USER MOD reduce.3.24.130724 H: found=0, std=0, add=706, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 702 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 Single : A 1 GLY N :NH3+ -121:sc= 0.0882 (180deg=0) USER MOD Single : A 2 SER OG : rot 12:sc= 1.1 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 47:sc= 0.0585 USER MOD Single : A 11 GLN : amide:sc= -0.512 K(o=-0.51,f=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 ASN : amide:sc= -5.09! C(o=-5.1!,f=-8!) USER MOD Single : A 19 LYS NZ :NH3+ 160:sc= 0.271 (180deg=0.142) USER MOD Single : A 20 TYR OH : rot 15:sc= -2.28 USER MOD Single : A 27 ASN : amide:sc=-0.00141 X(o=-0.0014,f=-0.45) USER MOD Single : A 34 TYR OH : rot -29:sc= 0.0603 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 SER OG : rot 170:sc= -0.865 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -2.52! C(o=-2.5!,f=-9.6!) USER MOD Single : A 59 ASN : amide:sc= -0.0939 K(o=-0.094,f=-1.7!) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 TYR OH : rot 149:sc= 1.95 USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 78 MET CE :methyl 145:sc= -1.41 (180deg=-2.51!) USER MOD Single : A 82 ASN : amide:sc= -0.235 K(o=-0.23,f=-1.8!) USER MOD Single : A 83 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 24:sc= 0.451 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.372 4.281 -23.993 1.00 0.00 N ATOM 2 CA GLY A 1 8.023 4.929 -22.868 1.00 0.00 C ATOM 3 C GLY A 1 7.433 4.448 -21.541 1.00 0.00 C ATOM 4 O GLY A 1 6.778 3.408 -21.490 1.00 0.00 O ATOM 0 H1 GLY A 1 8.080 3.764 -24.553 1.00 0.00 H new ATOM 0 H2 GLY A 1 6.654 3.615 -23.642 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.916 4.999 -24.591 1.00 0.00 H new ATOM 0 HA2 GLY A 1 9.092 4.719 -22.892 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.909 6.010 -22.950 1.00 0.00 H new ATOM 8 N SER A 2 7.686 5.228 -20.501 1.00 0.00 N ATOM 9 CA SER A 2 7.188 4.894 -19.177 1.00 0.00 C ATOM 10 C SER A 2 6.091 5.878 -18.767 1.00 0.00 C ATOM 11 O SER A 2 6.378 7.020 -18.411 1.00 0.00 O ATOM 12 CB SER A 2 8.318 4.899 -18.146 1.00 0.00 C ATOM 13 OG SER A 2 8.763 6.219 -17.847 1.00 0.00 O ATOM 0 H SER A 2 8.229 6.090 -20.548 1.00 0.00 H new ATOM 0 HA SER A 2 6.770 3.888 -19.213 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.976 4.416 -17.231 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.155 4.311 -18.523 1.00 0.00 H new ATOM 0 HG SER A 2 8.133 6.869 -18.223 1.00 0.00 H new ATOM 19 N SER A 3 4.857 5.400 -18.830 1.00 0.00 N ATOM 20 CA SER A 3 3.716 6.223 -18.470 1.00 0.00 C ATOM 21 C SER A 3 3.162 5.784 -17.112 1.00 0.00 C ATOM 22 O SER A 3 2.930 4.598 -16.886 1.00 0.00 O ATOM 23 CB SER A 3 2.623 6.149 -19.538 1.00 0.00 C ATOM 24 OG SER A 3 3.100 6.556 -20.818 1.00 0.00 O ATOM 0 H SER A 3 4.623 4.452 -19.125 1.00 0.00 H new ATOM 0 HA SER A 3 4.050 7.258 -18.402 1.00 0.00 H new ATOM 0 HB2 SER A 3 2.245 5.129 -19.600 1.00 0.00 H new ATOM 0 HB3 SER A 3 1.786 6.782 -19.245 1.00 0.00 H new ATOM 0 HG SER A 3 2.374 6.493 -21.473 1.00 0.00 H new ATOM 30 N GLY A 4 2.965 6.766 -16.243 1.00 0.00 N ATOM 31 CA GLY A 4 2.442 6.496 -14.915 1.00 0.00 C ATOM 32 C GLY A 4 2.383 7.775 -14.079 1.00 0.00 C ATOM 33 O GLY A 4 1.328 8.399 -13.967 1.00 0.00 O ATOM 0 H GLY A 4 3.158 7.749 -16.433 1.00 0.00 H new ATOM 0 HA2 GLY A 4 1.445 6.063 -14.994 1.00 0.00 H new ATOM 0 HA3 GLY A 4 3.071 5.759 -14.415 1.00 0.00 H new ATOM 37 N SER A 5 3.527 8.128 -13.514 1.00 0.00 N ATOM 38 CA SER A 5 3.619 9.323 -12.691 1.00 0.00 C ATOM 39 C SER A 5 2.586 9.262 -11.564 1.00 0.00 C ATOM 40 O SER A 5 1.446 9.693 -11.737 1.00 0.00 O ATOM 41 CB SER A 5 3.415 10.586 -13.529 1.00 0.00 C ATOM 42 OG SER A 5 4.300 10.634 -14.645 1.00 0.00 O ATOM 0 H SER A 5 4.399 7.608 -13.609 1.00 0.00 H new ATOM 0 HA SER A 5 4.619 9.364 -12.258 1.00 0.00 H new ATOM 0 HB2 SER A 5 2.384 10.625 -13.882 1.00 0.00 H new ATOM 0 HB3 SER A 5 3.571 11.465 -12.904 1.00 0.00 H new ATOM 0 HG SER A 5 4.138 11.454 -15.156 1.00 0.00 H new ATOM 48 N SER A 6 3.021 8.724 -10.434 1.00 0.00 N ATOM 49 CA SER A 6 2.147 8.602 -9.279 1.00 0.00 C ATOM 50 C SER A 6 2.896 7.927 -8.127 1.00 0.00 C ATOM 51 O SER A 6 3.088 6.711 -8.133 1.00 0.00 O ATOM 52 CB SER A 6 0.883 7.811 -9.625 1.00 0.00 C ATOM 53 OG SER A 6 1.174 6.654 -10.402 1.00 0.00 O ATOM 0 H SER A 6 3.966 8.368 -10.293 1.00 0.00 H new ATOM 0 HA SER A 6 1.844 9.603 -8.972 1.00 0.00 H new ATOM 0 HB2 SER A 6 0.379 7.513 -8.706 1.00 0.00 H new ATOM 0 HB3 SER A 6 0.193 8.452 -10.174 1.00 0.00 H new ATOM 0 HG SER A 6 1.926 6.171 -10.000 1.00 0.00 H new ATOM 59 N GLY A 7 3.298 8.745 -7.165 1.00 0.00 N ATOM 60 CA GLY A 7 4.021 8.243 -6.009 1.00 0.00 C ATOM 61 C GLY A 7 3.100 7.427 -5.099 1.00 0.00 C ATOM 62 O GLY A 7 3.417 6.291 -4.748 1.00 0.00 O ATOM 0 H GLY A 7 3.137 9.752 -7.163 1.00 0.00 H new ATOM 0 HA2 GLY A 7 4.855 7.623 -6.338 1.00 0.00 H new ATOM 0 HA3 GLY A 7 4.445 9.077 -5.450 1.00 0.00 H new ATOM 66 N LEU A 8 1.980 8.037 -4.744 1.00 0.00 N ATOM 67 CA LEU A 8 1.012 7.382 -3.881 1.00 0.00 C ATOM 68 C LEU A 8 0.826 5.933 -4.339 1.00 0.00 C ATOM 69 O LEU A 8 0.908 5.008 -3.532 1.00 0.00 O ATOM 70 CB LEU A 8 -0.291 8.182 -3.832 1.00 0.00 C ATOM 71 CG LEU A 8 -0.173 9.627 -3.340 1.00 0.00 C ATOM 72 CD1 LEU A 8 -1.327 10.482 -3.866 1.00 0.00 C ATOM 73 CD2 LEU A 8 -0.070 9.678 -1.815 1.00 0.00 C ATOM 0 H LEU A 8 1.721 8.979 -5.038 1.00 0.00 H new ATOM 0 HA LEU A 8 1.378 7.349 -2.855 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -0.725 8.194 -4.832 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -0.993 7.655 -3.186 1.00 0.00 H new ATOM 0 HG LEU A 8 0.748 10.051 -3.740 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.219 11.503 -3.501 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.312 10.482 -4.956 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -2.274 10.070 -3.516 1.00 0.00 H new ATOM 0 HD21 LEU A 8 0.013 10.715 -1.490 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -0.961 9.230 -1.375 1.00 0.00 H new ATOM 0 HD23 LEU A 8 0.812 9.125 -1.491 1.00 0.00 H new ATOM 85 N ARG A 9 0.578 5.782 -5.632 1.00 0.00 N ATOM 86 CA ARG A 9 0.380 4.462 -6.206 1.00 0.00 C ATOM 87 C ARG A 9 1.413 3.480 -5.649 1.00 0.00 C ATOM 88 O ARG A 9 1.053 2.496 -5.005 1.00 0.00 O ATOM 89 CB ARG A 9 0.496 4.502 -7.731 1.00 0.00 C ATOM 90 CG ARG A 9 0.298 3.110 -8.332 1.00 0.00 C ATOM 91 CD ARG A 9 -1.130 2.937 -8.855 1.00 0.00 C ATOM 92 NE ARG A 9 -1.343 3.798 -10.039 1.00 0.00 N ATOM 93 CZ ARG A 9 -2.541 4.026 -10.596 1.00 0.00 C ATOM 94 NH1 ARG A 9 -3.639 3.460 -10.079 1.00 0.00 N ATOM 95 NH2 ARG A 9 -2.640 4.823 -11.668 1.00 0.00 N ATOM 0 H ARG A 9 0.510 6.552 -6.298 1.00 0.00 H new ATOM 0 HA ARG A 9 -0.623 4.131 -5.937 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -0.248 5.187 -8.138 1.00 0.00 H new ATOM 0 HB3 ARG A 9 1.475 4.889 -8.015 1.00 0.00 H new ATOM 0 HG2 ARG A 9 1.008 2.956 -9.145 1.00 0.00 H new ATOM 0 HG3 ARG A 9 0.508 2.351 -7.578 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -1.306 1.894 -9.117 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -1.846 3.195 -8.074 1.00 0.00 H new ATOM 0 HE ARG A 9 -0.528 4.246 -10.458 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -3.564 2.855 -9.261 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -4.550 3.634 -10.503 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -1.804 5.256 -12.060 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -3.551 4.997 -12.092 1.00 0.00 H new ATOM 109 N GLU A 10 2.675 3.783 -5.915 1.00 0.00 N ATOM 110 CA GLU A 10 3.761 2.939 -5.448 1.00 0.00 C ATOM 111 C GLU A 10 3.699 2.788 -3.927 1.00 0.00 C ATOM 112 O GLU A 10 3.898 1.695 -3.400 1.00 0.00 O ATOM 113 CB GLU A 10 5.117 3.495 -5.889 1.00 0.00 C ATOM 114 CG GLU A 10 5.610 2.795 -7.157 1.00 0.00 C ATOM 115 CD GLU A 10 6.506 1.603 -6.812 1.00 0.00 C ATOM 116 OE1 GLU A 10 7.304 1.750 -5.861 1.00 0.00 O ATOM 117 OE2 GLU A 10 6.372 0.573 -7.506 1.00 0.00 O ATOM 0 H GLU A 10 2.969 4.601 -6.448 1.00 0.00 H new ATOM 0 HA GLU A 10 3.647 1.952 -5.897 1.00 0.00 H new ATOM 0 HB2 GLU A 10 5.033 4.567 -6.070 1.00 0.00 H new ATOM 0 HB3 GLU A 10 5.846 3.363 -5.089 1.00 0.00 H new ATOM 0 HG2 GLU A 10 4.757 2.455 -7.744 1.00 0.00 H new ATOM 0 HG3 GLU A 10 6.162 3.502 -7.776 1.00 0.00 H new ATOM 124 N GLN A 11 3.425 3.902 -3.265 1.00 0.00 N ATOM 125 CA GLN A 11 3.335 3.907 -1.814 1.00 0.00 C ATOM 126 C GLN A 11 2.332 2.852 -1.340 1.00 0.00 C ATOM 127 O GLN A 11 2.624 2.079 -0.429 1.00 0.00 O ATOM 128 CB GLN A 11 2.956 5.296 -1.293 1.00 0.00 C ATOM 129 CG GLN A 11 4.029 6.325 -1.650 1.00 0.00 C ATOM 130 CD GLN A 11 4.174 7.372 -0.543 1.00 0.00 C ATOM 131 OE1 GLN A 11 5.060 7.309 0.294 1.00 0.00 O ATOM 132 NE2 GLN A 11 3.258 8.335 -0.586 1.00 0.00 N ATOM 0 H GLN A 11 3.262 4.807 -3.706 1.00 0.00 H new ATOM 0 HA GLN A 11 4.315 3.657 -1.408 1.00 0.00 H new ATOM 0 HB2 GLN A 11 2.000 5.600 -1.718 1.00 0.00 H new ATOM 0 HB3 GLN A 11 2.827 5.260 -0.211 1.00 0.00 H new ATOM 0 HG2 GLN A 11 4.983 5.822 -1.807 1.00 0.00 H new ATOM 0 HG3 GLN A 11 3.770 6.816 -2.588 1.00 0.00 H new ATOM 0 HE21 GLN A 11 2.544 8.327 -1.314 1.00 0.00 H new ATOM 0 HE22 GLN A 11 3.270 9.081 0.109 1.00 0.00 H new ATOM 141 N VAL A 12 1.173 2.854 -1.981 1.00 0.00 N ATOM 142 CA VAL A 12 0.125 1.906 -1.637 1.00 0.00 C ATOM 143 C VAL A 12 0.603 0.489 -1.956 1.00 0.00 C ATOM 144 O VAL A 12 0.308 -0.450 -1.216 1.00 0.00 O ATOM 145 CB VAL A 12 -1.173 2.276 -2.358 1.00 0.00 C ATOM 146 CG1 VAL A 12 -2.213 1.164 -2.217 1.00 0.00 C ATOM 147 CG2 VAL A 12 -1.722 3.610 -1.847 1.00 0.00 C ATOM 0 H VAL A 12 0.936 3.497 -2.737 1.00 0.00 H new ATOM 0 HA VAL A 12 -0.090 1.945 -0.569 1.00 0.00 H new ATOM 0 HB VAL A 12 -0.948 2.391 -3.418 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -3.126 1.452 -2.738 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -1.822 0.243 -2.651 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -2.433 1.003 -1.162 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -2.645 3.850 -2.375 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -1.925 3.535 -0.779 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -0.988 4.397 -2.022 1.00 0.00 H new ATOM 157 N LYS A 13 1.332 0.377 -3.056 1.00 0.00 N ATOM 158 CA LYS A 13 1.853 -0.912 -3.481 1.00 0.00 C ATOM 159 C LYS A 13 2.689 -1.517 -2.352 1.00 0.00 C ATOM 160 O LYS A 13 2.383 -2.603 -1.862 1.00 0.00 O ATOM 161 CB LYS A 13 2.612 -0.774 -4.802 1.00 0.00 C ATOM 162 CG LYS A 13 1.688 -1.027 -5.995 1.00 0.00 C ATOM 163 CD LYS A 13 2.481 -1.078 -7.302 1.00 0.00 C ATOM 164 CE LYS A 13 2.042 0.036 -8.254 1.00 0.00 C ATOM 165 NZ LYS A 13 2.788 -0.048 -9.530 1.00 0.00 N ATOM 0 H LYS A 13 1.575 1.157 -3.666 1.00 0.00 H new ATOM 0 HA LYS A 13 1.036 -1.606 -3.680 1.00 0.00 H new ATOM 0 HB2 LYS A 13 3.042 0.225 -4.876 1.00 0.00 H new ATOM 0 HB3 LYS A 13 3.442 -1.480 -4.824 1.00 0.00 H new ATOM 0 HG2 LYS A 13 1.154 -1.966 -5.853 1.00 0.00 H new ATOM 0 HG3 LYS A 13 0.937 -0.239 -6.052 1.00 0.00 H new ATOM 0 HD2 LYS A 13 3.546 -0.981 -7.089 1.00 0.00 H new ATOM 0 HD3 LYS A 13 2.339 -2.047 -7.780 1.00 0.00 H new ATOM 0 HE2 LYS A 13 0.972 -0.042 -8.446 1.00 0.00 H new ATOM 0 HE3 LYS A 13 2.212 1.007 -7.