USER MOD reduce.3.24.130724 H: found=0, std=0, add=627, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 624 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 2 LYS NZ :NH3+ 160:sc= 2 (180deg=0.778) USER MOD Set 1.2: A 43 GLN : amide:sc= 1.11 K(o=3.1,f=-4.5) USER MOD Set 2.1: A 29 HIS : no HD1:sc=-0.00453 K(o=-0.38,f=-2.9!) USER MOD Set 2.2: A 46 ASN :FLIP amide:sc= -0.371 F(o=-2.1,f=-0.38) USER MOD Single : A 3 SER OG : rot -10:sc= 0.187 USER MOD Single : A 9 ASN : amide:sc= 0.725 K(o=0.72,f=-3!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 ASN : amide:sc= -0.0933 K(o=-0.093,f=-0.81) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 75:sc= 1.2 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 MET CE :methyl 168:sc= 0 (180deg=-0.373) USER MOD Single : A 32 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 34 ASN : amide:sc= -0.13 K(o=-0.13,f=-4.2!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=-0.002) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 SER OG : rot -120:sc= 1.91 USER MOD Single : A 56 CYS SG : rot 180:sc= -0.0677 USER MOD Single : A 58 SER OG : rot 70:sc= 0.0112 USER MOD Single : A 59 GLN : amide:sc= -0.15 K(o=-0.15,f=-2.5!) USER MOD Single : A 61 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= 0 K(o=0,f=-0.99) USER MOD Single : A 65 LYS NZ :NH3+ -161:sc= 0.595 (180deg=0.383) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 173:sc= 0.598 USER MOD Single : A 73 SER OG : rot 180:sc= 0.149 USER MOD Single : A 74 SER OG : rot 180:sc=0.000939 USER MOD Single : A 75 ASN : amide:sc= 0.18 K(o=0.18,f=-2.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 17.716 33.420 15.768 1.00 0.00 N ATOM 2 CA PRO A 1 18.486 34.505 16.419 1.00 0.00 C ATOM 3 C PRO A 1 19.904 34.049 16.799 1.00 0.00 C ATOM 4 O PRO A 1 20.044 32.950 17.334 1.00 0.00 O ATOM 5 CB PRO A 1 17.684 34.938 17.659 1.00 0.00 C ATOM 6 CG PRO A 1 16.694 33.798 17.903 1.00 0.00 C ATOM 7 CD PRO A 1 16.426 33.343 16.476 1.00 0.00 C ATOM 0 H2 PRO A 1 18.217 32.533 15.827 1.00 0.00 H new ATOM 0 H3 PRO A 1 17.576 33.618 14.777 1.00 0.00 H new ATOM 0 HA PRO A 1 18.619 35.341 15.733 1.00 0.00 H new ATOM 0 HB2 PRO A 1 18.336 35.086 18.520 1.00 0.00 H new ATOM 0 HB3 PRO A 1 17.166 35.881 17.485 1.00 0.00 H new ATOM 0 HG2 PRO A 1 17.121 33.004 18.517 1.00 0.00 H new ATOM 0 HG3 PRO A 1 15.788 34.138 18.406 1.00 0.00 H new ATOM 0 HD2 PRO A 1 16.033 32.326 16.459 1.00 0.00 H new ATOM 0 HD3 PRO A 1 15.682 33.980 15.998 1.00 0.00 H new ATOM 15 N LYS A 2 20.933 34.884 16.575 1.00 0.00 N ATOM 16 CA LYS A 2 22.361 34.605 16.846 1.00 0.00 C ATOM 17 C LYS A 2 22.699 34.689 18.347 1.00 0.00 C ATOM 18 O LYS A 2 23.425 35.577 18.809 1.00 0.00 O ATOM 19 CB LYS A 2 23.255 35.518 15.984 1.00 0.00 C ATOM 20 CG LYS A 2 24.722 35.034 15.990 1.00 0.00 C ATOM 21 CD LYS A 2 25.749 36.130 15.661 1.00 0.00 C ATOM 22 CE LYS A 2 25.754 37.328 16.624 1.00 0.00 C ATOM 23 NZ LYS A 2 25.910 36.932 18.042 1.00 0.00 N ATOM 0 H LYS A 2 20.790 35.815 16.183 1.00 0.00 H new ATOM 0 HA LYS A 2 22.565 33.573 16.560 1.00 0.00 H new ATOM 0 HB2 LYS A 2 22.880 35.537 14.961 1.00 0.00 H new ATOM 0 HB3 LYS A 2 23.205 36.540 16.360 1.00 0.00 H new ATOM 0 HG2 LYS A 2 24.952 34.619 16.971 1.00 0.00 H new ATOM 0 HG3 LYS A 2 24.828 34.224 15.269 1.00 0.00 H new ATOM 0 HD2 LYS A 2 26.744 35.684 15.655 1.00 0.00 H new ATOM 0 HD3 LYS A 2 25.557 36.495 14.652 1.00 0.00 H new ATOM 0 HE2 LYS A 2 26.565 38.003 16.350 1.00 0.00 H new ATOM 0 HE3 LYS A 2 24.823 37.884 16.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 26.242 37.747 18.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 24.994 36.609 18.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 26.604 36.160 18.113 1.00 0.00 H new ATOM 37 N SER A 3 22.139 33.742 19.091 1.00 0.00 N ATOM 38 CA SER A 3 22.307 33.511 20.525 1.00 0.00 C ATOM 39 C SER A 3 23.753 33.157 20.910 1.00 0.00 C ATOM 40 O SER A 3 24.592 32.871 20.051 1.00 0.00 O ATOM 41 CB SER A 3 21.343 32.390 20.930 1.00 0.00 C ATOM 42 OG SER A 3 20.918 32.583 22.255 1.00 0.00 O ATOM 0 H SER A 3 21.504 33.060 18.675 1.00 0.00 H new ATOM 0 HA SER A 3 22.081 34.433 21.060 1.00 0.00 H new ATOM 0 HB2 SER A 3 20.483 32.378 20.261 1.00 0.00 H new ATOM 0 HB3 SER A 3 21.835 31.422 20.834 1.00 0.00 H new ATOM 0 HG SER A 3 21.452 33.293 22.670 1.00 0.00 H new ATOM 48 N ARG A 4 24.082 33.185 22.206 1.00 0.00 N ATOM 49 CA ARG A 4 25.461 33.045 22.711 1.00 0.00 C ATOM 50 C ARG A 4 25.534 32.213 23.998 1.00 0.00 C ATOM 51 O ARG A 4 24.770 32.434 24.929 1.00 0.00 O ATOM 52 CB ARG A 4 26.057 34.448 22.918 1.00 0.00 C ATOM 53 CG ARG A 4 26.378 35.198 21.613 1.00 0.00 C ATOM 54 CD ARG A 4 27.219 36.462 21.853 1.00 0.00 C ATOM 55 NE ARG A 4 26.494 37.473 22.639 1.00 0.00 N ATOM 56 CZ ARG A 4 26.725 37.869 23.874 1.00 0.00 C ATOM 57 NH1 ARG A 4 27.613 37.314 24.644 1.00 0.00 N ATOM 58 NH2 ARG A 4 26.014 38.829 24.384 1.00 0.00 N ATOM 0 H ARG A 4 23.392 33.307 22.947 1.00 0.00 H new ATOM 0 HA ARG A 4 26.047 32.500 21.971 1.00 0.00 H new ATOM 0 HB2 ARG A 4 25.357 35.044 23.504 1.00 0.00 H new ATOM 0 HB3 ARG A 4 26.970 34.359 23.506 1.00 0.00 H new ATOM 0 HG2 ARG A 4 26.914 34.532 20.937 1.00 0.00 H new ATOM 0 HG3 ARG A 4 25.447 35.473 21.117 1.00 0.00 H new ATOM 0 HD2 ARG A 4 28.138 36.191 22.373 1.00 0.00 H new ATOM 0 HD3 ARG A 4 27.510 36.890 20.894 1.00 0.00 H new ATOM 0 HE ARG A 4 25.712 37.926 22.167 1.00 0.00 H new ATOM 0 HH11 ARG A 4 28.171 36.533 24.299 1.00 0.00 H new ATOM 0 HH12 ARG A 4 27.752 37.660 25.593 1.00 0.00 H new ATOM 0 HH21 ARG A 4 25.282 39.272 23.829 1.00 0.00 H new ATOM 0 HH22 ARG A 4 26.188 39.140 25.340 1.00 0.00 H new ATOM 72 N LEU A 5 26.476 31.273 24.045 1.00 0.00 N ATOM 73 CA LEU A 5 26.710 30.301 25.115 1.00 0.00 C ATOM 74 C LEU A 5 28.140 30.450 25.647 1.00 0.00 C ATOM 75 O LEU A 5 29.098 30.394 24.876 1.00 0.00 O ATOM 76 CB LEU A 5 26.450 28.886 24.537 1.00 0.00 C ATOM 77 CG