USER MOD reduce.3.24.130724 H: found=0, std=0, add=716, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 717 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 45 LYS NZ :NH3+ -118:sc= 2.69 (180deg=-0.247) USER MOD Set 1.2: A 59 MET CE :methyl 145:sc= 0 (180deg=-0.645) USER MOD Set 2.1: A 25 LYS NZ :NH3+ -154:sc= 1.98 (180deg=0.194) USER MOD Set 2.2: A 35 HIS : no HD1:sc= 0.485 K(o=2.5,f=-2.7!) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ -157:sc= 1.01 (180deg=0.378!) USER MOD Single : A 29 GLN : amide:sc= 0.285 K(o=0.28,f=-0.27) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -114:sc= 1.36 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 177:sc= 1.23 (180deg=1.18) USER MOD Single : A 40 MET CE :methyl 155:sc= -0.39 (180deg=-1.26) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 150:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 150:sc= 1.18 (180deg=1.15) USER MOD Single : A 48 LYS NZ :NH3+ 177:sc= 2.36 (180deg=2.3) USER MOD Single : A 50 SER OG : rot 74:sc= 1.31 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 CYS SG : rot 49:sc= 1.13 USER MOD Single : A 53 GLN : amide:sc= -0.36 K(o=-0.36,f=-2.8) USER MOD Single : A 55 GLN : amide:sc= -0.0503 X(o=-0.05,f=-0.05) USER MOD Single : A 60 ASN : amide:sc= -0.116 K(o=-0.12,f=-0.68) USER MOD Single : A 61 SER OG : rot -77:sc= 1.27 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 74 ASN : amide:sc= -0.0524 X(o=-0.052,f=-0.36) USER MOD Single : A 75 HIS : no HD1:sc= 0.578 K(o=0.58,f=-6!) USER MOD Single : A 76 THR OG1 : rot -72:sc= 1.28 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 180:sc= 1.21 USER MOD Single : A 92 GLN : amide:sc= 0.894 K(o=0.89,f=0) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.0879 USER MOD Single : B 357 ASN : amide:sc= -0.269 K(o=-0.27,f=1) USER MOD Single : B 358 ASN : amide:sc= -0.128 K(o=-0.13,f=-4.1!) USER MOD Single : B 365 SER OG : rot 180:sc= 0.0141 USER MOD Single : B 367 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 21 13.683 -4.719 -2.269 1.00 10.00 N ATOM 2 CA TYR A 21 12.317 -4.158 -2.196 1.00 10.00 C ATOM 3 C TYR A 21 11.576 -4.747 -1.009 1.00 10.00 C ATOM 4 O TYR A 21 11.638 -5.954 -0.772 1.00 10.00 O ATOM 5 CB TYR A 21 11.551 -4.450 -3.489 1.00 10.00 C ATOM 6 CG TYR A 21 11.788 -3.434 -4.587 1.00 10.00 C ATOM 7 CD1 TYR A 21 10.767 -2.589 -5.006 1.00 10.00 C ATOM 8 CD2 TYR A 21 13.025 -3.323 -5.207 1.00 10.00 C ATOM 9 CE1 TYR A 21 10.972 -1.664 -6.011 1.00 10.00 C ATOM 10 CE2 TYR A 21 13.241 -2.397 -6.212 1.00 10.00 C ATOM 11 CZ TYR A 21 12.210 -1.572 -6.611 1.00 10.00 C ATOM 12 OH TYR A 21 12.418 -0.655 -7.617 1.00 10.00 O ATOM 0 HA TYR A 21 12.390 -3.078 -2.070 1.00 10.00 H new ATOM 0 HB2 TYR A 21 11.836 -5.437 -3.853 1.00 10.00 H new ATOM 0 HB3 TYR A 21 10.485 -4.488 -3.267 1.00 10.00 H new ATOM 0 HD1 TYR A 21 9.796 -2.657 -4.537 1.00 10.00 H new ATOM 0 HD2 TYR A 21 13.833 -3.971 -4.900 1.00 10.00 H new ATOM 0 HE1 TYR A 21 10.167 -1.016 -6.325 1.00 10.00 H new ATOM 0 HE2 TYR A 21 14.211 -2.321 -6.681 1.00 10.00 H new ATOM 0 HH TYR A 21 13.344 -0.719 -7.931 1.00 10.00 H new ATOM 22 N ILE A 22 10.881 -3.900 -0.266 1.00 10.00 N ATOM 23 CA ILE A 22 10.133 -4.346 0.901 1.00 10.00 C ATOM 24 C ILE A 22 8.776 -4.880 0.473 1.00 10.00 C ATOM 25 O ILE A 22 8.048 -4.218 -0.267 1.00 10.00 O ATOM 26 CB ILE A 22 9.937 -3.205 1.923 1.00 10.00 C ATOM 27 CG1 ILE A 22 11.281 -2.548 2.262 1.00 10.00 C ATOM 28 CG2 ILE A 22 9.260 -3.728 3.184 1.00 10.00 C ATOM 29 CD1 ILE A 22 12.284 -3.488 2.902 1.00 10.00 C ATOM 0 H ILE A 22 10.819 -2.899 -0.450 1.00 10.00 H new ATOM 0 HA ILE A 22 10.710 -5.137 1.381 1.00 10.00 H new ATOM 0 HB ILE A 22 9.291 -2.449 1.476 1.00 10.00 H new ATOM 0 HG12 ILE A 22 11.714 -2.138 1.349 1.00 10.00 H new ATOM 0 HG13 ILE A 22 11.104 -1.709 2.935 1.00 10.00 H new ATOM 0 HG21 ILE A 22 9.130 -2.910 3.893 1.00 10.00 H new ATOM 0 HG22 ILE A 22 8.286 -4.145 2.928 1.00 10.00 H new ATOM 0 HG23 ILE A 22 9.879 -4.504 3.634 1.00 10.00 H new ATOM 0 HD11 ILE A 22 13.207 -2.948 3.111 1.00 10.00 H new ATOM 0 HD12 ILE A 22 11.874 -3.879 3.833 1.00 10.00 H new ATOM 0 HD13 ILE A 22 12.493 -4.314 2.223 1.00 10.00 H new ATOM 41 N LYS A 23 8.442 -6.074 0.925 1.00 10.00 N ATOM 42 CA LYS A 23 7.178 -6.691 0.569 1.00 10.00 C ATOM 43 C LYS A 23 6.152 -6.531 1.688 1.00 10.00 C ATOM 44 O LYS A 23 6.297 -7.096 2.776 1.00 10.00 O ATOM 45 CB LYS A 23 7.400 -8.169 0.259 1.00 10.00 C ATOM 46 CG LYS A 23 6.203 -8.853 -0.370 1.00 10.00 C ATOM 47 CD LYS A 23 6.345 -10.364 -0.313 1.00 10.00 C ATOM 48 CE LYS A 23 5.953 -10.912 1.052 1.00 10.00 C ATOM 49 NZ LYS A 23 7.104 -11.014 1.993 1.00 10.00 N ATOM 0 H LYS A 23 9.029 -6.637 1.540 1.00 10.00 H new ATOM 0 HA LYS A 23 6.785 -6.191 -0.316 1.00 10.00 H new ATOM 0 HB2 LYS A 23 8.254 -8.265 -0.411 1.00 10.00 H new ATOM 0 HB3 LYS A 23 7.659 -8.688 1.182 1.00 10.00 H new ATOM 0 HG2 LYS A 23 5.293 -8.550 0.148 1.00 10.00 H new ATOM 0 HG3 LYS A 23 6.101 -8.533 -1.407 1.00 10.00 H new ATOM 0 HD2 LYS A 23 5.719 -10.818 -1.081 1.00 10.00 H new ATOM 0 HD3 LYS A 23 7.375 -10.642 -0.535 1.00 10.00 H new ATOM 0 HE2 LYS A 23 5.189 -10.269 1.490 1.00 10.00 H new ATOM 0 HE3 LYS A 23 5.506 -11.898 0.926 1.00 10.00 H new ATOM 0 HZ1 LYS A 23 6.892 -11.721 2.726 1.00 10.00 H new ATOM 0 HZ2 LYS A 23 7.955 -11.303 1.470 1.00 10.00 H new ATOM 0 HZ3 LYS A 23 7.269 -10.090 2.441 1.00 10.00 H new ATOM 63 N LEU A 24 5.119 -5.751 1.416 1.00 10.00 N ATOM 64 CA LEU A 24 4.058 -5.513 2.383 1.00 10.00 C ATOM 65 C LEU A 24 2.843 -6.373 2.054 1.00 10.00 C ATOM 66 O LEU A 24 2.525 -6.588 0.886 1.00 10.00 O ATOM 67 CB LEU A 24 3.664 -4.034 2.385 1.00 10.00 C ATOM 68 CG LEU A 24 4.800 -3.053 2.681 1.00 10.00 C ATOM 69 CD1 LEU A 24 4.323 -1.620 2.503 1.00 10.00 C ATOM 70 CD2 LEU A 24 5.338 -3.261 4.087 1.00 10.00 C ATOM 0 H LEU A 24 4.992 -5.268 0.527 1.00 10.00 H new ATOM 0 HA LEU A 24 4.425 -5.782 3.374 1.00 10.00 H new ATOM 0 HB2 LEU A 24 3.238 -3.788 1.412 1.00 10.00 H new ATOM 0 HB3 LEU A 24 2.877 -3.886 3.124 1.00 10.00 H new ATOM 0 HG LEU A 24 5.608 -3.242 1.974 1.00 10.00 H new ATOM 0 HD11 LEU A 24 5.143 -0.934 2.717 1.00 10.00 H new ATOM 0 HD12 LEU A 24 3.986 -1.473 1.477 1.00 10.00 H new ATOM 0 HD13 LEU A 24 3.498 -1.424 3.187 1.00 10.00 H new ATOM 0 HD21 LEU A 24 6.145 -2.553 4.276 1.00 10.00 H new ATOM 0 HD22 LEU A 24 4.538 -3.101 4.810 1.00 10.00 H new ATOM 0 HD23 LEU A 24 5.717 -4.278 4.185 1.00 10.00 H new ATOM 82 N LYS A 25 2.168 -6.860 3.079 1.00 10.00 N ATOM 83 CA LYS A 25 0.995 -7.696 2.884 1.00 10.00 C ATOM 84 C LYS A 25 -0.278 -6.863 2.989 1.00 10.00 C ATOM 85 O LYS A 25 -0.653 -6.420 4.076 1.00 10.00 O ATOM 86 CB LYS A 25 0.971 -8.824 3.919 1.00 10.00 C ATOM 87 CG LYS A 25 2.301 -9.550 4.066 1.00 10.00 C ATOM 88 CD LYS A 25 2.315 -10.448 5.295 1.00 10.00 C ATOM 89 CE LYS A 25 1.711 -11.811 5.000 1.00 10.00 C ATOM 90 NZ LYS A 25 2.672 -12.707 4.309 1.00 10.00 N ATOM 0 H LYS A 25 2.411 -6.692 4.055 1.00 10.00 H new ATOM 0 HA LYS A 25 1.044 -8.133 1.886 1.00 10.00 H new ATOM 0 HB2 LYS A 25 0.684 -8.411 4.886 1.00 10.00 H new ATOM 0 HB3 LYS A 25 0.203 -9.545 3.639 1.00 10.00 H new ATOM 0 HG2 LYS A 25 2.490 -10.149 3.175 1.00 10.00 H new ATOM 0 HG3 LYS A 25 3.108 -8.821 4.138 1.00 10.00 H new ATOM 0 HD2 LYS A 25 3.340 -10.572 5.644 1.00 10.00 H new ATOM 0 HD3 LYS A 25 1.759 -9.970 6.102 1.00 10.00 H new ATOM 0 HE2 LYS A 25 1.389 -12.275 5.933 1.00 10.00 H new ATOM 0 HE3 LYS A 25 0.822 -11.687 4.382 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 2.150 -13.410 3.748 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 3.280 -12.145 3.680 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 3.261 -13.195 5.014 1.00 10.00 H new ATOM 104 N VAL A 26 -0.929 -6.647 1.857 1.00 10.00 N ATOM 105 CA VAL A 26 -2.159 -5.868 1.820 1.00 10.00 C ATOM 106 C VAL A 26 -3.354 -6.788 2.019 1.00 10.00 C ATOM 107 O VAL A 26 -3.557 -7.737 1.257 1.00 10.00 O ATOM 108 CB VAL A 26 -2.326 -5.103 0.491 1.00 10.00 C ATOM 109 CG1 VAL A 26 -3.252 -3.911 0.670 1.00 10.00 C ATOM 110 CG2 VAL A 26 -0.981 -4.656 -0.055 1.00 10.00 C ATOM 0 H VAL A 26 -0.626 -7.000 0.949 1.00 10.00 H new ATOM 0 HA VAL A 26 -2.103 -5.134 2.624 1.00 10.00 H new ATOM 0 HB VAL A 26 -2.775 -5.783 -0.233 1.00 10.00 H new ATOM 0 HG11 VAL A 26 -3.356 -3.385 -0.279 1.00 10.00 H new ATOM 0 HG12 VAL A 26 -4.231 -4.257 1.002 1.00 10.00 H new ATOM 0 HG13 VAL A 26 -2.834 -3.234 1.415 1.00 10.00 H new ATOM 0 HG21 VAL A 26 -1.129 -4.119 -0.992 1.00 10.00 H new ATOM 0 HG22 VAL A 26 -0.496 -3.999 0.667 1.00 10.00 H new ATOM 0 HG23 VAL A 26 -0.352 -5.528 -0.232 1.00 10.00 H new ATOM 120 N ILE A 27 -4.136 -6.509 3.047 1.00 10.00 N ATOM 121 CA ILE A 27 -5.299 -7.320 3.363 1.00 10.00 C ATOM 122 C ILE A 27 -6.592 -6.644 2.926 1.00 10.00 C ATOM 123 O ILE A 27 -6.905 -5.532 3.361 1.00 10.00 O ATOM 124 CB ILE A 27 -5.378 -7.612 4.876 1.00 10.00 C ATOM 125 CG1 ILE A 27 -4.053 -8.194 5.386 1.00 10.00 C ATOM 126 CG2 ILE A 27 -6.533 -8.559 5.177 1.00 10.00 C ATOM 127 CD1 ILE A 27 -3.665 -9.506 4.736 1.00 10.00 C ATOM 0 H ILE A 27 -3.986 -5.723 3.680 1.00 10.00 H new ATOM 0 HA ILE A 27 -5.184 -8.255 2.815 1.00 10.00 H new ATOM 0 HB ILE A 27 -5.559 -6.672 5.398 1.00 10.00 H new ATOM 0 HG12 ILE A 27 -3.259 -7.467 5.215 1.00 10.00 H new ATOM 0 HG13 ILE A 27 -4.124 -8.341 6.464 1.00 10.00 H new ATOM 0 HG21 ILE A 27 -6.574 -8.754 6.249 1.00 10.00 H new ATOM 0 HG22 ILE A 27 -7.470 -8.104 4.855 1.00 10.00 H new ATOM 0 HG23 ILE A 27 -6.383 -9.497 4.643 1.00 10.00 H new ATOM 0 HD11 ILE A 27 -2.718 -9.851 5.150 1.00 10.00 H new ATOM 0 HD12 ILE A 27 -4.438 -10.250 4.929 1.00 10.00 H new ATOM 0 HD13 ILE A 27 -3.560 -9.362 3.661 1.00 10.00 H new ATOM 139 N GLY A 28 -7.329 -7.318 2.054 1.00 10.00 N ATOM 140 CA GLY A 28 -8.595 -6.793 1.590 1.00 10.00 C ATOM 141 C GLY A 28 -9.751 -7.331 2.412 1.00 10.00 C ATOM 142 O GLY A 28 -9.553 -8.182 3.285 1.00 10.00 O ATOM 0 H GLY A 28 -7.070 -8.222 1.659 1.00 10.00 H new ATOM 0 HA2 GLY A 28 -8.582 -5.705 1.646 1.00 10.00 H new ATOM 0 HA3 GLY A 28 -8.738 -7.056 0.542 1.00 10.00 H new ATOM 146 N GLN A 29 -10.958 -6.860 2.128 1.00 10.00 N ATOM 147 CA GLN A 29 -12.141 -7.298 2.863 1.00 10.00 C ATOM 148 C GLN A 29 -12.512 -8.735 2.500 1.00 10.00 C ATOM 149 O GLN A 29 -13.202 -9.422 3.254 1.00 10.00 O ATOM 150 CB GLN A 29 -13.317 -6.357 2.585 1.00 10.00 C ATOM 151 CG GLN A 29 -14.543 -6.629 3.443 1.00 10.00 