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 2.478 0.715 -10.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 3.807 0.049 -9.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 2.605 -0.968 -9.979 1.00 0.00 H new ATOM 179 N GLU A 14 3.727 -0.788 -1.971 1.00 0.00 N ATOM 180 CA GLU A 14 4.609 -1.238 -0.908 1.00 0.00 C ATOM 181 C GLU A 14 3.812 -1.485 0.374 1.00 0.00 C ATOM 182 O GLU A 14 4.152 -2.369 1.160 1.00 0.00 O ATOM 183 CB GLU A 14 5.737 -0.232 -0.668 1.00 0.00 C ATOM 184 CG GLU A 14 6.839 -0.384 -1.718 1.00 0.00 C ATOM 185 CD GLU A 14 7.994 -1.234 -1.182 1.00 0.00 C ATOM 186 OE1 GLU A 14 7.849 -2.475 -1.219 1.00 0.00 O ATOM 187 OE2 GLU A 14 8.995 -0.623 -0.749 1.00 0.00 O ATOM 0 H GLU A 14 3.977 0.112 -2.380 1.00 0.00 H new ATOM 0 HA GLU A 14 5.066 -2.179 -1.215 1.00 0.00 H new ATOM 0 HB2 GLU A 14 5.338 0.782 -0.699 1.00 0.00 H new ATOM 0 HB3 GLU A 14 6.155 -0.380 0.328 1.00 0.00 H new ATOM 0 HG2 GLU A 14 6.429 -0.846 -2.616 1.00 0.00 H new ATOM 0 HG3 GLU A 14 7.210 0.600 -2.006 1.00 0.00 H new ATOM 194 N LEU A 15 2.767 -0.689 0.547 1.00 0.00 N ATOM 195 CA LEU A 15 1.919 -0.810 1.720 1.00 0.00 C ATOM 196 C LEU A 15 1.338 -2.224 1.781 1.00 0.00 C ATOM 197 O LEU A 15 1.643 -2.985 2.697 1.00 0.00 O ATOM 198 CB LEU A 15 0.858 0.292 1.730 1.00 0.00 C ATOM 199 CG LEU A 15 -0.451 -0.045 2.447 1.00 0.00 C ATOM 200 CD1 LEU A 15 -0.266 -0.023 3.966 1.00 0.00 C ATOM 201 CD2 LEU A 15 -1.578 0.885 1.995 1.00 0.00 C ATOM 0 H LEU A 15 2.488 0.043 -0.107 1.00 0.00 H new ATOM 0 HA LEU A 15 2.503 -0.666 2.629 1.00 0.00 H new ATOM 0 HB2 LEU A 15 1.287 1.178 2.197 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.627 0.556 0.698 1.00 0.00 H new ATOM 0 HG LEU A 15 -0.739 -1.060 2.172 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -1.211 -0.266 4.451 1.00 0.00 H new ATOM 0 HD12 LEU A 15 0.487 -0.757 4.251 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.058 0.970 4.279 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -2.497 0.624 2.520 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -1.311 1.917 2.222 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -1.730 0.777 0.921 1.00 0.00 H new ATOM 213 N PHE A 16 0.513 -2.532 0.792 1.00 0.00 N ATOM 214 CA PHE A 16 -0.114 -3.842 0.721 1.00 0.00 C ATOM 215 C PHE A 16 0.932 -4.955 0.813 1.00 0.00 C ATOM 216 O PHE A 16 0.718 -5.957 1.494 1.00 0.00 O ATOM 217 CB PHE A 16 -0.816 -3.929 -0.635 1.00 0.00 C ATOM 218 CG PHE A 16 -2.135 -3.156 -0.703 1.00 0.00 C ATOM 219 CD1 PHE A 16 -3.075 -3.329 0.265 1.00 0.00 C ATOM 220 CD2 PHE A 16 -2.369 -2.298 -1.732 1.00 0.00 C ATOM 221 CE1 PHE A 16 -4.299 -2.612 0.202 1.00 0.00 C ATOM 222 CE2 PHE A 16 -3.592 -1.582 -1.796 1.00 0.00 C ATOM 223 CZ PHE A 16 -4.532 -1.754 -0.827 1.00 0.00 C ATOM 0 H PHE A 16 0.264 -1.898 0.033 1.00 0.00 H new ATOM 0 HA PHE A 16 -0.812 -3.966 1.549 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -0.144 -3.550 -1.405 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -1.008 -4.977 -0.867 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -2.890 -4.012 1.081 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -1.623 -2.162 -2.501 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -5.045 -2.748 0.971 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -3.777 -0.901 -2.613 1.00 0.00 H new ATOM 0 HZ PHE A 16 -5.463 -1.209 -0.875 1.00 0.00 H new ATOM 233 N ASN A 17 2.039 -4.742 0.119 1.00 0.00 N ATOM 234 CA ASN A 17 3.119 -5.716 0.113 1.00 0.00 C ATOM 235 C ASN A 17 3.716 -5.815 1.518 1.00 0.00 C ATOM 236 O ASN A 17 3.988 -6.912 2.005 1.00 0.00 O ATOM 237 CB ASN A 17 4.234 -5.296 -0.847 1.00 0.00 C ATOM 238 CG ASN A 17 3.695 -5.116 -2.267 1.00 0.00 C ATOM 239 OD1 ASN A 17 2.514 -4.901 -2.489 1.00 0.00 O ATOM 240 ND2 ASN A 17 4.624 -5.216 -3.215 1.00 0.00 N ATOM 0 H ASN A 17 2.213 -3.909 -0.444 1.00 0.00 H new ATOM 0 HA ASN A 17 2.709 -6.674 -0.208 1.00 0.00 H new ATOM 0 HB2 ASN A 17 4.683 -4.364 -0.504 1.00 0.00 H new ATOM 0 HB3 ASN A 17 5.022 -6.049 -0.846 1.00 0.00 H new ATOM 0 HD21 ASN A 17 4.365 -5.111 -4.196 1.00 0.00 H new ATOM 0 HD22 ASN A 17 5.595 -5.397 -2.960 1.00 0.00 H new ATOM 247 N GLU A 18 3.904 -4.656 2.130 1.00 0.00 N ATOM 248 CA GLU A 18 4.466 -4.598 3.469 1.00 0.00 C ATOM 249 C GLU A 18 3.608 -5.414 4.439 1.00 0.00 C ATOM 250 O GLU A 18 4.136 -6.178 5.246 1.00 0.00 O ATOM 251 CB GLU A 18 4.604 -3.150 3.944 1.00 0.00 C ATOM 252 CG GLU A 18 5.743 -2.439 3.211 1.00 0.00 C ATOM 253 CD GLU A 18 6.946 -2.235 4.134 1.00 0.00 C ATOM 254 OE1 GLU A 18 7.598 -3.253 4.450 1.00 0.00 O ATOM 255 OE2 GLU A 18 7.187 -1.065 4.503 1.00 0.00 O ATOM 0 H GLU A 18 3.677 -3.748 1.723 1.00 0.00 H new ATOM 0 HA GLU A 18 5.465 -5.033 3.442 1.00 0.00 H new ATOM 0 HB2 GLU A 18 3.669 -2.617 3.774 1.00 0.00 H new ATOM 0 HB3 GLU A 18 4.790 -3.132 5.018 1.00 0.00 H new ATOM 0 HG2 GLU A 18 6.042 -3.025 2.342 1.00 0.00 H new ATOM 0 HG3 GLU A 18 5.396 -1.474 2.841 1.00 0.00 H new ATOM 262 N LYS A 19 2.302 -5.224 4.327 1.00 0.00 N ATOM 263 CA LYS A 19 1.367 -5.932 5.184 1.00 0.00 C ATOM 264 C LYS A 19 1.544 -7.440 4.989 1.00 0.00 C ATOM 265 O LYS A 19 1.832 -8.164 5.940 1.00 0.00 O ATOM 266 CB LYS A 19 -0.061 -5.444 4.939 1.00 0.00 C ATOM 267 CG LYS A 19 -0.204 -3.962 5.294 1.00 0.00 C ATOM 268 CD LYS A 19 -0.315 -3.771 6.809 1.00 0.00 C ATOM 269 CE LYS A 19 -0.068 -2.311 7.195 1.00 0.00 C ATOM 270 NZ LYS A 19 0.118 -2.187 8.658 1.00 0.00 N ATOM 0 H LYS A 19 1.869 -4.590 3.656 1.00 0.00 H new ATOM 0 HA LYS A 19 1.576 -5.719 6.232 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -0.327 -5.598 3.893 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -0.758 -6.033 5.535 1.00 0.00 H new ATOM 0 HG2 LYS A 19 0.656 -3.409 4.916 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -1.088 -3.551 4.806 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -1.305 -4.078 7.147 1.00 0.00 H new ATOM 0 HD3 LYS A 19 0.407 -4.412 7.314 1.00 0.00 H new ATOM 0 HE2 LYS A 19 0.815 -1.936 6.677 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -0.910 -1.697 6.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 0.607 -1.294 8.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -0.810 -2.194 9.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 0.688 -2.985 9.004 1.00 0.00 H new ATOM 284 N TYR A 20 1.365 -7.867 3.747 1.00 0.00 N ATOM 285 CA TYR A 20 1.501 -9.275 3.414 1.00 0.00 C ATOM 286 C TYR A 20 2.724 -9.886 4.100 1.00 0.00 C ATOM 287 O TYR A 20 2.618 -10.912 4.769 1.00 0.00 O ATOM 288 CB TYR A 20 1.700 -9.332 1.898 1.00 0.00 C ATOM 289 CG TYR A 20 1.168 -10.611 1.248 1.00 0.00 C ATOM 290 CD1 TYR A 20 -0.120 -11.034 1.510 1.00 0.00 C ATOM 291 CD2 TYR A 20 1.976 -11.342 0.400 1.00 0.00 C ATOM 292 CE1 TYR A 20 -0.621 -12.237 0.898 1.00 0.00 C ATOM 293 CE2 TYR A 20 1.475 -12.546 -0.211 1.00 0.00 C ATOM 294 CZ TYR A 20 0.201 -12.934 0.068 1.00 0.00 C ATOM 295 OH TYR A 20 -0.272 -14.070 -0.510 1.00 0.00 O ATOM 0 H TYR A 20 1.127 -7.263 2.960 1.00 0.00 H new ATOM 0 HA TYR A 20 0.624 -9.833 3.742 1.00 0.00 H new ATOM 0 HB2 TYR A 20 1.205 -8.473 1.444 1.00 0.00 H new ATOM 0 HB3 TYR A 20 2.764 -9.240 1.678 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -0.752 -10.462 2.174 1.00 0.00 H new ATOM 0 HD2 TYR A 20 2.983 -11.011 0.195 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -1.627 -12.578 1.093 1.00 0.00 H new ATOM 0 HE2 TYR A 20 2.096 -13.128 -0.876 1.00 0.00 H new ATOM 0 HH TYR A 20 -1.247 -14.101 -0.420 1.00 0.00 H new ATOM 305 N GLY A 21 3.858 -9.227 3.911 1.00 0.00 N ATOM 306 CA GLY A 21 5.101 -9.693 4.505 1.00 0.00 C ATOM 307 C GLY A 21 4.930 -9.954 6.002 1.00 0.00 C ATOM 308 O GLY A 21 5.193 -11.058 6.478 1.00 0.00 O ATOM 0 H GLY A 21 3.943 -8.375 3.356 1.00 0.00 H new ATOM 0 HA2 GLY A 21 5.425 -10.607 4.008 1.00 0.00 H new ATOM 0 HA3 GLY A 21 5.883 -8.950 4.349 1.00 0.00 H new ATOM 312 N GLU A 22 4.490 -8.920 6.705 1.00 0.00 N ATOM 313 CA GLU A 22 4.280 -9.025 8.138 1.00 0.00 C ATOM 314 C GLU A 22 3.282 -10.141 8.449 1.00 0.00 C ATOM 315 O GLU A 22 3.519 -10.961 9.335 1.00 0.00 O ATOM 316 CB GLU A 22 3.810 -7.690 8.722 1.00 0.00 C ATOM 317 CG GLU A 22 4.752 -6.554 8.322 1.00 0.00 C ATOM 318 CD GLU A 22 4.977 -5.591 9.490 1.00 0.00 C ATOM 319 OE1 GLU A 22 4.140 -4.673 9.637 1.00 0.00 O ATOM 320 OE2 GLU A 22 5.978 -5.794 10.208 1.00 0.00 O ATOM 0 H GLU A 22 4.273 -8.006 6.308 1.00 0.00 H new ATOM 0 HA GLU A 22 5.231 -9.275 8.607 1.00 0.00 H new ATOM 0 HB2 GLU A 22 2.801 -7.471 8.372 1.00 0.00 H new ATOM 0 HB3 GLU A 22 3.762 -7.761 9.809 1.00 0.00 H new ATOM 0 HG2 GLU A 22 5.707 -6.966 7.997 1.00 0.00 H new ATOM 0 HG3 GLU A 22 4.334 -6.012 7.474 1.00 0.00 H new ATOM 327 N ALA A 23 2.187 -10.138 7.704 1.00 0.00 N ATOM 328 CA ALA A 23 1.152 -11.141 7.888 1.00 0.00 C ATOM 329 C ALA A 23 1.736 -12.527 7.610 1.00 0.00 C ATOM 330 O ALA A 23 1.350 -13.507 8.246 1.00 0.00 O ATOM 331 CB ALA A 23 -0.040 -10.818 6.984 1.00 0.00 C ATOM 0 H ALA A 23 1.994 -9.456 6.971 1.00 0.00 H new ATOM 0 HA ALA A 23 0.791 -11.135 8.917 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -0.816 -11.571 7.122 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -0.437 -9.836 7.242 1.00 0.00 H new ATOM 0 HB3 ALA A 23 0.283 -10.817 5.943 1.00 0.00 H new ATOM 337 N LEU A 24 2.657 -12.567 6.658 1.00 0.00 N ATOM 338 CA LEU A 24 3.299 -13.817 6.288 1.00 0.00 C ATOM 339 C LEU A 24 4.246 -14.251 7.409 1.00 0.00 C ATOM 340 O LEU A 24 4.802 -15.347 7.367 1.00 0.00 O ATOM 341 CB LEU A 24 3.980 -13.686 4.925 1.00 0.00 C ATOM 342 CG LEU A 24 3.089 -13.928 3.704 1.00 0.00 C ATOM 343 CD1 LEU A 24 3.764 -13.428 2.425 1.00 0.00 C ATOM 344 CD2 LEU A 24 2.686 -15.400 3.601 1.00 0.00 C ATOM 0 H LEU A 24 2.974 -11.753 6.131 1.00 0.00 H new ATOM 0 HA LEU A 24 2.557 -14.607 6.174 1.00 0.00 H new ATOM 0 HB2 LEU A 24 4.404 -12.685 4.848 1.00 0.00 H new ATOM 0 HB3 LEU A 24 4.812 -14.389 4.888 1.00 0.00 H new ATOM 0 HG LEU A 24 2.172 -13.352 3.831 1.00 0.00 