LEU A 5 26.397 27.749 25.573 1.00 0.00 C ATOM 78 CD1 LEU A 5 25.649 26.524 25.044 1.00 0.00 C ATOM 79 CD2 LEU A 5 27.772 27.239 26.001 1.00 0.00 C ATOM 0 H LEU A 5 27.144 31.161 23.283 1.00 0.00 H new ATOM 0 HA LEU A 5 26.037 30.470 25.956 1.00 0.00 H new ATOM 0 HB2 LEU A 5 25.506 28.902 23.992 1.00 0.00 H new ATOM 0 HB3 LEU A 5 27.232 28.659 23.813 1.00 0.00 H new ATOM 0 HG LEU A 5 25.885 28.204 26.421 1.00 0.00 H new ATOM 0 HD11 LEU A 5 25.637 25.747 25.808 1.00 0.00 H new ATOM 0 HD12 LEU A 5 24.626 26.803 24.793 1.00 0.00 H new ATOM 0 HD13 LEU A 5 26.151 26.148 24.153 1.00 0.00 H new ATOM 0 HD21 LEU A 5 27.652 26.439 26.732 1.00 0.00 H new ATOM 0 HD22 LEU A 5 28.306 26.858 25.130 1.00 0.00 H new ATOM 0 HD23 LEU A 5 28.340 28.055 26.446 1.00 0.00 H new ATOM 91 N PHE A 6 28.302 30.569 26.964 1.00 0.00 N ATOM 92 CA PHE A 6 29.609 30.555 27.623 1.00 0.00 C ATOM 93 C PHE A 6 29.665 29.498 28.731 1.00 0.00 C ATOM 94 O PHE A 6 28.770 29.437 29.580 1.00 0.00 O ATOM 95 CB PHE A 6 29.924 31.949 28.170 1.00 0.00 C ATOM 96 CG PHE A 6 31.299 32.085 28.798 1.00 0.00 C ATOM 97 CD1 PHE A 6 32.417 32.353 27.988 1.00 0.00 C ATOM 98 CD2 PHE A 6 31.462 31.959 30.192 1.00 0.00 C ATOM 99 CE1 PHE A 6 33.692 32.497 28.565 1.00 0.00 C ATOM 100 CE2 PHE A 6 32.737 32.096 30.769 1.00 0.00 C ATOM 101 CZ PHE A 6 33.852 32.367 29.955 1.00 0.00 C ATOM 0 H PHE A 6 27.521 30.679 27.611 1.00 0.00 H new ATOM 0 HA PHE A 6 30.368 30.286 26.888 1.00 0.00 H new ATOM 0 HB2 PHE A 6 29.836 32.672 27.359 1.00 0.00 H new ATOM 0 HB3 PHE A 6 29.172 32.212 28.914 1.00 0.00 H new ATOM 0 HD1 PHE A 6 32.296 32.449 26.919 1.00 0.00 H new ATOM 0 HD2 PHE A 6 30.606 31.757 30.819 1.00 0.00 H new ATOM 0 HE1 PHE A 6 34.547 32.707 27.940 1.00 0.00 H new ATOM 0 HE2 PHE A 6 32.860 31.993 31.837 1.00 0.00 H new ATOM 0 HZ PHE A 6 34.831 32.475 30.398 1.00 0.00 H new ATOM 111 N ILE A 7 30.742 28.705 28.755 1.00 0.00 N ATOM 112 CA ILE A 7 31.085 27.823 29.878 1.00 0.00 C ATOM 113 C ILE A 7 32.485 28.167 30.379 1.00 0.00 C ATOM 114 O ILE A 7 33.462 28.023 29.639 1.00 0.00 O ATOM 115 CB ILE A 7 30.994 26.300 29.577 1.00 0.00 C ATOM 116 CG1 ILE A 7 30.060 25.857 28.430 1.00 0.00 C ATOM 117 CG2 ILE A 7 30.549 25.590 30.870 1.00 0.00 C ATOM 118 CD1 ILE A 7 30.722 25.955 27.046 1.00 0.00 C ATOM 0 H ILE A 7 31.409 28.657 27.985 1.00 0.00 H new ATOM 0 HA ILE A 7 30.328 28.009 30.640 1.00 0.00 H new ATOM 0 HB ILE A 7 31.990 26.024 29.231 1.00 0.00 H new ATOM 0 HG12 ILE A 7 29.743 24.829 28.603 1.00 0.00 H new ATOM 0 HG13 ILE A 7 29.161 26.474 28.442 1.00 0.00 H new ATOM 0 HG21 ILE A 7 30.476 24.518 30.690 1.00 0.00 H new ATOM 0 HG22 ILE A 7 31.279 25.777 31.657 1.00 0.00 H new ATOM 0 HG23 ILE A 7 29.576 25.973 31.179 1.00 0.00 H new ATOM 0 HD11 ILE A 7 30.016 25.630 26.281 1.00 0.00 H new ATOM 0 HD12 ILE A 7 31.015 26.987 26.855 1.00 0.00 H new ATOM 0 HD13 ILE A 7 31.605 25.317 27.019 1.00 0.00 H new ATOM 130 N GLY A 8 32.584 28.556 31.650 1.00 0.00 N ATOM 131 CA GLY A 8 33.852 28.820 32.328 1.00 0.00 C ATOM 132 C GLY A 8 34.665 27.557 32.637 1.00 0.00 C ATOM 133 O GLY A 8 35.864 27.647 32.888 1.00 0.00 O ATOM 0 H GLY A 8 31.770 28.699 32.248 1.00 0.00 H new ATOM 0 HA2 GLY A 8 34.453 29.485 31.708 1.00 0.00 H new ATOM 0 HA3 GLY A 8 33.651 29.348 33.260 1.00 0.00 H new ATOM 137 N ASN A 9 34.031 26.379 32.599 1.00 0.00 N ATOM 138 CA ASN A 9 34.659 25.076 32.831 1.00 0.00 C ATOM 139 C ASN A 9 33.970 23.960 32.021 1.00 0.00 C ATOM 140 O ASN A 9 33.060 23.291 32.513 1.00 0.00 O ATOM 141 CB ASN A 9 34.642 24.800 34.347 1.00 0.00 C ATOM 142 CG ASN A 9 35.285 23.479 34.734 1.00 0.00 C ATOM 143 OD1 ASN A 9 35.727 22.683 33.918 1.00 0.00 O ATOM 144 ND2 ASN A 9 35.337 23.183 36.003 1.00 0.00 N ATOM 0 H ASN A 9 33.033 26.306 32.399 1.00 0.00 H new ATOM 0 HA ASN A 9 35.691 25.092 32.482 1.00 0.00 H new ATOM 0 HB2 ASN A 9 35.159 25.610 34.861 1.00 0.00 H new ATOM 0 HB3 ASN A 9 33.610 24.808 34.697 1.00 0.00 H new ATOM 0 HD21 ASN A 9 35.743 22.297 36.304 1.00 0.00 H new ATOM 0 HD22 ASN A 9 34.972 23.838 36.695 1.00 0.00 H new ATOM 151 N LEU A 10 34.422 23.733 30.783 1.00 0.00 N ATOM 152 CA LEU A 10 34.137 22.499 30.033 1.00 0.00 C ATOM 153 C LEU A 10 35.227 22.184 28.985 1.00 0.00 C ATOM 154 O LEU A 10 35.834 21.116 29.091 1.00 0.00 O ATOM 155 CB LEU A 10 32.702 22.527 29.455 1.00 0.00 C ATOM 156 CG LEU A 10 32.367 21.347 28.521 1.00 0.00 C ATOM 157 CD1 LEU A 10 32.403 20.007 29.258 1.00 0.00 C ATOM 158 CD2 LEU A 10 30.976 21.542 27.924 1.00 0.00 C ATOM 0 H LEU A 10 34.998 24.400 30.269 1.00 0.00 H new ATOM 0 HA LEU A 10 34.173 21.661 30.729 1.00 0.00 H new ATOM 0 HB2 LEU A 10 31.991 22.533 30.281 1.00 0.00 H new ATOM 0 HB3 LEU A 10 32.562 23.459 28.907 1.00 0.00 H new ATOM 0 HG LEU A 10 33.123 21.328 27.736 1.00 0.00 H new ATOM 0 HD11 LEU A 10 32.161 19.203 28.563 1.00 0.00 H new ATOM 0 HD12 LEU A 10 33.399 19.844 29.669 1.00 0.00 H new ATOM 0 HD13 LEU A 10 31.674 20.018 30.068 1.00 0.00 H new ATOM 0 HD21 LEU A 10 30.743 20.706 27.264 1.00 0.00 H new ATOM 0 HD22 LEU A 10 30.239 21.588 28.726 1.00 0.00 H new ATOM 0 HD23 LEU A 10 30.951 22.471 27.355 1.00 0.00 H new ATOM 170 N PRO A 11 35.536 23.062 28.008 1.00 0.00 N ATOM 171 CA PRO A 11 36.606 22.815 27.041 1.00 0.00 C ATOM 172 C PRO A 11 37.969 23.202 27.635 1.00 0.00 C ATOM 173 O PRO A 11 38.446 24.326 27.470 1.00 0.00 O ATOM 174 CB PRO A 11 36.209 23.635 25.816 1.00 0.00 C ATOM 175 CG PRO A 11 35.535 24.853 26.424 1.00 0.00 C ATOM 176 CD PRO A 11 34.808 24.272 27.635 1.00 0.00 C ATOM 0 HA PRO A 11 36.720 21.765 26.772 1.00 0.00 H new ATOM 0 HB2 PRO A 11 37.077 23.911 25.217 1.00 0.00 H new ATOM 0 HB3 PRO A 11 35.533 23.083 25.163 1.00 0.00 H new ATOM 0 HG2 PRO A 11 36.260 25.613 26.715 1.00 0.00 H new ATOM 0 HG3 PRO A 11 34.843 25.323 25.725 1.00 0.00 H new ATOM 0 HD2 PRO A 11 34.792 24.986 28.459 1.00 0.00 H new ATOM 0 HD3 PRO A 11 33.770 24.042 27.392 1.00 0.00 H new ATOM 184 