C ATOM 152 CD GLN A 29 -14.235 -6.610 4.927 1.00 10.00 C ATOM 153 OE1 GLN A 29 -14.290 -5.564 5.571 1.00 10.00 O ATOM 154 NE2 GLN A 29 -13.913 -7.769 5.481 1.00 10.00 N ATOM 0 H GLN A 29 -11.145 -6.176 1.395 1.00 10.00 H new ATOM 0 HA GLN A 29 -11.910 -7.268 3.928 1.00 10.00 H new ATOM 0 HB2 GLN A 29 -12.993 -5.329 2.748 1.00 10.00 H new ATOM 0 HB3 GLN A 29 -13.596 -6.441 1.535 1.00 10.00 H new ATOM 0 HG2 GLN A 29 -15.307 -5.882 3.225 1.00 10.00 H new ATOM 0 HG3 GLN A 29 -14.961 -7.600 3.175 1.00 10.00 H new ATOM 0 HE21 GLN A 29 -13.879 -8.614 4.911 1.00 10.00 H new ATOM 0 HE22 GLN A 29 -13.699 -7.816 6.477 1.00 10.00 H new ATOM 163 N ASP A 30 -12.027 -9.193 1.354 1.00 10.00 N ATOM 164 CA ASP A 30 -12.306 -10.546 0.890 1.00 10.00 C ATOM 165 C ASP A 30 -11.310 -11.533 1.489 1.00 10.00 C ATOM 166 O ASP A 30 -11.309 -12.720 1.144 1.00 10.00 O ATOM 167 CB ASP A 30 -12.242 -10.609 -0.638 1.00 10.00 C ATOM 168 CG ASP A 30 -10.819 -10.652 -1.156 1.00 10.00 C ATOM 169 OD1 ASP A 30 -10.495 -11.573 -1.936 1.00 10.00 O ATOM 170 OD2 ASP A 30 -10.018 -9.771 -0.786 1.00 10.00 O ATOM 0 H ASP A 30 -11.437 -8.646 0.727 1.00 10.00 H new ATOM 0 HA ASP A 30 -13.310 -10.818 1.215 1.00 10.00 H new ATOM 0 HB2 ASP A 30 -12.779 -11.492 -0.985 1.00 10.00 H new ATOM 0 HB3 ASP A 30 -12.752 -9.741 -1.056 1.00 10.00 H new ATOM 175 N SER A 31 -10.470 -11.026 2.393 1.00 10.00 N ATOM 176 CA SER A 31 -9.451 -11.826 3.057 1.00 10.00 C ATOM 177 C SER A 31 -8.440 -12.341 2.040 1.00 10.00 C ATOM 178 O SER A 31 -8.429 -13.519 1.679 1.00 10.00 O ATOM 179 CB SER A 31 -10.084 -12.982 3.834 1.00 10.00 C ATOM 180 OG SER A 31 -11.195 -12.533 4.597 1.00 10.00 O ATOM 0 H SER A 31 -10.481 -10.048 2.682 1.00 10.00 H new ATOM 0 HA SER A 31 -8.927 -11.193 3.773 1.00 10.00 H new ATOM 0 HB2 SER A 31 -10.405 -13.759 3.140 1.00 10.00 H new ATOM 0 HB3 SER A 31 -9.342 -13.431 4.494 1.00 10.00 H new ATOM 0 HG SER A 31 -11.585 -13.289 5.084 1.00 10.00 H new ATOM 186 N SER A 32 -7.619 -11.424 1.557 1.00 10.00 N ATOM 187 CA SER A 32 -6.593 -11.736 0.583 1.00 10.00 C ATOM 188 C SER A 32 -5.206 -11.617 1.216 1.00 10.00 C ATOM 189 O SER A 32 -5.089 -11.306 2.405 1.00 10.00 O ATOM 190 CB SER A 32 -6.728 -10.781 -0.602 1.00 10.00 C ATOM 191 OG SER A 32 -7.442 -9.610 -0.221 1.00 10.00 O ATOM 0 H SER A 32 -7.647 -10.442 1.831 1.00 10.00 H new ATOM 0 HA SER A 32 -6.716 -12.762 0.236 1.00 10.00 H new ATOM 0 HB2 SER A 32 -5.739 -10.507 -0.970 1.00 10.00 H new ATOM 0 HB3 SER A 32 -7.246 -11.280 -1.421 1.00 10.00 H new ATOM 0 HG SER A 32 -8.294 -9.575 -0.704 1.00 10.00 H new ATOM 197 N GLU A 33 -4.171 -11.888 0.433 1.00 10.00 N ATOM 198 CA GLU A 33 -2.800 -11.793 0.910 1.00 10.00 C ATOM 199 C GLU A 33 -1.934 -11.145 -0.163 1.00 10.00 C ATOM 200 O GLU A 33 -0.913 -11.690 -0.572 1.00 10.00 O ATOM 201 CB GLU A 33 -2.261 -13.182 1.261 1.00 10.00 C ATOM 202 CG GLU A 33 -1.194 -13.167 2.345 1.00 10.00 C ATOM 203 CD GLU A 33 -0.048 -14.111 2.044 1.00 10.00 C ATOM 204 OE1 GLU A 33 1.074 -13.866 2.544 1.00 10.00 O ATOM 205 OE2 GLU A 33 -0.254 -15.094 1.300 1.00 10.00 O ATOM 0 H GLU A 33 -4.257 -12.177 -0.541 1.00 10.00 H new ATOM 0 HA GLU A 33 -2.775 -11.179 1.810 1.00 10.00 H new ATOM 0 HB2 GLU A 33 -3.089 -13.812 1.587 1.00 10.00 H new ATOM 0 HB3 GLU A 33 -1.847 -13.639 0.362 1.00 10.00 H new ATOM 0 HG2 GLU A 33 -0.807 -12.154 2.455 1.00 10.00 H new ATOM 0 HG3 GLU A 33 -1.645 -13.441 3.299 1.00 10.00 H new ATOM 212 N ILE A 34 -2.358 -9.975 -0.620 1.00 10.00 N ATOM 213 CA ILE A 34 -1.641 -9.251 -1.663 1.00 10.00 C ATOM 214 C ILE A 34 -0.249 -8.846 -1.182 1.00 10.00 C ATOM 215 O ILE A 34 -0.087 -8.357 -0.066 1.00 10.00 O ATOM 216 CB ILE A 34 -2.421 -7.996 -2.108 1.00 10.00 C ATOM 217 CG1 ILE A 34 -3.902 -8.327 -2.332 1.00 10.00 C ATOM 218 CG2 ILE A 34 -1.812 -7.408 -3.370 1.00 10.00 C ATOM 219 CD1 ILE A 34 -4.149 -9.352 -3.422 1.00 10.00 C ATOM 0 H ILE A 34 -3.198 -9.505 -0.284 1.00 10.00 H new ATOM 0 HA ILE A 34 -1.542 -9.921 -2.517 1.00 10.00 H new ATOM 0 HB ILE A 34 -2.353 -7.254 -1.313 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -4.326 -8.696 -1.398 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -4.434 -7.410 -2.583 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -2.376 -6.524 -3.668 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -0.776 -7.130 -3.178 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -1.847 -8.148 -4.170 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -5.220 -9.530 -3.518 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -3.757 -8.979 -4.368 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -3.647 -10.285 -3.165 1.00 10.00 H new ATOM 231 N HIS A 35 0.747 -9.048 -2.028 1.00 10.00 N ATOM 232 CA HIS A 35 2.121 -8.724 -1.681 1.00 10.00 C ATOM 233 C HIS A 35 2.599 -7.517 -2.471 1.00 10.00 C ATOM 234 O HIS A 35 2.984 -7.638 -3.629 1.00 10.00 O ATOM 235 CB HIS A 35 3.037 -9.914 -1.965 1.00 10.00 C ATOM 236 CG HIS A 35 2.878 -11.061 -1.014 1.00 10.00 C ATOM 237 ND1 HIS A 35 3.504 -12.259 -1.241 1.00 10.00 N ATOM 238 CD2 HIS A 35 2.180 -11.140 0.145 1.00 10.00 C ATOM 239 CE1 HIS A 35 3.181 -13.034 -0.225 1.00 10.00 C ATOM 240 NE2 HIS A 35 2.378 -12.403 0.642 1.00 10.00 N ATOM 0 H HIS A 35 0.629 -9.436 -2.964 1.00 10.00 H new ATOM 0 HA HIS A 35 2.156 -8.490 -0.617 1.00 10.00 H new ATOM 0 HB2 HIS A 35 2.847 -10.269 -2.978 1.00 10.00 H new ATOM 0 HB3 HIS A 35 4.072 -9.575 -1.935 1.00 10.00 H new ATOM 0 HD2 HIS A 35 1.583 -10.359 0.591 1.00 10.00 H new ATOM 0 HE1 HIS A 35 3.522 -14.052 -0.106 1.00 10.00 H new ATOM 0 HE2 HIS A 35 1.990 -12.787 1.504 1.00 10.00 H new ATOM 248 N PHE A 36 2.585 -6.359 -1.843 1.00 10.00 N ATOM 249 CA PHE A 36 3.008 -5.132 -2.500 1.00 10.00 C ATOM 250 C PHE A 36 4.495 -4.890 -2.267 1.00 10.00 C ATOM 251 O PHE A 36 4.923 -4.662 -1.135 1.00 10.00 O ATOM 252 CB PHE A 36 2.188 -3.946 -1.975 1.00 10.00 C ATOM 253 CG PHE A 36 2.210 -2.722 -2.858 1.00 10.00 C ATOM 254 CD1 PHE A 36 2.849 -2.733 -4.090 1.00 10.00 C ATOM 255 CD2 PHE A 36 1.581 -1.558 -2.446 1.00 10.00 C ATOM 256 CE1 PHE A 36 2.857 -1.608 -4.891 1.00 10.00 C ATOM 257 CE2 PHE A 36 1.587 -0.429 -3.243 1.00 10.00 C ATOM 258 CZ PHE A 36 2.226 -0.454 -4.467 1.00 10.00 C ATOM 0 H PHE A 36 2.285 -6.238 -0.876 1.00 10.00 H new ATOM 0 HA PHE A 36 2.838 -5.232 -3.572 1.00 10.00 H new ATOM 0 HB2 PHE A 36 1.154 -4.266 -1.847 1.00 10.00 H new ATOM 0 HB3 PHE A 36 2.562 -3.672 -0.988 1.00 10.00 H new ATOM 0 HD1 PHE A 36 3.346 -3.631 -4.426 1.00 10.00 H new ATOM 0 HD2 PHE A 36 1.080 -1.533 -1.490 1.00 10.00 H new ATOM 0 HE1 PHE A 36 3.356 -1.630 -5.848 1.00 10.00 H new ATOM 0 HE2 PHE A 36 1.093 0.471 -2.909 1.00 10.00 H new ATOM 0 HZ PHE A 36 2.233 0.427 -5.092 1.00 10.00 H new ATOM 268 N LYS A 37 5.281 -4.952 -3.333 1.00 10.00 N ATOM 269 CA LYS A 37 6.715 -4.724 -3.225 1.00 10.00 C ATOM 270 C LYS A 37 7.017 -3.238 -3.396 1.00 10.00 C ATOM 271 O LYS A 37 7.012 -2.713 -4.510 1.00 10.00 O ATOM 272 CB LYS A 37 7.482 -5.558 -4.254 1.00 10.00 C ATOM 273 CG LYS A 37 7.257 -7.055 -4.110 1.00 10.00 C ATOM 274 CD LYS A 37 8.298 -7.858 -4.875 1.00 10.00 C ATOM 275 CE LYS A 37 8.016 -9.351 -4.799 1.00 10.00 C ATOM 276 NZ LYS A 37 9.070 -10.152 -5.475 1.00 10.00 N ATOM 0 H LYS A 37 4.953 -5.157 -4.277 1.00 10.00 H new ATOM 0 HA LYS A 37 7.045 -5.038 -2.235 1.00 10.00 H new ATOM 0 HB2 LYS A 37 7.184 -5.248 -5.256 1.00 10.00 H new ATOM 0 HB3 LYS A 37 8.547 -5.348 -4.159 1.00 10.00 H new ATOM 0 HG2 LYS A 37 7.290 -7.328 -3.055 1.00 10.00 H new ATOM 0 HG3 LYS A 37 6.262 -7.310 -4.474 1.00 10.00 H new ATOM 0 HD2 LYS A 37 8.309 -7.541 -5.918 1.00 10.00 H new ATOM 0 HD3 LYS A 37 9.288 -7.652 -4.469 1.00 10.00 H new ATOM 0 HE2 LYS A 37 7.945 -9.654 -3.754 1.00 10.00 H new ATOM 0 HE3 LYS A 37 7.050 -9.561 -5.258 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 8.839 -11.163 -5.400 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 9.121 -9.882 -6.478 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 9.988 -9.972 -5.021 1.00 10.00 H new ATOM 290 N VAL A 38 7.270 -2.570 -2.281 1.00 10.00 N ATOM 291 CA VAL A 38 7.545 -1.139 -2.285 1.00 10.00 C ATOM 292 C VAL A 38 9.043 -0.849 -2.224 1.00 10.00 C ATOM 293 O VAL A 38 9.855 -1.731 -1.932 1.00 10.00 O ATOM 294 CB VAL A 38 6.845 -0.431 -1.103 1.00 10.00 C ATOM 295 CG1 VAL A 38 5.345 -0.670 -1.150 1.00 10.00 C ATOM 296 CG2 VAL A 38 7.421 -0.894 0.230 1.00 10.00 C ATOM 0 H VAL A 38 7.291 -2.998 -1.355 1.00 10.00 H new ATOM 0 HA VAL A 38 7.150 -0.751 -3.224 1.00 10.00 H new ATOM 0 HB VAL A 38 7.027 0.640 -1.195 1.00 10.00 H new ATOM 0 HG11 VAL A 38 4.869 -0.164 -0.310 1.00 10.00 H new ATOM 0 HG12 VAL A 38 4.943 -0.278 -2.084 1.00 10.00 H new ATOM 0 HG13 VAL A 38 5.145 -1.740 -1.089 1.00 10.00 H new ATOM 0 HG21 VAL A 38 6.911 -0.380 1.045 1.00 10.00 H new ATOM 0 HG22 VAL A 38 7.279 -1.970 0.334 1.00 10.00 H new ATOM 0 HG23 VAL A 38 8.486 -0.663 0.266 1.00 10.00 H new ATOM 306 N LYS A 39 9.395 0.402 -2.487 1.00 10.00 N ATOM 307 CA LYS A 39 10.782 0.834 -2.476 1.00 10.00 C ATOM 308 C LYS A 39 11.083 1.615 -1.199 1.00 10.00 C ATOM 309 O LYS A 39 10.412 2.605 -0.896 1.00 10.00 O ATOM 310 CB LYS A 39 11.060 1.699 -3.705 1.00 10.00 C ATOM 311 CG LYS A 39 12.484 1.602 -4.225 1.00 10.00 C ATOM 312 CD LYS A 39 12.608 2.260 -5.588 1.00 10.00 C ATOM 313 CE LYS A 39 14.027 2.199 -6.123 1.00 10.00 C ATOM 314 NZ LYS A 39 14.132 2.798 -7.480 1.00 10.00 N ATOM 0 H LYS A 39 8.729 1.141 -2.713 1.00 10.00 H new ATOM 0 HA LYS A 39 11.429 -0.043 -2.504 1.00 10.00 H new ATOM 0 HB2 LYS A 39 10.374 1.411 -4.501 1.00 10.00 H new ATOM 0 HB3 LYS A 39 10.845 2.739 -3.460 1.00 10.00 H new ATOM 0 HG2 LYS A 39 13.166 2.081 -3.522 1.00 10.00 H new ATOM 0 HG3 LYS A 39 12.780 0.555 -4.294 1.00 10.00 H new ATOM 0 HD2 LYS A 39 11.935 1.769 -6.290 1.00 10.00 H new ATOM 0 HD3 LYS A 39 12.292 3.301 -5.518 1.00 10.00 H new ATOM 0 HE2 LYS A 39 14.695 2.725 -5.441 1.00 10.00 H new ATOM 0 HE3 LYS A 39 14.358 1.161 -6.157 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 15.125 2.783 -7.790 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 13.553 2.250 -8.147 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 13.792 3.781 -7.453 1.00 10.00 H new ATOM 328 N MET A 40 12.088 1.169 -0.455 1.00 10.00 N ATOM 329 CA MET A 40 12.469 1.821 0.794 1.00 10.00 C ATOM 330 C MET A 40 13.334 3.052 0.521 1.00 10.00 C ATOM 331 O MET A 40 14.553 3.031 0.710 1.00 10.00 O ATOM 332 