H new ATOM 0 HD11 LEU A 24 3.110 -13.612 1.573 1.00 0.00 H new ATOM 0 HD12 LEU A 24 3.957 -12.359 2.510 1.00 0.00 H new ATOM 0 HD13 LEU A 24 4.706 -13.957 2.280 1.00 0.00 H new ATOM 0 HD21 LEU A 24 2.053 -15.544 2.725 1.00 0.00 H new ATOM 0 HD22 LEU A 24 3.580 -16.016 3.508 1.00 0.00 H new ATOM 0 HD23 LEU A 24 2.137 -15.690 4.497 1.00 0.00 H new ATOM 356 N GLY A 25 4.399 -13.368 8.386 1.00 0.00 N ATOM 357 CA GLY A 25 5.268 -13.647 9.516 1.00 0.00 C ATOM 358 C GLY A 25 6.739 -13.466 9.134 1.00 0.00 C ATOM 359 O GLY A 25 7.624 -14.030 9.776 1.00 0.00 O ATOM 0 H GLY A 25 3.936 -12.460 8.418 1.00 0.00 H new ATOM 0 HA2 GLY A 25 5.019 -12.983 10.344 1.00 0.00 H new ATOM 0 HA3 GLY A 25 5.102 -14.666 9.864 1.00 0.00 H new ATOM 363 N LEU A 26 6.954 -12.678 8.091 1.00 0.00 N ATOM 364 CA LEU A 26 8.302 -12.417 7.616 1.00 0.00 C ATOM 365 C LEU A 26 8.737 -11.023 8.070 1.00 0.00 C ATOM 366 O LEU A 26 8.010 -10.349 8.799 1.00 0.00 O ATOM 367 CB LEU A 26 8.386 -12.624 6.102 1.00 0.00 C ATOM 368 CG LEU A 26 7.627 -13.831 5.546 1.00 0.00 C ATOM 369 CD1 LEU A 26 7.945 -14.044 4.065 1.00 0.00 C ATOM 370 CD2 LEU A 26 7.905 -15.083 6.378 1.00 0.00 C ATOM 0 H LEU A 26 6.217 -12.212 7.562 1.00 0.00 H new ATOM 0 HA LEU A 26 9.004 -13.128 8.052 1.00 0.00 H new ATOM 0 HB2 LEU A 26 8.010 -11.726 5.611 1.00 0.00 H new ATOM 0 HB3 LEU A 26 9.436 -12.722 5.827 1.00 0.00 H new ATOM 0 HG LEU A 26 6.559 -13.627 5.619 1.00 0.00 H new ATOM 0 HD11 LEU A 26 7.393 -14.908 3.695 1.00 0.00 H new ATOM 0 HD12 LEU A 26 7.655 -13.158 3.500 1.00 0.00 H new ATOM 0 HD13 LEU A 26 9.014 -14.218 3.944 1.00 0.00 H new ATOM 0 HD21 LEU A 26 7.354 -15.926 5.962 1.00 0.00 H new ATOM 0 HD22 LEU A 26 8.972 -15.303 6.359 1.00 0.00 H new ATOM 0 HD23 LEU A 26 7.587 -14.914 7.407 1.00 0.00 H new ATOM 382 N ASN A 27 9.922 -10.632 7.624 1.00 0.00 N ATOM 383 CA ASN A 27 10.462 -9.330 7.977 1.00 0.00 C ATOM 384 C ASN A 27 10.761 -8.543 6.699 1.00 0.00 C ATOM 385 O ASN A 27 11.581 -7.628 6.707 1.00 0.00 O ATOM 386 CB ASN A 27 11.768 -9.471 8.761 1.00 0.00 C ATOM 387 CG ASN A 27 11.521 -10.115 10.126 1.00 0.00 C ATOM 388 OD1 ASN A 27 10.550 -9.833 10.808 1.00 0.00 O ATOM 389 ND2 ASN A 27 12.453 -10.994 10.486 1.00 0.00 N ATOM 0 H ASN A 27 10.523 -11.194 7.021 1.00 0.00 H new ATOM 0 HA ASN A 27 9.725 -8.814 8.592 1.00 0.00 H new ATOM 0 HB2 ASN A 27 12.474 -10.076 8.192 1.00 0.00 H new ATOM 0 HB3 ASN A 27 12.224 -8.490 8.895 1.00 0.00 H new ATOM 0 HD21 ASN A 27 12.379 -11.478 11.381 1.00 0.00 H new ATOM 0 HD22 ASN A 27 13.241 -11.184 9.867 1.00 0.00 H new ATOM 396 N ARG A 28 10.078 -8.930 5.631 1.00 0.00 N ATOM 397 CA ARG A 28 10.259 -8.273 4.348 1.00 0.00 C ATOM 398 C ARG A 28 8.918 -8.142 3.623 1.00 0.00 C ATOM 399 O ARG A 28 8.028 -8.973 3.803 1.00 0.00 O ATOM 400 CB ARG A 28 11.236 -9.050 3.463 1.00 0.00 C ATOM 401 CG ARG A 28 10.997 -10.557 3.577 1.00 0.00 C ATOM 402 CD ARG A 28 11.810 -11.320 2.529 1.00 0.00 C ATOM 403 NE ARG A 28 11.298 -12.704 2.401 1.00 0.00 N ATOM 404 CZ ARG A 28 11.990 -13.714 1.857 1.00 0.00 C ATOM 405 NH1 ARG A 28 13.228 -13.502 1.388 1.00 0.00 N ATOM 406 NH2 ARG A 28 11.445 -14.936 1.783 1.00 0.00 N ATOM 0 H ARG A 28 9.398 -9.691 5.628 1.00 0.00 H new ATOM 0 HA ARG A 28 10.670 -7.282 4.540 1.00 0.00 H new ATOM 0 HB2 ARG A 28 11.121 -8.737 2.425 1.00 0.00 H new ATOM 0 HB3 ARG A 28 12.260 -8.817 3.754 1.00 0.00 H new ATOM 0 HG2 ARG A 28 11.272 -10.898 4.575 1.00 0.00 H new ATOM 0 HG3 ARG A 28 9.936 -10.772 3.447 1.00 0.00 H new ATOM 0 HD2 ARG A 28 11.749 -10.810 1.567 1.00 0.00 H new ATOM 0 HD3 ARG A 28 12.862 -11.337 2.814 1.00 0.00 H new ATOM 0 HE ARG A 28 10.360 -12.900 2.749 1.00 0.00 H new ATOM 0 HH11 ARG A 28 13.643 -12.572 1.445 1.00 0.00 H new ATOM 0 HH12 ARG A 28 13.755 -14.271 0.974 1.00 0.00 H new ATOM 0 HH21 ARG A 28 10.503 -15.097 2.141 1.00 0.00 H new ATOM 0 HH22 ARG A 28 11.972 -15.705 1.369 1.00 0.00 H new ATOM 420 N PRO A 29 8.813 -7.067 2.798 1.00 0.00 N ATOM 421 CA PRO A 29 7.594 -6.818 2.045 1.00 0.00 C ATOM 422 C PRO A 29 7.474 -7.781 0.862 1.00 0.00 C ATOM 423 O PRO A 29 8.405 -7.915 0.070 1.00 0.00 O ATOM 424 CB PRO A 29 7.686 -5.362 1.619 1.00 0.00 C ATOM 425 CG PRO A 29 9.152 -4.982 1.746 1.00 0.00 C ATOM 426 CD PRO A 29 9.845 -6.063 2.561 1.00 0.00 C ATOM 0 HA PRO A 29 6.693 -6.991 2.633 1.00 0.00 H new ATOM 0 HB2 PRO A 29 7.336 -5.232 0.595 1.00 0.00 H new ATOM 0 HB3 PRO A 29 7.063 -4.730 2.251 1.00 0.00 H new ATOM 0 HG2 PRO A 29 9.610 -4.894 0.761 1.00 0.00 H new ATOM 0 HG3 PRO A 29 9.254 -4.012 2.233 1.00 0.00 H new ATOM 0 HD2 PRO A 29 10.692 -6.485 2.020 1.00 0.00 H new ATOM 0 HD3 PRO A 29 10.233 -5.665 3.499 1.00 0.00 H new ATOM 434 N VAL A 30 6.321 -8.427 0.781 1.00 0.00 N ATOM 435 CA VAL A 30 6.067 -9.375 -0.291 1.00 0.00 C ATOM 436 C VAL A 30 4.814 -8.946 -1.059 1.00 0.00 C ATOM 437 O VAL A 30 3.846 -8.478 -0.461 1.00 0.00 O ATOM 438 CB VAL A 30 5.966 -10.792 0.276 1.00 0.00 C ATOM 439 CG1 VAL A 30 5.532 -11.785 -0.806 1.00 0.00 C ATOM 440 CG2 VAL A 30 7.285 -11.222 0.918 1.00 0.00 C ATOM 0 H VAL A 30 5.551 -8.313 1.440 1.00 0.00 H new ATOM 0 HA VAL A 30 6.896 -9.382 -0.999 1.00 0.00 H new ATOM 0 HB VAL A 30 5.202 -10.788 1.054 1.00 0.00 H new ATOM 0 HG11 VAL A 30 5.468 -12.785 -0.377 1.00 0.00 H new ATOM 0 HG12 VAL A 30 4.557 -11.494 -1.197 1.00 0.00 H new ATOM 0 HG13 VAL A 30 6.262 -11.783 -1.615 1.00 0.00 H new ATOM 0 HG21 VAL A 30 7.185 -12.233 1.313 1.00 0.00 H new ATOM 0 HG22 VAL A 30 8.078 -11.201 0.170 1.00 0.00 H new ATOM 0 HG23 VAL A 30 7.534 -10.539 1.730 1.00 0.00 H new ATOM 450 N LEU A 31 4.874 -9.120 -2.370 1.00 0.00 N ATOM 451 CA LEU A 31 3.756 -8.757 -3.225 1.00 0.00 C ATOM 452 C LEU A 31 2.505 -9.511 -2.769 1.00 0.00 C ATOM 453 O LEU A 31 2.604 -10.529 -2.086 1.00 0.00 O ATOM 454 CB LEU A 31 4.111 -8.986 -4.696 1.00 0.00 C ATOM 455 CG LEU A 31 4.818 -7.829 -5.404 1.00 0.00 C ATOM 456 CD1 LEU A 31 5.607 -8.327 -6.616 1.00 0.00 C ATOM 457 CD2 LEU A 31 3.826 -6.728 -5.779 1.00 0.00 C ATOM 0 H LEU A 31 5.679 -9.508 -2.862 1.00 0.00 H new ATOM 0 HA LEU A 31 3.537 -7.693 -3.136 1.00 0.00 H new ATOM 0 HB2 LEU A 31 4.747 -9.869 -4.762 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.194 -9.212 -5.240 1.00 0.00 H new ATOM 0 HG LEU A 31 5.536 -7.392 -4.710 1.00 0.00 H new ATOM 0 HD11 LEU A 31 6.100 -7.484 -7.101 1.00 0.00 H new ATOM 0 HD12 LEU A 31 6.357 -9.048 -6.291 1.00 0.00 H new ATOM 0 HD13 LEU A 31 4.927 -8.805 -7.322 1.00 0.00 H new ATOM 0 HD21 LEU A 31 4.355 -5.918 -6.281 1.00 0.00 H new ATOM 0 HD22 LEU A 31 3.067 -7.135 -6.447 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.348 -6.346 -4.877 1.00 0.00 H new ATOM 469 N VAL A 32 1.357 -8.981 -3.165 1.00 0.00 N ATOM 470 CA VAL A 32 0.088 -9.591 -2.805 1.00 0.00 C ATOM 471 C VAL A 32 -0.508 -10.280 -4.035 1.00 0.00 C ATOM 472 O VAL A 32 -0.792 -9.629 -5.039 1.00 0.00 O ATOM 473 CB VAL A 32 -0.843 -8.540 -2.199 1.00 0.00 C ATOM 474 CG1 VAL A 32 -2.274 -9.073 -2.090 1.00 0.00 C ATOM 475 CG2 VAL A 32 -0.328 -8.071 -0.836 1.00 0.00 C ATOM 0 H VAL A 32 1.279 -8.136 -3.731 1.00 0.00 H new ATOM 0 HA VAL A 32 0.234 -10.356 -2.042 1.00 0.00 H new ATOM 0 HB VAL A 32 -0.855 -7.679 -2.867 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -2.916 -8.306 -1.656 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -2.641 -9.335 -3.082 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -2.285 -9.958 -1.454 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -1.008 -7.324 -0.427 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -0.272 -8.921 -0.156 1.00 0.00 H new ATOM 0 HG23 VAL A 32 0.663 -7.633 -0.953 1.00 0.00 H new ATOM 485 N PRO A 33 -0.683 -11.623 -3.912 1.00 0.00 N ATOM 486 CA PRO A 33 -1.240 -12.408 -5.001 1.00 0.00 C ATOM 487 C PRO A 33 -2.749 -12.187 -5.119 1.00 0.00 C ATOM 488 O PRO A 33 -3.529 -13.133 -5.012 1.00 0.00 O ATOM 489 CB PRO A 33 -0.874 -13.847 -4.675 1.00 0.00 C ATOM 490 CG PRO A 33 -0.535 -13.867 -3.193 1.00 0.00 C ATOM 491 CD PRO A 33 -0.357 -12.427 -2.737 1.00 0.00 C ATOM 0 HA PRO A 33 -0.842 -12.120 -5.974 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -1.703 -14.520 -4.895 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -0.026 -14.179 -5.274 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -1.330 -14.352 -2.626 1.00 0.00 H new ATOM 0 HG3 PRO A 33 0.376 -14.439 -3.017 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -1.016 -12.192 -1.901 1.00 0.00 H new ATOM 0 HD3 PRO A 33 0.663 -12.241 -2.401 1.00 0.00 H new ATOM 499 N TYR A 34 -3.116 -10.933 -5.339 1.00 0.00 N ATOM 500 CA TYR A 34 -4.518 -10.575 -5.473 1.00 0.00 C ATOM 501 C TYR A 34 -5.262 -11.594 -6.339 1.00 0.00 C ATOM 502 O TYR A 34 -6.353 -12.037 -5.983 1.00 0.00 O ATOM 503 CB TYR A 34 -4.541 -9.215 -6.173 1.00 0.00 C ATOM 504 CG TYR A 34 -3.746 -8.129 -5.447 1.00 0.00 C ATOM 505 CD1 TYR A 34 -4.310 -7.453 -4.385 1.00 0.00 C ATOM 506 CD2 TYR A 34 -2.463 -7.823 -5.856 1.00 0.00 C ATOM 507 CE1 TYR A 34 -3.562 -6.430 -3.702 1.00 0.00 C ATOM 508 CE2 TYR A 34 -1.715 -6.799 -5.173 1.00 0.00 C ATOM 509 CZ TYR A 34 -2.301 -6.154 -4.130 1.00 0.00 C ATOM 510 OH TYR A 34 -1.594 -5.187 -3.484 1.00 0.00 O ATOM 0 H TYR A 34 -2.466 -10.152 -5.428 1.00 0.00 H new ATOM 0 HA TYR A 34 -5.004 -10.551 -4.497 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -4.143 -9.330 -7.181 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -5.576 -8.887 -6.274 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -5.314 -7.691 -4.066 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -2.021 -8.351 -6.688 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -3.992 -5.894 -2.869 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -0.711 -6.549 -5.483 1.00 0.00 H new ATOM 0 HH TYR A 34 -2.212 -4.524 -3.110 1.00 0.00 H new ATOM 520 N LYS A 35 -4.643 -11.936 -7.458 1.00 0.00 N ATOM 521 CA LYS A 35 -5.234 -12.895 -8.377 1.00 0.00 C ATOM 522 C LYS A 35 -5.726 -14.111 -7.592 1.00 0.00 C ATOM 523 O LYS A 35 -6.818 -14.617 -7.844 1.00 0.00 O ATOM 524 CB LYS A 35 -4.248 -13.241 -9.495 1.00 0.00 C ATOM 525 CG LYS A 35 -4.645 -12.559 -10.807 1.00 0.00 C ATOM 526 CD LYS A 35 -3.748 -13.021 -11.957 1.00 0.00 C ATOM 527 CE LYS A 35 -4.446 -12.836 -13.305 1.00 0.00 C ATOM 528 NZ LYS A 35 -3.922 -13.800 -14.299 1.00 0.00 N ATOM 0 H LYS A 35 -3.738 -11.567 -7.750 1.00 0.00 H new ATOM 0 HA LYS A 35 -6.104 -12.463 -8.872 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -3.244 -12.929 -9.208 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -4.218 -14.321 -9.637 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -5.686 -12.786 -11.039 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -4.572 -11.477 -10.696 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -2.816 -12.456 -11.946 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -3.486 -14.070 -11.820 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -5.521 -12.975 -13.187 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -4.294 -11.818 -13.