N LEU A 12 38.587 22.275 28.364 1.00 0.00 N ATOM 185 CA LEU A 12 39.844 22.505 29.086 1.00 0.00 C ATOM 186 C LEU A 12 41.074 22.358 28.185 1.00 0.00 C ATOM 187 O LEU A 12 42.044 23.097 28.381 1.00 0.00 O ATOM 188 CB LEU A 12 39.904 21.567 30.312 1.00 0.00 C ATOM 189 CG LEU A 12 39.352 22.149 31.628 1.00 0.00 C ATOM 190 CD1 LEU A 12 40.310 23.191 32.198 1.00 0.00 C ATOM 191 CD2 LEU A 12 37.969 22.785 31.484 1.00 0.00 C ATOM 0 H LEU A 12 38.226 21.327 28.474 1.00 0.00 H new ATOM 0 HA LEU A 12 39.862 23.539 29.431 1.00 0.00 H new ATOM 0 HB2 LEU A 12 39.350 20.658 30.078 1.00 0.00 H new ATOM 0 HB3 LEU A 12 40.942 21.275 30.473 1.00 0.00 H new ATOM 0 HG LEU A 12 39.256 21.300 32.305 1.00 0.00 H new ATOM 0 HD11 LEU A 12 39.903 23.590 33.127 1.00 0.00 H new ATOM 0 HD12 LEU A 12 41.277 22.727 32.395 1.00 0.00 H new ATOM 0 HD13 LEU A 12 40.436 24.001 31.480 1.00 0.00 H new ATOM 0 HD21 LEU A 12 37.645 23.173 32.450 1.00 0.00 H new ATOM 0 HD22 LEU A 12 38.017 23.601 30.763 1.00 0.00 H new ATOM 0 HD23 LEU A 12 37.258 22.035 31.137 1.00 0.00 H new ATOM 203 N LYS A 13 41.035 21.452 27.197 1.00 0.00 N ATOM 204 CA LYS A 13 42.074 21.308 26.156 1.00 0.00 C ATOM 205 C LYS A 13 41.633 20.556 24.888 1.00 0.00 C ATOM 206 O LYS A 13 42.239 20.764 23.839 1.00 0.00 O ATOM 207 CB LYS A 13 43.306 20.606 26.775 1.00 0.00 C ATOM 208 CG LYS A 13 44.568 20.604 25.895 1.00 0.00 C ATOM 209 CD LYS A 13 45.016 22.014 25.484 1.00 0.00 C ATOM 210 CE LYS A 13 46.340 21.956 24.722 1.00 0.00 C ATOM 211 NZ LYS A 13 46.702 23.292 24.202 1.00 0.00 N ATOM 0 H LYS A 13 40.270 20.786 27.094 1.00 0.00 H new ATOM 0 HA LYS A 13 42.305 22.319 25.820 1.00 0.00 H new ATOM 0 HB2 LYS A 13 43.543 21.091 27.722 1.00 0.00 H new ATOM 0 HB3 LYS A 13 43.040 19.574 27.003 1.00 0.00 H new ATOM 0 HG2 LYS A 13 45.379 20.114 26.434 1.00 0.00 H new ATOM 0 HG3 LYS A 13 44.378 20.014 24.999 1.00 0.00 H new ATOM 0 HD2 LYS A 13 44.251 22.477 24.861 1.00 0.00 H new ATOM 0 HD3 LYS A 13 45.127 22.639 26.370 1.00 0.00 H new ATOM 0 HE2 LYS A 13 47.128 21.590 25.380 1.00 0.00 H new ATOM 0 HE3 LYS A 13 46.260 21.248 23.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 47.604 23.232 23.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 45.958 23.627 23.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 46.799 23.958 24.995 1.00 0.00 H new ATOM 225 N ASN A 14 40.622 19.688 24.962 1.00 0.00 N ATOM 226 CA ASN A 14 40.232 18.748 23.905 1.00 0.00 C ATOM 227 C ASN A 14 38.731 18.846 23.567 1.00 0.00 C ATOM 228 O ASN A 14 37.968 17.880 23.711 1.00 0.00 O ATOM 229 CB ASN A 14 40.698 17.339 24.318 1.00 0.00 C ATOM 230 CG ASN A 14 40.446 16.260 23.274 1.00 0.00 C ATOM 231 OD1 ASN A 14 40.047 16.497 22.137 1.00 0.00 O ATOM 232 ND2 ASN A 14 40.653 15.025 23.653 1.00 0.00 N ATOM 0 H ASN A 14 40.030 19.617 25.789 1.00 0.00 H new ATOM 0 HA ASN A 14 40.726 19.004 22.968 1.00 0.00 H new ATOM 0 HB2 ASN A 14 41.765 17.373 24.537 1.00 0.00 H new ATOM 0 HB3 ASN A 14 40.192 17.059 25.242 1.00 0.00 H new ATOM 0 HD21 ASN A 14 40.483 14.257 23.004 1.00 0.00 H new ATOM 0 HD22 ASN A 14 40.984 14.830 24.598 1.00 0.00 H new ATOM 239 N VAL A 15 38.313 20.026 23.100 1.00 0.00 N ATOM 240 CA VAL A 15 37.025 20.247 22.428 1.00 0.00 C ATOM 241 C VAL A 15 37.239 21.053 21.140 1.00 0.00 C ATOM 242 O VAL A 15 37.847 22.126 21.150 1.00 0.00 O ATOM 243 CB VAL A 15 36.026 20.950 23.363 1.00 0.00 C ATOM 244 CG1 VAL A 15 34.673 21.220 22.695 1.00 0.00 C ATOM 245 CG2 VAL A 15 35.736 20.120 24.623 1.00 0.00 C ATOM 0 H VAL A 15 38.872 20.875 23.180 1.00 0.00 H new ATOM 0 HA VAL A 15 36.598 19.279 22.165 1.00 0.00 H new ATOM 0 HB VAL A 15 36.510 21.892 23.619 1.00 0.00 H new ATOM 0 HG11 VAL A 15 34.010 21.717 23.403 1.00 0.00 H new ATOM 0 HG12 VAL A 15 34.818 21.859 21.824 1.00 0.00 H new ATOM 0 HG13 VAL A 15 34.227 20.276 22.382 1.00 0.00 H new ATOM 0 HG21 VAL A 15 35.026 20.654 25.255 1.00 0.00 H new ATOM 0 HG22 VAL A 15 35.313 19.157 24.335 1.00 0.00 H new ATOM 0 HG23 VAL A 15 36.663 19.959 25.174 1.00 0.00 H new ATOM 255 N SER A 16 36.709 20.542 20.031 1.00 0.00 N ATOM 256 CA SER A 16 36.706 21.156 18.695 1.00 0.00 C ATOM 257 C SER A 16 35.273 21.236 18.136 1.00 0.00 C ATOM 258 O SER A 16 34.333 20.744 18.767 1.00 0.00 O ATOM 259 CB SER A 16 37.624 20.358 17.757 1.00 0.00 C ATOM 260 OG SER A 16 38.941 20.278 18.275 1.00 0.00 O ATOM 0 H SER A 16 36.242 19.635 20.036 1.00 0.00 H new ATOM 0 HA SER A 16 37.087 22.175 18.770 1.00 0.00 H new ATOM 0 HB2 SER A 16 37.223 19.354 17.619 1.00 0.00 H new ATOM 0 HB3 SER A 16 37.645 20.831 16.775 1.00 0.00 H new ATOM 0 HG SER A 16 39.504 19.764 17.659 1.00 0.00 H new ATOM 266 N LYS A 17 35.085 21.857 16.965 1.00 0.00 N ATOM 267 CA LYS A 17 33.784 22.084 16.298 1.00 0.00 C ATOM 268 C LYS A 17 32.872 20.853 16.282 1.00 0.00 C ATOM 269 O LYS A 17 31.708 20.930 16.665 1.00 0.00 O ATOM 270 CB LYS A 17 34.062 22.554 14.860 1.00 0.00 C ATOM 271 CG LYS A 17 32.780 22.946 14.111 1.00 0.00 C ATOM 272 CD LYS A 17 33.109 23.451 12.703 1.00 0.00 C ATOM 273 CE LYS A 17 31.805 23.754 11.964 1.00 0.00 C ATOM 274 NZ LYS A 17 32.057 24.189 10.575 1.00 0.00 N ATOM 0 H LYS A 17 35.866 22.234 16.428 1.00 0.00 H new ATOM 0 HA LYS A 17 33.245 22.839 16.871 1.00 0.00 H new ATOM 0 HB2 LYS A 17 34.740 23.407 14.885 1.00 0.00 H new ATOM 0 HB3 LYS A 17 34.570 21.759 14.313 1.00 0.00 H new ATOM 0 HG2 LYS A 17 32.113 22.087 14.048 1.00 0.00 H new ATOM 0 HG3 LYS A 17 32.251 23.720 14.666 1.00 0.00 H new ATOM 0 HD2 LYS A 17 33.726 24.347 12.760 1.00 0.00 H new ATOM 0 HD3 LYS A 17 33.684 22.702 12.159 1.00 0.00 H new ATOM 0 HE2 LYS A 17 31.174 22.865 11.959 1.00 0.00 H new ATOM 0 HE3 LYS A 17 31.257 24.532 12.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 31.151 24.386 10.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 32.639 25.051 10.