CB MET A 40 13.204 0.825 1.707 1.00 10.00 C ATOM 333 CG MET A 40 13.734 1.429 3.003 1.00 10.00 C ATOM 334 SD MET A 40 12.441 2.167 4.019 1.00 10.00 S ATOM 335 CE MET A 40 11.611 0.698 4.621 1.00 10.00 C ATOM 0 H MET A 40 12.656 0.356 -0.695 1.00 10.00 H new ATOM 0 HA MET A 40 11.565 2.155 1.303 1.00 10.00 H new ATOM 0 HB2 MET A 40 12.526 0.008 1.952 1.00 10.00 H new ATOM 0 HB3 MET A 40 14.038 0.392 1.155 1.00 10.00 H new ATOM 0 HG2 MET A 40 14.241 0.654 3.577 1.00 10.00 H new ATOM 0 HG3 MET A 40 14.479 2.188 2.765 1.00 10.00 H new ATOM 0 HE1 MET A 40 11.109 0.923 5.562 1.00 10.00 H new ATOM 0 HE2 MET A 40 10.875 0.369 3.887 1.00 10.00 H new ATOM 0 HE3 MET A 40 12.343 -0.094 4.781 1.00 10.00 H new ATOM 345 N THR A 41 12.691 4.119 0.056 1.00 10.00 N ATOM 346 CA THR A 41 13.375 5.372 -0.242 1.00 10.00 C ATOM 347 C THR A 41 12.414 6.377 -0.880 1.00 10.00 C ATOM 348 O THR A 41 12.565 7.587 -0.709 1.00 10.00 O ATOM 349 CB THR A 41 14.606 5.158 -1.164 1.00 10.00 C ATOM 350 OG1 THR A 41 15.463 6.309 -1.128 1.00 10.00 O ATOM 351 CG2 THR A 41 14.191 4.876 -2.603 1.00 10.00 C ATOM 0 H THR A 41 11.687 4.139 -0.124 1.00 10.00 H new ATOM 0 HA THR A 41 13.733 5.772 0.707 1.00 10.00 H new ATOM 0 HB THR A 41 15.145 4.288 -0.789 1.00 10.00 H new ATOM 0 HG1 THR A 41 16.236 6.160 -1.712 1.00 10.00 H new ATOM 0 HG21 THR A 41 15.080 4.732 -3.217 1.00 10.00 H new ATOM 0 HG22 THR A 41 13.578 3.975 -2.635 1.00 10.00 H new ATOM 0 HG23 THR A 41 13.617 5.719 -2.988 1.00 10.00 H new ATOM 359 N THR A 42 11.421 5.871 -1.598 1.00 10.00 N ATOM 360 CA THR A 42 10.446 6.720 -2.260 1.00 10.00 C ATOM 361 C THR A 42 9.219 6.931 -1.376 1.00 10.00 C ATOM 362 O THR A 42 8.897 6.086 -0.538 1.00 10.00 O ATOM 363 CB THR A 42 10.007 6.093 -3.598 1.00 10.00 C ATOM 364 OG1 THR A 42 11.147 5.546 -4.274 1.00 10.00 O ATOM 365 CG2 THR A 42 9.330 7.123 -4.491 1.00 10.00 C ATOM 0 H THR A 42 11.271 4.872 -1.736 1.00 10.00 H new ATOM 0 HA THR A 42 10.918 7.684 -2.448 1.00 10.00 H new ATOM 0 HB THR A 42 9.290 5.301 -3.383 1.00 10.00 H new ATOM 0 HG1 THR A 42 10.868 4.779 -4.817 1.00 10.00 H new ATOM 0 HG21 THR A 42 9.031 6.652 -5.428 1.00 10.00 H new ATOM 0 HG22 THR A 42 8.449 7.519 -3.986 1.00 10.00 H new ATOM 0 HG23 THR A 42 10.025 7.937 -4.699 1.00 10.00 H new ATOM 373 N HIS A 43 8.557 8.070 -1.551 1.00 10.00 N ATOM 374 CA HIS A 43 7.354 8.387 -0.793 1.00 10.00 C ATOM 375 C HIS A 43 6.259 7.388 -1.115 1.00 10.00 C ATOM 376 O HIS A 43 6.182 6.880 -2.237 1.00 10.00 O ATOM 377 CB HIS A 43 6.866 9.799 -1.123 1.00 10.00 C ATOM 378 CG HIS A 43 7.657 10.882 -0.460 1.00 10.00 C ATOM 379 ND1 HIS A 43 8.817 11.363 -1.013 1.00 10.00 N ATOM 380 CD2 HIS A 43 7.406 11.546 0.691 1.00 10.00 C ATOM 381 CE1 HIS A 43 9.242 12.306 -0.193 1.00 10.00 C ATOM 382 NE2 HIS A 43 8.421 12.452 0.856 1.00 10.00 N ATOM 0 H HIS A 43 8.836 8.792 -2.215 1.00 10.00 H new ATOM 0 HA HIS A 43 7.595 8.335 0.269 1.00 10.00 H new ATOM 0 HB2 HIS A 43 6.904 9.943 -2.203 1.00 10.00 H new ATOM 0 HB3 HIS A 43 5.821 9.891 -0.826 1.00 10.00 H new ATOM 0 HD2 HIS A 43 6.567 11.392 1.353 1.00 10.00 H new ATOM 0 HE1 HIS A 43 10.139 12.887 -0.348 1.00 10.00 H new ATOM 0 HE2 HIS A 43 8.530 13.110 1.628 1.00 10.00 H new ATOM 390 N LEU A 44 5.400 7.122 -0.142 1.00 10.00 N ATOM 391 CA LEU A 44 4.308 6.179 -0.328 1.00 10.00 C ATOM 392 C LEU A 44 3.274 6.735 -1.300 1.00 10.00 C ATOM 393 O LEU A 44 2.344 6.039 -1.694 1.00 10.00 O ATOM 394 CB LEU A 44 3.664 5.832 1.016 1.00 10.00 C ATOM 395 CG LEU A 44 4.496 4.889 1.893 1.00 10.00 C ATOM 396 CD1 LEU A 44 3.999 4.894 3.327 1.00 10.00 C ATOM 397 CD2 LEU A 44 4.475 3.476 1.329 1.00 10.00 C ATOM 0 H LEU A 44 5.438 7.546 0.785 1.00 10.00 H new ATOM 0 HA LEU A 44 4.714 5.263 -0.757 1.00 10.00 H new ATOM 0 HB2 LEU A 44 3.482 6.755 1.567 1.00 10.00 H new ATOM 0 HB3 LEU A 44 2.692 5.374 0.832 1.00 10.00 H new ATOM 0 HG LEU A 44 5.524 5.250 1.890 1.00 10.00 H new ATOM 0 HD11 LEU A 44 4.608 4.216 3.925 1.00 10.00 H new ATOM 0 HD12 LEU A 44 4.072 5.903 3.734 1.00 10.00 H new ATOM 0 HD13 LEU A 44 2.960 4.567 3.353 1.00 10.00 H new ATOM 0 HD21 LEU A 44 5.071 2.821 1.965 1.00 10.00 H new ATOM 0 HD22 LEU A 44 3.448 3.113 1.296 1.00 10.00 H new ATOM 0 HD23 LEU A 44 4.891 3.480 0.322 1.00 10.00 H new ATOM 409 N LYS A 45 3.456 7.994 -1.684 1.00 10.00 N ATOM 410 CA LYS A 45 2.577 8.658 -2.636 1.00 10.00 C ATOM 411 C LYS A 45 2.514 7.865 -3.937 1.00 10.00 C ATOM 412 O LYS A 45 1.434 7.503 -4.410 1.00 10.00 O ATOM 413 CB LYS A 45 3.094 10.076 -2.917 1.00 10.00 C ATOM 414 CG LYS A 45 2.466 10.737 -4.132 1.00 10.00 C ATOM 415 CD LYS A 45 1.027 11.130 -3.867 1.00 10.00 C ATOM 416 CE LYS A 45 0.282 11.424 -5.155 1.00 10.00 C ATOM 417 NZ LYS A 45 -1.127 11.833 -4.899 1.00 10.00 N ATOM 0 H LYS A 45 4.217 8.581 -1.343 1.00 10.00 H new ATOM 0 HA LYS A 45 1.575 8.716 -2.210 1.00 10.00 H new ATOM 0 HB2 LYS A 45 2.908 10.699 -2.042 1.00 10.00 H new ATOM 0 HB3 LYS A 45 4.174 10.036 -3.057 1.00 10.00 H new ATOM 0 HG2 LYS A 45 3.042 11.621 -4.405 1.00 10.00 H new ATOM 0 HG3 LYS A 45 2.508 10.055 -4.981 1.00 10.00 H new ATOM 0 HD2 LYS A 45 0.523 10.327 -3.330 1.00 10.00 H new ATOM 0 HD3 LYS A 45 1.002 12.009 -3.223 1.00 10.00 H new ATOM 0 HE2 LYS A 45 0.797 12.215 -5.700 1.00 10.00 H new ATOM 0 HE3 LYS A 45 0.294 10.539 -5.791 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 -1.773 11.146 -5.337 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 -1.299 11.864 -3.874 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 -1.295 12.775 -5.307 1.00 10.00 H new ATOM 431 N LYS A 46 3.689 7.565 -4.482 1.00 10.00 N ATOM 432 CA LYS A 46 3.792 6.827 -5.735 1.00 10.00 C ATOM 433 C LYS A 46 3.291 5.399 -5.571 1.00 10.00 C ATOM 434 O LYS A 46 2.782 4.799 -6.514 1.00 10.00 O ATOM 435 CB LYS A 46 5.239 6.821 -6.233 1.00 10.00 C ATOM 436 CG LYS A 46 5.370 7.042 -7.732 1.00 10.00 C ATOM 437 CD LYS A 46 4.950 8.451 -8.127 1.00 10.00 C ATOM 438 CE LYS A 46 5.054 8.674 -9.627 1.00 10.00 C ATOM 439 NZ LYS A 46 4.092 7.832 -10.388 1.00 10.00 N ATOM 0 H LYS A 46 4.587 7.823 -4.073 1.00 10.00 H new ATOM 0 HA LYS A 46 3.165 7.328 -6.473 1.00 10.00 H new ATOM 0 HB2 LYS A 46 5.797 7.597 -5.710 1.00 10.00 H new ATOM 0 HB3 LYS A 46 5.699 5.868 -5.974 1.00 10.00 H new ATOM 0 HG2 LYS A 46 6.402 6.870 -8.037 1.00 10.00 H new ATOM 0 HG3 LYS A 46 4.755 6.316 -8.263 1.00 10.00 H new ATOM 0 HD2 LYS A 46 3.924 8.628 -7.804 1.00 10.00 H new ATOM 0 HD3 LYS A 46 5.577 9.176 -7.608 1.00 10.00 H new ATOM 0 HE2 LYS A 46 4.870 9.725 -9.850 1.00 10.00 H new ATOM 0 HE3 LYS A 46 6.069 8.451 -9.956 1.00 10.00 H new ATOM 0 HZ1 LYS A 46 3.819 8.322 -11.264 1.00 10.00 H new ATOM 0 HZ2 LYS A 46 4.538 6.923 -10.625 1.00 10.00 H new ATOM 0 HZ3 LYS A 46 3.246 7.661 -9.808 1.00 10.00 H new ATOM 453 N LEU A 47 3.430 4.860 -4.371 1.00 10.00 N ATOM 454 CA LEU A 47 2.983 3.501 -4.097 1.00 10.00 C ATOM 455 C LEU A 47 1.459 3.448 -4.011 1.00 10.00 C ATOM 456 O LEU A 47 0.826 2.558 -4.581 1.00 10.00 O ATOM 457 CB LEU A 47 3.603 2.975 -2.796 1.00 10.00 C ATOM 458 CG LEU A 47 5.069 2.524 -2.884 1.00 10.00 C ATOM 459 CD1 LEU A 47 5.308 1.695 -4.134 1.00 10.00 C ATOM 460 CD2 LEU A 47 6.010 3.716 -2.855 1.00 10.00 C ATOM 0 H LEU A 47 3.847 5.339 -3.573 1.00 10.00 H new ATOM 0 HA LEU A 47 3.312 2.864 -4.918 1.00 10.00 H new ATOM 0 HB2 LEU A 47 3.528 3.756 -2.039 1.00 10.00 H new ATOM 0 HB3 LEU A 47 3.005 2.134 -2.446 1.00 10.00 H new ATOM 0 HG LEU A 47 5.276 1.903 -2.013 1.00 10.00 H new ATOM 0 HD11 LEU A 47 6.353 1.388 -4.173 1.00 10.00 H new ATOM 0 HD12 LEU A 47 4.671 0.811 -4.112 1.00 10.00 H new ATOM 0 HD13 LEU A 47 5.072 2.290 -5.016 1.00 10.00 H new ATOM 0 HD21 LEU A 47 7.041 3.367 -2.919 1.00 10.00 H new ATOM 0 HD22 LEU A 47 5.795 4.370 -3.700 1.00 10.00 H new ATOM 0 HD23 LEU A 47 5.870 4.267 -1.925 1.00 10.00 H new ATOM 472 N LYS A 48 0.879 4.417 -3.310 1.00 10.00 N ATOM 473 CA LYS A 48 -0.569 4.490 -3.141 1.00 10.00 C ATOM 474 C LYS A 48 -1.284 4.619 -4.485 1.00 10.00 C ATOM 475 O LYS A 48 -2.252 3.902 -4.747 1.00 10.00 O ATOM 476 CB LYS A 48 -0.943 5.671 -2.244 1.00 10.00 C ATOM 477 CG LYS A 48 -0.611 5.453 -0.777 1.00 10.00 C ATOM 478 CD LYS A 48 -0.903 6.696 0.056 1.00 10.00 C ATOM 479 CE LYS A 48 -2.398 6.950 0.187 1.00 10.00 C ATOM 480 NZ LYS A 48 -2.690 8.219 0.906 1.00 10.00 N ATOM 0 H LYS A 48 1.393 5.167 -2.847 1.00 10.00 H new ATOM 0 HA LYS A 48 -0.891 3.561 -2.670 1.00 10.00 H new ATOM 0 HB2 LYS A 48 -0.424 6.562 -2.596 1.00 10.00 H new ATOM 0 HB3 LYS A 48 -2.011 5.865 -2.341 1.00 10.00 H new ATOM 0 HG2 LYS A 48 -1.190 4.613 -0.393 1.00 10.00 H new ATOM 0 HG3 LYS A 48 0.441 5.187 -0.677 1.00 10.00 H new ATOM 0 HD2 LYS A 48 -0.466 6.580 1.048 1.00 10.00 H new ATOM 0 HD3 LYS A 48 -0.426 7.562 -0.403 1.00 10.00 H new ATOM 0 HE2 LYS A 48 -2.848 6.985 -0.805 1.00 10.00 H new ATOM 0 HE3 LYS A 48 -2.861 6.118 0.718 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 -3.718 8.377 0.928 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 -2.329 8.158 1.879 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 -2.228 9.011 0.414 1.00 10.00 H new ATOM 494 N GLU A 49 -0.808 5.527 -5.332 1.00 10.00 N ATOM 495 CA GLU A 49 -1.424 5.737 -6.639 1.00 10.00 C ATOM 496 C GLU A 49 -1.276 4.496 -7.519 1.00 10.00 C ATOM 497 O GLU A 49 -2.209 4.121 -8.230 1.00 10.00 O ATOM 498 CB GLU A 49 -0.834 6.967 -7.341 1.00 10.00 C ATOM 499 CG GLU A 49 0.676 6.925 -7.496 1.00 10.00 C ATOM 500 CD GLU A 49 1.218 8.065 -8.335 1.00 10.00 C ATOM 501 OE1 GLU A 49 1.278 9.203 -7.830 1.00 10.00 O ATOM 502 OE2 GLU A 49 1.609 7.818 -9.498 1.00 10.00 O ATOM 0 H GLU A 49 -0.004 6.125 -5.140 1.00 10.00 H new ATOM 0 HA GLU A 49 -2.486 5.918 -6.477 1.00 10.00 H new ATOM 0 HB2 GLU A 49 -1.288 7.062 -8.328 1.00 10.00 H new ATOM 0 HB3 GLU A 49 -1.106 7.860 -6.778 1.00 10.00 H new ATOM 0 HG2 GLU A 49 1.138 6.956 -6.509 1.00 10.00 H new ATOM 0 HG3 GLU A 49 0.963 5.977 -7.952 1.00 10.00 H new ATOM 509 N SER A 50 -0.117 3.846 -7.448 1.00 10.00 N ATOM 510 CA SER A 50 0.133 2.648 -8.240 1.00 10.00 C ATOM 511 C SER A 50 -0.824 1.529 -7.850 1.00 10.00 C ATOM 512 O SER A 50 -1.281 0.771 -8.702 1.00 10.00 O ATOM 513 CB SER A 50 1.579 2.188 -8.072 1.00 10.00 C ATOM 514 OG SER A 50 2.481 3.186 -8.521 1.00 10.00 O ATOM 0 H SER A 50 0.661 4.129 -6.852 1.00 10.00 H new ATOM 0 HA SER A 50 -0.037 2.895 -9.288 1.00 10.00 H new ATOM 0 HB2 SER A 50 1.773 1.961 -7.024 1.00 10.00 H new ATOM 0 HB3 SER