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -4.407 -13.660 -15.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -2.901 -13.648 -14.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -4.089 -14.770 -13.963 1.00 0.00 H new ATOM 542 N LEU A 36 -4.896 -14.546 -6.655 1.00 0.00 N ATOM 543 CA LEU A 36 -5.233 -15.694 -5.831 1.00 0.00 C ATOM 544 C LEU A 36 -6.323 -15.298 -4.833 1.00 0.00 C ATOM 545 O LEU A 36 -7.428 -15.837 -4.867 1.00 0.00 O ATOM 546 CB LEU A 36 -3.978 -16.270 -5.173 1.00 0.00 C ATOM 547 CG LEU A 36 -2.991 -16.969 -6.110 1.00 0.00 C ATOM 548 CD1 LEU A 36 -1.700 -17.332 -5.375 1.00 0.00 C ATOM 549 CD2 LEU A 36 -3.634 -18.188 -6.774 1.00 0.00 C ATOM 0 H LEU A 36 -3.991 -14.124 -6.448 1.00 0.00 H new ATOM 0 HA LEU A 36 -5.639 -16.497 -6.446 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -3.454 -15.461 -4.664 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -4.287 -16.981 -4.407 1.00 0.00 H new ATOM 0 HG LEU A 36 -2.724 -16.273 -6.905 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -1.016 -17.828 -6.064 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -1.233 -16.425 -4.990 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.929 -18.002 -4.546 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.911 -18.666 -7.435 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -3.949 -18.896 -6.007 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -4.501 -17.871 -7.354 1.00 0.00 H new ATOM 561 N ILE A 37 -5.973 -14.358 -3.966 1.00 0.00 N ATOM 562 CA ILE A 37 -6.908 -13.882 -2.960 1.00 0.00 C ATOM 563 C ILE A 37 -8.270 -13.634 -3.612 1.00 0.00 C ATOM 564 O ILE A 37 -9.303 -13.704 -2.947 1.00 0.00 O ATOM 565 CB ILE A 37 -6.340 -12.660 -2.237 1.00 0.00 C ATOM 566 CG1 ILE A 37 -5.059 -13.016 -1.480 1.00 0.00 C ATOM 567 CG2 ILE A 37 -7.390 -12.029 -1.319 1.00 0.00 C ATOM 568 CD1 ILE A 37 -4.009 -11.913 -1.631 1.00 0.00 C ATOM 0 H ILE A 37 -5.055 -13.914 -3.940 1.00 0.00 H new ATOM 0 HA ILE A 37 -7.057 -14.639 -2.190 1.00 0.00 H new ATOM 0 HB ILE A 37 -6.075 -11.914 -2.986 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -5.286 -13.165 -0.424 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -4.659 -13.958 -1.857 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -6.960 -11.162 -0.817 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -8.250 -11.716 -1.911 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -7.708 -12.759 -0.575 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -3.108 -12.191 -1.084 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -3.767 -11.783 -2.686 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -4.403 -10.979 -1.231 1.00 0.00 H new ATOM 580 N ARG A 38 -8.227 -13.347 -4.905 1.00 0.00 N ATOM 581 CA ARG A 38 -9.446 -13.088 -5.654 1.00 0.00 C ATOM 582 C ARG A 38 -10.266 -14.372 -5.794 1.00 0.00 C ATOM 583 O ARG A 38 -11.428 -14.417 -5.391 1.00 0.00 O ATOM 584 CB ARG A 38 -9.130 -12.539 -7.047 1.00 0.00 C ATOM 585 CG ARG A 38 -10.408 -12.115 -7.772 1.00 0.00 C ATOM 586 CD ARG A 38 -10.512 -10.590 -7.854 1.00 0.00 C ATOM 587 NE ARG A 38 -9.980 -10.116 -9.151 1.00 0.00 N ATOM 588 CZ ARG A 38 -9.567 -8.862 -9.379 1.00 0.00 C ATOM 589 NH1 ARG A 38 -9.624 -7.948 -8.400 1.00 0.00 N ATOM 590 NH2 ARG A 38 -9.099 -8.520 -10.587 1.00 0.00 N ATOM 0 H ARG A 38 -7.369 -13.288 -5.453 1.00 0.00 H new ATOM 0 HA ARG A 38 -10.021 -12.343 -5.104 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -8.456 -11.686 -6.962 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -8.611 -13.298 -7.632 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -10.418 -12.538 -8.776 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -11.277 -12.515 -7.249 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -11.552 -10.282 -7.743 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -9.955 -10.135 -7.035 1.00 0.00 H new ATOM 0 HE ARG A 38 -9.924 -10.785 -9.919 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -9.982 -8.207 -7.481 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -9.309 -6.994 -8.574 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -9.057 -9.214 -11.333 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -8.785 -7.565 -10.761 1.00 0.00 H new ATOM 604 N ASP A 39 -9.631 -15.384 -6.365 1.00 0.00 N ATOM 605 CA ASP A 39 -10.288 -16.665 -6.563 1.00 0.00 C ATOM 606 C ASP A 39 -10.431 -17.373 -5.214 1.00 0.00 C ATOM 607 O ASP A 39 -11.302 -18.225 -5.046 1.00 0.00 O ATOM 608 CB ASP A 39 -9.467 -17.568 -7.487 1.00 0.00 C ATOM 609 CG ASP A 39 -10.272 -18.636 -8.229 1.00 0.00 C ATOM 610 OD1 ASP A 39 -11.454 -18.352 -8.523 1.00 0.00 O ATOM 611 OD2 ASP A 39 -9.688 -19.710 -8.487 1.00 0.00 O ATOM 0 H ASP A 39 -8.668 -15.343 -6.697 1.00 0.00 H new ATOM 0 HA ASP A 39 -11.263 -16.479 -7.014 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -8.957 -16.944 -8.221 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -8.695 -18.061 -6.896 1.00 0.00 H new ATOM 616 N SER A 40 -9.562 -16.995 -4.288 1.00 0.00 N ATOM 617 CA SER A 40 -9.581 -17.583 -2.959 1.00 0.00 C ATOM 618 C SER A 40 -9.734 -16.487 -1.904 1.00 0.00 C ATOM 619 O SER A 40 -8.747 -15.902 -1.463 1.00 0.00 O ATOM 620 CB SER A 40 -8.312 -18.397 -2.700 1.00 0.00 C ATOM 621 OG SER A 40 -8.279 -18.927 -1.377 1.00 0.00 O ATOM 0 H SER A 40 -8.840 -16.289 -4.432 1.00 0.00 H new ATOM 0 HA SER A 40 -10.433 -18.259 -2.896 1.00 0.00 H new ATOM 0 HB2 SER A 40 -8.252 -19.214 -3.419 1.00 0.00 H new ATOM 0 HB3 SER A 40 -7.438 -17.766 -2.860 1.00 0.00 H new ATOM 0 HG SER A 40 -7.542 -19.568 -1.300 1.00 0.00 H new ATOM 627 N PRO A 41 -11.015 -16.235 -1.519 1.00 0.00 N ATOM 628 CA PRO A 41 -11.311 -15.219 -0.523 1.00 0.00 C ATOM 629 C PRO A 41 -10.948 -15.706 0.881 1.00 0.00 C ATOM 630 O PRO A 41 -10.887 -14.914 1.820 1.00 0.00 O ATOM 631 CB PRO A 41 -12.794 -14.928 -0.686 1.00 0.00 C ATOM 632 CG PRO A 41 -13.370 -16.115 -1.441 1.00 0.00 C ATOM 633 CD PRO A 41 -12.209 -16.908 -2.020 1.00 0.00 C ATOM 0 HA PRO A 41 -10.723 -14.311 -0.661 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -13.278 -14.809 0.284 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -12.952 -14.001 -1.237 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -13.964 -16.740 -0.774 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -14.034 -15.776 -2.236 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -12.241 -17.949 -1.699 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -12.235 -16.910 -3.110 1.00 0.00 H new ATOM 641 N ASP A 42 -10.716 -17.007 0.981 1.00 0.00 N ATOM 642 CA ASP A 42 -10.360 -17.608 2.255 1.00 0.00 C ATOM 643 C ASP A 42 -8.868 -17.946 2.255 1.00 0.00 C ATOM 644 O ASP A 42 -8.476 -19.043 2.647 1.00 0.00 O ATOM 645 CB ASP A 42 -11.138 -18.905 2.487 1.00 0.00 C ATOM 646 CG ASP A 42 -12.582 -18.718 2.959 1.00 0.00 C ATOM 647 OD1 ASP A 42 -12.757 -18.037 3.994 1.00 0.00 O ATOM 648 OD2 ASP A 42 -13.477 -19.258 2.276 1.00 0.00 O ATOM 0 H ASP A 42 -10.768 -17.661 0.200 1.00 0.00 H new ATOM 0 HA ASP A 42 -10.601 -16.896 3.044 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -11.146 -19.477 1.559 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -10.605 -19.504 3.226 1.00 0.00 H new ATOM 653 N ALA A 43 -8.076 -16.980 1.812 1.00 0.00 N ATOM 654 CA ALA A 43 -6.635 -17.161 1.758 1.00 0.00 C ATOM 655 C ALA A 43 -5.962 -16.143 2.680 1.00 0.00 C ATOM 656 O ALA A 43 -5.171 -16.513 3.547 1.00 0.00 O ATOM 657 CB ALA A 43 -6.159 -17.038 0.308 1.00 0.00 C ATOM 0 H ALA A 43 -8.405 -16.071 1.488 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.360 -18.156 2.109 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.078 -17.174 0.267 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -6.644 -17.802 -0.300 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -6.416 -16.051 -0.077 1.00 0.00 H new ATOM 663 N VAL A 44 -6.299 -14.881 2.462 1.00 0.00 N ATOM 664 CA VAL A 44 -5.738 -13.807 3.264 1.00 0.00 C ATOM 665 C VAL A 44 -6.849 -12.826 3.644 1.00 0.00 C ATOM 666 O VAL A 44 -7.755 -12.571 2.853 1.00 0.00 O ATOM 667 CB VAL A 44 -4.584 -13.140 2.511 1.00 0.00 C ATOM 668 CG1 VAL A 44 -4.120 -11.873 3.230 1.00 0.00 C ATOM 669 CG2 VAL A 44 -3.422 -14.116 2.313 1.00 0.00 C ATOM 0 H VAL A 44 -6.954 -14.578 1.741 1.00 0.00 H new ATOM 0 HA VAL A 44 -5.320 -14.200 4.191 1.00 0.00 H new ATOM 0 HB VAL A 44 -4.950 -12.850 1.526 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -3.300 -11.419 2.674 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -4.948 -11.168 3.295 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -3.781 -12.128 4.234 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -2.615 -13.617 1.776 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -3.058 -14.451 3.285 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -3.764 -14.976 1.738 1.00 0.00 H new ATOM 679 N GLU A 45 -6.741 -12.303 4.857 1.00 0.00 N ATOM 680 CA GLU A 45 -7.726 -11.355 5.353 1.00 0.00 C ATOM 681 C GLU A 45 -7.168 -9.933 5.297 1.00 0.00 C ATOM 682 O GLU A 45 -6.073 -9.671 5.793 1.00 0.00 O ATOM 683 CB GLU A 45 -8.168 -11.717 6.772 1.00 0.00 C ATOM 684 CG GLU A 45 -8.714 -10.489 7.504 1.00 0.00 C ATOM 685 CD GLU A 45 -9.491 -10.900 8.757 1.00 0.00 C ATOM 686 OE1 GLU A 45 -8.899 -11.632 9.579 1.00 0.00 O ATOM 687 OE2 GLU A 45 -10.662 -10.473 8.865 1.00 0.00 O ATOM 0 H GLU A 45 -5.988 -12.517 5.510 1.00 0.00 H new ATOM 0 HA GLU A 45 -8.606 -11.404 4.711 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -8.934 -12.492 6.732 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -7.325 -12.130 7.326 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -7.891 -9.830 7.781 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -9.364 -9.923 6.837 1.00 0.00 H new ATOM 694 N VAL A 46 -7.946 -9.048 4.690 1.00 0.00 N ATOM 695 CA VAL A 46 -7.542 -7.658 4.563 1.00 0.00 C ATOM 696 C VAL A 46 -8.515 -6.776 5.349 1.00 0.00 C ATOM 697 O VAL A 46 -9.723 -6.828 5.127 1.00 0.00 O ATOM 698 CB VAL A 46 -7.448 -7.273 3.085 1.00 0.00 C ATOM 699 CG1 VAL A 46 -7.259 -5.764 2.923 1.00 0.00 C ATOM 700 CG2 VAL A 46 -6.325 -8.045 2.389 1.00 0.00 C ATOM 0 H VAL A 46 -8.854 -9.267 4.281 1.00 0.00 H new ATOM 0 