HA ALA A 114 -3.295 -1.916 5.842 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -5.240 -1.472 7.278 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -4.112 -0.096 7.251 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -5.622 -0.028 6.311 1.00 0.00 H new ATOM 1794 N TRP A 115 -5.988 -1.518 3.966 1.00 0.00 N ATOM 1795 CA TRP A 115 -6.947 -2.227 3.132 1.00 0.00 C ATOM 1796 C TRP A 115 -6.236 -3.085 2.095 1.00 0.00 C ATOM 1797 O TRP A 115 -6.466 -4.290 2.014 1.00 0.00 O ATOM 1798 CB TRP A 115 -7.861 -1.227 2.444 1.00 0.00 C ATOM 1799 CG TRP A 115 -9.027 -0.852 3.288 1.00 0.00 C ATOM 1800 CD1 TRP A 115 -9.152 0.253 4.075 1.00 0.00 C ATOM 1801 CD2 TRP A 115 -10.223 -1.603 3.460 1.00 0.00 C ATOM 1802 NE1 TRP A 115 -10.370 0.251 4.697 1.00 0.00 N ATOM 1803 CE2 TRP A 115 -11.047 -0.879 4.337 1.00 0.00 C ATOM 1804 CE3 TRP A 115 -10.684 -2.812 2.946 1.00 0.00 C ATOM 1805 CZ2 TRP A 115 -12.305 -1.332 4.709 1.00 0.00 C ATOM 1806 CZ3 TRP A 115 -11.934 -3.254 3.327 1.00 0.00 C ATOM 1807 CH2 TRP A 115 -12.726 -2.519 4.193 1.00 0.00 C ATOM 0 H TRP A 115 -6.101 -0.504 3.968 1.00 0.00 H new ATOM 0 HA TRP A 115 -7.540 -2.885 3.767 1.00 0.00 H new ATOM 0 HB2 TRP A 115 -7.293 -0.331 2.195 1.00 0.00 H new ATOM 0 HB3 TRP A 115 -8.217 -1.650 1.505 1.00 0.00 H new ATOM 0 HD1 TRP A 115 -8.399 1.019 4.191 1.00 0.00 H new ATOM 0 HE1 TRP A 115 -10.716 0.975 5.327 1.00 0.00 H new ATOM 0 HE3 TRP A 115 -10.077 -3.390 2.265 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 -12.928 -0.763 5.384 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 -12.303 -4.193 2.942 1.00 0.00 H new ATOM 0 HH2 TRP A 115 -13.701 -2.896 4.465 1.00 0.00 H new ATOM 1818 N VAL A 116 -5.360 -2.463 1.312 1.00 0.00 N ATOM 1819 CA VAL A 116 -4.616 -3.187 0.291 1.00 0.00 C ATOM 1820 C VAL A 116 -3.872 -4.365 0.913 1.00 0.00 C ATOM 1821 O VAL A 116 -3.757 -5.432 0.309 1.00 0.00 O ATOM 1822 CB VAL A 116 -3.619 -2.265 -0.442 1.00 0.00 C ATOM 1823 CG1 VAL A 116 -2.790 -3.050 -1.452 1.00 0.00 C ATOM 1824 CG2 VAL A 116 -4.359 -1.123 -1.125 1.00 0.00 C ATOM 0 H VAL A 116 -5.150 -1.466 1.365 1.00 0.00 H new ATOM 0 HA VAL A 116 -5.334 -3.559 -0.440 1.00 0.00 H new ATOM 0 HB VAL A 116 -2.936 -1.844 0.296 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -2.096 -2.377 -1.955 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -2.230 -3.830 -0.936 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -3.451 -3.506 -2.189 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -3.643 -0.481 -1.638 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -5.066 -1.529 -1.849 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -4.898 -0.541 -0.378 1.00 0.00 H new ATOM 1834 N GLN A 117 -3.388 -4.170 2.138 1.00 0.00 N ATOM 1835 CA GLN A 117 -2.676 -5.223 2.846 1.00 0.00 C ATOM 1836 C GLN A 117 -3.662 -6.220 3.446 1.00 0.00 C ATOM 1837 O GLN A 117 -3.344 -7.394 3.617 1.00 0.00 O ATOM 1838 CB GLN A 117 -1.790 -4.626 3.945 1.00 0.00 C ATOM 1839 CG GLN A 117 -0.312 -4.930 3.760 1.00 0.00 C ATOM 1840 CD GLN A 117 0.529 -4.464 4.933 1.00 0.00 C ATOM 1841 OE1 GLN A 117 0.372 -4.947 6.054 1.00 0.00 O ATOM 1842 NE2 GLN A 117 1.431 -3.524 4.679 1.00 0.00 N ATOM 0 H GLN A 117 -3.477 -3.296 2.656 1.00 0.00 H new ATOM 0 HA GLN A 117 -2.039 -5.748 2.134 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -1.931 -3.545 3.968 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -2.114 -5.011 4.912 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -0.179 -6.004 3.626 1.00 0.00 H new ATOM 0 HG3 GLN