A 50 1.740 1.267 -8.633 1.00 10.00 H new ATOM 0 HG SER A 50 2.514 3.915 -7.867 1.00 10.00 H new ATOM 520 N TYR A 51 -1.124 1.425 -6.560 1.00 10.00 N ATOM 521 CA TYR A 51 -2.044 0.404 -6.086 1.00 10.00 C ATOM 522 C TYR A 51 -3.438 0.676 -6.638 1.00 10.00 C ATOM 523 O TYR A 51 -4.147 -0.247 -7.036 1.00 10.00 O ATOM 524 CB TYR A 51 -2.072 0.364 -4.556 1.00 10.00 C ATOM 525 CG TYR A 51 -2.770 -0.859 -3.994 1.00 10.00 C ATOM 526 CD1 TYR A 51 -2.089 -2.062 -3.850 1.00 10.00 C ATOM 527 CD2 TYR A 51 -4.107 -0.813 -3.614 1.00 10.00 C ATOM 528 CE1 TYR A 51 -2.720 -3.184 -3.347 1.00 10.00 C ATOM 529 CE2 TYR A 51 -4.744 -1.930 -3.107 1.00 10.00 C ATOM 530 CZ TYR A 51 -4.047 -3.112 -2.977 1.00 10.00 C ATOM 531 OH TYR A 51 -4.681 -4.228 -2.478 1.00 10.00 O ATOM 0 H TYR A 51 -0.746 2.031 -5.831 1.00 10.00 H new ATOM 0 HA TYR A 51 -1.702 -0.569 -6.440 1.00 10.00 H new ATOM 0 HB2 TYR A 51 -1.049 0.392 -4.181 1.00 10.00 H new ATOM 0 HB3 TYR A 51 -2.572 1.259 -4.186 1.00 10.00 H new ATOM 0 HD1 TYR A 51 -1.049 -2.121 -4.136 1.00 10.00 H new ATOM 0 HD2 TYR A 51 -4.657 0.111 -3.717 1.00 10.00 H new ATOM 0 HE1 TYR A 51 -2.177 -4.112 -3.244 1.00 10.00 H new ATOM 0 HE2 TYR A 51 -5.782 -1.877 -2.814 1.00 10.00 H new ATOM 0 HH TYR A 51 -5.612 -4.008 -2.265 1.00 10.00 H new ATOM 541 N CYS A 52 -3.817 1.951 -6.670 1.00 10.00 N ATOM 542 CA CYS A 52 -5.118 2.347 -7.193 1.00 10.00 C ATOM 543 C CYS A 52 -5.206 1.978 -8.669 1.00 10.00 C ATOM 544 O CYS A 52 -6.218 1.447 -9.131 1.00 10.00 O ATOM 545 CB CYS A 52 -5.340 3.853 -7.009 1.00 10.00 C ATOM 546 SG CYS A 52 -5.117 4.435 -5.309 1.00 10.00 S ATOM 0 H CYS A 52 -3.241 2.726 -6.340 1.00 10.00 H new ATOM 0 HA CYS A 52 -5.896 1.819 -6.641 1.00 10.00 H new ATOM 0 HB2 CYS A 52 -4.651 4.392 -7.659 1.00 10.00 H new ATOM 0 HB3 CYS A 52 -6.349 4.103 -7.337 1.00 10.00 H new ATOM 0 HG CYS A 52 -3.999 3.972 -4.835 1.00 10.00 H new ATOM 552 N GLN A 53 -4.125 2.244 -9.396 1.00 10.00 N ATOM 553 CA GLN A 53 -4.052 1.929 -10.817 1.00 10.00 C ATOM 554 C GLN A 53 -4.114 0.417 -11.022 1.00 10.00 C ATOM 555 O GLN A 53 -4.747 -0.066 -11.960 1.00 10.00 O ATOM 556 CB GLN A 53 -2.766 2.496 -11.423 1.00 10.00 C ATOM 557 CG GLN A 53 -2.674 4.013 -11.347 1.00 10.00 C ATOM 558 CD GLN A 53 -1.284 4.543 -11.650 1.00 10.00 C ATOM 559 OE1 GLN A 53 -0.281 3.862 -11.438 1.00 10.00 O ATOM 560 NE2 GLN A 53 -1.215 5.771 -12.141 1.00 10.00 N ATOM 0 H GLN A 53 -3.283 2.680 -9.020 1.00 10.00 H new ATOM 0 HA GLN A 53 -4.903 2.387 -11.322 1.00 10.00 H new ATOM 0 HB2 GLN A 53 -1.909 2.062 -10.907 1.00 10.00 H new ATOM 0 HB3 GLN A 53 -2.699 2.188 -12.467 1.00 10.00 H new ATOM 0 HG2 GLN A 53 -3.384 4.449 -12.050 1.00 10.00 H new ATOM 0 HG3 GLN A 53 -2.971 4.339 -10.350 1.00 10.00 H new ATOM 0 HE21 GLN A 53 -2.069 6.304 -12.303 1.00 10.00 H new ATOM 0 HE22 GLN A 53 -0.308 6.184 -12.357 1.00 10.00 H new ATOM 569 N ARG A 54 -3.454 -0.317 -10.131 1.00 10.00 N ATOM 570 CA ARG A 54 -3.438 -1.777 -10.184 1.00 10.00 C ATOM 571 C ARG A 54 -4.853 -2.335 -10.036 1.00 10.00 C ATOM 572 O ARG A 54 -5.227 -3.287 -10.717 1.00 10.00 O ATOM 573 CB ARG A 54 -2.533 -2.333 -9.076 1.00 10.00 C ATOM 574 CG ARG A 54 -2.517 -3.855 -8.984 1.00 10.00 C ATOM 575 CD ARG A 54 -1.546 -4.474 -9.977 1.00 10.00 C ATOM 576 NE ARG A 54 -1.258 -5.877 -9.663 1.00 10.00 N ATOM 577 CZ ARG A 54 -0.125 -6.502 -9.994 1.00 10.00 C ATOM 578 NH1 ARG A 54 0.831 -5.851 -10.646 1.00 10.00 N ATOM 579 NH2 ARG A 54 0.060 -7.776 -9.661 1.00 10.00 N ATOM 0 H ARG A 54 -2.919 0.078 -9.358 1.00 10.00 H new ATOM 0 HA ARG A 54 -3.045 -2.085 -11.153 1.00 10.00 H new ATOM 0 HB2 ARG A 54 -1.515 -1.980 -9.243 1.00 10.00 H new ATOM 0 HB3 ARG A 54 -2.859 -1.926 -8.119 1.00 10.00 H new ATOM 0 HG2 ARG A 54 -2.242 -4.154 -7.973 1.00 10.00 H new ATOM 0 HG3 ARG A 54 -3.520 -4.240 -9.169 1.00 10.00 H new ATOM 0 HD2 ARG A 54 -1.963 -4.406 -10.982 1.00 10.00 H new ATOM 0 HD3 ARG A 54 -0.617 -3.905 -9.978 1.00 10.00 H new ATOM 0 HE ARG A 54 -1.968 -6.409 -9.160 1.00 10.00 H new ATOM 0 HH11 ARG A 54 0.701 -4.871 -10.896 1.00 10.00 H new ATOM 0 HH12 ARG A 54 1.695 -6.331 -10.897 1.00 10.00 H new ATOM 0 HH21 ARG A 54 -0.665 -8.280 -9.151 1.00 10.00 H new ATOM 0 HH22 ARG A 54 0.927 -8.249 -9.916 1.00 10.00 H new ATOM 593 N GLN A 55 -5.635 -1.733 -9.146 1.00 10.00 N ATOM 594 CA GLN A 55 -7.010 -2.171 -8.921 1.00 10.00 C ATOM 595 C GLN A 55 -7.926 -1.653 -10.027 1.00 10.00 C ATOM 596 O GLN A 55 -8.965 -2.247 -10.320 1.00 10.00 O ATOM 597 CB GLN A 55 -7.520 -1.682 -7.559 1.00 10.00 C ATOM 598 CG GLN A 55 -6.651 -2.090 -6.378 1.00 10.00 C ATOM 599 CD GLN A 55 -6.375 -3.581 -6.326 1.00 10.00 C ATOM 600 OE1 GLN A 55 -5.342 -4.052 -6.802 1.00 10.00 O ATOM 601 NE2 GLN A 55 -7.301 -4.335 -5.757 1.00 10.00 N ATOM 0 H GLN A 55 -5.343 -0.943 -8.570 1.00 10.00 H new ATOM 0 HA GLN A 55 -7.020 -3.261 -8.931 1.00 10.00 H new ATOM 0 HB2 GLN A 55 -7.594 -0.595 -7.582 1.00 10.00 H new ATOM 0 HB3 GLN A 55 -8.528 -2.067 -7.403 1.00 10.00 H new ATOM 0 HG2 GLN A 55 -5.704 -1.553 -6.430 1.00 10.00 H new ATOM 0 HG3 GLN A 55 -7.140 -1.785 -5.453 1.00 10.00 H new ATOM 0 HE21 GLN A 55 -8.144 -3.906 -5.374 1.00 10.00 H new ATOM 0 HE22 GLN A 55 -7.172 -5.345 -5.701 1.00 10.00 H new ATOM 610 N GLY A 56 -7.536 -0.542 -10.636 1.00 10.00 N ATOM 611 CA GLY A 56 -8.329 0.043 -11.696 1.00 10.00 C ATOM 612 C GLY A 56 -9.305 1.076 -11.172 1.00 10.00 C ATOM 613 O GLY A 56 -10.412 1.217 -11.695 1.00 10.00 O ATOM 0 H GLY A 56 -6.680 -0.034 -10.413 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -7.669 0.507 -12.429 1.00 10.00 H new ATOM 0 HA3 GLY A 56 -8.877 -0.743 -12.214 1.00 10.00 H new ATOM 617 N VAL A 57 -8.898 1.793 -10.135 1.00 10.00 N ATOM 618 CA VAL A 57 -9.733 2.822 -9.530 1.00 10.00 C ATOM 619 C VAL A 57 -8.945 4.119 -9.365 1.00 10.00 C ATOM 620 O VAL A 57 -7.715 4.100 -9.326 1.00 10.00 O ATOM 621 CB VAL A 57 -10.274 2.377 -8.148 1.00 10.00 C ATOM 622 CG1 VAL A 57 -11.281 1.244 -8.294 1.00 10.00 C ATOM 623 CG2 VAL A 57 -9.135 1.963 -7.225 1.00 10.00 C ATOM 0 H VAL A 57 -7.987 1.680 -9.691 1.00 10.00 H new ATOM 0 HA VAL A 57 -10.579 2.986 -10.198 1.00 10.00 H new ATOM 0 HB VAL A 57 -10.784 3.230 -7.701 1.00 10.00 H new ATOM 0 HG11 VAL A 57 -11.645 0.951 -7.309 1.00 10.00 H new ATOM 0 HG12 VAL A 57 -12.119 1.579 -8.905 1.00 10.00 H new ATOM 0 HG13 VAL A 57 -10.801 0.390 -8.772 1.00 10.00 H new ATOM 0 HG21 VAL A 57 -9.541 1.655 -6.261 1.00 10.00 H new ATOM 0 HG22 VAL A 57 -8.589 1.132 -7.671 1.00 10.00 H new ATOM 0 HG23 VAL A 57 -8.459 2.806 -7.081 1.00 10.00 H new ATOM 633 N PRO A 58 -9.635 5.268 -9.293 1.00 10.00 N ATOM 634 CA PRO A 58 -8.977 6.563 -9.112 1.00 10.00 C ATOM 635 C PRO A 58 -8.358 6.676 -7.721 1.00 10.00 C ATOM 636 O PRO A 58 -8.692 5.903 -6.824 1.00 10.00 O ATOM 637 CB PRO A 58 -10.116 7.572 -9.277 1.00 10.00 C ATOM 638 CG PRO A 58 -11.349 6.812 -8.933 1.00 10.00 C ATOM 639 CD PRO A 58 -11.103 5.402 -9.390 1.00 10.00 C ATOM 0 HA PRO A 58 -8.160 6.720 -9.816 1.00 10.00 H new ATOM 0 HB2 PRO A 58 -9.983 8.430 -8.618 1.00 10.00 H new ATOM 0 HB3 PRO A 58 -10.160 7.957 -10.296 1.00 10.00 H new ATOM 0 HG2 PRO A 58 -11.543 6.847 -7.861 1.00 10.00 H new ATOM 0 HG3 PRO A 58 -12.221 7.237 -9.429 1.00 10.00 H new ATOM 0 HD2 PRO A 58 -11.616 4.678 -8.757 1.00 10.00 H new ATOM 0 HD3 PRO A 58 -11.456 5.241 -10.409 1.00 10.00 H new ATOM 647 N MET A 59 -7.465 7.634 -7.536 1.00 10.00 N ATOM 648 CA MET A 59 -6.819 7.812 -6.244 1.00 10.00 C ATOM 649 C MET A 59 -7.766 8.476 -5.252 1.00 10.00 C ATOM 650 O MET A 59 -8.727 9.137 -5.649 1.00 10.00 O ATOM 651 CB MET A 59 -5.539 8.638 -6.385 1.00 10.00 C ATOM 652 CG MET A 59 -4.499 8.310 -5.325 1.00 10.00 C ATOM 653 SD MET A 59 -3.097 9.443 -5.332 1.00 10.00 S ATOM 654 CE MET A 59 -2.114 8.745 -4.006 1.00 10.00 C ATOM 0 H MET A 59 -7.172 8.295 -8.255 1.00 10.00 H new ATOM 0 HA MET A 59 -6.555 6.825 -5.864 1.00 10.00 H new ATOM 0 HB2 MET A 59 -5.110 8.467 -7.372 1.00 10.00 H new ATOM 0 HB3 MET A 59 -5.789 9.697 -6.325 1.00 10.00 H new ATOM 0 HG2 MET A 59 -4.971 8.332 -4.343 1.00 10.00 H new ATOM 0 HG3 MET A 59 -4.138 7.294 -5.482 1.00 10.00 H new ATOM 0 HE1 MET A 59 -1.055 8.855 -4.241 1.00 10.00 H new ATOM 0 HE2 MET A 59 -2.335 9.268 -3.075 1.00 10.00 H new ATOM 0 HE3 MET A 59 -2.353 7.687 -3.894 1.00 10.00 H new ATOM 664 N ASN A 60 -7.490 8.266 -3.964 1.00 10.00 N ATOM 665 CA ASN A 60 -8.280 8.826 -2.861 1.00 10.00 C ATOM 666 C ASN A 60 -9.643 8.149 -2.746 1.00 10.00 C ATOM 667 O ASN A 60 -10.577 8.696 -2.152 1.00 10.00 O ATOM 668 CB ASN A 60 -8.453 10.342 -2.995 1.00 10.00 C ATOM 669 CG ASN A 60 -8.334 11.050 -1.658 1.00 10.00 C ATOM 670 OD1 ASN A 60 -7.463 10.725 -0.848 1.00 10.00 O ATOM 671 ND2 ASN A 60 -9.208 12.013 -1.411 1.00 10.00 N ATOM 0 H ASN A 60 -6.704 7.696 -3.652 1.00 10.00 H new ATOM 0 HA ASN A 60 -7.720 8.629 -1.947 1.00 10.00 H new ATOM 0 HB2 ASN A 60 -7.701 10.733 -3.680 1.00 10.00 H new ATOM 0 HB3 ASN A 60 -9.427 10.558 -3.434 1.00 10.00 H new ATOM 0 HD21 ASN A 60 -9.176 12.516 -0.524 1.00 10.00 H new ATOM 0 HD22 ASN A 60 -9.914 12.252 -2.108 1.00 10.00 H new ATOM 678 N SER A 61 -9.754 6.966 -3.328 1.00 10.00 N ATOM 679 CA SER A 61 -10.984 6.197 -3.261 1.00 10.00 C ATOM 680 C SER A 61 -10.859 5.161 -2.153 1.00 10.00 C ATOM 681 O SER A 61 -11.819 4.854 -1.442 1.00 10.00 O ATOM 682 CB SER A 61 -11.248 5.508 -4.600 1.00 10.00 C ATOM 683 OG SER A 61 -10.127 4.737 -4.997 1.00 10.00 O ATOM 0 H SER A 61 -9.004 6.517 -3.854 1.00 10.00 H new ATOM 0 HA SER A 61 -11.820 6.862 -3.047 1.00 10.00 H new ATOM 0 HB2 SER A 61 -12.126 4.867 -4.518 1.00 10.00 H new ATOM 0 HB3 SER A 61 -11.470 6.256 -5.362 1.00 10.00 H new ATOM 0 HG SER A 61 -9.432 5.329 -5.352 1.00 10.00 H new ATOM 689 N LEU A 62 -9.646 4.642 -2.009 1.00 10.00 N ATOM 690 CA LEU A 62 -9.338 3.645 -1.004 1.00 10.00 C ATOM 691 C LEU A 62 -8.412 4.238 0.050 1.00 10.00 C ATOM 692 O LEU A 62 -7.538 5.050 -0.263 1.00 10.00 O ATOM 693 CB LEU A 62 -8.676 2.427 -1.651 1.00 10.00 C ATOM 694 CG LEU A 62 -9.444 1.807 -2.822 1.00 10.00 C ATOM 695 CD1 LEU A 62 -8.601 0.747 -3.508 1.00 10.00 C ATOM 696 CD2 LEU A 62 -10.760 1.208 -2.345 1.00 10.00 C ATOM 0 H LEU A 62 -8.850 4.904 -2.590 1.00 10.00 H new ATOM 0 HA LEU A 62 -10.266 3.330 -0.528 1.00 10.00 H new ATOM 0 HB2 LEU A 62 -7.685 2.716 -2.001 1.00 10.00 H new ATOM 0 HB3 LEU A 62 -8.534 1.663 -0.887 1.00 10.00 H new ATOM 0 HG LEU A 62 -9.665 2.596 -3.541 1.00 10.00 H new ATOM 