HA VAL A 46 -6.549 -7.508 4.988 1.00 0.00 H new ATOM 0 HB VAL A 46 -8.389 -7.545 2.606 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -7.195 -5.517 1.863 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -8.106 -5.241 3.367 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -6.341 -5.457 3.423 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.279 -7.753 1.340 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -5.374 -7.817 2.871 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -6.521 -9.115 2.460 1.00 0.00 H new ATOM 710 N THR A 47 -7.951 -5.987 6.252 1.00 0.00 N ATOM 711 CA THR A 47 -8.752 -5.095 7.073 1.00 0.00 C ATOM 712 C THR A 47 -7.988 -3.801 7.355 1.00 0.00 C ATOM 713 O THR A 47 -6.813 -3.681 7.012 1.00 0.00 O ATOM 714 CB THR A 47 -9.155 -5.852 8.339 1.00 0.00 C ATOM 715 OG1 THR A 47 -7.992 -6.600 8.683 1.00 0.00 O ATOM 716 CG2 THR A 47 -10.217 -6.921 8.070 1.00 0.00 C ATOM 0 H THR A 47 -6.948 -5.947 6.433 1.00 0.00 H new ATOM 0 HA THR A 47 -9.662 -4.791 6.556 1.00 0.00 H new ATOM 0 HB THR A 47 -9.530 -5.145 9.079 1.00 0.00 H new ATOM 0 HG1 THR A 47 -8.166 -7.120 9.495 1.00 0.00 H new ATOM 0 HG21 THR A 47 -10.467 -7.428 9.002 1.00 0.00 H new ATOM 0 HG22 THR A 47 -11.111 -6.451 7.662 1.00 0.00 H new ATOM 0 HG23 THR A 47 -9.830 -7.647 7.355 1.00 0.00 H new ATOM 724 N GLY A 48 -8.686 -2.863 7.979 1.00 0.00 N ATOM 725 CA GLY A 48 -8.089 -1.582 8.312 1.00 0.00 C ATOM 726 C GLY A 48 -8.312 -0.564 7.192 1.00 0.00 C ATOM 727 O GLY A 48 -8.359 0.639 7.442 1.00 0.00 O ATOM 0 H GLY A 48 -9.660 -2.966 8.263 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.520 -1.207 9.240 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -7.020 -1.709 8.485 1.00 0.00 H new ATOM 731 N LEU A 49 -8.444 -1.085 5.980 1.00 0.00 N ATOM 732 CA LEU A 49 -8.662 -0.238 4.821 1.00 0.00 C ATOM 733 C LEU A 49 -9.689 0.841 5.169 1.00 0.00 C ATOM 734 O LEU A 49 -10.395 0.731 6.170 1.00 0.00 O ATOM 735 CB LEU A 49 -9.044 -1.082 3.604 1.00 0.00 C ATOM 736 CG LEU A 49 -7.882 -1.594 2.751 1.00 0.00 C ATOM 737 CD1 LEU A 49 -8.378 -2.550 1.665 1.00 0.00 C ATOM 738 CD2 LEU A 49 -7.076 -0.431 2.168 1.00 0.00 C ATOM 0 H LEU A 49 -8.404 -2.084 5.777 1.00 0.00 H new ATOM 0 HA LEU A 49 -7.741 0.276 4.546 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -9.621 -1.940 3.949 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -9.702 -0.490 2.968 1.00 0.00 H new ATOM 0 HG LEU A 49 -7.209 -2.161 3.395 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -7.532 -2.899 1.073 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -8.872 -3.403 2.129 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -9.084 -2.030 1.017 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -6.256 -0.822 1.566 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -7.724 0.184 1.543 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -6.673 0.175 2.979 1.00 0.00 H new ATOM 750 N PRO A 50 -9.743 1.886 4.300 1.00 0.00 N ATOM 751 CA PRO A 50 -10.673 2.983 4.505 1.00 0.00 C ATOM 752 C PRO A 50 -12.101 2.567 4.146 1.00 0.00 C ATOM 753 O PRO A 50 -12.306 1.757 3.242 1.00 0.00 O ATOM 754 CB PRO A 50 -10.148 4.113 3.634 1.00 0.00 C ATOM 755 CG PRO A 50 -9.217 3.461 2.623 1.00 0.00 C ATOM 756 CD PRO A 50 -8.923 2.050 3.104 1.00 0.00 C ATOM 0 HA PRO A 50 -10.730 3.295 5.548 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -10.965 4.633 3.134 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -9.618 4.854 4.233 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -9.680 3.439 1.636 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -8.294 4.033 2.530 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -9.179 1.312 2.344 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -7.864 1.921 3.329 1.00 0.00 H new ATOM 764 N ASP A 51 -13.050 3.137 4.872 1.00 0.00 N ATOM 765 CA ASP A 51 -14.453 2.835 4.641 1.00 0.00 C ATOM 766 C ASP A 51 -14.834 3.254 3.220 1.00 0.00 C ATOM 767 O ASP A 51 -14.277 4.210 2.681 1.00 0.00 O ATOM 768 CB ASP A 51 -15.350 3.602 5.616 1.00 0.00 C ATOM 769 CG ASP A 51 -16.811 3.734 5.183 1.00 0.00 C ATOM 770 OD1 ASP A 51 -17.481 2.680 5.116 1.00 0.00 O ATOM 771 OD2 ASP A 51 -17.226 4.885 4.929 1.00 0.00 O ATOM 0 H ASP A 51 -12.876 3.807 5.621 1.00 0.00 H new ATOM 0 HA ASP A 51 -14.595 1.764 4.786 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -15.318 3.104 6.585 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -14.937 4.601 5.757 1.00 0.00 H new ATOM 776 N ASP A 52 -15.779 2.518 2.653 1.00 0.00 N ATOM 777 CA ASP A 52 -16.240 2.802 1.305 1.00 0.00 C ATOM 778 C ASP A 52 -15.102 2.543 0.316 1.00 0.00 C ATOM 779 O ASP A 52 -15.015 3.196 -0.722 1.00 0.00 O ATOM 780 CB ASP A 52 -16.664 4.266 1.164 1.00 0.00 C ATOM 781 CG ASP A 52 -17.631 4.551 0.014 1.00 0.00 C ATOM 782 OD1 ASP A 52 -18.472 3.665 -0.254 1.00 0.00 O ATOM 783 OD2 ASP A 52 -17.509 5.648 -0.573 1.00 0.00 O ATOM 0 H ASP A 52 -16.238 1.726 3.103 1.00 0.00 H new ATOM 0 HA ASP A 52 -17.094 2.157 1.099 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -17.128 4.586 2.097 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -15.771 4.876 1.027 1.00 0.00 H new ATOM 788 N ILE A 53 -14.256 1.587 0.674 1.00 0.00 N ATOM 789 CA ILE A 53 -13.127 1.233 -0.169 1.00 0.00 C ATOM 790 C ILE A 53 -12.797 -0.249 0.023 1.00 0.00 C ATOM 791 O ILE A 53 -12.427 -0.668 1.119 1.00 0.00 O ATOM 792 CB ILE A 53 -11.944 2.166 0.098 1.00 0.00 C ATOM 793 CG1 ILE A 53 -12.290 3.609 -0.275 1.00 0.00 C ATOM 794 CG2 ILE A 53 -10.685 1.675 -0.618 1.00 0.00 C ATOM 795 CD1 ILE A 53 -11.074 4.523 -0.116 1.00 0.00 C ATOM 0 H ILE A 53 -14.330 1.047 1.536 1.00 0.00 H new ATOM 0 HA ILE A 53 -13.380 1.370 -1.220 1.00 0.00 H new ATOM 0 HB ILE A 53 -11.732 2.151 1.167 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -12.646 3.647 -1.305 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -13.103 3.967 0.357 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -9.860 2.356 -0.411 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -10.430 0.677 -0.262 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -10.867 1.641 -1.692 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -11.347 5.543 -0.388 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -10.736 4.502 0.920 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -10.271 4.177 -0.767 1.00 0.00 H new ATOM 807 N PRO A 54 -12.945 -1.021 -1.087 1.00 0.00 N ATOM 808 CA PRO A 54 -12.667 -2.446 -1.050 1.00 0.00 C ATOM 809 C PRO A 54 -11.160 -2.710 -1.026 1.00 0.00 C ATOM 810 O PRO A 54 -10.375 -1.818 -0.708 1.00 0.00 O ATOM 811 CB PRO A 54 -13.350 -3.012 -2.284 1.00 0.00 C ATOM 812 CG PRO A 54 -13.588 -1.829 -3.208 1.00 0.00 C ATOM 813 CD PRO A 54 -13.381 -0.558 -2.401 1.00 0.00 C ATOM 0 HA PRO A 54 -13.045 -2.925 -0.147 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -12.725 -3.764 -2.766 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -14.290 -3.498 -2.022 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -12.901 -1.861 -4.053 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -14.598 -1.861 -3.617 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -12.633 0.087 -2.862 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -14.302 0.021 -2.331 1.00 0.00 H new ATOM 821 N PHE A 55 -10.802 -3.939 -1.366 1.00 0.00 N ATOM 822 CA PHE A 55 -9.403 -4.332 -1.388 1.00 0.00 C ATOM 823 C PHE A 55 -9.025 -4.942 -2.738 1.00 0.00 C ATOM 824 O PHE A 55 -9.226 -6.135 -2.962 1.00 0.00 O ATOM 825 CB PHE A 55 -9.217 -5.387 -0.295 1.00 0.00 C ATOM 826 CG PHE A 55 -8.014 -6.305 -0.514 1.00 0.00 C ATOM 827 CD1 PHE A 55 -6.753 -5.794 -0.484 1.00 0.00 C ATOM 828 CD2 PHE A 55 -8.203 -7.633 -0.739 1.00 0.00 C ATOM 829 CE1 PHE A 55 -5.636 -6.646 -0.689 1.00 0.00 C ATOM 830 CE2 PHE A 55 -7.086 -8.486 -0.943 1.00 0.00 C ATOM 831 CZ PHE A 55 -5.827 -7.975 -0.913 1.00 0.00 C ATOM 0 H PHE A 55 -11.456 -4.676 -1.629 1.00 0.00 H new ATOM 0 HA PHE A 55 -8.770 -3.460 -1.224 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -9.107 -4.884 0.666 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -10.119 -5.996 -0.235 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -6.602 -4.740 -0.304 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -9.203 -8.039 -0.763 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -4.635 -6.240 -0.667 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -7.237 -9.540 -1.122 1.00 0.00 H new ATOM 0 HZ PHE A 55 -4.977 -8.624 -1.067 1.00 0.00 H new ATOM 841 N ARG A 56 -8.486 -4.097 -3.604 1.00 0.00 N ATOM 842 CA ARG A 56 -8.079 -4.538 -4.927 1.00 0.00 C ATOM 843 C ARG A 56 -6.759 -3.876 -5.325 1.00 0.00 C ATOM 844 O ARG A 56 -6.309 -2.938 -4.669 1.00 0.00 O ATOM 845 CB ARG A 56 -9.145 -4.203 -5.971 1.00 0.00 C ATOM 846 CG ARG A 56 -10.500 -4.800 -5.585 1.00 0.00 C ATOM 847 CD ARG A 56 -11.146 -5.512 -6.775 1.00 0.00 C ATOM 848 NE ARG A 56 -12.278 -4.710 -7.291 1.00 0.00 N ATOM 849 CZ ARG A 56 -13.180 -5.163 -8.172 1.00 0.00 C ATOM 850 NH1 ARG A 56 -13.088 -6.416 -8.641 1.00 0.00 N ATOM 851 NH2 ARG A 56 -14.175 -4.366 -8.584 1.00 0.00 N ATOM 0 H ARG A 56 -8.322 -3.108 -3.415 1.00 0.00 H new ATOM 0 HA ARG A 56 -7.950 -5.620 -4.890 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -9.235 -3.121 -6.069 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -8.839 -4.587 -6.944 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -10.370 -5.504 -4.763 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -11.161 -4.010 -5.227 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -10.408 -5.664 -7.563 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -11.497 -6.499 -6.472 1.00 0.00 H new ATOM 0 HE ARG A 56 -12.378 -3.752 -6.955 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -12.331 -7.024 -8.327 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -13.775 -6.761 -9.312 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -14.246 -3.413 -8.227 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -14.861 -4.712 -9.255 1.00 0.00 H new ATOM 865 N ASN A 57 -6.175 -4.391 -6.397 1.00 0.00 N ATOM 866 CA ASN A 57 -4.914 -3.861 -6.890 1.00 0.00 C ATOM 867 C ASN A 57 -4.930 -2.335 -6.781 1.00 0.00 C ATOM 868 O ASN A 57 -5.943 -1.699 -7.069 1.00 0.00 O ATOM 869 CB ASN A 57 -4.700 -4.227 -8.359 1.00 0.00 C ATOM 870 CG ASN A 57 -5.961 -3.954 -9.183 1.00 0.00 C ATOM 871 OD1 ASN A 57 -7.057 -3.822 -8.662 1.00 0.00 O ATOM 872 ND2 ASN A 57 -5.745 -3.878 -10.493 1.00 0.00 N ATOM 0 H ASN A 57 -6.551 -5.169 -6.938 1.00 0.00 H new ATOM 0 HA ASN A 57 -4.111 -4.289 -6.291 