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 32.558 23.437 10.061 1.00 0.00 H new ATOM 288 N GLU A 18 33.399 19.706 15.872 1.00 0.00 N ATOM 289 CA GLU A 18 32.642 18.458 15.751 1.00 0.00 C ATOM 290 C GLU A 18 32.438 17.743 17.099 1.00 0.00 C ATOM 291 O GLU A 18 31.630 16.817 17.171 1.00 0.00 O ATOM 292 CB GLU A 18 33.341 17.537 14.739 1.00 0.00 C ATOM 293 CG GLU A 18 33.333 18.075 13.299 1.00 0.00 C ATOM 294 CD GLU A 18 31.935 18.117 12.674 1.00 0.00 C ATOM 295 OE1 GLU A 18 31.156 17.147 12.845 1.00 0.00 O ATOM 296 OE2 GLU A 18 31.634 19.077 11.922 1.00 0.00 O ATOM 0 H GLU A 18 34.380 19.611 15.609 1.00 0.00 H new ATOM 0 HA GLU A 18 31.643 18.710 15.394 1.00 0.00 H new ATOM 0 HB2 GLU A 18 34.373 17.385 15.054 1.00 0.00 H new ATOM 0 HB3 GLU A 18 32.856 16.561 14.755 1.00 0.00 H new ATOM 0 HG2 GLU A 18 33.757 19.079 13.292 1.00 0.00 H new ATOM 0 HG3 GLU A 18 33.980 17.451 12.682 1.00 0.00 H new ATOM 303 N ASP A 19 33.133 18.159 18.166 1.00 0.00 N ATOM 304 CA ASP A 19 32.896 17.706 19.545 1.00 0.00 C ATOM 305 C ASP A 19 31.758 18.519 20.170 1.00 0.00 C ATOM 306 O ASP A 19 30.737 17.967 20.579 1.00 0.00 O ATOM 307 CB ASP A 19 34.157 17.834 20.424 1.00 0.00 C ATOM 308 CG ASP A 19 35.399 17.146 19.869 1.00 0.00 C ATOM 309 OD1 ASP A 19 35.271 16.124 19.153 1.00 0.00 O ATOM 310 OD2 ASP A 19 36.520 17.664 20.086 1.00 0.00 O ATOM 0 H ASP A 19 33.893 18.835 18.094 1.00 0.00 H new ATOM 0 HA ASP A 19 32.626 16.651 19.499 1.00 0.00 H new ATOM 0 HB2 ASP A 19 34.378 18.892 20.565 1.00 0.00 H new ATOM 0 HB3 ASP A 19 33.939 17.420 21.409 1.00 0.00 H new ATOM 315 N LEU A 20 31.891 19.851 20.184 1.00 0.00 N ATOM 316 CA LEU A 20 30.880 20.744 20.753 1.00 0.00 C ATOM 317 C LEU A 20 29.549 20.656 19.994 1.00 0.00 C ATOM 318 O LEU A 20 28.489 20.705 20.619 1.00 0.00 O ATOM 319 CB LEU A 20 31.439 22.174 20.881 1.00 0.00 C ATOM 320 CG LEU A 20 31.769 22.886 19.554 1.00 0.00 C ATOM 321 CD1 LEU A 20 30.586 23.691 19.013 1.00 0.00 C ATOM 322 CD2 LEU A 20 32.945 23.845 19.736 1.00 0.00 C ATOM 0 H LEU A 20 32.702 20.337 19.801 1.00 0.00 H new ATOM 0 HA LEU A 20 30.645 20.414 21.765 1.00 0.00 H new ATOM 0 HB2 LEU A 20 30.715 22.780 21.426 1.00 0.00 H new ATOM 0 HB3 LEU A 20 32.344 22.137 21.487 1.00 0.00 H new ATOM 0 HG LEU A 20 32.017 22.099 18.842 1.00 0.00 H new ATOM 0 HD11 LEU A 20 30.871 24.173 18.078 1.00 0.00 H new ATOM 0 HD12 LEU A 20 29.743 23.024 18.835 1.00 0.00 H new ATOM 0 HD13 LEU A 20 30.300 24.451 19.740 1.00 0.00 H new ATOM 0 HD21 LEU A 20 33.163 24.338 18.788 1.00 0.00 H new ATOM 0 HD22 LEU A 20 32.690 24.595 20.485 1.00 0.00 H new ATOM 0 HD23 LEU A 20 33.822 23.287 20.065 1.00 0.00 H new ATOM 334 N PHE A 21 29.572 20.448 18.671 1.00 0.00 N ATOM 335 CA PHE A 21 28.336 20.259 17.920 1.00 0.00 C ATOM 336 C PHE A 21 27.661 18.927 18.250 1.00 0.00 C ATOM 337 O PHE A 21 26.458 18.933 18.502 1.00 0.00 O ATOM 338 CB PHE A 21 28.558 20.421 16.412 1.00 0.00 C ATOM 339 CG PHE A 21 27.292 20.255 15.579 1.00 0.00 C ATOM 340 CD1 PHE A 21 26.089 20.890 15.951 1.00 0.00 C ATOM 341 CD2 PHE A 21 27.315 19.460 14.418 1.00 0.00 C ATOM 342 CE1 PHE A 21 24.935 20.757 15.160 1.00 0.00 C ATOM 343 CE2 PHE A 21 26.161 19.330 13.626 1.00 0.00 C ATOM 344 CZ PHE A 21 24.971 19.979 13.992 1.00 0.00 C ATOM 0 H PHE A 21 30.423 20.408 18.110 1.00 0.00 H new ATOM 0 HA PHE A 21 27.652 21.048 18.234 1.00 0.00 H new ATOM 0 HB2 PHE A 21 28.980 21.408 16.221 1.00 0.00 H new ATOM 0 HB3 PHE A 21 29.296 19.690 16.083 1.00 0.00 H new ATOM 0 HD1 PHE A 21 26.054 21.484 16.852 1.00 0.00 H new ATOM 0 HD2 PHE A 21 28.223 18.948 14.134 1.00 0.00 H new ATOM 0 HE1 PHE A 21 24.021 21.253 15.451 1.00 0.00 H new ATOM 0 HE2 PHE A 21 26.190 18.727 12.730 1.00 0.00 H new ATOM 0 HZ PHE A 21 24.088 19.880 13.378 1.00 0.00 H new ATOM 354 N ARG A 22 28.383 17.797 18.315 1.00 0.00 N ATOM 355 CA ARG A 22 27.737 16.507 18.630 1.00 0.00 C ATOM 356 C ARG A 22 27.208 16.460 20.060 1.00 0.00 C ATOM 357 O ARG A 22 26.102 15.969 20.272 1.00 0.00 O ATOM 358 CB ARG A 22 28.629 15.302 18.278 1.00 0.00 C ATOM 359 CG ARG A 22 29.771 15.042 19.264 1.00 0.00 C ATOM 360 CD ARG A 22 30.654 13.890 18.798 1.00 0.00 C ATOM 361 NE ARG A 22 31.767 13.676 19.733 1.00 0.00 N ATOM 362 CZ ARG A 22 32.837 12.945 19.507 1.00 0.00 C ATOM 363 NH1 ARG A 22 33.008 12.275 18.404 1.00 0.00 N ATOM 364 NH2 ARG A 22 33.761 12.893 20.412 1.00 0.00 N ATOM 0 H ARG A 22 29.390 17.746 18.158 1.00 0.00 H new ATOM 0 HA ARG A 22 26.863 16.428 17.983 1.00 0.00 H new ATOM 0 HB2 ARG A 22 28.005 14.410 18.222 1.00 0.00 H new ATOM 0 HB3 ARG A 22 29.052 15.458 17.286 1.00 0.00 H new ATOM 0 HG2 ARG A 22 30.373 15.944 19.372 1.00 0.00 H new ATOM 0 HG3 ARG A 22 29.360 14.813 20.247 1.00 0.00 H new ATOM 0 HD2 ARG A 22 30.060 12.980 18.718 1.00 0.00 H new ATOM 0 HD3 ARG A 22 31.045 14.104 17.803 1.00 0.00 H new ATOM 0 HE ARG A 22 31.704 14.137 20.641 1.00 0.00 H new ATOM 0 HH11 ARG A 22 32.296 12.305 17.674 1.00 0.00 H new ATOM 0 HH12 ARG A 22 33.854 11.720 18.270 1.00 0.00 H new ATOM 0 HH21 ARG A 22 33.652 13.413 21.282 1.00 0.00 H new ATOM 0 HH22 ARG A 22 34.598 12.331 20.255 1.00 0.00 H new ATOM 378 N ILE A 23 27.942 17.002 21.037 1.00 0.00 N ATOM 379 CA ILE A 23 27.523 16.936 22.447 1.00 0.00 C ATOM 380 C ILE A 23 26.364 17.891 22.771 1.00 0.00 C ATOM 381 O ILE A 23 25.545 17.554 23.624 1.00 0.00 O ATOM 382 CB ILE A 23 28.709 17.071 23.428 1.00 0.00 C ATOM 383 CG1 ILE A 23 29.403 18.450 23.386 1.00 0.00 C ATOM 384 CG2 ILE A 23 29.732 15.947 23.196 1.00 0.00 C ATOM 385 CD1 ILE A 23 29.134 19.262 24.650 1.00 0.00 C ATOM 0 H ILE A 23 28.825 17.489 20.882 1.00 0.00 H new ATOM 0 HA ILE A 23 27.126 15.932 22.596 1.00 0.00 H new ATOM 0 HB ILE A 23 28.282 16.980 24.427 1.00 0.00 H new ATOM 0 HG12 ILE A 23 30.477 18.312 23.265 1.00 0.00 H new ATOM 0 HG13 ILE A 23 29.053 19.006 22.516 1.00 0.00 H new ATOM 0 HG21 ILE A 23 30.560 16.059 23.896 1.00 0.00 H new ATOM 0 HG22 ILE A 23 29.252 14.981 23.352 1.00 0.00 H new ATOM 0 HG23 ILE A 23 30.110 16.004 22.175 1.00 0.00 H new ATOM 