0 HD11 LEU A 62 -9.162 0.317 -4.338 1.00 10.00 H new ATOM 0 HD12 LEU A 62 -7.684 1.200 -3.886 1.00 10.00 H new ATOM 0 HD13 LEU A 62 -8.351 -0.037 -2.794 1.00 10.00 H new ATOM 0 HD21 LEU A 62 -11.290 0.773 -3.192 1.00 10.00 H new ATOM 0 HD22 LEU A 62 -10.560 0.433 -1.605 1.00 10.00 H new ATOM 0 HD23 LEU A 62 -11.373 1.989 -1.896 1.00 10.00 H new ATOM 708 N ARG A 63 -8.611 3.836 1.293 1.00 10.00 N ATOM 709 CA ARG A 63 -7.799 4.322 2.395 1.00 10.00 C ATOM 710 C ARG A 63 -6.899 3.211 2.929 1.00 10.00 C ATOM 711 O ARG A 63 -7.362 2.108 3.231 1.00 10.00 O ATOM 712 CB ARG A 63 -8.683 4.878 3.520 1.00 10.00 C ATOM 713 CG ARG A 63 -9.740 3.903 4.021 1.00 10.00 C ATOM 714 CD ARG A 63 -10.652 4.554 5.046 1.00 10.00 C ATOM 715 NE ARG A 63 -11.645 3.623 5.580 1.00 10.00 N ATOM 716 CZ ARG A 63 -12.926 3.934 5.783 1.00 10.00 C ATOM 717 NH1 ARG A 63 -13.394 5.130 5.436 1.00 10.00 N ATOM 718 NH2 ARG A 63 -13.743 3.037 6.323 1.00 10.00 N ATOM 0 H ARG A 63 -9.333 3.169 1.566 1.00 10.00 H new ATOM 0 HA ARG A 63 -7.170 5.130 2.021 1.00 10.00 H new ATOM 0 HB2 ARG A 63 -8.047 5.169 4.356 1.00 10.00 H new ATOM 0 HB3 ARG A 63 -9.177 5.782 3.165 1.00 10.00 H new ATOM 0 HG2 ARG A 63 -10.333 3.543 3.180 1.00 10.00 H new ATOM 0 HG3 ARG A 63 -9.254 3.033 4.464 1.00 10.00 H new ATOM 0 HD2 ARG A 63 -10.050 4.948 5.865 1.00 10.00 H new ATOM 0 HD3 ARG A 63 -11.162 5.402 4.588 1.00 10.00 H new ATOM 0 HE ARG A 63 -11.339 2.678 5.811 1.00 10.00 H new ATOM 0 HH11 ARG A 63 -12.772 5.817 5.011 1.00 10.00 H new ATOM 0 HH12 ARG A 63 -14.375 5.359 5.595 1.00 10.00 H new ATOM 0 HH21 ARG A 63 -13.390 2.115 6.580 1.00 10.00 H new ATOM 0 HH22 ARG A 63 -14.724 3.270 6.480 1.00 10.00 H new ATOM 732 N PHE A 64 -5.611 3.506 3.017 1.00 10.00 N ATOM 733 CA PHE A 64 -4.637 2.550 3.518 1.00 10.00 C ATOM 734 C PHE A 64 -4.461 2.728 5.016 1.00 10.00 C ATOM 735 O PHE A 64 -4.078 3.805 5.478 1.00 10.00 O ATOM 736 CB PHE A 64 -3.296 2.732 2.807 1.00 10.00 C ATOM 737 CG PHE A 64 -3.323 2.332 1.361 1.00 10.00 C ATOM 738 CD1 PHE A 64 -3.639 3.256 0.377 1.00 10.00 C ATOM 739 CD2 PHE A 64 -3.034 1.031 0.986 1.00 10.00 C ATOM 740 CE1 PHE A 64 -3.660 2.888 -0.954 1.00 10.00 C ATOM 741 CE2 PHE A 64 -3.054 0.659 -0.344 1.00 10.00 C ATOM 742 CZ PHE A 64 -3.369 1.589 -1.315 1.00 10.00 C ATOM 0 H PHE A 64 -5.215 4.406 2.746 1.00 10.00 H new ATOM 0 HA PHE A 64 -5.001 1.542 3.319 1.00 10.00 H new ATOM 0 HB2 PHE A 64 -2.994 3.777 2.881 1.00 10.00 H new ATOM 0 HB3 PHE A 64 -2.538 2.144 3.324 1.00 10.00 H new ATOM 0 HD1 PHE A 64 -3.871 4.274 0.654 1.00 10.00 H new ATOM 0 HD2 PHE A 64 -2.790 0.299 1.742 1.00 10.00 H new ATOM 0 HE1 PHE A 64 -3.904 3.617 -1.712 1.00 10.00 H new ATOM 0 HE2 PHE A 64 -2.824 -0.358 -0.624 1.00 10.00 H new ATOM 0 HZ PHE A 64 -3.387 1.300 -2.355 1.00 10.00 H new ATOM 752 N LEU A 65 -4.748 1.682 5.767 1.00 10.00 N ATOM 753 CA LEU A 65 -4.636 1.739 7.213 1.00 10.00 C ATOM 754 C LEU A 65 -3.479 0.889 7.713 1.00 10.00 C ATOM 755 O LEU A 65 -3.445 -0.329 7.512 1.00 10.00 O ATOM 756 CB LEU A 65 -5.941 1.279 7.869 1.00 10.00 C ATOM 757 CG LEU A 65 -7.169 2.136 7.552 1.00 10.00 C ATOM 758 CD1 LEU A 65 -8.386 1.615 8.295 1.00 10.00 C ATOM 759 CD2 LEU A 65 -6.919 3.595 7.903 1.00 10.00 C ATOM 0 H LEU A 65 -5.060 0.783 5.401 1.00 10.00 H new ATOM 0 HA LEU A 65 -4.442 2.776 7.489 1.00 10.00 H new ATOM 0 HB2 LEU A 65 -6.143 0.254 7.558 1.00 10.00 H new ATOM 0 HB3 LEU A 65 -5.799 1.262 8.950 1.00 10.00 H new ATOM 0 HG LEU A 65 -7.360 2.071 6.481 1.00 10.00 H new ATOM 0 HD11 LEU A 65 -9.250 2.236 8.058 1.00 10.00 H new ATOM 0 HD12 LEU A 65 -8.584 0.587 7.993 1.00 10.00 H new ATOM 0 HD13 LEU A 65 -8.199 1.648 9.368 1.00 10.00 H new ATOM 0 HD21 LEU A 65 -7.806 4.183 7.668 1.00 10.00 H new ATOM 0 HD22 LEU A 65 -6.698 3.681 8.967 1.00 10.00 H new ATOM 0 HD23 LEU A 65 -6.073 3.968 7.326 1.00 10.00 H new ATOM 771 N PHE A 66 -2.530 1.547 8.355 1.00 10.00 N ATOM 772 CA PHE A 66 -1.372 0.881 8.918 1.00 10.00 C ATOM 773 C PHE A 66 -1.360 1.113 10.421 1.00 10.00 C ATOM 774 O PHE A 66 -1.183 2.244 10.876 1.00 10.00 O ATOM 775 CB PHE A 66 -0.083 1.408 8.285 1.00 10.00 C ATOM 776 CG PHE A 66 1.148 0.642 8.692 1.00 10.00 C ATOM 777 CD1 PHE A 66 1.455 -0.571 8.098 1.00 10.00 C ATOM 778 CD2 PHE A 66 2.004 1.144 9.661 1.00 10.00 C ATOM 779 CE1 PHE A 66 2.583 -1.275 8.471 1.00 10.00 C ATOM 780 CE2 PHE A 66 3.133 0.444 10.038 1.00 10.00 C ATOM 781 CZ PHE A 66 3.426 -0.765 9.439 1.00 10.00 C ATOM 0 H PHE A 66 -2.542 2.557 8.500 1.00 10.00 H new ATOM 0 HA PHE A 66 -1.430 -0.187 8.710 1.00 10.00 H new ATOM 0 HB2 PHE A 66 -0.180 1.372 7.200 1.00 10.00 H new ATOM 0 HB3 PHE A 66 0.044 2.455 8.559 1.00 10.00 H new ATOM 0 HD1 PHE A 66 0.805 -0.971 7.334 1.00 10.00 H new ATOM 0 HD2 PHE A 66 1.785 2.094 10.126 1.00 10.00 H new ATOM 0 HE1 PHE A 66 2.806 -2.224 8.006 1.00 10.00 H new ATOM 0 HE2 PHE A 66 3.786 0.842 10.801 1.00 10.00 H new ATOM 0 HZ PHE A 66 4.312 -1.311 9.727 1.00 10.00 H new ATOM 791 N GLU A 67 -1.584 0.045 11.183 1.00 10.00 N ATOM 792 CA GLU A 67 -1.627 0.126 12.641 1.00 10.00 C ATOM 793 C GLU A 67 -2.776 1.028 13.084 1.00 10.00 C ATOM 794 O GLU A 67 -2.733 1.636 14.151 1.00 10.00 O ATOM 795 CB GLU A 67 -0.295 0.636 13.206 1.00 10.00 C ATOM 796 CG GLU A 67 0.821 -0.398 13.172 1.00 10.00 C ATOM 797 CD GLU A 67 0.537 -1.590 14.059 1.00 10.00 C ATOM 798 OE1 GLU A 67 0.339 -1.403 15.277 1.00 10.00 O ATOM 799 OE2 GLU A 67 0.509 -2.728 13.543 1.00 10.00 O ATOM 0 H GLU A 67 -1.739 -0.892 10.812 1.00 10.00 H new ATOM 0 HA GLU A 67 -1.795 -0.877 13.033 1.00 10.00 H new ATOM 0 HB2 GLU A 67 0.017 1.513 12.640 1.00 10.00 H new ATOM 0 HB3 GLU A 67 -0.447 0.959 14.236 1.00 10.00 H new ATOM 0 HG2 GLU A 67 0.964 -0.739 12.147 1.00 10.00 H new ATOM 0 HG3 GLU A 67 1.754 0.070 13.486 1.00 10.00 H new ATOM 806 N GLY A 68 -3.803 1.113 12.246 1.00 10.00 N ATOM 807 CA GLY A 68 -4.956 1.938 12.553 1.00 10.00 C ATOM 808 C GLY A 68 -4.867 3.329 11.950 1.00 10.00 C ATOM 809 O GLY A 68 -5.888 3.966 11.685 1.00 10.00 O ATOM 0 H GLY A 68 -3.857 0.622 11.354 1.00 10.00 H new ATOM 0 HA2 GLY A 68 -5.856 1.446 12.186 1.00 10.00 H new ATOM 0 HA3 GLY A 68 -5.058 2.023 13.635 1.00 10.00 H new ATOM 813 N GLN A 69 -3.647 3.798 11.721 1.00 10.00 N ATOM 814 CA GLN A 69 -3.428 5.126 11.159 1.00 10.00 C ATOM 815 C GLN A 69 -3.494 5.087 9.635 1.00 10.00 C ATOM 816 O GLN A 69 -2.982 4.160 9.008 1.00 10.00 O ATOM 817 CB GLN A 69 -2.073 5.682 11.611 1.00 10.00 C ATOM 818 CG GLN A 69 -1.948 5.834 13.118 1.00 10.00 C ATOM 819 CD GLN A 69 -0.617 6.424 13.549 1.00 10.00 C ATOM 820 OE1 GLN A 69 0.415 6.221 12.908 1.00 10.00 O ATOM 821 NE2 GLN A 69 -0.635 7.163 14.644 1.00 10.00 N ATOM 0 H GLN A 69 -2.792 3.278 11.916 1.00 10.00 H new ATOM 0 HA GLN A 69 -4.218 5.782 11.524 1.00 10.00 H new ATOM 0 HB2 GLN A 69 -1.282 5.022 11.254 1.00 10.00 H new ATOM 0 HB3 GLN A 69 -1.914 6.653 11.142 1.00 10.00 H new ATOM 0 HG2 GLN A 69 -2.755 6.470 13.481 1.00 10.00 H new ATOM 0 HG3 GLN A 69 -2.075 4.858 13.587 1.00 10.00 H new ATOM 0 HE21 GLN A 69 -1.510 7.308 15.147 1.00 10.00 H new ATOM 0 HE22 GLN A 69 0.226 7.589 14.986 1.00 10.00 H new ATOM 830 N ARG A 70 -4.136 6.085 9.041 1.00 10.00 N ATOM 831 CA ARG A 70 -4.246 6.149 7.592 1.00 10.00 C ATOM 832 C ARG A 70 -2.975 6.741 6.995 1.00 10.00 C ATOM 833 O ARG A 70 -2.494 7.788 7.433 1.00 10.00 O ATOM 834 CB ARG A 70 -5.478 6.950 7.155 1.00 10.00 C ATOM 835 CG ARG A 70 -5.589 8.321 7.792 1.00 10.00 C ATOM 836 CD ARG A 70 -6.918 8.979 7.459 1.00 10.00 C ATOM 837 NE ARG A 70 -6.937 9.524 6.100 1.00 10.00 N ATOM 838 CZ ARG A 70 -7.951 9.378 5.244 1.00 10.00 C ATOM 839 NH1 ARG A 70 -9.028 8.683 5.582 1.00 10.00 N ATOM 840 NH2 ARG A 70 -7.887 9.937 4.041 1.00 10.00 N ATOM 0 H ARG A 70 -4.585 6.855 9.537 1.00 10.00 H new ATOM 0 HA ARG A 70 -4.370 5.133 7.218 1.00 10.00 H new ATOM 0 HB2 ARG A 70 -5.456 7.066 6.071 1.00 10.00 H new ATOM 0 HB3 ARG A 70 -6.373 6.377 7.395 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -5.486 8.231 8.873 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -4.771 8.953 7.445 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -7.721 8.250 7.568 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -7.115 9.779 8.173 1.00 10.00 H new ATOM 0 HE ARG A 70 -6.121 10.050 5.787 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -9.088 8.253 6.505 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -9.796 8.579 4.919 1.00 10.00 H new ATOM 0 HH21 ARG A 70 -7.064 10.477 3.773 1.00 10.00 H new ATOM 0 HH22 ARG A 70 -8.661 9.827 3.386 1.00 10.00 H new ATOM 854 N ILE A 71 -2.435 6.047 6.009 1.00 10.00 N ATOM 855 CA ILE A 71 -1.213 6.465 5.339 1.00 10.00 C ATOM 856 C ILE A 71 -1.432 7.717 4.496 1.00 10.00 C ATOM 857 O ILE A 71 -2.287 7.742 3.605 1.00 10.00 O ATOM 858 CB ILE A 71 -0.672 5.332 4.440 1.00 10.00 C ATOM 859 CG1 ILE A 71 -0.319 4.103 5.283 1.00 10.00 C ATOM 860 CG2 ILE A 71 0.539 5.800 3.644 1.00 10.00 C ATOM 861 CD1 ILE A 71 0.718 4.371 6.355 1.00 10.00 C ATOM 0 H ILE A 71 -2.830 5.178 5.649 1.00 10.00 H new ATOM 0 HA ILE A 71 -0.484 6.695 6.116 1.00 10.00 H new ATOM 0 HB ILE A 71 -1.454 5.056 3.733 1.00 10.00 H new ATOM 0 HG12 ILE A 71 -1.226 3.726 5.755 1.00 10.00 H new ATOM 0 HG13 ILE A 71 0.049 3.316 4.624 1.00 10.00 H new ATOM 0 HG21 ILE A 71 0.901 4.984 3.019 1.00 10.00 H new ATOM 0 HG22 ILE A 71 0.256 6.642 3.013 1.00 10.00 H new ATOM 0 HG23 ILE A 71 1.328 6.109 4.330 1.00 10.00 H new ATOM 0 HD11 ILE A 71 0.914 3.453 6.909 1.00 10.00 H new ATOM 0 HD12 ILE A 71 1.641 4.719 5.890 1.00 10.00 H new ATOM 0 HD13 ILE A 71 0.346 5.134 7.038 1.00 10.00 H new ATOM 873 N ALA A 72 -0.651 8.748 4.782 1.00 10.00 N ATOM 874 CA ALA A 72 -0.731 9.998 4.048 1.00 10.00 C ATOM 875 C ALA A 72 0.080 9.896 2.765 1.00 10.00 C ATOM 876 O ALA A 72 0.878 8.972 2.597 1.00 10.00 O ATOM 877 CB ALA A 72 -0.239 11.154 4.906 1.00 10.00 C ATOM 0 H ALA A 72 0.050 8.741 5.523 1.00 10.00 H new ATOM 0 HA ALA A 72 -1.772 10.190 3.790 1.00 10.00 H new ATOM 0 HB1 ALA A 72 -0.306 12.082 4.339 1.00 10.00 H new ATOM 0 HB2 ALA A 72 -0.855 11.230 5.802 1.00 10.00 H new ATOM 0 HB3 ALA A 72 0.798 10.979 5.193 1.00 10.00 H new ATOM 883 N ASP A 73 -0.116 10.841 1.865 1.00 10.00 N ATOM 884 CA ASP A 73 0.601 10.837 0.596 1.00 10.00 C ATOM 885 C ASP A 73 2.062 11.223 0.794 1.00 10.00 C ATOM 886 O ASP A 73 2.934 10.802 0.038 1.00 10.00 O ATOM 887 CB ASP A 73 -0.061 11.793 -0.399 1.00 10.00 C ATOM 888 CG