A 117 0.043 -4.449 2.849 1.00 0.00 H new ATOM 0 HE21 GLN A 117 1.527 -3.152 3.734 1.00 0.00 H new ATOM 0 HE22 GLN A 117 2.028 -3.174 5.428 1.00 0.00 H new ATOM 1851 N ALA A 118 -4.865 -5.743 3.754 1.00 0.00 N ATOM 1852 CA ALA A 118 -5.900 -6.594 4.323 1.00 0.00 C ATOM 1853 C ALA A 118 -6.455 -7.532 3.266 1.00 0.00 C ATOM 1854 O ALA A 118 -6.739 -8.698 3.539 1.00 0.00 O ATOM 1855 CB ALA A 118 -7.012 -5.746 4.921 1.00 0.00 C ATOM 0 H ALA A 118 -5.145 -4.772 3.618 1.00 0.00 H new ATOM 0 HA ALA A 118 -5.458 -7.195 5.118 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -7.779 -6.396 5.343 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -6.603 -5.111 5.707 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -7.453 -5.123 4.143 1.00 0.00 H new ATOM 1861 N ILE A 119 -6.595 -7.019 2.051 1.00 0.00 N ATOM 1862 CA ILE A 119 -7.103 -7.812 0.946 1.00 0.00 C ATOM 1863 C ILE A 119 -6.075 -8.866 0.536 1.00 0.00 C ATOM 1864 O ILE A 119 -6.402 -10.046 0.406 1.00 0.00 O ATOM 1865 CB ILE A 119 -7.472 -6.915 -0.262 1.00 0.00 C ATOM 1866 CG1 ILE A 119 -8.836 -6.259 -0.030 1.00 0.00 C ATOM 1867 CG2 ILE A 119 -7.483 -7.713 -1.561 1.00 0.00 C ATOM 1868 CD1 ILE A 119 -8.769 -4.979 0.773 1.00 0.00 C ATOM 0 H ILE A 119 -6.363 -6.056 1.808 1.00 0.00 H new ATOM 0 HA ILE A 119 -8.011 -8.316 1.278 1.00 0.00 H new ATOM 0 HB ILE A 119 -6.712 -6.139 -0.353 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -9.296 -6.048 -0.995 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -9.486 -6.966 0.485 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -7.745 -7.055 -2.390 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -6.495 -8.139 -1.735 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -8.217 -8.516 -1.489 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -9.773 -4.573 0.896 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -8.339 -5.186 1.753 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -8.146 -4.253 0.250 1.00 0.00 H new ATOM 1880 N GLU A 120 -4.828 -8.443 0.349 1.00 0.00 N ATOM 1881 CA GLU A 120 -3.768 -9.368 -0.032 1.00 0.00 C ATOM 1882 C GLU A 120 -3.480 -10.354 1.098 1.00 0.00 C ATOM 1883 O GLU A 120 -3.131 -11.507 0.849 1.00 0.00 O ATOM 1884 CB GLU A 120 -2.495 -8.607 -0.408 1.00 0.00 C ATOM 1885 CG GLU A 120 -1.923 -7.771 0.724 1.00 0.00 C ATOM 1886 CD GLU A 120 -0.504 -8.167 1.084 1.00 0.00 C ATOM 1887 OE1 GLU A 120 -0.227 -9.383 1.155 1.00 0.00 O ATOM 1888 OE2 GLU A 120 0.331 -7.262 1.295 1.00 0.00 O ATOM 0 H GLU A 120 -4.529 -7.473 0.454 1.00 0.00 H new ATOM 0 HA GLU A 120 -4.106 -9.929 -0.903 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -1.740 -9.321 -0.737 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -2.709 -7.956 -1.256 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -1.941 -6.719 0.439 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -2.559 -7.874 1.603 1.00 0.00 H new ATOM 1895 N SER A 121 -3.638 -9.902 2.342 1.00 0.00 N ATOM 1896 CA SER A 121 -3.399 -10.768 3.491 1.00 0.00 C ATOM 1897 C SER A 121 -4.482 -11.833 3.579 1.00 0.00 C ATOM 1898 O SER A 121 -4.206 -12.990 3.895 1.00 0.00 O ATOM 1899 CB SER A 121 -3.346 -9.959 4.791 1.00 0.00 C ATOM 1900 OG SER A 121 -4.620 -9.436 5.126 1.00 0.00 O ATOM 0 H SER A 121 -3.927 -8.952 2.576 1.00 0.00 H new ATOM 0 HA SER A 121 -2.432 -11.253 3.355 1.00 0.00 H new ATOM 0 HB2 SER A 121 -2.986 -10.593 5.602 1.00 0.00 H new ATOM 0 HB3 SER A 121 -2.632 -9.142 4.684 1.00 0.00 H new ATOM 0 HG SER A 121 -5.130 -9.267 4.306 1.00 0.00 H new ATOM 1906 N