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -3.866 -3.652 -8.763 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -4.430 -5.280 -8.439 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -6.523 -3.699 -11.129 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -4.802 -3.998 -10.862 1.00 0.00 H new ATOM 879 N PRO A 58 -3.767 -1.778 -6.353 1.00 0.00 N ATOM 880 CA PRO A 58 -3.637 -0.338 -6.201 1.00 0.00 C ATOM 881 C PRO A 58 -3.504 0.346 -7.564 1.00 0.00 C ATOM 882 O PRO A 58 -3.351 1.564 -7.638 1.00 0.00 O ATOM 883 CB PRO A 58 -2.415 -0.144 -5.317 1.00 0.00 C ATOM 884 CG PRO A 58 -1.638 -1.447 -5.389 1.00 0.00 C ATOM 885 CD PRO A 58 -2.547 -2.499 -6.003 1.00 0.00 C ATOM 0 HA PRO A 58 -4.516 0.119 -5.747 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -1.809 0.692 -5.666 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -2.707 0.081 -4.291 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -0.738 -1.322 -5.991 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -1.316 -1.755 -4.394 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -2.090 -2.953 -6.882 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -2.752 -3.305 -5.298 1.00 0.00 H new ATOM 893 N ASN A 59 -3.569 -0.467 -8.608 1.00 0.00 N ATOM 894 CA ASN A 59 -3.458 0.045 -9.963 1.00 0.00 C ATOM 895 C ASN A 59 -4.859 0.232 -10.549 1.00 0.00 C ATOM 896 O ASN A 59 -5.154 -0.268 -11.633 1.00 0.00 O ATOM 897 CB ASN A 59 -2.697 -0.933 -10.860 1.00 0.00 C ATOM 898 CG ASN A 59 -1.939 -0.189 -11.963 1.00 0.00 C ATOM 899 OD1 ASN A 59 -2.027 1.018 -12.105 1.00 0.00 O ATOM 900 ND2 ASN A 59 -1.194 -0.978 -12.731 1.00 0.00 N ATOM 0 H ASN A 59 -3.697 -1.477 -8.543 1.00 0.00 H new ATOM 0 HA ASN A 59 -2.919 0.992 -9.923 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -1.996 -1.513 -10.260 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -3.395 -1.641 -11.307 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -0.650 -0.579 -13.496 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -1.167 -1.982 -12.555 1.00 0.00 H new ATOM 907 N THR A 60 -5.685 0.954 -9.805 1.00 0.00 N ATOM 908 CA THR A 60 -7.048 1.214 -10.238 1.00 0.00 C ATOM 909 C THR A 60 -7.667 2.337 -9.404 1.00 0.00 C ATOM 910 O THR A 60 -8.371 3.194 -9.936 1.00 0.00 O ATOM 911 CB THR A 60 -7.827 -0.102 -10.160 1.00 0.00 C ATOM 912 OG1 THR A 60 -9.171 0.306 -9.921 1.00 0.00 O ATOM 913 CG2 THR A 60 -7.462 -0.926 -8.924 1.00 0.00 C ATOM 0 H THR A 60 -5.437 1.367 -8.906 1.00 0.00 H new ATOM 0 HA THR A 60 -7.076 1.565 -11.270 1.00 0.00 H new ATOM 0 HB THR A 60 -7.637 -0.691 -11.057 1.00 0.00 H new ATOM 0 HG1 THR A 60 -9.747 -0.485 -9.858 1.00 0.00 H new ATOM 0 HG21 THR A 60 -8.043 -1.849 -8.917 1.00 0.00 H new ATOM 0 HG22 THR A 60 -6.399 -1.166 -8.948 1.00 0.00 H new ATOM 0 HG23 THR A 60 -7.684 -0.351 -8.025 1.00 0.00 H new ATOM 921 N TYR A 61 -7.382 2.297 -8.110 1.00 0.00 N ATOM 922 CA TYR A 61 -7.901 3.301 -7.198 1.00 0.00 C ATOM 923 C TYR A 61 -7.750 4.706 -7.784 1.00 0.00 C ATOM 924 O TYR A 61 -7.108 4.885 -8.818 1.00 0.00 O ATOM 925 CB TYR A 61 -7.054 3.197 -5.929 1.00 0.00 C ATOM 926 CG TYR A 61 -7.255 1.894 -5.151 1.00 0.00 C ATOM 927 CD1 TYR A 61 -8.531 1.423 -4.914 1.00 0.00 C ATOM 928 CD2 TYR A 61 -6.162 1.192 -4.686 1.00 0.00 C ATOM 929 CE1 TYR A 61 -8.720 0.197 -4.183 1.00 0.00 C ATOM 930 CE2 TYR A 61 -6.352 -0.033 -3.954 1.00 0.00 C ATOM 931 CZ TYR A 61 -7.622 -0.471 -3.738 1.00 0.00 C ATOM 932 OH TYR A 61 -7.801 -1.627 -3.047 1.00 0.00 O ATOM 0 H TYR A 61 -6.798 1.584 -7.672 1.00 0.00 H new ATOM 0 HA TYR A 61 -8.961 3.134 -7.008 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -6.002 3.289 -6.198 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -7.290 4.038 -5.277 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -9.386 1.974 -5.277 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -5.164 1.561 -4.871 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -9.712 -0.184 -3.992 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -5.505 -0.592 -3.584 1.00 0.00 H new ATOM 0 HH TYR A 61 -7.045 -2.228 -3.213 1.00 0.00 H new ATOM 942 N ASP A 62 -8.351 5.667 -7.099 1.00 0.00 N ATOM 943 CA ASP A 62 -8.290 7.050 -7.538 1.00 0.00 C ATOM 944 C ASP A 62 -7.410 7.850 -6.576 1.00 0.00 C ATOM 945 O ASP A 62 -6.930 7.314 -5.577 1.00 0.00 O ATOM 946 CB ASP A 62 -9.681 7.688 -7.545 1.00 0.00 C ATOM 947 CG ASP A 62 -10.769 6.856 -8.226 1.00 0.00 C ATOM 948 OD1 ASP A 62 -10.782 6.850 -9.476 1.00 0.00 O ATOM 949 OD2 ASP A 62 -11.566 6.244 -7.482 1.00 0.00 O ATOM 0 H ASP A 62 -8.883 5.515 -6.242 1.00 0.00 H new ATOM 0 HA ASP A 62 -7.881 7.064 -8.548 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -9.982 7.879 -6.515 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -9.618 8.655 -8.044 1.00 0.00 H new ATOM 954 N ILE A 63 -7.222 9.117 -6.909 1.00 0.00 N ATOM 955 CA ILE A 63 -6.407 9.995 -6.087 1.00 0.00 C ATOM 956 C ILE A 63 -6.899 9.933 -4.640 1.00 0.00 C ATOM 957 O ILE A 63 -6.102 10.008 -3.705 1.00 0.00 O ATOM 958 CB ILE A 63 -6.388 11.411 -6.669 1.00 0.00 C ATOM 959 CG1 ILE A 63 -5.001 12.042 -6.529 1.00 0.00 C ATOM 960 CG2 ILE A 63 -7.480 12.278 -6.040 1.00 0.00 C ATOM 961 CD1 ILE A 63 -5.098 13.568 -6.474 1.00 0.00 C ATOM 0 H ILE A 63 -7.620 9.558 -7.738 1.00 0.00 H new ATOM 0 HA ILE A 63 -5.369 9.661 -6.087 1.00 0.00 H new ATOM 0 HB ILE A 63 -6.605 11.345 -7.735 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -4.518 11.672 -5.625 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -4.375 11.744 -7.370 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -7.444 13.278 -6.471 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -8.456 11.833 -6.236 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -7.320 12.341 -4.964 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -4.099 13.993 -6.374 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -5.559 13.937 -7.390 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.705 13.863 -5.618 1.00 0.00 H new ATOM 973 N HIS A 64 -8.209 9.797 -4.499 1.00 0.00 N ATOM 974 CA HIS A 64 -8.817 9.724 -3.182 1.00 0.00 C ATOM 975 C HIS A 64 -8.435 8.402 -2.512 1.00 0.00 C ATOM 976 O HIS A 64 -7.629 8.383 -1.583 1.00 0.00 O ATOM 977 CB HIS A 64 -10.332 9.928 -3.269 1.00 0.00 C ATOM 978 CG HIS A 64 -10.772 11.356 -3.054 1.00 0.00 C ATOM 979 ND1 HIS A 64 -11.612 11.733 -2.020 1.00 0.00 N ATOM 980 CD2 HIS A 64 -10.481 12.492 -3.749 1.00 0.00 C ATOM 981 CE1 HIS A 64 -11.811 13.041 -2.100 1.00 0.00 C ATOM 982 NE2 HIS A 64 -11.111 13.509 -3.172 1.00 0.00 N ATOM 0 H HIS A 64 -8.867 9.735 -5.276 1.00 0.00 H new ATOM 0 HA HIS A 64 -8.435 10.532 -2.558 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -10.678 9.596 -4.248 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -10.817 9.293 -2.527 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -9.846 12.554 -4.621 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -12.421 13.632 -1.433 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -11.077 14.481 -3.480 1.00 0.00 H new ATOM 990 N ARG A 65 -9.030 7.329 -3.011 1.00 0.00 N ATOM 991 CA ARG A 65 -8.762 6.006 -2.473 1.00 0.00 C ATOM 992 C ARG A 65 -7.262 5.825 -2.235 1.00 0.00 C ATOM 993 O ARG A 65 -6.850 5.361 -1.173 1.00 0.00 O ATOM 994 CB ARG A 65 -9.256 4.915 -3.424 1.00 0.00 C ATOM 995 CG ARG A 65 -10.776 4.983 -3.595 1.00 0.00 C ATOM 996 CD ARG A 65 -11.363 3.593 -3.842 1.00 0.00 C ATOM 997 NE ARG A 65 -11.647 3.411 -5.282 1.00 0.00 N ATOM 998 CZ ARG A 65 -11.810 2.219 -5.872 1.00 0.00 C ATOM 999 NH1 ARG A 65 -11.718 1.095 -5.149 1.00 0.00 N ATOM 1000 NH2 ARG A 65 -12.066 2.151 -7.186 1.00 0.00 N ATOM 0 H ARG A 65 -9.697 7.349 -3.782 1.00 0.00 H new ATOM 0 HA ARG A 65 -9.297 5.917 -1.527 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -8.772 5.027 -4.394 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -8.973 3.936 -3.038 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -11.227 5.419 -2.703 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -11.023 5.639 -4.430 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -10.664 2.829 -3.502 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -12.279 3.468 -3.264 1.00 0.00 H new ATOM 0 HE ARG A 65 -11.724 4.246 -5.863 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -11.524 1.146 -4.149 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -11.842 0.188 -5.599 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -12.137 3.007 -7.737 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -12.190 1.244 -7.635 1.00 0.00 H new ATOM 1014 N LEU A 66 -6.486 6.198 -3.242 1.00 0.00 N ATOM 1015 CA LEU A 66 -5.040 6.083 -3.156 1.00 0.00 C ATOM 1016 C LEU A 66 -4.552 6.775 -1.882 1.00 0.00 C ATOM 1017 O LEU A 66 -3.696 6.246 -1.174 1.00 0.00 O ATOM 1018 CB LEU A 66 -4.383 6.611 -4.433 1.00 0.00 C ATOM 1019 CG LEU A 66 -4.378 5.657 -5.630 1.00 0.00 C ATOM 1020 CD1 LEU A 66 -3.568 6.238 -6.790 1.00 0.00 C ATOM 1021 CD2 LEU A 66 -3.882 4.269 -5.222 1.00 0.00 C ATOM 0 H LEU A 66 -6.832 6.580 -4.122 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.745 5.036 -3.083 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -4.893 7.528 -4.727 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.352 6.879 -4.203 1.00 0.00 H new ATOM 0 HG LEU A 66 -5.404 5.542 -5.980 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -3.580 5.541 -7.628 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.006 7.186 -7.101 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.539 6.402 -6.469 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -3.888 3.611 -6.091 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.867 4.345 -4.832 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -4.537 3.860 -4.452 1.00 0.00 H new ATOM 1033 N GLU A 67 -5.118 7.946 -1.629 1.00 0.00 N ATOM 1034 CA GLU A 67 -4.751 8.715 -0.452 1.00 0.00 C ATOM 1035 C GLU A 67 -5.381 8.102 0.801 1.00 0.00 C ATOM 1036 O GLU A 67 -4.708 7.918 1.813 1.00 0.00 O ATOM 1037 CB GLU A 67 -5.157 10.182 -0.608 1.00 0.00 C ATOM 1038 CG GLU A 67 -4.135 10.946 -1.453 1.00 0.00 C ATOM 1039 CD GLU A 67 -3.374 11.966 -0.604 1.00 0.00 C ATOM 1040 OE1 GLU A 67 -4.040 12.901 -0.108 1.00 0.00 O ATOM 1041 OE2 GLU A 67 -2.144 11.789 -0.469 1.00 0.00 O ATOM 0 H GLU A 67 -5.828 8.381 -2.219 1.00 0.00 H new ATOM 0 HA GLU A 67 -3.667 8.681 -0.343 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -6.140 10.244 -1.076 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -5.242 10.646 0.375 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -3.432 10.244 -1.902 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -4.643 11.456 -2.272 1.00 0.00 H new ATOM 1048 N LYS A 68 -6.667 7.803 0.691 1.00 0.00 N ATOM 1049 CA LYS A 68 -7.396 7.215 1.802 1.00 0.00 C ATOM 1050 C LYS A 68 -6.612 6.020 2.345 1.00 0.00 C ATOM 1051 O LYS A 68 -6.245 5.994 3.519 1.00 0.00 O ATOM 1052 CB LYS A 68 -8.827 6.872 1.383 1.00 0.00 C ATOM 1053 CG LYS A 68 -9.545 8.103 0.826 1.00 0.00 C ATOM 1054 CD LYS A 68 -10.812 8.409 1.629 1.00 0.00 C ATOM 1055 CE LYS A 68 -11.576 9.586 1.019 1.00 0.00 C ATOM 1056 NZ LYS A 68 -10.985 10.871 1.458 1.00 0.00 N ATOM 0 H LYS A 68 -7.223 7.957 -0.150 1.00 0.00 H new ATOM 0 HA LYS A 68 -7.490 7.932 2.617 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -8.810 6.084 0.630 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -9.377 6.482 2.240 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -8.876 8.963 0.854 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -9.804 7.935 -0.219 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -11.453 7.528 1.653 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -10.546 8.639 2.661 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -11.550 9.520 -0.069 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -12.624 9.540 1.