ASP A 73 -1.268 11.187 -1.095 1.00 10.00 C ATOM 889 OD1 ASP A 73 -1.893 10.265 -0.526 1.00 10.00 O ATOM 890 OD2 ASP A 73 -1.606 11.645 -2.212 1.00 10.00 O ATOM 0 H ASP A 73 -0.763 11.621 1.985 1.00 10.00 H new ATOM 0 HA ASP A 73 0.562 9.825 0.193 1.00 10.00 H new ATOM 0 HB2 ASP A 73 -0.368 12.698 0.125 1.00 10.00 H new ATOM 0 HB3 ASP A 73 0.671 12.092 -1.149 1.00 10.00 H new ATOM 895 N ASN A 74 2.327 12.007 1.831 1.00 10.00 N ATOM 896 CA ASN A 74 3.688 12.457 2.122 1.00 10.00 C ATOM 897 C ASN A 74 4.393 11.513 3.095 1.00 10.00 C ATOM 898 O ASN A 74 5.461 11.834 3.619 1.00 10.00 O ATOM 899 CB ASN A 74 3.671 13.878 2.699 1.00 10.00 C ATOM 900 CG ASN A 74 2.911 13.979 4.009 1.00 10.00 C ATOM 901 OD1 ASN A 74 1.688 14.124 4.020 1.00 10.00 O ATOM 902 ND2 ASN A 74 3.624 13.916 5.123 1.00 10.00 N ATOM 0 H ASN A 74 1.621 12.346 2.485 1.00 10.00 H new ATOM 0 HA ASN A 74 4.242 12.456 1.183 1.00 10.00 H new ATOM 0 HB2 ASN A 74 4.697 14.213 2.854 1.00 10.00 H new ATOM 0 HB3 ASN A 74 3.221 14.554 1.972 1.00 10.00 H new ATOM 0 HD21 ASN A 74 3.162 13.988 6.029 1.00 10.00 H new ATOM 0 HD22 ASN A 74 4.636 13.795 5.075 1.00 10.00 H new ATOM 909 N HIS A 75 3.802 10.350 3.327 1.00 10.00 N ATOM 910 CA HIS A 75 4.379 9.367 4.236 1.00 10.00 C ATOM 911 C HIS A 75 5.411 8.516 3.511 1.00 10.00 C ATOM 912 O HIS A 75 5.331 8.325 2.296 1.00 10.00 O ATOM 913 CB HIS A 75 3.292 8.463 4.821 1.00 10.00 C ATOM 914 CG HIS A 75 2.801 8.896 6.166 1.00 10.00 C ATOM 915 ND1 HIS A 75 1.534 8.586 6.600 1.00 10.00 N ATOM 916 CD2 HIS A 75 3.442 9.593 7.134 1.00 10.00 C ATOM 917 CE1 HIS A 75 1.432 9.099 7.814 1.00 10.00 C ATOM 918 NE2 HIS A 75 2.564 9.717 8.178 1.00 10.00 N ATOM 0 H HIS A 75 2.922 10.063 2.898 1.00 10.00 H new ATOM 0 HA HIS A 75 4.864 9.906 5.050 1.00 10.00 H new ATOM 0 HB2 HIS A 75 2.449 8.432 4.130 1.00 10.00 H new ATOM 0 HB3 HIS A 75 3.680 7.447 4.897 1.00 10.00 H new ATOM 0 HD2 HIS A 75 4.451 9.977 7.091 1.00 10.00 H new ATOM 0 HE1 HIS A 75 0.550 9.029 8.433 1.00 10.00 H new ATOM 0 HE2 HIS A 75 2.739 10.190 9.065 1.00 10.00 H new ATOM 926 N THR A 76 6.390 8.030 4.253 1.00 10.00 N ATOM 927 CA THR A 76 7.434 7.191 3.692 1.00 10.00 C ATOM 928 C THR A 76 7.534 5.889 4.477 1.00 10.00 C ATOM 929 O THR A 76 7.102 5.828 5.626 1.00 10.00 O ATOM 930 CB THR A 76 8.802 7.903 3.707 1.00 10.00 C ATOM 931 OG1 THR A 76 9.158 8.286 5.044 1.00 10.00 O ATOM 932 CG2 THR A 76 8.786 9.131 2.813 1.00 10.00 C ATOM 0 H THR A 76 6.484 8.204 5.254 1.00 10.00 H new ATOM 0 HA THR A 76 7.168 6.981 2.656 1.00 10.00 H new ATOM 0 HB THR A 76 9.545 7.202 3.326 1.00 10.00 H new ATOM 0 HG1 THR A 76 8.592 9.032 5.332 1.00 10.00 H new ATOM 0 HG21 THR A 76 9.762 9.615 2.842 1.00 10.00 H new ATOM 0 HG22 THR A 76 8.558 8.833 1.790 1.00 10.00 H new ATOM 0 HG23 THR A 76 8.026 9.828 3.166 1.00 10.00 H new ATOM 940 N PRO A 77 8.094 4.828 3.872 1.00 10.00 N ATOM 941 CA PRO A 77 8.248 3.529 4.541 1.00 10.00 C ATOM 942 C PRO A 77 9.277 3.582 5.670 1.00 10.00 C ATOM 943 O PRO A 77 9.349 2.677 6.503 1.00 10.00 O ATOM 944 CB PRO A 77 8.732 2.592 3.423 1.00 10.00 C ATOM 945 CG PRO A 77 8.509 3.331 2.148 1.00 10.00 C ATOM 946 CD PRO A 77 8.600 4.787 2.490 1.00 10.00 C ATOM 0 HA PRO A 77 7.319 3.204 5.008 1.00 10.00 H new ATOM 0 HB2 PRO A 77 9.785 2.342 3.551 1.00 10.00 H new ATOM 0 HB3 PRO A 77 8.178 1.653 3.433 1.00 10.00 H new ATOM 0 HG2 PRO A 77 9.257 3.058 1.404 1.00 10.00 H new ATOM 0 HG3 PRO A 77 7.534 3.091 1.724 1.00 10.00 H new ATOM 0 HD2 PRO A 77 9.624 5.155 2.423 1.00 10.00 H new ATOM 0 HD3 PRO A 77 7.996 5.399 1.820 1.00 10.00 H new ATOM 954 N LYS A 78 10.072 4.651 5.690 1.00 10.00 N ATOM 955 CA LYS A 78 11.095 4.828 6.710 1.00 10.00 C ATOM 956 C LYS A 78 10.450 5.155 8.049 1.00 10.00 C ATOM 957 O LYS A 78 10.835 4.611 9.085 1.00 10.00 O ATOM 958 CB LYS A 78 12.069 5.937 6.304 1.00 10.00 C ATOM 959 CG LYS A 78 13.237 6.115 7.271 1.00 10.00 C ATOM 960 CD LYS A 78 14.104 4.865 7.356 1.00 10.00 C ATOM 961 CE LYS A 78 14.836 4.600 6.052 1.00 10.00 C ATOM 962 NZ LYS A 78 15.607 3.331 6.098 1.00 10.00 N ATOM 0 H LYS A 78 10.024 5.408 5.008 1.00 10.00 H new ATOM 0 HA LYS A 78 11.653 3.897 6.808 1.00 10.00 H new ATOM 0 HB2 LYS A 78 12.462 5.718 5.311 1.00 10.00 H new ATOM 0 HB3 LYS A 78 11.524 6.878 6.230 1.00 10.00 H new ATOM 0 HG2 LYS A 78 13.848 6.959 6.950 1.00 10.00 H new ATOM 0 HG3 LYS A 78 12.853 6.358 8.262 1.00 10.00 H new ATOM 0 HD2 LYS A 78 14.828 4.978 8.163 1.00 10.00 H new ATOM 0 HD3 LYS A 78 13.481 4.006 7.605 1.00 10.00 H new ATOM 0 HE2 LYS A 78 14.117 4.559 5.234 1.00 10.00 H new ATOM 0 HE3 LYS A 78 15.512 5.428 5.840 1.00 10.00 H new ATOM 0 HZ1 LYS A 78 16.092 3.186 5.189 1.00 10.00 H new ATOM 0 HZ2 LYS A 78 16.311 3.380 6.862 1.00 10.00 H new ATOM 0 HZ3 LYS A 78 14.959 2.537 6.275 1.00 10.00 H new ATOM 976 N GLU A 79 9.462 6.041 8.024 1.00 10.00 N ATOM 977 CA GLU A 79 8.760 6.420 9.239 1.00 10.00 C ATOM 978 C GLU A 79 7.693 5.378 9.552 1.00 10.00 C ATOM 979 O GLU A 79 7.476 4.462 8.754 1.00 10.00 O ATOM 980 CB GLU A 79 8.145 7.819 9.104 1.00 10.00 C ATOM 981 CG GLU A 79 7.110 7.938 7.999 1.00 10.00 C ATOM 982 CD GLU A 79 6.949 9.359 7.495 1.00 10.00 C ATOM 983 OE1 GLU A 79 6.501 10.229 8.271 1.00 10.00 O ATOM 984 OE2 GLU A 79 7.270 9.613 6.316 1.00 10.00 O ATOM 0 H GLU A 79 9.132 6.507 7.179 1.00 10.00 H new ATOM 0 HA GLU A 79 9.470 6.458 10.065 1.00 10.00 H new ATOM 0 HB2 GLU A 79 7.682 8.093 10.052 1.00 10.00 H new ATOM 0 HB3 GLU A 79 8.943 8.538 8.919 1.00 10.00 H new ATOM 0 HG2 GLU A 79 7.396 7.293 7.168 1.00 10.00 H new ATOM 0 HG3 GLU A 79 6.150 7.577 8.367 1.00 10.00 H new ATOM 991 N LEU A 80 7.060 5.499 10.724 1.00 10.00 N ATOM 992 CA LEU A 80 6.016 4.566 11.173 1.00 10.00 C ATOM 993 C LEU A 80 6.640 3.237 11.607 1.00 10.00 C ATOM 994 O LEU A 80 6.320 2.709 12.673 1.00 10.00 O ATOM 995 CB LEU A 80 4.961 4.325 10.083 1.00 10.00 C ATOM 996 CG LEU A 80 4.231 5.577 9.588 1.00 10.00 C ATOM 997 CD1 LEU A 80 3.834 5.419 8.127 1.00 10.00 C ATOM 998 CD2 LEU A 80 3.007 5.851 10.446 1.00 10.00 C ATOM 0 H LEU A 80 7.256 6.246 11.390 1.00 10.00 H new ATOM 0 HA LEU A 80 5.514 5.021 12.026 1.00 10.00 H new ATOM 0 HB2 LEU A 80 5.445 3.847 9.232 1.00 10.00 H new ATOM 0 HB3 LEU A 80 4.222 3.621 10.466 1.00 10.00 H new ATOM 0 HG LEU A 80 4.908 6.428 9.671 1.00 10.00 H new ATOM 0 HD11 LEU A 80 3.316 6.318 7.791 1.00 10.00 H new ATOM 0 HD12 LEU A 80 4.728 5.267 7.521 1.00 10.00 H new ATOM 0 HD13 LEU A 80 3.173 4.559 8.020 1.00 10.00 H new ATOM 0 HD21 LEU A 80 2.499 6.744 10.081 1.00 10.00 H new ATOM 0 HD22 LEU A 80 2.328 5.000 10.393 1.00 10.00 H new ATOM 0 HD23 LEU A 80 3.315 6.006 11.480 1.00 10.00 H new ATOM 1010 N GLY A 81 7.535 2.709 10.783 1.00 10.00 N ATOM 1011 CA GLY A 81 8.198 1.460 11.097 1.00 10.00 C ATOM 1012 C GLY A 81 7.749 0.322 10.207 1.00 10.00 C ATOM 1013 O GLY A 81 7.458 -0.768 10.695 1.00 10.00 O ATOM 0 H GLY A 81 7.815 3.128 9.896 1.00 10.00 H new ATOM 0 HA2 GLY A 81 9.276 1.590 10.998 1.00 10.00 H new ATOM 0 HA3 GLY A 81 8.003 1.201 12.138 1.00 10.00 H new ATOM 1017 N MET A 82 7.692 0.570 8.905 1.00 10.00 N ATOM 1018 CA MET A 82 7.275 -0.452 7.955 1.00 10.00 C ATOM 1019 C MET A 82 8.390 -1.462 7.730 1.00 10.00 C ATOM 1020 O MET A 82 9.440 -1.128 7.178 1.00 10.00 O ATOM 1021 CB MET A 82 6.874 0.182 6.622 1.00 10.00 C ATOM 1022 CG MET A 82 5.485 0.790 6.637 1.00 10.00 C ATOM 1023 SD MET A 82 4.984 1.410 5.019 1.00 10.00 S ATOM 1024 CE MET A 82 3.263 1.796 5.327 1.00 10.00 C ATOM 0 H MET A 82 7.929 1.468 8.484 1.00 10.00 H new ATOM 0 HA MET A 82 6.411 -0.968 8.374 1.00 10.00 H new ATOM 0 HB2 MET A 82 7.598 0.955 6.364 1.00 10.00 H new ATOM 0 HB3 MET A 82 6.923 -0.575 5.839 1.00 10.00 H new ATOM 0 HG2 MET A 82 4.768 0.041 6.973 1.00 10.00 H new ATOM 0 HG3 MET A 82 5.457 1.606 7.360 1.00 10.00 H new ATOM 0 HE1 MET A 82 2.811 2.192 4.418 1.00 10.00 H new ATOM 0 HE2 MET A 82 2.736 0.891 5.631 1.00 10.00 H new ATOM 0 HE3 MET A 82 3.193 2.540 6.121 1.00 10.00 H new ATOM 1034 N GLU A 83 8.163 -2.690 8.165 1.00 10.00 N ATOM 1035 CA GLU A 83 9.149 -3.747 8.014 1.00 10.00 C ATOM 1036 C GLU A 83 8.695 -4.762 6.974 1.00 10.00 C ATOM 1037 O GLU A 83 7.590 -4.669 6.442 1.00 10.00 O ATOM 1038 CB GLU A 83 9.384 -4.443 9.357 1.00 10.00 C ATOM 1039 CG GLU A 83 10.161 -3.601 10.354 1.00 10.00 C ATOM 1040 CD GLU A 83 11.608 -3.400 9.951 1.00 10.00 C ATOM 1041 OE1 GLU A 83 11.951 -2.300 9.476 1.00 10.00 O ATOM 1042 OE2 GLU A 83 12.413 -4.339 10.115 1.00 10.00 O ATOM 0 H GLU A 83 7.301 -2.980 8.627 1.00 10.00 H new ATOM 0 HA GLU A 83 10.084 -3.300 7.676 1.00 10.00 H new ATOM 0 HB2 GLU A 83 8.420 -4.708 9.792 1.00 10.00 H new ATOM 0 HB3 GLU A 83 9.923 -5.375 9.184 1.00 10.00 H new ATOM 0 HG2 GLU A 83 9.679 -2.629 10.456 1.00 10.00 H new ATOM 0 HG3 GLU A 83 10.124 -4.079 11.333 1.00 10.00 H new ATOM 1049 N GLU A 84 9.558 -5.725 6.683 1.00 10.00 N ATOM 1050 CA GLU A 84 9.246 -6.769 5.722 1.00 10.00 C ATOM 1051 C GLU A 84 8.178 -7.696 6.304 1.00 10.00 C ATOM 1052 O GLU A 84 8.169 -7.950 7.512 1.00 10.00 O ATOM 1053 CB GLU A 84 10.523 -7.547 5.369 1.00 10.00 C ATOM 1054 CG GLU A 84 10.293 -8.787 4.520 1.00 10.00 C ATOM 1055 CD GLU A 84 9.576 -8.482 3.224 1.00 10.00 C ATOM 1056 OE1 GLU A 84 10.097 -7.676 2.426 1.00 10.00 O ATOM 1057 OE2 GLU A 84 8.489 -9.050 3.000 1.00 10.00 O ATOM 0 H GLU A 84 10.484 -5.803 7.102 1.00 10.00 H new ATOM 0 HA GLU A 84 8.854 -6.325 4.807 1.00 10.00 H new ATOM 0 HB2 GLU A 84 11.204 -6.881 4.839 1.00 10.00 H new ATOM 0 HB3 GLU A 84 11.020 -7.842 6.293 1.00 10.00 H new ATOM 0 HG2 GLU A 84 11.253 -9.254 4.298 1.00 10.00 H new ATOM 0 HG3 GLU A 84 9.711 -9.510 5.091 1.00 10.00 H new ATOM 1064 N GLU A 85 7.270 -8.166 5.446 1.00 10.00 N ATOM 1065 CA GLU A 85 6.186 -9.060 5.853 1.00 10.00 C ATOM 1066 C GLU A 85 5.191 -8.346 6.764 1.00 10.00 C ATOM 1067 O GLU A 85 4.465 -8.988 7.526 1.00 10.00 O ATOM 1068 CB GLU A 85 6.735 -10.307 6.557 1.00 10.00 C ATOM 1069 CG GLU A 85 6.966 -11.487 5.629 1.00 10.00 C ATOM 1070 CD GLU A 85 5.675 -12.084 5.115 1.00 10.00 C ATOM 1071 OE1 GLU A 85 4.980 -12.778 5.886 1.00 10.00 O ATOM 1072 OE2 GLU A 85 5.344 -11.865 3.933 1.00 10.00 O ATOM 0 H GLU A 85 7.266 -7.938 4.452 1.00 10.00 H new ATOM 0 HA GLU A 85 5.665 -9.370 4.947 1.00 10.00 H new ATOM 0 HB2 GLU A 85 7.676 -10.052 7.045 1.00 10.00 H new ATOM 0 HB3 GLU A 85 6.039 -10.605 7.341 1.00 10.00 H new ATOM 0 HG2 GLU A 85 7.575 -11.166 4.784 1.00 10.00 H new ATOM 