GLN A 122 -5.717 -11.441 3.281 1.00 0.00 N ATOM 1907 CA GLN A 122 -6.836 -12.372 3.309 1.00 0.00 C ATOM 1908 C GLN A 122 -6.661 -13.426 2.224 1.00 0.00 C ATOM 1909 O GLN A 122 -7.056 -14.580 2.390 1.00 0.00 O ATOM 1910 CB GLN A 122 -8.160 -11.629 3.113 1.00 0.00 C ATOM 1911 CG GLN A 122 -8.923 -11.393 4.405 1.00 0.00 C ATOM 1912 CD GLN A 122 -8.180 -10.481 5.360 1.00 0.00 C ATOM 1913 OE1 GLN A 122 -8.353 -9.262 5.332 1.00 0.00 O ATOM 1914 NE2 GLN A 122 -7.344 -11.066 6.210 1.00 0.00 N ATOM 0 H GLN A 122 -5.966 -10.487 3.018 1.00 0.00 H new ATOM 0 HA GLN A 122 -6.857 -12.862 4.282 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -7.961 -10.668 2.638 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -8.789 -12.199 2.429 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -9.895 -10.958 4.174 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -9.110 -12.350 4.893 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -7.231 -12.080 6.198 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -6.814 -10.502 6.874 1.00 0.00 H new ATOM 1923 N ILE A 123 -6.059 -13.015 1.112 1.00 0.00 N ATOM 1924 CA ILE A 123 -5.822 -13.915 -0.006 1.00 0.00 C ATOM 1925 C ILE A 123 -4.717 -14.915 0.320 1.00 0.00 C ATOM 1926 O ILE A 123 -4.791 -16.081 -0.063 1.00 0.00 O ATOM 1927 CB ILE A 123 -5.445 -13.132 -1.280 1.00 0.00 C ATOM 1928 CG1 ILE A 123 -6.545 -12.134 -1.633 1.00 0.00 C ATOM 1929 CG2 ILE A 123 -5.203 -14.084 -2.440 1.00 0.00 C ATOM 1930 CD1 ILE A 123 -6.039 -10.906 -2.355 1.00 0.00 C ATOM 0 H ILE A 123 -5.727 -12.062 0.963 1.00 0.00 H new ATOM 0 HA ILE A 123 -6.750 -14.457 -0.186 1.00 0.00 H new ATOM 0 HB ILE A 123 -4.523 -12.583 -1.088 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -7.289 -12.631 -2.256 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -7.051 -11.825 -0.718 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -4.938 -13.513 -3.330 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -4.389 -14.764 -2.189 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -6.109 -14.659 -2.634 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -6.875 -10.242 -2.574 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -5.317 -10.385 -1.726 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -5.559 -11.204 -3.287 1.00 0.00 H new ATOM 1942 N LEU A 124 -3.697 -14.450 1.030 1.00 0.00 N ATOM 1943 CA LEU A 124 -2.581 -15.307 1.410 1.00 0.00 C ATOM 1944 C LEU A 124 -3.023 -16.355 2.424 1.00 0.00 C ATOM 1945 O LEU A 124 -2.536 -17.486 2.416 1.00 0.00 O ATOM 1946 CB LEU A 124 -1.437 -14.471 1.986 1.00 0.00 C ATOM 1947 CG LEU A 124 -0.161 -15.253 2.307 1.00 0.00 C ATOM 1948 CD1 LEU A 124 0.737 -15.333 1.083 1.00 0.00 C ATOM 1949 CD2 LEU A 124 0.577 -14.613 3.472 1.00 0.00 C ATOM 0 H LEU A 124 -3.619 -13.486 1.354 1.00 0.00 H new ATOM 0 HA LEU A 124 -2.228 -15.819 0.515 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -1.192 -13.681 1.276 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -1.786 -13.985 2.897 1.00 0.00 H new ATOM 0 HG LEU A 124 -0.441 -16.267 2.594 1.00 0.00 H new ATOM 0 HD11 LEU A 124 1.639 -15.892 1.330 1.00 0.00 H new ATOM 0 HD12 LEU A 124 0.207 -15.837 0.275 1.00 0.00 H new ATOM 0 HD13 LEU A 124 1.010 -14.327 0.765 1.00 0.00 H new ATOM 0 HD21 LEU A 124 1.482 -15.182 3.686 1.00 0.00 H new ATOM 0 HD22 LEU A 124 0.845 -13.589 3.214 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -0.066 -14.609 4.352 1.00 0.00 H new ATOM 1961 N ALA A 125 -3.953 -15.974 3.293 1.00 0.00 N ATOM 1962 CA ALA A 125 -4.464 -16.883 4.311 1.00 0.00 C ATOM 1963 C ALA A 125 -5.440 -17.887 3.709 1.00 0.00 C ATOM 1964 O ALA A 125 -5.495 -19.044 4.126 1.00 0.00 O ATOM 1965 CB ALA A 125 -5.133 -16.100 5.431 1.00 0.00 C ATOM 0 H ALA A 125 -4.368 -15.042 3.312 1.00 0.00 H new ATOM 0 HA ALA A 125 -3.621 -17.437 4.724 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -5.510 -16.792 6.184 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -4.408 -15.427 5.888 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -5.961 -15.520 5.025 1.00 0.00 H new ATOM 1971 N SER A 126 -6.208 -17.435 2.723 1.00 0.00 N ATOM 1972 CA SER A 126 -7.184 -18.291 2.060 1.00 0.00 C ATOM 1973 C SER A 126 -6.504 -19.214 1.055 1.00 0.00 C ATOM 1974 O SER A 126 -6.963 -20.328 0.811 1.00 0.00 O ATOM 1975 CB SER A 126 -8.242 -17.439 1.354 1.00 0.00 C ATOM 1976 OG SER A 126 -9.487 -18.115 1.299 1.00 0.00 O ATOM 0 H SER A 126 -6.173 -16.480 2.366 1.00 0.00 H new ATOM 0 HA SER A 126 -7.668 -18.905 2.819 1.00 0.00 H new ATOM 0 HB2 SER A 126 -8.362 -16.492 1.880 1.00 0.00 H new ATOM 0 HB3 SER A 126 -7.908 -17.202 0.344 1.00 0.00 H new ATOM 0 HG SER A 126 -10.104 -17.617 0.723 1.00 0.00 H new ATOM 1982 N LEU A 127 -5.406 -18.741 0.473 1.00 0.00 N ATOM 1983 CA LEU A 127 -4.663 -19.526 -0.506 1.00 0.00 C ATOM 1984 C LEU A 127 -3.938 -20.686 0.165 1.00 0.00 C ATOM 1985 O LEU A 127 -3.987 -21.821 -0.309 1.00 0.00 O ATOM 1986 CB LEU A 127 -3.658 -18.638 -1.244 1.00 0.00 C ATOM 1987 CG LEU A 127 -4.126 -18.131 -2.611 1.00 0.00 C ATOM 1988 CD1 LEU A 127 -3.231 -17.001 -3.095 1.00 0.00 C ATOM 1989 CD2 LEU A 127 -4.147 -19.269 -3.621 1.00 0.00 C ATOM 0 H LEU A 127 -5.012 -17.819 0.662 1.00 0.00 H new ATOM 0 HA LEU A 127 -5.374 -19.934 -1.225 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.424 -17.779 -0.615 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -2.732 -19.197 -1.378 1.00 0.00 H new ATOM 0 HG LEU A 127 -5.140 -17.744 -2.508 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -3.578 -16.653 -4.068 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -3.266 -16.178 -2.381 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -2.206 -17.361 -3.183 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -4.482 -18.892 -4.587 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -3.144 -19.685 -3.721 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -4.830 -20.047 -3.279 1.00 0.00 H new ATOM 2001 N GLN A 128 -3.268 -20.390 1.270 1.00 0.00 N ATOM 2002 CA GLN A 128 -2.530 -21.404 2.014 1.00 0.00 C ATOM 2003 C GLN A 128 -3.480 -22.296 2.807 1.00 0.00 C ATOM 2004 O GLN A 128 -2.993 -23.058 3.669 1.00 0.00 O ATOM 2005 CB GLN A 128 -1.526 -20.742 2.961 1.00 0.00 C ATOM 2006 CG GLN A 128 -0.673 -19.674 2.293 1.00 0.00 C ATOM 2007 CD GLN A 128 0.648 -20.219 1.785 1.00 0.00 C ATOM 2008 OE1 GLN A 128 1.572 -20.462 2.560 1.00 0.00 O ATOM 2009 NE2 GLN A 128 0.742 -20.413 0.474 1.00 0.00 N ATOM 2010 OXT GLN A 128 -4.701 -22.227 2.558 1.00 0.00 O ATOM 0 H GLN A 128 -3.220 -19.454 1.673 1.00 0.00 H new ATOM 0 HA GLN A 128 -1.991 -22.023 1.297 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -2.066 -20.295 3.795 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -0.873 -21.508 3.379 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -1.227 -19.239 1.461 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -0.481 -18.870 3.003 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -0.050 -20.198 -0.132 1.00 0.00 H new ATOM 0 HE22 GLN A 128 1.606 -20.777 0.073 1.00 0.00 H new TER 2019 GLN A 128