0 HD11 ILE A 23 29.640 20.225 24.579 1.00 0.00 H new ATOM 0 HD12 ILE A 23 28.061 19.423 24.757 1.00 0.00 H new ATOM 0 HD13 ILE A 23 29.508 18.719 25.518 1.00 0.00 H new ATOM 397 N PHE A 24 26.217 19.014 22.054 1.00 0.00 N ATOM 398 CA PHE A 24 25.074 19.927 22.211 1.00 0.00 C ATOM 399 C PHE A 24 23.941 19.740 21.188 1.00 0.00 C ATOM 400 O PHE A 24 22.857 20.278 21.403 1.00 0.00 O ATOM 401 CB PHE A 24 25.566 21.381 22.254 1.00 0.00 C ATOM 402 CG PHE A 24 26.489 21.733 23.411 1.00 0.00 C ATOM 403 CD1 PHE A 24 26.165 21.353 24.729 1.00 0.00 C ATOM 404 CD2 PHE A 24 27.650 22.498 23.180 1.00 0.00 C ATOM 405 CE1 PHE A 24 26.986 21.744 25.800 1.00 0.00 C ATOM 406 CE2 PHE A 24 28.466 22.892 24.256 1.00 0.00 C ATOM 407 CZ PHE A 24 28.128 22.525 25.568 1.00 0.00 C ATOM 0 H PHE A 24 26.888 19.316 21.348 1.00 0.00 H new ATOM 0 HA PHE A 24 24.613 19.665 23.163 1.00 0.00 H new ATOM 0 HB2 PHE A 24 26.086 21.597 21.321 1.00 0.00 H new ATOM 0 HB3 PHE A 24 24.697 22.038 22.294 1.00 0.00 H new ATOM 0 HD1 PHE A 24 25.283 20.759 24.916 1.00 0.00 H new ATOM 0 HD2 PHE A 24 27.914 22.783 22.172 1.00 0.00 H new ATOM 0 HE1 PHE A 24 26.737 21.442 26.806 1.00 0.00 H new ATOM 0 HE2 PHE A 24 29.354 23.478 24.072 1.00 0.00 H new ATOM 0 HZ PHE A 24 28.745 22.843 26.396 1.00 0.00 H new ATOM 417 N SER A 25 24.119 18.955 20.119 1.00 0.00 N ATOM 418 CA SER A 25 23.091 18.707 19.086 1.00 0.00 C ATOM 419 C SER A 25 21.702 18.325 19.629 1.00 0.00 C ATOM 420 O SER A 25 20.736 19.016 19.293 1.00 0.00 O ATOM 421 CB SER A 25 23.568 17.637 18.099 1.00 0.00 C ATOM 422 OG SER A 25 24.336 18.247 17.085 1.00 0.00 O ATOM 0 H SER A 25 24.994 18.463 19.939 1.00 0.00 H new ATOM 0 HA SER A 25 22.962 19.666 18.585 1.00 0.00 H new ATOM 0 HB2 SER A 25 24.162 16.885 18.619 1.00 0.00 H new ATOM 0 HB3 SER A 25 22.713 17.121 17.663 1.00 0.00 H new ATOM 0 HG SER A 25 25.219 18.480 17.439 1.00 0.00 H new ATOM 428 N PRO A 26 21.561 17.317 20.518 1.00 0.00 N ATOM 429 CA PRO A 26 20.264 16.958 21.094 1.00 0.00 C ATOM 430 C PRO A 26 19.790 17.921 22.204 1.00 0.00 C ATOM 431 O PRO A 26 18.802 17.633 22.879 1.00 0.00 O ATOM 432 CB PRO A 26 20.419 15.504 21.554 1.00 0.00 C ATOM 433 CG PRO A 26 21.892 15.414 21.934 1.00 0.00 C ATOM 434 CD PRO A 26 22.576 16.354 20.943 1.00 0.00 C ATOM 0 HA PRO A 26 19.465 17.052 20.359 1.00 0.00 H new ATOM 0 HB2 PRO A 26 19.770 15.278 22.400 1.00 0.00 H new ATOM 0 HB3 PRO A 26 20.164 14.801 20.761 1.00 0.00 H new ATOM 0 HG2 PRO A 26 22.060 15.727 22.965 1.00 0.00 H new ATOM 0 HG3 PRO A 26 22.268 14.395 21.845 1.00 0.00 H new ATOM 0 HD2 PRO A 26 23.421 16.861 21.409 1.00 0.00 H new ATOM 0 HD3 PRO A 26 22.967 15.800 20.090 1.00 0.00 H new ATOM 442 N TYR A 27 20.447 19.069 22.401 1.00 0.00 N ATOM 443 CA TYR A 27 20.075 20.110 23.372 1.00 0.00 C ATOM 444 C TYR A 27 19.784 21.470 22.725 1.00 0.00 C ATOM 445 O TYR A 27 18.958 22.218 23.250 1.00 0.00 O ATOM 446 CB TYR A 27 21.179 20.251 24.427 1.00 0.00 C ATOM 447 CG TYR A 27 21.398 18.987 25.225 1.00 0.00 C ATOM 448 CD1 TYR A 27 20.637 18.759 26.387 1.00 0.00 C ATOM 449 CD2 TYR A 27 22.298 18.008 24.769 1.00 0.00 C ATOM 450 CE1 TYR A 27 20.762 17.544 27.082 1.00 0.00 C ATOM 451 CE2 TYR A 27 22.406 16.784 25.451 1.00 0.00 C ATOM 452 CZ TYR A 27 21.635 16.549 26.603 1.00 0.00 C ATOM 453 OH TYR A 27 21.721 15.356 27.239 1.00 0.00 O ATOM 0 H TYR A 27 21.284 19.310 21.870 1.00 0.00 H new ATOM 0 HA TYR A 27 19.145 19.788 23.840 1.00 0.00 H new ATOM 0 HB2 TYR A 27 22.111 20.529 23.935 1.00 0.00 H new ATOM 0 HB3 TYR A 27 20.923 21.063 25.107 1.00 0.00 H new ATOM 0 HD1 TYR A 27 19.957 19.518 26.745 1.00 0.00 H new ATOM 0 HD2 TYR A 27 22.905 18.196 23.896 1.00 0.00 H new ATOM 0 HE1 TYR A 27 20.189 17.374 27.982 1.00 0.00 H new ATOM 0 HE2 TYR A 27 23.082 16.023 25.090 1.00 0.00 H new ATOM 0 HH TYR A 27 22.369 14.785 26.777 1.00 0.00 H new ATOM 463 N GLY A 28 20.414 21.787 21.588 1.00 0.00 N ATOM 464 CA GLY A 28 20.221 23.065 20.913 1.00 0.00 C ATOM 465 C GLY A 28 20.645 23.124 19.444 1.00 0.00 C ATOM 466 O GLY A 28 21.216 22.185 18.886 1.00 0.00 O ATOM 0 H GLY A 28 21.069 21.164 21.115 1.00 0.00 H new ATOM 0 HA2 GLY A 28 19.165 23.330 20.976 1.00 0.00 H new ATOM 0 HA3 GLY A 28 20.774 23.828 21.460 1.00 0.00 H new ATOM 470 N HIS A 29 20.322 24.253 18.806 1.00 0.00 N ATOM 471 CA HIS A 29 20.350 24.443 17.350 1.00 0.00 C ATOM 472 C HIS A 29 21.720 24.869 16.781 1.00 0.00 C ATOM 473 O HIS A 29 21.959 24.615 15.604 1.00 0.00 O ATOM 474 CB HIS A 29 19.243 25.437 16.953 1.00 0.00 C ATOM 475 CG HIS A 29 17.824 25.048 17.315 1.00 0.00 C ATOM 476 ND1 HIS A 29 17.236 25.186 18.578 1.00 0.00 N ATOM 477 CD2 HIS A 29 16.860 24.634 16.445 1.00 0.00 C ATOM 478 CE1 HIS A 29 15.941 24.856 18.438 1.00 0.00 C ATOM 479 NE2 HIS A 29 15.691 24.508 17.164 1.00 0.00 N ATOM 0 H HIS A 29 20.023 25.090 19.306 1.00 0.00 H new ATOM 0 HA HIS A 29 20.166 23.467 16.900 1.00 0.00 H new ATOM 0 HB2 HIS A 29 19.463 26.397 17.420 1.00 0.00 H new ATOM 0 HB3 HIS A 29 19.291 25.588 15.875 1.00 0.00 H new ATOM 0 HD2 HIS A 29 16.988 24.441 15.390 1.00 0.00 H new ATOM 0 HE1 HIS A 29 15.209 24.869 19.232 1.00 0.00 H new ATOM 0 HE2 HIS A 29 14.791 24.203 16.793 1.00 0.00 H new ATOM 487 N ILE A 30 22.634 25.428 17.593 1.00 0.00 N ATOM 488 CA ILE A 30 24.025 25.828 17.238 1.00 0.00 C ATOM 489 C ILE A 30 24.154 26.922 16.141 1.00 0.00 C ATOM 490 O ILE A 30 23.258 27.106 15.322 1.00 0.00 O ATOM 491 CB ILE A 30 24.895 24.563 16.973 1.00 0.00 C ATOM 492 CG1 ILE A 30 26.122 24.462 17.907 1.00 0.00 C ATOM 493 CG2 ILE A 30 25.305 24.382 15.498 1.00 0.00 C ATOM 494 CD1 ILE A 30 27.272 25.448 17.674 1.00 0.00 C ATOM 0 H ILE A 30 22.420 25.628 18.570 1.00 0.00 H new ATOM 0 HA ILE A 30 24.425 26.344 18.111 1.00 0.00 H new ATOM 0 HB ILE A 30 24.232 23.732 17.214 1.00 0.00 H new ATOM 0 HG12 ILE A 30 25.775 24.586 18.933 1.00 0.00 H new ATOM 0 HG13 ILE A 30 26.524 23.452 17.827 1.00 0.00 H new ATOM 0 HG21 ILE A 