0 HG3 GLU A 85 7.532 -12.254 6.157 1.00 10.00 H new ATOM 1079 N ASP A 86 5.158 -7.022 6.680 1.00 10.00 N ATOM 1080 CA ASP A 86 4.248 -6.234 7.502 1.00 10.00 C ATOM 1081 C ASP A 86 2.838 -6.287 6.931 1.00 10.00 C ATOM 1082 O ASP A 86 2.654 -6.587 5.752 1.00 10.00 O ATOM 1083 CB ASP A 86 4.720 -4.786 7.612 1.00 10.00 C ATOM 1084 CG ASP A 86 4.676 -4.288 9.040 1.00 10.00 C ATOM 1085 OD1 ASP A 86 3.763 -4.704 9.790 1.00 10.00 O ATOM 1086 OD2 ASP A 86 5.554 -3.485 9.425 1.00 10.00 O ATOM 0 H ASP A 86 5.748 -6.473 6.054 1.00 10.00 H new ATOM 0 HA ASP A 86 4.240 -6.665 8.503 1.00 10.00 H new ATOM 0 HB2 ASP A 86 5.738 -4.705 7.230 1.00 10.00 H new ATOM 0 HB3 ASP A 86 4.093 -4.151 6.986 1.00 10.00 H new ATOM 1091 N VAL A 87 1.851 -5.984 7.759 1.00 10.00 N ATOM 1092 CA VAL A 87 0.458 -6.038 7.337 1.00 10.00 C ATOM 1093 C VAL A 87 -0.159 -4.649 7.206 1.00 10.00 C ATOM 1094 O VAL A 87 -0.058 -3.819 8.111 1.00 10.00 O ATOM 1095 CB VAL A 87 -0.385 -6.876 8.324 1.00 10.00 C ATOM 1096 CG1 VAL A 87 -1.857 -6.865 7.944 1.00 10.00 C ATOM 1097 CG2 VAL A 87 0.129 -8.303 8.384 1.00 10.00 C ATOM 0 H VAL A 87 1.988 -5.698 8.728 1.00 10.00 H new ATOM 0 HA VAL A 87 0.451 -6.510 6.355 1.00 10.00 H new ATOM 0 HB VAL A 87 -0.287 -6.422 9.310 1.00 10.00 H new ATOM 0 HG11 VAL A 87 -2.422 -7.464 8.659 1.00 10.00 H new ATOM 0 HG12 VAL A 87 -2.228 -5.840 7.956 1.00 10.00 H new ATOM 0 HG13 VAL A 87 -1.978 -7.283 6.945 1.00 10.00 H new ATOM 0 HG21 VAL A 87 -0.477 -8.879 9.084 1.00 10.00 H new ATOM 0 HG22 VAL A 87 0.066 -8.754 7.394 1.00 10.00 H new ATOM 0 HG23 VAL A 87 1.167 -8.302 8.717 1.00 10.00 H new ATOM 1107 N ILE A 88 -0.806 -4.414 6.072 1.00 10.00 N ATOM 1108 CA ILE A 88 -1.470 -3.150 5.804 1.00 10.00 C ATOM 1109 C ILE A 88 -2.866 -3.430 5.238 1.00 10.00 C ATOM 1110 O ILE A 88 -3.034 -4.314 4.398 1.00 10.00 O ATOM 1111 CB ILE A 88 -0.644 -2.265 4.834 1.00 10.00 C ATOM 1112 CG1 ILE A 88 -1.324 -0.911 4.621 1.00 10.00 C ATOM 1113 CG2 ILE A 88 -0.425 -2.972 3.502 1.00 10.00 C ATOM 1114 CD1 ILE A 88 -0.458 0.089 3.885 1.00 10.00 C ATOM 0 H ILE A 88 -0.884 -5.094 5.315 1.00 10.00 H new ATOM 0 HA ILE A 88 -1.560 -2.594 6.737 1.00 10.00 H new ATOM 0 HB ILE A 88 0.331 -2.090 5.288 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -2.248 -1.061 4.062 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -1.602 -0.496 5.590 1.00 10.00 H new ATOM 0 HG21 ILE A 88 0.157 -2.330 2.841 1.00 10.00 H new ATOM 0 HG22 ILE A 88 0.114 -3.904 3.669 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -1.389 -3.188 3.042 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -1.003 1.026 3.769 1.00 10.00 H new ATOM 0 HD12 ILE A 88 0.455 0.268 4.453 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -0.202 -0.306 2.902 1.00 10.00 H new ATOM 1126 N GLU A 89 -3.868 -2.709 5.718 1.00 10.00 N ATOM 1127 CA GLU A 89 -5.239 -2.918 5.263 1.00 10.00 C ATOM 1128 C GLU A 89 -5.695 -1.807 4.328 1.00 10.00 C ATOM 1129 O GLU A 89 -5.212 -0.676 4.405 1.00 10.00 O ATOM 1130 CB GLU A 89 -6.185 -3.004 6.460 1.00 10.00 C ATOM 1131 CG GLU A 89 -5.933 -4.210 7.350 1.00 10.00 C ATOM 1132 CD GLU A 89 -6.707 -4.138 8.648 1.00 10.00 C ATOM 1133 OE1 GLU A 89 -7.937 -4.341 8.626 1.00 10.00 O ATOM 1134 OE2 GLU A 89 -6.087 -3.881 9.702 1.00 10.00 O ATOM 0 H GLU A 89 -3.761 -1.976 6.420 1.00 10.00 H new ATOM 0 HA GLU A 89 -5.263 -3.857 4.710 1.00 10.00 H new ATOM 0 HB2 GLU A 89 -6.087 -2.097 7.056 1.00 10.00 H new ATOM 0 HB3 GLU A 89 -7.213 -3.038 6.098 1.00 10.00 H new ATOM 0 HG2 GLU A 89 -6.210 -5.118 6.814 1.00 10.00 H new ATOM 0 HG3 GLU A 89 -4.867 -4.281 7.568 1.00 10.00 H new ATOM 1141 N VAL A 90 -6.626 -2.138 3.448 1.00 10.00 N ATOM 1142 CA VAL A 90 -7.159 -1.173 2.504 1.00 10.00 C ATOM 1143 C VAL A 90 -8.688 -1.262 2.445 1.00 10.00 C ATOM 1144 O VAL A 90 -9.258 -2.332 2.226 1.00 10.00 O ATOM 1145 CB VAL A 90 -6.546 -1.358 1.091 1.00 10.00 C ATOM 1146 CG1 VAL A 90 -6.809 -2.756 0.545 1.00 10.00 C ATOM 1147 CG2 VAL A 90 -7.065 -0.295 0.136 1.00 10.00 C ATOM 0 H VAL A 90 -7.029 -3.072 3.369 1.00 10.00 H new ATOM 0 HA VAL A 90 -6.882 -0.180 2.857 1.00 10.00 H new ATOM 0 HB VAL A 90 -5.466 -1.240 1.181 1.00 10.00 H new ATOM 0 HG11 VAL A 90 -6.365 -2.849 -0.446 1.00 10.00 H new ATOM 0 HG12 VAL A 90 -6.366 -3.496 1.212 1.00 10.00 H new ATOM 0 HG13 VAL A 90 -7.884 -2.924 0.478 1.00 10.00 H new ATOM 0 HG21 VAL A 90 -6.622 -0.443 -0.849 1.00 10.00 H new ATOM 0 HG22 VAL A 90 -8.150 -0.371 0.062 1.00 10.00 H new ATOM 0 HG23 VAL A 90 -6.795 0.693 0.510 1.00 10.00 H new ATOM 1157 N TYR A 91 -9.343 -0.135 2.684 1.00 10.00 N ATOM 1158 CA TYR A 91 -10.799 -0.070 2.656 1.00 10.00 C ATOM 1159 C TYR A 91 -11.248 1.101 1.797 1.00 10.00 C ATOM 1160 O TYR A 91 -10.432 1.938 1.425 1.00 10.00 O ATOM 1161 CB TYR A 91 -11.357 0.065 4.076 1.00 10.00 C ATOM 1162 CG TYR A 91 -11.067 -1.131 4.959 1.00 10.00 C ATOM 1163 CD1 TYR A 91 -11.860 -2.272 4.903 1.00 10.00 C ATOM 1164 CD2 TYR A 91 -9.994 -1.123 5.841 1.00 10.00 C ATOM 1165 CE1 TYR A 91 -11.594 -3.367 5.703 1.00 10.00 C ATOM 1166 CE2 TYR A 91 -9.720 -2.216 6.645 1.00 10.00 C ATOM 1167 CZ TYR A 91 -10.523 -3.335 6.572 1.00 10.00 C ATOM 1168 OH TYR A 91 -10.256 -4.429 7.366 1.00 10.00 O ATOM 0 H TYR A 91 -8.887 0.752 2.901 1.00 10.00 H new ATOM 0 HA TYR A 91 -11.184 -0.994 2.223 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -10.937 0.958 4.539 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -12.436 0.212 4.021 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -12.698 -2.303 4.223 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -9.363 -0.249 5.901 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -12.222 -4.244 5.648 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -8.882 -2.193 7.326 1.00 10.00 H new ATOM 0 HH TYR A 91 -9.469 -4.247 7.920 1.00 10.00 H new ATOM 1178 N GLN A 92 -12.533 1.168 1.488 1.00 10.00 N ATOM 1179 CA GLN A 92 -13.053 2.248 0.657 1.00 10.00 C ATOM 1180 C GLN A 92 -13.437 3.449 1.513 1.00 10.00 C ATOM 1181 O GLN A 92 -13.962 3.292 2.616 1.00 10.00 O ATOM 1182 CB GLN A 92 -14.269 1.776 -0.146 1.00 10.00 C ATOM 1183 CG GLN A 92 -14.669 2.732 -1.257 1.00 10.00 C ATOM 1184 CD GLN A 92 -16.156 2.699 -1.549 1.00 10.00 C ATOM 1185 OE1 GLN A 92 -16.624 1.889 -2.348 1.00 10.00 O ATOM 1186 NE2 GLN A 92 -16.907 3.581 -0.907 1.00 10.00 N ATOM 0 H GLN A 92 -13.233 0.493 1.796 1.00 10.00 H new ATOM 0 HA GLN A 92 -12.266 2.545 -0.036 1.00 10.00 H new ATOM 0 HB2 GLN A 92 -14.052 0.799 -0.578 1.00 10.00 H new ATOM 0 HB3 GLN A 92 -15.113 1.645 0.531 1.00 10.00 H new ATOM 0 HG2 GLN A 92 -14.380 3.746 -0.980 1.00 10.00 H new ATOM 0 HG3 GLN A 92 -14.119 2.480 -2.164 1.00 10.00 H new ATOM 0 HE21 GLN A 92 -16.478 4.235 -0.252 1.00 10.00 H new ATOM 0 HE22 GLN A 92 -17.914 3.606 -1.067 1.00 10.00 H new ATOM 1195 N GLU A 93 -13.166 4.643 1.003 1.00 10.00 N ATOM 1196 CA GLU A 93 -13.499 5.872 1.711 1.00 10.00 C ATOM 1197 C GLU A 93 -14.985 6.173 1.569 1.00 10.00 C ATOM 1198 O GLU A 93 -15.648 5.645 0.672 1.00 10.00 O ATOM 1199 CB GLU A 93 -12.672 7.042 1.170 1.00 10.00 C ATOM 1200 CG GLU A 93 -11.315 7.182 1.834 1.00 10.00 C ATOM 1201 CD GLU A 93 -11.419 7.696 3.256 1.00 10.00 C ATOM 1202 OE1 GLU A 93 -12.153 7.087 4.061 1.00 10.00 O ATOM 1203 OE2 GLU A 93 -10.764 8.709 3.576 1.00 10.00 O ATOM 0 H GLU A 93 -12.715 4.787 0.099 1.00 10.00 H new ATOM 0 HA GLU A 93 -13.264 5.738 2.767 1.00 10.00 H new ATOM 0 HB2 GLU A 93 -12.531 6.911 0.097 1.00 10.00 H new ATOM 0 HB3 GLU A 93 -13.232 7.967 1.308 1.00 10.00 H new ATOM 0 HG2 GLU A 93 -10.813 6.215 1.836 1.00 10.00 H new ATOM 0 HG3 GLU A 93 -10.695 7.862 1.249 1.00 10.00 H new ATOM 1210 N GLN A 94 -15.503 7.029 2.441 1.00 10.00 N ATOM 1211 CA GLN A 94 -16.916 7.391 2.406 1.00 10.00 C ATOM 1212 C GLN A 94 -17.230 8.207 1.155 1.00 10.00 C ATOM 1213 O GLN A 94 -18.376 8.274 0.711 1.00 10.00 O ATOM 1214 CB GLN A 94 -17.299 8.173 3.668 1.00 10.00 C ATOM 1215 CG GLN A 94 -17.016 9.666 3.583 1.00 10.00 C ATOM 1216 CD GLN A 94 -17.331 10.400 4.870 1.00 10.00 C ATOM 1217 OE1 GLN A 94 -16.463 10.581 5.724 1.00 10.00 O ATOM 1218 NE2 GLN A 94 -18.573 10.829 5.022 1.00 10.00 N ATOM 0 H GLN A 94 -14.968 7.485 3.180 1.00 10.00 H new ATOM 0 HA GLN A 94 -17.506 6.475 2.374 1.00 10.00 H new ATOM 0 HB2 GLN A 94 -18.361 8.026 3.865 1.00 10.00 H new ATOM 0 HB3 GLN A 94 -16.756 7.759 4.518 1.00 10.00 H new ATOM 0 HG2 GLN A 94 -15.966 9.818 3.332 1.00 10.00 H new ATOM 0 HG3 GLN A 94 -17.604 10.096 2.772 1.00 10.00 H new ATOM 0 HE21 GLN A 94 -19.264 10.659 4.291 1.00 10.00 H new ATOM 0 HE22 GLN A 94 -18.840 11.329 5.870 1.00 10.00 H new ATOM 1227 N THR A 95 -16.200 8.819 0.592 1.00 10.00 N ATOM 1228 CA THR A 95 -16.349 9.627 -0.602 1.00 10.00 C ATOM 1229 C THR A 95 -16.515 8.746 -1.837 1.00 10.00 C ATOM 1230 O THR A 95 -17.209 9.109 -2.785 1.00 10.00 O ATOM 1231 CB THR A 95 -15.126 10.535 -0.782 1.00 10.00 C ATOM 1232 OG1 THR A 95 -13.964 9.883 -0.246 1.00 10.00 O ATOM 1233 CG2 THR A 95 -15.334 11.870 -0.083 1.00 10.00 C ATOM 0 H THR A 95 -15.246 8.769 0.948 1.00 10.00 H new ATOM 0 HA THR A 95 -17.243 10.240 -0.486 1.00 10.00 H new ATOM 0 HB THR A 95 -14.986 10.724 -1.846 1.00 10.00 H new ATOM 0 HG1 THR A 95 -13.182 10.462 -0.362 1.00 10.00 H new ATOM 0 HG21 THR A 95 -14.453 12.496 -0.225 1.00 10.00 H new ATOM 0 HG22 THR A 95 -16.206 12.370 -0.505 1.00 10.00 H new ATOM 0 HG23 THR A 95 -15.492 11.702 0.982 1.00 10.00 H new ATOM 1241 N GLY A 96 -15.872 7.582 -1.813 1.00 10.00 N ATOM 1242 CA GLY A 96 -15.952 6.658 -2.931 1.00 10.00 C ATOM 1243 C GLY A 96 -15.080 7.081 -4.098 1.00 10.00 C ATOM 1244 O GLY A 96 -15.172 6.516 -5.190 1.00 10.00 O ATOM 0 H GLY A 96 -15.295 7.261 -1.036 1.00 10.00 H new ATOM 0 HA2 GLY A 96 -15.652 5.664 -2.599 1.00 10.00 H new ATOM 0 HA3 GLY A 96 -16.987 6.584 -3.263 1.00 10.00 H new ATOM 1248 N GLY A 97 -14.237 8.073 -3.871 1.00 10.00 N ATOM 1249 CA GLY A 97 -13.364 8.557 -4.916 1.00 10.00 C ATOM 1250 C GLY A 97 -13.499 10.050 -5.101 1.00 10.00 C ATOM 1251 O GLY A 97 -13.820 10.739 -4.110 1.00 10.00 O ATOM 0 H GLY A 97 -14.141 8.554 -2.977 1.00 10.00 H new ATOM 0 HA2 GLY A 97 -12.331 8.311 -4.671 1.00 10.00 H new ATOM 0 HA3 GLY A 97 -13.599 8.050 -5.852 1.00 10.00 H new TER 1255 GLY A 97 ATOM 1256 N ASN B 357 -4.229 -20.259 -2.979 1.00 10.00 N ATOM 1257 CA ASN B 357 -3.404 -19.067 -2.676 1.00 10.00 C ATOM 1258 C ASN B 357 -4.156 -17.796 -3.042 1.00 10.00 C ATOM 1259 O ASN B 