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -11.515 11.659 1.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -11.032 10.939 2.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -9.992 10.919 1.153 1.00 0.00 H new ATOM 1070 N ILE A 69 -6.376 5.057 1.465 1.00 0.00 N ATOM 1071 CA ILE A 69 -5.642 3.862 1.842 1.00 0.00 C ATOM 1072 C ILE A 69 -4.372 4.265 2.596 1.00 0.00 C ATOM 1073 O ILE A 69 -4.091 3.735 3.670 1.00 0.00 O ATOM 1074 CB ILE A 69 -5.377 2.987 0.615 1.00 0.00 C ATOM 1075 CG1 ILE A 69 -6.652 2.269 0.168 1.00 0.00 C ATOM 1076 CG2 ILE A 69 -4.230 2.009 0.876 1.00 0.00 C ATOM 1077 CD1 ILE A 69 -6.939 2.531 -1.312 1.00 0.00 C ATOM 0 H ILE A 69 -6.681 5.081 0.492 1.00 0.00 H new ATOM 0 HA ILE A 69 -6.235 3.249 2.520 1.00 0.00 H new ATOM 0 HB ILE A 69 -5.067 3.634 -0.205 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.549 1.197 0.338 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -7.495 2.607 0.771 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -4.063 1.399 -0.012 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -3.323 2.566 1.110 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -4.486 1.364 1.716 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.850 2.009 -1.604 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -7.066 3.601 -1.474 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -6.105 2.169 -1.914 1.00 0.00 H new ATOM 1089 N LEU A 70 -3.642 5.197 2.003 1.00 0.00 N ATOM 1090 CA LEU A 70 -2.410 5.676 2.605 1.00 0.00 C ATOM 1091 C LEU A 70 -2.719 6.281 3.977 1.00 0.00 C ATOM 1092 O LEU A 70 -1.920 6.163 4.905 1.00 0.00 O ATOM 1093 CB LEU A 70 -1.689 6.638 1.658 1.00 0.00 C ATOM 1094 CG LEU A 70 -0.819 5.991 0.580 1.00 0.00 C ATOM 1095 CD1 LEU A 70 -0.404 7.017 -0.478 1.00 0.00 C ATOM 1096 CD2 LEU A 70 0.389 5.286 1.199 1.00 0.00 C ATOM 0 H LEU A 70 -3.880 5.633 1.112 1.00 0.00 H new ATOM 0 HA LEU A 70 -1.720 4.848 2.768 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -2.436 7.262 1.168 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -1.062 7.301 2.254 1.00 0.00 H new ATOM 0 HG LEU A 70 -1.412 5.228 0.075 1.00 0.00 H new ATOM 0 HD11 LEU A 70 0.214 6.531 -1.233 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -1.294 7.433 -0.950 1.00 0.00 H new ATOM 0 HD13 LEU A 70 0.164 7.818 -0.005 1.00 0.00 H new ATOM 0 HD21 LEU A 70 0.991 4.835 0.410 1.00 0.00 H new ATOM 0 HD22 LEU A 70 0.992 6.011 1.746 1.00 0.00 H new ATOM 0 HD23 LEU A 70 0.046 4.510 1.883 1.00 0.00 H new ATOM 1108 N LYS A 71 -3.879 6.914 4.062 1.00 0.00 N ATOM 1109 CA LYS A 71 -4.303 7.536 5.304 1.00 0.00 C ATOM 1110 C LYS A 71 -4.647 6.448 6.323 1.00 0.00 C ATOM 1111 O LYS A 71 -4.630 6.693 7.529 1.00 0.00 O ATOM 1112 CB LYS A 71 -5.447 8.521 5.047 1.00 0.00 C ATOM 1113 CG LYS A 71 -5.024 9.951 5.388 1.00 0.00 C ATOM 1114 CD LYS A 71 -6.239 10.880 5.456 1.00 0.00 C ATOM 1115 CE LYS A 71 -6.598 11.207 6.907 1.00 0.00 C ATOM 1116 NZ LYS A 71 -7.462 12.407 6.968 1.00 0.00 N ATOM 0 H LYS A 71 -4.539 7.010 3.290 1.00 0.00 H new ATOM 0 HA LYS A 71 -3.492 8.128 5.730 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -5.751 8.467 4.002 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -6.314 8.242 5.646 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -4.500 9.961 6.344 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -4.324 10.316 4.637 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -6.028 11.801 4.913 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -7.090 10.408 4.964 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -7.110 10.359 7.361 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -5.689 11.376 7.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -7.697 12.616 7.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -6.960 13.218 6.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -8.337 12.232 6.434 1.00 0.00 H new ATOM 1130 N ALA A 72 -4.950 5.268 5.802 1.00 0.00 N ATOM 1131 CA ALA A 72 -5.296 4.142 6.652 1.00 0.00 C ATOM 1132 C ALA A 72 -4.188 3.090 6.574 1.00 0.00 C ATOM 1133 O ALA A 72 -4.401 1.932 6.929 1.00 0.00 O ATOM 1134 CB ALA A 72 -6.659 3.585 6.231 1.00 0.00 C ATOM 0 H ALA A 72 -4.963 5.068 4.802 1.00 0.00 H new ATOM 0 HA ALA A 72 -5.379 4.457 7.692 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -6.919 2.740 6.868 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -7.417 4.362 6.332 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -6.613 3.256 5.193 1.00 0.00 H new ATOM 1140 N ARG A 73 -3.029 3.532 6.109 1.00 0.00 N ATOM 1141 CA ARG A 73 -1.886 2.643 5.981 1.00 0.00 C ATOM 1142 C ARG A 73 -1.514 2.056 7.344 1.00 0.00 C ATOM 1143 O ARG A 73 -1.032 0.927 7.427 1.00 0.00 O ATOM 1144 CB ARG A 73 -0.677 3.381 5.405 1.00 0.00 C ATOM 1145 CG ARG A 73 -0.146 4.421 6.393 1.00 0.00 C ATOM 1146 CD ARG A 73 0.894 5.327 5.731 1.00 0.00 C ATOM 1147 NE ARG A 73 1.280 6.416 6.657 1.00 0.00 N ATOM 1148 CZ ARG A 73 2.134 7.399 6.345 1.00 0.00 C ATOM 1149 NH1 ARG A 73 2.697 7.437 5.130 1.00 0.00 N ATOM 1150 NH2 ARG A 73 2.426 8.345 7.249 1.00 0.00 N ATOM 0 H ARG A 73 -2.856 4.494 5.816 1.00 0.00 H new ATOM 0 HA ARG A 73 -2.166 1.839 5.300 1.00 0.00 H new ATOM 0 HB2 ARG A 73 0.110 2.666 5.167 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -0.956 3.870 4.472 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -0.972 5.025 6.770 1.00 0.00 H new ATOM 0 HG3 ARG A 73 0.299 3.918 7.252 1.00 0.00 H new ATOM 0 HD2 ARG A 73 1.773 4.744 5.455 1.00 0.00 H new ATOM 0 HD3 ARG A 73 0.489 5.748 4.811 1.00 0.00 H new ATOM 0 HE ARG A 73 0.870 6.417 7.591 1.00 0.00 H new ATOM 0 HH11 ARG A 73 2.475 6.717 4.442 1.00 0.00 H new ATOM 0 HH12 ARG A 73 3.347 8.186 4.893 1.00 0.00 H new ATOM 0 HH21 ARG A 73 1.998 8.316 8.174 1.00 0.00 H new ATOM 0 HH22 ARG A 73 3.077 9.094 7.012 1.00 0.00 H new ATOM 1164 N GLU A 74 -1.753 2.848 8.379 1.00 0.00 N ATOM 1165 CA GLU A 74 -1.450 2.421 9.734 1.00 0.00 C ATOM 1166 C GLU A 74 -2.580 1.546 10.280 1.00 0.00 C ATOM 1167 O GLU A 74 -2.382 0.796 11.235 1.00 0.00 O ATOM 1168 CB GLU A 74 -1.199 3.625 10.645 1.00 0.00 C ATOM 1169 CG GLU A 74 0.140 4.289 10.320 1.00 0.00 C ATOM 1170 CD GLU A 74 0.466 5.391 11.330 1.00 0.00 C ATOM 1171 OE1 GLU A 74 -0.474 6.140 11.676 1.00 0.00 O ATOM 1172 OE2 GLU A 74 1.647 5.459 11.735 1.00 0.00 O ATOM 0 H GLU A 74 -2.153 3.783 8.306 1.00 0.00 H new ATOM 0 HA GLU A 74 -0.536 1.827 9.711 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -2.006 4.349 10.528 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -1.207 3.305 11.687 1.00 0.00 H new ATOM 0 HG2 GLU A 74 0.932 3.540 10.326 1.00 0.00 H new ATOM 0 HG3 GLU A 74 0.107 4.710 9.315 1.00 0.00 H new ATOM 1179 N HIS A 75 -3.739 1.671 9.652 1.00 0.00 N ATOM 1180 CA HIS A 75 -4.900 0.900 10.062 1.00 0.00 C ATOM 1181 C HIS A 75 -4.946 -0.414 9.282 1.00 0.00 C ATOM 1182 O HIS A 75 -5.253 -1.464 9.846 1.00 0.00 O ATOM 1183 CB HIS A 75 -6.180 1.725 9.910 1.00 0.00 C ATOM 1184 CG HIS A 75 -6.501 2.588 11.108 1.00 0.00 C ATOM 1185 ND1 HIS A 75 -6.948 2.066 12.309 1.00 0.00 N ATOM 1186 CD2 HIS A 75 -6.434 3.940 11.276 1.00 0.00 C ATOM 1187 CE1 HIS A 75 -7.139 3.068 13.155 1.00 0.00 C ATOM 1188 NE2 HIS A 75 -6.821 4.229 12.512 1.00 0.00 N ATOM 0 H HIS A 75 -3.899 2.295 8.861 1.00 0.00 H new ATOM 0 HA HIS A 75 -4.820 0.651 11.120 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -6.087 2.362 9.031 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -7.016 1.050 9.727 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -6.119 4.654 10.530 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -7.485 2.981 14.174 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -6.872 5.165 12.915 1.00 0.00 H new ATOM 1196 N VAL A 76 -4.637 -0.315 7.998 1.00 0.00 N ATOM 1197 CA VAL A 76 -4.638 -1.483 7.134 1.00 0.00 C ATOM 1198 C VAL A 76 -3.843 -2.607 7.803 1.00 0.00 C ATOM 1199 O VAL A 76 -2.722 -2.392 8.259 1.00 0.00 O ATOM 1200 CB VAL A 76 -4.101 -1.113 5.751 1.00 0.00 C ATOM 1201 CG1 VAL A 76 -3.782 -2.366 4.933 1.00 0.00 C ATOM 1202 CG2 VAL A 76 -5.083 -0.207 5.006 1.00 0.00 C ATOM 0 H VAL A 76 -4.384 0.558 7.534 1.00 0.00 H new ATOM 0 HA VAL A 76 -5.655 -1.847 6.985 1.00 0.00 H new ATOM 0 HB VAL A 76 -3.173 -0.559 5.890 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -3.402 -2.074 3.954 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -3.029 -2.958 5.453 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -4.688 -2.960 4.808 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -4.677 0.041 4.025 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -6.035 -0.724 4.884 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -5.238 0.709 5.577 1.00 0.00 H new ATOM 1212 N ARG A 77 -4.457 -3.782 7.841 1.00 0.00 N ATOM 1213 CA ARG A 77 -3.821 -4.939 8.445 1.00 0.00 C ATOM 1214 C ARG A 77 -4.233 -6.216 7.711 1.00 0.00 C ATOM 1215 O ARG A 77 -5.400 -6.385 7.360 1.00 0.00 O ATOM 1216 CB ARG A 77 -4.198 -5.064 9.924 1.00 0.00 C ATOM 1217 CG ARG A 77 -3.740 -6.409 10.493 1.00 0.00 C ATOM 1218 CD ARG A 77 -3.032 -6.222 11.838 1.00 0.00 C ATOM 1219 NE ARG A 77 -3.903 -6.691 12.937 1.00 0.00 N ATOM 1220 CZ ARG A 77 -4.025 -7.973 13.305 1.00 0.00 C ATOM 1221 NH1 ARG A 77 -3.331 -8.922 12.663 1.00 0.00 N ATOM 1222 NH2 ARG A 77 -4.840 -8.306 14.315 1.00 0.00 N ATOM 0 H ARG A 77 -5.388 -3.956 7.463 1.00 0.00 H new