30 25.908 23.480 15.396 1.00 0.00 H new ATOM 0 HG22 ILE A 30 24.411 24.293 14.880 1.00 0.00 H new ATOM 0 HG23 ILE A 30 25.886 25.245 15.173 1.00 0.00 H new ATOM 0 HD11 ILE A 30 28.063 25.262 18.400 1.00 0.00 H new ATOM 0 HD12 ILE A 30 27.666 25.316 16.666 1.00 0.00 H new ATOM 0 HD13 ILE A 30 26.906 26.468 17.790 1.00 0.00 H new ATOM 506 N MET A 31 25.276 27.658 16.125 1.00 0.00 N ATOM 507 CA MET A 31 25.685 28.576 15.045 1.00 0.00 C ATOM 508 C MET A 31 27.202 28.559 14.769 1.00 0.00 C ATOM 509 O MET A 31 27.611 28.019 13.738 1.00 0.00 O ATOM 510 CB MET A 31 25.193 30.020 15.297 1.00 0.00 C ATOM 511 CG MET A 31 23.806 30.272 14.712 1.00 0.00 C ATOM 512 SD MET A 31 23.764 30.137 12.908 1.00 0.00 S ATOM 513 CE MET A 31 21.986 30.067 12.661 1.00 0.00 C ATOM 0 H MET A 31 25.949 27.631 16.891 1.00 0.00 H new ATOM 0 HA MET A 31 25.197 28.199 14.146 1.00 0.00 H new ATOM 0 HB2 MET A 31 25.172 30.212 16.370 1.00 0.00 H new ATOM 0 HB3 MET A 31 25.902 30.724 14.861 1.00 0.00 H new ATOM 0 HG2 MET A 31 23.102 29.559 15.141 1.00 0.00 H new ATOM 0 HG3 MET A 31 23.470 31.267 15.004 1.00 0.00 H new ATOM 0 HE1 MET A 31 21.760 30.196 11.602 1.00 0.00 H new ATOM 0 HE2 MET A 31 21.610 29.101 12.997 1.00 0.00 H new ATOM 0 HE3 MET A 31 21.508 30.862 13.234 1.00 0.00 H new ATOM 523 N GLN A 32 28.033 29.144 15.643 1.00 0.00 N ATOM 524 CA GLN A 32 29.473 29.409 15.421 1.00 0.00 C ATOM 525 C GLN A 32 30.314 29.108 16.679 1.00 0.00 C ATOM 526 O GLN A 32 29.759 28.844 17.743 1.00 0.00 O ATOM 527 CB GLN A 32 29.704 30.869 14.975 1.00 0.00 C ATOM 528 CG GLN A 32 28.971 31.281 13.689 1.00 0.00 C ATOM 529 CD GLN A 32 29.308 32.703 13.236 1.00 0.00 C ATOM 530 OE1 GLN A 32 30.106 33.419 13.832 1.00 0.00 O ATOM 531 NE2 GLN A 32 28.729 33.157 12.154 1.00 0.00 N ATOM 0 H GLN A 32 27.715 29.460 16.559 1.00 0.00 H new ATOM 0 HA GLN A 32 29.799 28.738 14.627 1.00 0.00 H new ATOM 0 HB2 GLN A 32 29.392 31.533 15.781 1.00 0.00 H new ATOM 0 HB3 GLN A 32 30.773 31.024 14.831 1.00 0.00 H new ATOM 0 HG2 GLN A 32 29.226 30.582 12.892 1.00 0.00 H new ATOM 0 HG3 GLN A 32 27.896 31.202 13.850 1.00 0.00 H new ATOM 0 HE21 GLN A 32 28.063 32.573 11.648 1.00 0.00 H new ATOM 0 HE22 GLN A 32 28.943 34.095 11.816 1.00 0.00 H new ATOM 540 N ILE A 33 31.646 29.141 16.581 1.00 0.00 N ATOM 541 CA ILE A 33 32.565 28.643 17.630 1.00 0.00 C ATOM 542 C ILE A 33 33.676 29.638 18.011 1.00 0.00 C ATOM 543 O ILE A 33 34.117 30.427 17.172 1.00 0.00 O ATOM 544 CB ILE A 33 33.166 27.281 17.202 1.00 0.00 C ATOM 545 CG1 ILE A 33 34.136 27.436 16.007 1.00 0.00 C ATOM 546 CG2 ILE A 33 32.036 26.276 16.907 1.00 0.00 C ATOM 547 CD1 ILE A 33 34.642 26.120 15.416 1.00 0.00 C ATOM 0 H ILE A 33 32.130 29.517 15.766 1.00 0.00 H new ATOM 0 HA ILE A 33 31.966 28.516 18.532 1.00 0.00 H new ATOM 0 HB ILE A 33 33.759 26.888 18.028 1.00 0.00 H new ATOM 0 HG12 ILE A 33 33.635 28.002 15.222 1.00 0.00 H new ATOM 0 HG13 ILE A 33 34.994 28.027 16.328 1.00 0.00 H new ATOM 0 HG21 ILE A 33 32.468 25.321 16.607 1.00 0.00 H new ATOM 0 HG22 ILE A 33 31.431 26.135 17.803 1.00 0.00 H new ATOM 0 HG23 ILE A 33 31.409 26.660 16.102 1.00 0.00 H new ATOM 0 HD11 ILE A 33 35.315 26.329 14.585 1.00 0.00 H new ATOM 0 HD12 ILE A 33 35.176 25.558 16.183 1.00 0.00 H new ATOM 0 HD13 ILE A 33 33.796 25.532 15.059 1.00 0.00 H new ATOM 559 N ASN A 34 34.146 29.557 19.262 1.00 0.00 N ATOM 560 CA ASN A 34 35.394 30.130 19.782 1.00 0.00 C ATOM 561 C ASN A 34 35.792 29.410 21.100 1.00 0.00 C ATOM 562 O ASN A 34 34.962 29.229 21.992 1.00 0.00 O ATOM 563 CB ASN A 34 35.195 31.648 19.987 1.00 0.00 C ATOM 564 CG ASN A 34 36.454 32.396 20.376 1.00 0.00 C ATOM 565 OD1 ASN A 34 37.482 31.833 20.722 1.00 0.00 O ATOM 566 ND2 ASN A 34 36.425 33.702 20.303 1.00 0.00 N ATOM 0 H ASN A 34 33.630 29.056 19.986 1.00 0.00 H new ATOM 0 HA ASN A 34 36.210 29.984 19.074 1.00 0.00 H new ATOM 0 HB2 ASN A 34 34.801 32.078 19.066 1.00 0.00 H new ATOM 0 HB3 ASN A 34 34.442 31.803 20.759 1.00 0.00 H new ATOM 0 HD21 ASN A 34 37.257 34.244 20.534 1.00 0.00 H new ATOM 0 HD22 ASN A 34 35.570 34.178 20.015 1.00 0.00 H new ATOM 573 N ILE A 35 37.048 28.968 21.245 1.00 0.00 N ATOM 574 CA ILE A 35 37.554 28.285 22.453 1.00 0.00 C ATOM 575 C ILE A 35 38.954 28.821 22.805 1.00 0.00 C ATOM 576 O ILE A 35 39.808 28.988 21.927 1.00 0.00 O ATOM 577 CB ILE A 35 37.498 26.743 22.277 1.00 0.00 C ATOM 578 CG1 ILE A 35 36.031 26.262 22.135 1.00 0.00 C ATOM 579 CG2 ILE A 35 38.164 26.018 23.458 1.00 0.00 C ATOM 580 CD1 ILE A 35 35.824 24.750 21.990 1.00 0.00 C ATOM 0 H ILE A 35 37.755 29.074 20.518 1.00 0.00 H new ATOM 0 HA ILE A 35 36.911 28.506 23.305 1.00 0.00 H new ATOM 0 HB ILE A 35 38.047 26.500 21.367 1.00 0.00 H new ATOM 0 HG12 ILE A 35 35.473 26.602 23.008 1.00 0.00 H new ATOM 0 HG13 ILE A 35 35.593 26.752 21.266 1.00 0.00 H new ATOM 0 HG21 ILE A 35 38.107 24.941 23.302 1.00 0.00 H new ATOM 0 HG22 ILE A 35 39.209 26.320 23.528 1.00 0.00 H new ATOM 0 HG23 ILE A 35 37.649 26.279 24.382 1.00 0.00 H new ATOM 0 HD11 ILE A 35 34.759 24.536 21.899 1.00 0.00 H new ATOM 0 HD12 ILE A 35 36.343 24.395 21.100 1.00 0.00 H new ATOM 0 HD13 ILE A 35 36.222 24.242 22.869 1.00 0.00 H new ATOM 592 N LYS A 36 39.187 29.126 24.092 1.00 0.00 N ATOM 593 CA LYS A 36 40.415 29.782 24.574 1.00 0.00 C ATOM 594 C LYS A 36 40.674 29.521 26.066 1.00 0.00 C ATOM 595 O LYS A 36 39.732 29.390 26.847 1.00 0.00 O ATOM 596 CB LYS A 36 40.278 31.298 24.307 1.00 0.00 C ATOM 597 CG LYS A 36 41.588 32.104 24.352 1.00 0.00 C ATOM 598 CD LYS A 36 42.673 31.661 23.353 1.00 0.00 C ATOM 599 CE LYS A 36 42.192 31.572 21.897 1.00 0.00 C ATOM 600 NZ LYS A 36 41.979 32.896 21.274 1.00 0.00 N ATOM 0 H LYS A 36 38.520 28.922 24.836 1.00 0.00 H new ATOM 0 HA LYS A 36 41.270 29.367 24.040 1.00 0.00 H new ATOM 0 HB2 LYS A 36 39.821 31.436 23.327 1.00 0.00 H new ATOM 0 HB3 LYS A 36 39.590 31.717 25.041 1.00 0.00 H new ATOM 0 HG2 LYS A 36 41.355 33.153 24.168 1.00 0.00 H new ATOM 0 HG3 LYS A 36 41.999 32.041 25.360 1.00 0.00 H new ATOM 0 HD2 LYS A 36 43.507 32.361 23.406 1.00 0.00 H new ATOM 0 HD3 LYS A 36 43.055 30.687 23.658 1.00 0.00 H new ATOM 0 HE2 LYS A 36 42.924 31.016 21.312 1.00 0.00 H new ATOM 0 HE3 LYS A 36 41.261 31.007 21.