357 -4.953 -17.781 -3.978 1.00 10.00 O ATOM 1260 CB ASN B 357 -2.063 -19.119 -3.427 1.00 10.00 C ATOM 1261 CG ASN B 357 -2.223 -19.123 -4.938 1.00 10.00 C ATOM 1262 OD1 ASN B 357 -3.206 -19.633 -5.471 1.00 10.00 O ATOM 1263 ND2 ASN B 357 -1.245 -18.570 -5.639 1.00 10.00 N ATOM 0 HA ASN B 357 -3.198 -19.063 -1.606 1.00 10.00 H new ATOM 0 HB2 ASN B 357 -1.457 -18.262 -3.135 1.00 10.00 H new ATOM 0 HB3 ASN B 357 -1.518 -20.013 -3.123 1.00 10.00 H new ATOM 0 HD21 ASN B 357 -1.292 -18.557 -6.658 1.00 10.00 H new ATOM 0 HD22 ASN B 357 -0.445 -18.157 -5.160 1.00 10.00 H new ATOM 1272 N ASN B 358 -3.907 -16.737 -2.288 1.00 10.00 N ATOM 1273 CA ASN B 358 -4.555 -15.451 -2.526 1.00 10.00 C ATOM 1274 C ASN B 358 -3.530 -14.326 -2.466 1.00 10.00 C ATOM 1275 O ASN B 358 -3.857 -13.182 -2.145 1.00 10.00 O ATOM 1276 CB ASN B 358 -5.681 -15.206 -1.506 1.00 10.00 C ATOM 1277 CG ASN B 358 -5.250 -15.413 -0.059 1.00 10.00 C ATOM 1278 OD1 ASN B 358 -4.077 -15.642 0.237 1.00 10.00 O ATOM 1279 ND2 ASN B 358 -6.205 -15.332 0.854 1.00 10.00 N ATOM 0 H ASN B 358 -3.258 -16.740 -1.501 1.00 10.00 H new ATOM 0 HA ASN B 358 -4.998 -15.470 -3.522 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -6.051 -14.188 -1.624 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -6.512 -15.875 -1.728 1.00 10.00 H new ATOM 0 HD21 ASN B 358 -5.980 -15.461 1.840 1.00 10.00 H new ATOM 0 HD22 ASN B 358 -7.166 -15.141 0.571 1.00 10.00 H new ATOM 1286 N ARG B 359 -2.285 -14.663 -2.785 1.00 10.00 N ATOM 1287 CA ARG B 359 -1.202 -13.691 -2.766 1.00 10.00 C ATOM 1288 C ARG B 359 -0.834 -13.263 -4.180 1.00 10.00 C ATOM 1289 O ARG B 359 -0.780 -14.086 -5.097 1.00 10.00 O ATOM 1290 CB ARG B 359 0.032 -14.253 -2.044 1.00 10.00 C ATOM 1291 CG ARG B 359 0.419 -15.664 -2.470 1.00 10.00 C ATOM 1292 CD ARG B 359 1.731 -16.101 -1.830 1.00 10.00 C ATOM 1293 NE ARG B 359 1.708 -15.955 -0.377 1.00 10.00 N ATOM 1294 CZ ARG B 359 2.702 -16.314 0.427 1.00 10.00 C ATOM 1295 NH1 ARG B 359 3.801 -16.872 -0.069 1.00 10.00 N ATOM 1296 NH2 ARG B 359 2.597 -16.100 1.729 1.00 10.00 N ATOM 0 H ARG B 359 -2.002 -15.604 -3.060 1.00 10.00 H new ATOM 0 HA ARG B 359 -1.552 -12.816 -2.218 1.00 10.00 H new ATOM 0 HB2 ARG B 359 0.877 -13.588 -2.222 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -0.156 -14.249 -0.970 1.00 10.00 H new ATOM 0 HG2 ARG B 359 -0.373 -16.359 -2.191 1.00 10.00 H new ATOM 0 HG3 ARG B 359 0.511 -15.705 -3.555 1.00 10.00 H new ATOM 0 HD2 ARG B 359 1.930 -17.142 -2.086 1.00 10.00 H new ATOM 0 HD3 ARG B 359 2.549 -15.509 -2.241 1.00 10.00 H new ATOM 0 HE ARG B 359 0.874 -15.551 0.048 1.00 10.00 H new ATOM 0 HH11 ARG B 359 3.885 -17.027 -1.074 1.00 10.00 H new ATOM 0 HH12 ARG B 359 4.560 -17.145 0.555 1.00 10.00 H new ATOM 0 HH21 ARG B 359 1.757 -15.662 2.108 1.00 10.00 H new ATOM 0 HH22 ARG B 359 3.356 -16.373 2.354 1.00 10.00 H new ATOM 1310 N ASP B 360 -0.586 -11.972 -4.348 1.00 10.00 N ATOM 1311 CA ASP B 360 -0.214 -11.409 -5.640 1.00 10.00 C ATOM 1312 C ASP B 360 0.916 -10.399 -5.468 1.00 10.00 C ATOM 1313 O ASP B 360 0.724 -9.353 -4.847 1.00 10.00 O ATOM 1314 CB ASP B 360 -1.424 -10.737 -6.299 1.00 10.00 C ATOM 1315 CG ASP B 360 -1.124 -10.283 -7.716 1.00 10.00 C ATOM 1316 OD1 ASP B 360 -1.578 -9.184 -8.105 1.00 10.00 O ATOM 1317 OD2 ASP B 360 -0.431 -11.027 -8.442 1.00 10.00 O ATOM 0 H ASP B 360 -0.637 -11.286 -3.595 1.00 10.00 H new ATOM 0 HA ASP B 360 0.130 -12.218 -6.285 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -2.262 -11.433 -6.312 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -1.732 -9.879 -5.701 1.00 10.00 H new ATOM 1322 N PRO B 361 2.121 -10.715 -5.978 1.00 10.00 N ATOM 1323 CA PRO B 361 3.284 -9.829 -5.884 1.00 10.00 C ATOM 1324 C PRO B 361 3.192 -8.630 -6.831 1.00 10.00 C ATOM 1325 O PRO B 361 3.376 -8.759 -8.045 1.00 10.00 O ATOM 1326 CB PRO B 361 4.473 -10.726 -6.271 1.00 10.00 C ATOM 1327 CG PRO B 361 3.924 -12.110 -6.396 1.00 10.00 C ATOM 1328 CD PRO B 361 2.456 -11.965 -6.668 1.00 10.00 C ATOM 0 HA PRO B 361 3.371 -9.397 -4.887 1.00 10.00 H new ATOM 0 HB2 PRO B 361 4.920 -10.398 -7.209 1.00 10.00 H new ATOM 0 HB3 PRO B 361 5.256 -10.684 -5.514 1.00 10.00 H new ATOM 0 HG2 PRO B 361 4.416 -12.651 -7.204 1.00 10.00 H new ATOM 0 HG3 PRO B 361 4.095 -12.679 -5.482 1.00 10.00 H new ATOM 0 HD2 PRO B 361 2.246 -11.907 -7.736 1.00 10.00 H new ATOM 0 HD3 PRO B 361 1.887 -12.808 -6.277 1.00 10.00 H new ATOM 1336 N ILE B 362 2.905 -7.467 -6.264 1.00 10.00 N ATOM 1337 CA ILE B 362 2.789 -6.239 -7.033 1.00 10.00 C ATOM 1338 C ILE B 362 4.090 -5.459 -6.989 1.00 10.00 C ATOM 1339 O ILE B 362 4.563 -5.092 -5.918 1.00 10.00 O ATOM 1340 CB ILE B 362 1.651 -5.339 -6.509 1.00 10.00 C ATOM 1341 CG1 ILE B 362 0.338 -6.121 -6.428 1.00 10.00 C ATOM 1342 CG2 ILE B 362 1.490 -4.114 -7.403 1.00 10.00 C ATOM 1343 CD1 ILE B 362 -0.812 -5.301 -5.892 1.00 10.00 C ATOM 0 H ILE B 362 2.747 -7.349 -5.263 1.00 10.00 H new ATOM 0 HA ILE B 362 2.561 -6.528 -8.059 1.00 10.00 H new ATOM 0 HB ILE B 362 1.911 -5.004 -5.505 1.00 10.00 H new ATOM 0 HG12 ILE B 362 0.081 -6.490 -7.421 1.00 10.00 H new ATOM 0 HG13 ILE B 362 0.481 -6.994 -5.791 1.00 10.00 H new ATOM 0 HG21 ILE B 362 0.683 -3.488 -7.021 1.00 10.00 H new ATOM 0 HG22 ILE B 362 2.419 -3.544 -7.410 1.00 10.00 H new ATOM 0 HG23 ILE B 362 1.252 -4.433 -8.418 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -1.713 -5.914 -5.860 1.00 10.00 H new ATOM 0 HD12 ILE B 362 -0.574 -4.954 -4.887 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -0.981 -4.442 -6.542 1.00 10.00 H new ATOM 1355 N VAL B 363 4.676 -5.225 -8.152 1.00 10.00 N ATOM 1356 CA VAL B 363 5.923 -4.480 -8.238 1.00 10.00 C ATOM 1357 C VAL B 363 5.754 -3.273 -9.152 1.00 10.00 C ATOM 1358 O VAL B 363 5.230 -3.395 -10.261 1.00 10.00 O ATOM 1359 CB VAL B 363 7.085 -5.352 -8.768 1.00 10.00 C ATOM 1360 CG1 VAL B 363 8.428 -4.709 -8.455 1.00 10.00 C ATOM 1361 CG2 VAL B 363 7.022 -6.763 -8.197 1.00 10.00 C ATOM 0 H VAL B 363 4.309 -5.540 -9.050 1.00 10.00 H new ATOM 0 HA VAL B 363 6.171 -4.156 -7.227 1.00 10.00 H new ATOM 0 HB VAL B 363 6.980 -5.423 -9.851 1.00 10.00 H new ATOM 0 HG11 VAL B 363 9.231 -5.339 -8.837 1.00 10.00 H new ATOM 0 HG12 VAL B 363 8.481 -3.728 -8.928 1.00 10.00 H new ATOM 0 HG13 VAL B 363 8.536 -4.598 -7.376 1.00 10.00 H new ATOM 0 HG21 VAL B 363 7.852 -7.351 -8.588 1.00 10.00 H new ATOM 0 HG22 VAL B 363 7.089 -6.719 -7.110 1.00 10.00 H new ATOM 0 HG23 VAL B 363 6.080 -7.230 -8.484 1.00 10.00 H new ATOM 1371 N ILE B 364 6.186 -2.113 -8.685 1.00 10.00 N ATOM 1372 CA ILE B 364 6.093 -0.892 -9.469 1.00 10.00 C ATOM 1373 C ILE B 364 7.453 -0.201 -9.518 1.00 10.00 C ATOM 1374 O ILE B 364 8.151 -0.108 -8.509 1.00 10.00 O ATOM 1375 CB ILE B 364 4.999 0.062 -8.917 1.00 10.00 C ATOM 1376 CG1 ILE B 364 5.079 1.451 -9.584 1.00 10.00 C ATOM 1377 CG2 ILE B 364 5.081 0.163 -7.397 1.00 10.00 C ATOM 1378 CD1 ILE B 364 5.699 2.539 -8.719 1.00 10.00 C ATOM 0 H ILE B 364 6.606 -1.991 -7.764 1.00 10.00 H new ATOM 0 HA ILE B 364 5.798 -1.159 -10.484 1.00 10.00 H new ATOM 0 HB ILE B 364 4.026 -0.361 -9.168 1.00 10.00 H new ATOM 0 HG12 ILE B 364 5.657 1.364 -10.504 1.00 10.00 H new ATOM 0 HG13 ILE B 364 4.073 1.761 -9.868 1.00 10.00 H new ATOM 0 HG21 ILE B 364 4.305 0.837 -7.035 1.00 10.00 H new ATOM 0 HG22 ILE B 364 4.938 -0.825 -6.958 1.00 10.00 H new ATOM 0 HG23 ILE B 364 6.059 0.549 -7.110 1.00 10.00 H new ATOM 0 HD11 ILE B 364 5.713 3.479 -9.271 1.00 10.00 H new ATOM 0 HD12 ILE B 364 5.110 2.661 -7.810 1.00 10.00 H new ATOM 0 HD13 ILE B 364 6.719 2.258 -8.456 1.00 10.00 H new ATOM 1390 N SER B 365 7.833 0.252 -10.703 1.00 10.00 N ATOM 1391 CA SER B 365 9.112 0.913 -10.898 1.00 10.00 C ATOM 1392 C SER B 365 9.056 2.387 -10.493 1.00 10.00 C ATOM 1393 O SER B 365 8.221 3.151 -10.982 1.00 10.00 O ATOM 1394 CB SER B 365 9.525 0.781 -12.362 1.00 10.00 C ATOM 1395 OG SER B 365 8.980 -0.401 -12.931 1.00 10.00 O ATOM 0 H SER B 365 7.269 0.172 -11.549 1.00 10.00 H new ATOM 0 HA SER B 365 9.851 0.430 -10.258 1.00 10.00 H new ATOM 0 HB2 SER B 365 9.183 1.652 -12.922 1.00 10.00 H new ATOM 0 HB3 SER B 365 10.612 0.760 -12.438 1.00 10.00 H new ATOM 0 HG SER B 365 9.253 -0.468 -13.870 1.00 10.00 H new ATOM 1401 N ASP B 366 9.946 2.774 -9.591 1.00 10.00 N ATOM 1402 CA ASP B 366 10.020 4.151 -9.121 1.00 10.00 C ATOM 1403 C ASP B 366 10.935 4.959 -10.032 1.00 10.00 C ATOM 1404 O ASP B 366 11.905 4.428 -10.576 1.00 10.00 O ATOM 1405 CB ASP B 366 10.515 4.185 -7.665 1.00 10.00 C ATOM 1406 CG ASP B 366 11.523 5.288 -7.382 1.00 10.00 C ATOM 1407 OD1 ASP B 366 12.737 5.044 -7.554 1.00 10.00 O ATOM 1408 OD2 ASP B 366 11.107 6.385 -6.960 1.00 10.00 O ATOM 0 H ASP B 366 10.632 2.149 -9.167 1.00 10.00 H new ATOM 0 HA ASP B 366 9.027 4.598 -9.150 1.00 10.00 H new ATOM 0 HB2 ASP B 366 9.658 4.311 -7.003 1.00 10.00 H new ATOM 0 HB3 ASP B 366 10.966 3.223 -7.423 1.00 10.00 H new ATOM 1413 N SER B 367 10.617 6.230 -10.214 1.00 10.00 N ATOM 1414 CA SER B 367 11.413 7.095 -11.066 1.00 10.00 C ATOM 1415 C SER B 367 11.623 8.454 -10.403 1.00 10.00 C ATOM 1416 O SER B 367 10.720 8.972 -9.740 1.00 10.00 O ATOM 1417 CB SER B 367 10.734 7.264 -12.428 1.00 10.00 C ATOM 1418 OG SER B 367 9.365 6.894 -12.363 1.00 10.00 O ATOM 0 H SER B 367 9.813 6.685 -9.782 1.00 10.00 H new ATOM 0 HA SER B 367 12.389 6.633 -11.216 1.00 10.00 H new ATOM 0 HB2 SER B 367 10.819 8.300 -12.755 1.00 10.00 H new ATOM 0 HB3 SER B 367 11.245 6.652 -13.172 1.00 10.00 H new ATOM 0 HG SER B 367 8.952 7.012 -13.244 1.00 10.00 H new ATOM 1424 N PRO B 368 12.830 9.030 -10.552 1.00 10.00 N ATOM 1425 CA PRO B 368 13.168 10.341 -9.982 1.00 10.00 C ATOM 1426 C PRO B 368 12.225 11.442 -10.458 1.00 10.00 C ATOM 1427 O PRO B 368 11.824 12.283 -9.626 1.00 10.00 O ATOM 1428 CB PRO B 368 14.586 10.605 -10.498 1.00 10.00 C ATOM 1429 CG PRO B 368 15.136 9.262 -10.818 1.00 10.00 C ATOM 1430 CD PRO B 368 13.969 8.439 -11.278 1.00 10.00 C ATOM 1431 OXT PRO B 368 11.884 11.460 -11.658 1.00 10.00 O ATOM 0 HA PRO B 368 13.087 10.339 -8.895 1.00 10.00 H new ATOM 0 HB2 PRO B 368 14.572 11.246 -11.380 1.00 10.00 H new ATOM 0 HB3 PRO B 368 15.192 11.110 -9.746 1.00 10.00 H new ATOM 0 HG2 PRO B 368 15.898 9.327 -11.594 1.00 10.00 H new ATOM 0 HG3 PRO B 368 15.609 8.815 -9.944 1.00 10.00 H new ATOM 0 HD2 PRO B 368 13.834 8.501 -12.358 1.00 10.00 H new ATOM 0 HD3 PRO B 368 14.099 7.385 -11.033 1.00 10.00 H new TER 1439 PRO B 368