ATOM 0 HA ARG A 77 -2.742 -4.804 8.366 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -3.742 -4.251 10.489 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -5.278 -4.965 10.038 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -4.600 -7.067 10.619 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -3.067 -6.896 9.788 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -2.094 -6.777 11.845 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -2.782 -5.171 11.984 1.00 0.00 H new ATOM 0 HE ARG A 77 -4.445 -5.994 13.447 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -2.710 -8.668 11.895 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -3.423 -9.899 12.943 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -5.368 -7.583 14.804 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -4.933 -9.282 14.595 1.00 0.00 H new ATOM 1236 N MET A 78 -3.253 -7.082 7.500 1.00 0.00 N ATOM 1237 CA MET A 78 -3.499 -8.339 6.812 1.00 0.00 C ATOM 1238 C MET A 78 -3.396 -9.520 7.778 1.00 0.00 C ATOM 1239 O MET A 78 -2.573 -9.509 8.693 1.00 0.00 O ATOM 1240 CB MET A 78 -2.482 -8.510 5.682 1.00 0.00 C ATOM 1241 CG MET A 78 -2.849 -7.642 4.477 1.00 0.00 C ATOM 1242 SD MET A 78 -1.586 -7.774 3.223 1.00 0.00 S ATOM 1243 CE MET A 78 -2.279 -6.705 1.972 1.00 0.00 C ATOM 0 H MET A 78 -2.287 -6.938 7.793 1.00 0.00 H new ATOM 0 HA MET A 78 -4.509 -8.317 6.402 1.00 0.00 H new ATOM 0 HB2 MET A 78 -1.488 -8.241 6.039 1.00 0.00 H new ATOM 0 HB3 MET A 78 -2.440 -9.557 5.381 1.00 0.00 H new ATOM 0 HG2 MET A 78 -3.810 -7.957 4.071 1.00 0.00 H new ATOM 0 HG3 MET A 78 -2.958 -6.603 4.787 1.00 0.00 H new ATOM 0 HE1 MET A 78 -1.475 -6.179 1.457 1.00 0.00 H new ATOM 0 HE2 MET A 78 -2.841 -7.302 1.254 1.00 0.00 H new ATOM 0 HE3 MET A 78 -2.945 -5.980 2.441 1.00 0.00 H new ATOM 1253 N VAL A 79 -4.240 -10.513 7.540 1.00 0.00 N ATOM 1254 CA VAL A 79 -4.254 -11.700 8.378 1.00 0.00 C ATOM 1255 C VAL A 79 -4.359 -12.943 7.491 1.00 0.00 C ATOM 1256 O VAL A 79 -5.322 -13.093 6.740 1.00 0.00 O ATOM 1257 CB VAL A 79 -5.383 -11.602 9.406 1.00 0.00 C ATOM 1258 CG1 VAL A 79 -5.466 -12.875 10.252 1.00 0.00 C ATOM 1259 CG2 VAL A 79 -5.213 -10.366 10.292 1.00 0.00 C ATOM 0 H VAL A 79 -4.919 -10.520 6.779 1.00 0.00 H new ATOM 0 HA VAL A 79 -3.325 -11.780 8.943 1.00 0.00 H new ATOM 0 HB VAL A 79 -6.322 -11.498 8.863 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -6.276 -12.779 10.975 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -5.657 -13.731 9.604 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -4.524 -13.023 10.780 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -6.029 -10.321 11.014 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -4.263 -10.426 10.822 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.227 -9.469 9.672 1.00 0.00 H new ATOM 1269 N ILE A 80 -3.357 -13.801 7.609 1.00 0.00 N ATOM 1270 CA ILE A 80 -3.324 -15.025 6.828 1.00 0.00 C ATOM 1271 C ILE A 80 -4.445 -15.955 7.297 1.00 0.00 C ATOM 1272 O ILE A 80 -4.360 -16.542 8.374 1.00 0.00 O ATOM 1273 CB ILE A 80 -1.934 -15.661 6.886 1.00 0.00 C ATOM 1274 CG1 ILE A 80 -0.889 -14.754 6.233 1.00 0.00 C ATOM 1275 CG2 ILE A 80 -1.945 -17.061 6.267 1.00 0.00 C ATOM 1276 CD1 ILE A 80 -1.294 -14.393 4.802 1.00 0.00 C ATOM 0 H ILE A 80 -2.561 -13.673 8.234 1.00 0.00 H new ATOM 0 HA ILE A 80 -3.507 -14.809 5.775 1.00 0.00 H new ATOM 0 HB ILE A 80 -1.653 -15.774 7.933 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -0.772 -13.844 6.822 1.00 0.00 H new ATOM 0 HG13 ILE A 80 0.079 -15.255 6.225 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -0.945 -17.491 6.321 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -2.642 -17.695 6.814 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -2.256 -16.995 5.224 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -0.534 -13.748 4.361 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -1.386 -15.303 4.209 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -2.251 -13.871 4.815 1.00 0.00 H new ATOM 1288 N ILE A 81 -5.471 -16.059 6.465 1.00 0.00 N ATOM 1289 CA ILE A 81 -6.608 -16.908 6.782 1.00 0.00 C ATOM 1290 C ILE A 81 -6.250 -18.364 6.483 1.00 0.00 C ATOM 1291 O ILE A 81 -6.460 -19.242 7.319 1.00 0.00 O ATOM 1292 CB ILE A 81 -7.861 -16.419 6.051 1.00 0.00 C ATOM 1293 CG1 ILE A 81 -8.261 -15.019 6.523 1.00 0.00 C ATOM 1294 CG2 ILE A 81 -9.007 -17.422 6.198 1.00 0.00 C ATOM 1295 CD1 ILE A 81 -8.325 -14.953 8.050 1.00 0.00 C ATOM 0 H ILE A 81 -5.539 -15.570 5.572 1.00 0.00 H new ATOM 0 HA ILE A 81 -6.844 -16.850 7.845 1.00 0.00 H new ATOM 0 HB ILE A 81 -7.630 -16.346 4.988 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -7.542 -14.288 6.154 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -9.231 -14.753 6.103 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -9.885 -17.051 5.670 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -8.708 -18.381 5.775 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -9.246 -17.550 7.254 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -8.611 -13.948 8.359 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -9.062 -15.668 8.415 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -7.347 -15.196 8.466 1.00 0.00 H new ATOM 1307 N ASN A 82 -5.718 -18.576 5.289 1.00 0.00 N ATOM 1308 CA ASN A 82 -5.329 -19.912 4.869 1.00 0.00 C ATOM 1309 C ASN A 82 -4.201 -19.811 3.840 1.00 0.00 C ATOM 1310 O ASN A 82 -4.457 -19.661 2.647 1.00 0.00 O ATOM 1311 CB ASN A 82 -6.502 -20.647 4.215 1.00 0.00 C ATOM 1312 CG ASN A 82 -6.734 -22.007 4.876 1.00 0.00 C ATOM 1313 OD1 ASN A 82 -5.884 -22.543 5.569 1.00 0.00 O ATOM 1314 ND2 ASN A 82 -7.927 -22.535 4.622 1.00 0.00 N ATOM 0 H ASN A 82 -5.547 -17.845 4.598 1.00 0.00 H new ATOM 0 HA ASN A 82 -5.006 -20.462 5.753 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -7.405 -20.041 4.294 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -6.303 -20.784 3.152 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -8.178 -23.442 5.016 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -8.592 -22.033 4.034 1.00 0.00 H new ATOM 1321 N GLN A 83 -2.978 -19.898 4.341 1.00 0.00 N ATOM 1322 CA GLN A 83 -1.809 -19.818 3.480 1.00 0.00 C ATOM 1323 C GLN A 83 -1.802 -20.982 2.486 1.00 0.00 C ATOM 1324 O GLN A 83 -2.608 -21.904 2.598 1.00 0.00 O ATOM 1325 CB GLN A 83 -0.522 -19.793 4.305 1.00 0.00 C ATOM 1326 CG GLN A 83 -0.323 -21.114 5.052 1.00 0.00 C ATOM 1327 CD GLN A 83 1.126 -21.268 5.517 1.00 0.00 C ATOM 1328 OE1 GLN A 83 1.895 -20.321 5.565 1.00 0.00 O ATOM 1329 NE2 GLN A 83 1.457 -22.511 5.856 1.00 0.00 N ATOM 0 H GLN A 83 -2.770 -20.023 5.332 1.00 0.00 H new ATOM 0 HA GLN A 83 -1.858 -18.886 2.917 1.00 0.00 H new ATOM 0 HB2 GLN A 83 0.330 -19.609 3.651 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -0.559 -18.970 5.018 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -0.991 -21.153 5.912 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -0.591 -21.947 4.402 1.00 0.00 H new ATOM 0 HE21 GLN A 83 0.766 -23.258 5.793 1.00 0.00 H new ATOM 0 HE22 GLN A 83 2.402 -22.717 6.179 1.00 0.00 H new ATOM 1338 N SER A 84 -0.881 -20.901 1.537 1.00 0.00 N ATOM 1339 CA SER A 84 -0.759 -21.936 0.525 1.00 0.00 C ATOM 1340 C SER A 84 0.652 -21.923 -0.068 1.00 0.00 C ATOM 1341 O SER A 84 1.325 -22.952 -0.099 1.00 0.00 O ATOM 1342 CB SER A 84 -1.800 -21.752 -0.581 1.00 0.00 C ATOM 1343 OG SER A 84 -1.572 -22.628 -1.681 1.00 0.00 O ATOM 0 H SER A 84 -0.213 -20.135 1.448 1.00 0.00 H new ATOM 0 HA SER A 84 -0.940 -22.901 0.999 1.00 0.00 H new ATOM 0 HB2 SER A 84 -2.796 -21.932 -0.175 1.00 0.00 H new ATOM 0 HB3 SER A 84 -1.780 -20.720 -0.930 1.00 0.00 H new ATOM 0 HG SER A 84 -2.259 -22.480 -2.365 1.00 0.00 H new ATOM 1349 N GLY A 85 1.057 -20.747 -0.523 1.00 0.00 N ATOM 1350 CA GLY A 85 2.376 -20.586 -1.113 1.00 0.00 C ATOM 1351 C GLY A 85 2.939 -19.193 -0.827 1.00 0.00 C ATOM 1352 O GLY A 85 2.185 -18.258 -0.558 1.00 0.00 O ATOM 0 H GLY A 85 0.495 -19.896 -0.495 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.051 -21.344 -0.715 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.318 -20.745 -2.190 1.00 0.00 H new ATOM 1356 N PRO A 86 4.293 -19.094 -0.899 1.00 0.00 N ATOM 1357 CA PRO A 86 4.965 -17.830 -0.651 1.00 0.00 C ATOM 1358 C PRO A 86 4.798 -16.879 -1.838 1.00 0.00 C ATOM 1359 O PRO A 86 4.179 -15.823 -1.710 1.00 0.00 O ATOM 1360 CB PRO A 86 6.416 -18.200 -0.386 1.00 0.00 C ATOM 1361 CG PRO A 86 6.597 -19.601 -0.950 1.00 0.00 C ATOM 1362 CD PRO A 86 5.217 -20.178 -1.216 1.00 0.00 C ATOM 0 HA PRO A 86 4.545 -17.290 0.197 1.00 0.00 H new ATOM 0 HB2 PRO A 86 7.093 -17.494 -0.867 1.00 0.00 H new ATOM 0 HB3 PRO A 86 6.637 -18.177 0.681 1.00 0.00 H new ATOM 0 HG2 PRO A 86 7.181 -19.570 -1.870 1.00 0.00 H new ATOM 0 HG3 PRO A 86 7.144 -20.228 -0.246 1.00 0.00 H new ATOM 0 HD2 PRO A 86 5.114 -20.495 -2.254 1.00 0.00 H new ATOM 0 HD3 PRO A 86 5.028 -21.054 -0.595 1.00 0.00 H new ATOM 1370 N SER A 87 5.362 -17.286 -2.965 1.00 0.00 N ATOM 1371 CA SER A 87 5.285 -16.483 -4.174 1.00 0.00 C ATOM 1372 C SER A 87 6.155 -15.233 -4.029 1.00 0.00 C ATOM 1373 O SER A 87 5.823 -14.325 -3.270 1.00 0.00 O ATOM 1374 CB SER A 87 3.838 -16.088 -4.481 1.00 0.00 C ATOM 1375 OG SER A 87 3.568 -16.095 -5.880 1.00 0.00 O ATOM 0 H SER A 87 5.875 -18.162 -3.067 1.00 0.00 H new ATOM 0 HA SER A 87 5.656 -17.082 -5.006 1.00 0.00 H new ATOM 0 HB2 SER A 87 3.160 -16.777 -3.977 1.00 0.00 H new ATOM 0 HB3 SER A 87 3.640 -15.094 -4.079 1.00 0.00 H new ATOM 0 HG SER A 87 2.635 -15.839 -6.034 1.00 0.00 H new ATOM 1381 N SER A 88 7.255 -15.228 -4.770 1.00 0.00 N ATOM 1382 CA SER A 88 8.177 -14.106 -4.734 1.00 0.00 C ATOM 1383 C SER A 88 8.969 -14.038 -6.040 1.00 0.00 C ATOM 1384 O SER A 88 9.223 -15.063 -6.671 1.00 0.00 O ATOM 1385 CB SER A 88 9.127 -14.213 -3.540 1.00 0.00 C ATOM 1386 OG SER A 88 8.539 -13.714 -2.342 1.00 0.00 O ATOM 0 H SER A 88 7.528 -15.984 -5.399 1.00 0.00 H new ATOM 0 HA SER A 88 7.598 -13.190 -4.621 1.00 0.00 H new ATOM 0 HB2 SER A 88 9.413 -15.255 -3.397 1.00 0.00 H new ATOM 0 HB3 SER A 88 10.041 -13.658 -3.753 1.00 0.00 H new ATOM 0 HG SER A 88 7.563 -13.760 -2.413 1.00 0.00 H new ATOM 1392 N GLY A 89 9.338 -12.820 -6.408 1.00 0.00 N ATOM 1393 CA GLY A 89 10.098 -12.605 -7.628 1.00 0.00 C ATOM 1394 C GLY A 89 11.336 -11.746 -7.360 1.00 0.00 C ATOM 1395 O GLY A 89 11.477 -10.662 -7.920 1.00 0.00 O ATOM 0 H GLY A 89 9.125 -11.972 -5.883 1.00 0.00 H new ATOM 0 HA2 GLY A 89 10.401 -13.565 -8.046 1.00 0.00 H new ATOM 0 HA3 GLY A 89 9.468 -12.118 -8.372 1.00 0.00 H new TER 1399 GLY A 89