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 41.655 32.770 20.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 41.260 33.421 21.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 42.872 33.429 21.278 1.00 0.00 H new ATOM 614 N ASN A 37 41.947 29.516 26.467 1.00 0.00 N ATOM 615 CA ASN A 37 42.414 29.399 27.851 1.00 0.00 C ATOM 616 C ASN A 37 41.954 28.096 28.544 1.00 0.00 C ATOM 617 O ASN A 37 42.606 27.056 28.420 1.00 0.00 O ATOM 618 CB ASN A 37 42.076 30.708 28.593 1.00 0.00 C ATOM 619 CG ASN A 37 42.664 30.753 29.987 1.00 0.00 C ATOM 620 OD1 ASN A 37 42.011 30.433 30.972 1.00 0.00 O ATOM 621 ND2 ASN A 37 43.913 31.121 30.084 1.00 0.00 N ATOM 0 H ASN A 37 42.718 29.597 25.804 1.00 0.00 H new ATOM 0 HA ASN A 37 43.498 29.288 27.871 1.00 0.00 H new ATOM 0 HB2 ASN A 37 42.449 31.555 28.017 1.00 0.00 H new ATOM 0 HB3 ASN A 37 40.993 30.817 28.655 1.00 0.00 H new ATOM 0 HD21 ASN A 37 44.368 31.147 30.997 1.00 0.00 H new ATOM 0 HD22 ASN A 37 44.434 31.383 29.247 1.00 0.00 H new ATOM 628 N ALA A 38 40.831 28.143 29.262 1.00 0.00 N ATOM 629 CA ALA A 38 40.196 27.014 29.944 1.00 0.00 C ATOM 630 C ALA A 38 38.658 27.021 29.799 1.00 0.00 C ATOM 631 O ALA A 38 37.958 26.268 30.482 1.00 0.00 O ATOM 632 CB ALA A 38 40.624 27.069 31.414 1.00 0.00 C ATOM 0 H ALA A 38 40.314 29.013 29.390 1.00 0.00 H new ATOM 0 HA ALA A 38 40.521 26.081 29.484 1.00 0.00 H new ATOM 0 HB1 ALA A 38 40.169 26.240 31.957 1.00 0.00 H new ATOM 0 HB2 ALA A 38 41.709 26.994 31.480 1.00 0.00 H new ATOM 0 HB3 ALA A 38 40.298 28.012 31.853 1.00 0.00 H new ATOM 638 N PHE A 39 38.132 27.904 28.944 1.00 0.00 N ATOM 639 CA PHE A 39 36.712 28.206 28.780 1.00 0.00 C ATOM 640 C PHE A 39 36.303 28.180 27.298 1.00 0.00 C ATOM 641 O PHE A 39 37.145 28.059 26.399 1.00 0.00 O ATOM 642 CB PHE A 39 36.399 29.546 29.475 1.00 0.00 C ATOM 643 CG PHE A 39 37.295 30.725 29.120 1.00 0.00 C ATOM 644 CD1 PHE A 39 37.169 31.367 27.874 1.00 0.00 C ATOM 645 CD2 PHE A 39 38.239 31.199 30.054 1.00 0.00 C ATOM 646 CE1 PHE A 39 37.983 32.471 27.562 1.00 0.00 C ATOM 647 CE2 PHE A 39 39.050 32.305 29.744 1.00 0.00 C ATOM 648 CZ PHE A 39 38.925 32.939 28.495 1.00 0.00 C ATOM 0 H PHE A 39 38.718 28.454 28.316 1.00 0.00 H new ATOM 0 HA PHE A 39 36.110 27.434 29.259 1.00 0.00 H new ATOM 0 HB2 PHE A 39 35.370 29.818 29.242 1.00 0.00 H new ATOM 0 HB3 PHE A 39 36.451 29.391 30.553 1.00 0.00 H new ATOM 0 HD1 PHE A 39 36.445 31.011 27.155 1.00 0.00 H new ATOM 0 HD2 PHE A 39 38.340 30.710 31.012 1.00 0.00 H new ATOM 0 HE1 PHE A 39 37.884 32.960 26.604 1.00 0.00 H new ATOM 0 HE2 PHE A 39 39.768 32.667 30.465 1.00 0.00 H new ATOM 0 HZ PHE A 39 39.552 33.784 28.253 1.00 0.00 H new ATOM 658 N GLY A 40 34.997 28.236 27.036 1.00 0.00 N ATOM 659 CA GLY A 40 34.432 28.209 25.684 1.00 0.00 C ATOM 660 C GLY A 40 33.358 29.267 25.485 1.00 0.00 C ATOM 661 O GLY A 40 32.515 29.457 26.361 1.00 0.00 O ATOM 0 H GLY A 40 34.290 28.302 27.768 1.00 0.00 H new ATOM 0 HA2 GLY A 40 35.229 28.363 24.957 1.00 0.00 H new ATOM 0 HA3 GLY A 40 34.008 27.224 25.489 1.00 0.00 H new ATOM 665 N PHE A 41 33.381 29.907 24.318 1.00 0.00 N ATOM 666 CA PHE A 41 32.386 30.864 23.849 1.00 0.00 C ATOM 667 C PHE A 41 31.816 30.361 22.516 1.00 0.00 C ATOM 668 O PHE A 41 32.432 30.472 21.461 1.00 0.00 O ATOM 669 CB PHE A 41 33.034 32.254 23.733 1.00 0.00 C ATOM 670 CG PHE A 41 32.206 33.262 22.956 1.00 0.00 C ATOM 671 CD1 PHE A 41 30.812 33.331 23.135 1.00 0.00 C ATOM 672 CD2 PHE A 41 32.824 34.084 21.992 1.00 0.00 C ATOM 673 CE1 PHE A 41 30.041 34.178 22.326 1.00 0.00 C ATOM 674 CE2 PHE A 41 32.049 34.950 21.201 1.00 0.00 C ATOM 675 CZ PHE A 41 30.656 34.993 21.360 1.00 0.00 C ATOM 0 H PHE A 41 34.131 29.764 23.642 1.00 0.00 H new ATOM 0 HA PHE A 41 31.558 30.955 24.552 1.00 0.00 H new ATOM 0 HB2 PHE A 41 33.214 32.644 24.735 1.00 0.00 H new ATOM 0 HB3 PHE A 41 34.006 32.151 23.251 1.00 0.00 H new ATOM 0 HD1 PHE A 41 30.335 32.731 23.896 1.00 0.00 H new ATOM 0 HD2 PHE A 41 33.895 34.048 21.861 1.00 0.00 H new ATOM 0 HE1 PHE A 41 28.968 34.204 22.446 1.00 0.00 H new ATOM 0 HE2 PHE A 41 32.527 35.584 20.469 1.00 0.00 H new ATOM 0 HZ PHE A 41 30.059 35.649 20.743 1.00 0.00 H new ATOM 685 N ILE A 42 30.634 29.757 22.563 1.00 0.00 N ATOM 686 CA ILE A 42 29.999 29.117 21.410 1.00 0.00 C ATOM 687 C ILE A 42 28.740 29.910 21.079 1.00 0.00 C ATOM 688 O ILE A 42 27.930 30.205 21.952 1.00 0.00 O ATOM 689 CB ILE A 42 29.722 27.627 21.697 1.00 0.00 C ATOM 690 CG1 ILE A 42 31.016 26.868 22.086 1.00 0.00 C ATOM 691 CG2 ILE A 42 29.094 26.965 20.457 1.00 0.00 C ATOM 692 CD1 ILE A 42 30.738 25.519 22.757 1.00 0.00 C ATOM 0 H ILE A 42 30.078 29.696 23.416 1.00 0.00 H new ATOM 0 HA ILE A 42 30.656 29.127 20.540 1.00 0.00 H new ATOM 0 HB ILE A 42 29.032 27.574 22.539 1.00 0.00 H new ATOM 0 HG12 ILE A 42 31.619 26.706 21.192 1.00 0.00 H new ATOM 0 HG13 ILE A 42 31.606 27.489 22.760 1.00 0.00 H new ATOM 0 HG21 ILE A 42 28.900 25.913 20.665 1.00 0.00 H new ATOM 0 HG22 ILE A 42 28.157 27.465 20.213 1.00 0.00 H new ATOM 0 HG23 ILE A 42 29.780 27.048 19.614 1.00 0.00 H new ATOM 0 HD11 ILE A 42 31.682 25.035 23.006 1.00 0.00 H new ATOM 0 HD12 ILE A 42 30.160 25.678 23.668 1.00 0.00 H new ATOM 0 HD13 ILE A 42 30.173 24.883 22.075 1.00 0.00 H new ATOM 704 N GLN A 43 28.547 30.261 19.817 1.00 0.00 N ATOM 705 CA GLN A 43 27.351 30.966 19.374 1.00 0.00 C ATOM 706 C GLN A 43 26.328 29.966 18.852 1.00 0.00 C ATOM 707 O GLN A 43 26.671 28.962 18.228 1.00 0.00 O ATOM 708 CB GLN A 43 27.702 32.065 18.376 1.00 0.00 C ATOM 709 CG GLN A 43 28.771 32.995 18.972 1.00 0.00 C ATOM 710 CD GLN A 43 28.844 34.298 18.210 1.00 0.00 C ATOM 711 OE1 GLN A 43 28.049 35.204 18.423 1.00 0.00 O ATOM 712 NE2 GLN A 43 29.756 34.420 17.278 1.00 0.00 N ATOM 0 H GLN A 43 29.214 30.066 19.070 1.00 0.00 H new ATOM 0 HA GLN A 43 26.889 31.478 20.218 1.00 0.00 H new ATOM 0 HB2 GLN A 43 28.069 31.623 17.450 1.00 0.00 H new ATOM 0 HB3 GLN A 43 26.809 32.638 18.124 1.00 0.00 H new ATOM 0 HG2 GLN A 43 28.541 33.195 20.019 1.00 0.00 H new ATOM 0 HG3 GLN A 43 29.742 32.501 18.947 1.00 0.00 H new ATOM 0 HE21 GLN A 43 30.415 33.660 17.107 1.00 0.00 H new ATOM 0 HE22 GLN A 43 29.807 35.275 16.724 1.00 0.00 H new ATOM 721 N PHE A 44 25.061 30.233 19.120 1.00 0.00 N ATOM 722 CA PHE A 44 23.949 29.314 18.921 1.00 0.00 C ATOM 723 C PHE A 44 22.835 29.972 18.120 1.00 0.00 C ATOM 724 O PHE A 44 22.734 31.192 18.055 1.00 0.00 O ATOM 725 CB PHE A 44 23.441 28.845 20.288 1.00 0.00 C ATOM 726 CG PHE A 44 24.071 27.559 20.786 1.00 0.00 C ATOM 727 CD1 PHE A 44 25.398 27.544 21.248 1.00 0.00 C ATOM 728 CD2 PHE A 44 23.321 26.368 20.796 1.00 0.00 C ATOM 729 CE1 PHE A 44 25.968 26.343 21.701 1.00 0.00 C ATOM 730 CE2 PHE A 44 23.887 25.168 21.261 1.00 0.00 C ATOM 731 CZ PHE A 44 25.215 25.158 21.714 1.00 0.00 C ATOM 0 H PHE A 44 24.765 31.133 19.498 1.00 0.00 H new ATOM 0 HA PHE A 44 24.291 28.452 18.349 1.00 0.00 H new ATOM 0 HB2 PHE A 44 23.625 29.632 21.019 1.00 0.00 H new ATOM 0 HB3 PHE A 44 22.361 28.708 20.233 1.00 0.00 H new ATOM 0 HD1 PHE A 44 25.979 28.455 21.255 1.00 0.00 H new ATOM 0 HD2 PHE A 44 22.300 26.376 20.443 1.00 0.00 H new ATOM 0 HE1 PHE A 44 26.993 26.331 22.042 1.00 0.00 H new ATOM 0 HE2 PHE A 44 23.303 24.259 21.269 1.00 0.00 H new ATOM 0 HZ PHE A 44 25.657 24.240 22.072 1.00 0.00 H new ATOM 741 N ASP A 45 21.950 29.150 17.571 1.00 0.00 N ATOM 742 CA ASP A 45 20.595 29.595 17.291 1.00 0.00 C ATOM 743 C ASP A 45 19.685 29.268 18.485 1.00 0.00 C ATOM 744 O ASP A 45 19.867 28.237 19.132 1.00 0.00 O ATOM 745 CB ASP A 45 20.126 29.010 15.961 1.00 0.00 C ATOM 746 CG ASP A 45 18.777 29.569 15.536 1.00 0.00 C ATOM 747 OD1 ASP A 45 18.486 30.755 15.810 1.00 0.00 O ATOM 748 OD2 ASP A 45 18.026 28.867 14.828 1.00 0.00 O ATOM 0 H ASP A 45 22.145 28.182 17.314 1.00 0.00 H new ATOM 0 HA ASP A 45 20.556 30.678 17.173 1.00 0.00 H new ATOM 0 HB2 ASP A 45 20.866 29.224 15.190 1.00 0.00 H new ATOM 0 HB3 ASP A 45 20.058 27.925 16.046 1.00 0.00 H new ATOM 753 N ASN A 46 18.705 30.133 18.748 1.00 0.00 N ATOM 754 CA ASN A 46 17.668 30.026 19.790 1.00 0.00 C ATOM 755 C ASN A 46 18.158 30.009 21.270 1.00 0.00 C ATOM 756 O ASN A 46 18.938 29.144 21.668 1.00 0.00 O ATOM 757 CB ASN A 46 16.742 28.844 19.446 1.00 0.00 C ATOM 758 CG ASN A 46 16.104 28.989 18.080 1.00 0.00 C ATOM 759 OD1 ASN A 46 16.011 27.928 17.318 1.00 0.00 O flip ATOM 760 ND2 ASN A 46 15.687 30.072 17.685 1.00 0.00 N flip ATOM 0 H ASN A 46 18.603 30.989 18.203 1.00 0.00 H new ATOM 0 HA ASN A 46 17.114 30.964 19.765 1.00 0.00 H new ATOM 0 HB2 ASN A 46 17.313 27.916 19.481 1.00 0.00 H new ATOM 0 HB3 ASN A 46 15.961 28.766 20.202 1.00 0.00 H new ATOM 0 HD21 ASN A 46 15.762 30.896 18.282 1.00 0.00 H new ATOM 0 HD22 ASN A 46 15.265 30.149 16.759 1.00 0.00 H new ATOM 767 N PRO A 47 17.643 30.901 22.147 1.00 0.00 N ATOM 768 CA PRO A 47 18.123 31.048 23.531 1.00 0.00 C ATOM 769 C PRO A 47 17.788 29.867 24.445 1.00 0.00 C ATOM 770 O PRO A 47 18.594 29.502 25.298 1.00 0.00 O ATOM 771 CB PRO A 47 17.452 32.316 24.059 1.00 0.00 C ATOM 772 CG PRO A 47 16.165 32.403 23.241 1.00 0.00 C ATOM 773 CD PRO A 47 16.604 31.884 21.878 1.00 0.00 C ATOM 0 HA PRO A 47 19.212 31.095 23.528 1.00 0.00 H new ATOM 0 HB2 PRO A 47 17.245 32.246 25.127 1.00 0.00 H new ATOM 0 HB3 PRO A 47 18.081 33.194 23.913 1.00 0.00 H new ATOM 0 HG2 PRO A 47 15.370 31.794 23.670 1.00 0.00 H new ATOM 0 HG3 PRO A 47 15.789 33.424 23.184 1.00 0.00 H new ATOM 0 HD2 PRO A 47 15.768 31.434 21.343 1.00 0.00 H new ATOM 0 HD3 PRO A 47 16.983 32.694 21.254 1.00 0.00 H new ATOM 781 N GLN A 48 16.630 29.228 24.258 1.00 0.00 N ATOM 782 CA GLN A 48 16.252 28.030 25.022 1.00 0.00 C ATOM 783 C GLN A 48 17.235 26.882 24.760 1.00 0.00 C ATOM 784 O GLN A 48 17.619 26.149 25.668 1.00 0.00 O ATOM 785 CB GLN A 48 14.832 27.611 24.644 1.00 0.00 C ATOM 786 CG GLN A 48 13.829 28.711 25.003 1.00 0.00 C ATOM 787 CD GLN A 48 12.398 28.290 24.719 1.00 0.00 C ATOM 788 OE1 GLN A 48 11.778 28.711 23.746 1.00 0.00 O ATOM 789 NE2 GLN A 48 11.828 27.461 25.558 1.00 0.00 N ATOM 0 H GLN A 48 15.930 29.522 23.577 1.00 0.00 H new ATOM 0 HA GLN A 48 16.288 28.266 26.086 1.00 0.00 H new ATOM 0 HB2 GLN A 48 14.782 27.401 23.576 1.00 0.00 H new ATOM 0 HB3 GLN A 48 14.569 26.689 25.163 1.00 0.00 H new ATOM 0 HG2 GLN A 48 13.930 28.963 26.059 1.00 0.00 H new ATOM 0 HG3 GLN A 48 14.061 29.613 24.436 1.00 0.00 H new ATOM 0 HE21 GLN A 48 12.347 27.114 26.365 1.00 0.00 H new ATOM 0 HE22 GLN A 48 10.865 27.162 25.405 1.00 0.00 H new ATOM 798 N SER A 49 17.702 26.815 23.514 1.00 0.00 N ATOM 799 CA SER A 49 18.717 25.898 23.008 1.00 0.00 C ATOM 800 C SER A 49 20.099 26.152 23.631 1.00 0.00 C ATOM 801 O SER A 49 20.793 25.194 23.972 1.00 0.00 O ATOM 802 CB SER A 49 18.659 25.997 21.476 1.00 0.00 C ATOM 803 OG SER A 49 19.903 26.241 20.865 1.00 0.00 O ATOM 0 H SER A 49 17.358 27.441 22.786 1.00 0.00 H new ATOM 0 HA SER A 49 18.518 24.867 23.302 1.00 0.00 H new ATOM 0 HB2 SER A 49 18.248 25.069 21.079 1.00 0.00 H new ATOM 0 HB3 SER A 49 17.969 26.795 21.201 1.00 0.00 H new ATOM 0 HG SER A 49 19.861 27.081 20.362 1.00 0.00 H new ATOM 809 N VAL A 50 20.454 27.414 23.915 1.00 0.00 N ATOM 810 CA VAL A 50 21.630 27.755 24.739 1.00 0.00 C ATOM 811 C VAL A 50 21.477 27.242 26.169 1.00 0.00 C ATOM 812 O VAL A 50 22.314 26.467 26.636 1.00 0.00 O ATOM 813 CB VAL A 50 21.917 29.271 24.764 1.00 0.00 C ATOM 814 CG1 VAL A 50 22.999 29.634 25.788 1.00 0.00 C ATOM 815 CG2 VAL A 50 22.399 29.747 23.401 1.00 0.00 C ATOM 0 H VAL A 50 19.937 28.228 23.582 1.00 0.00 H new ATOM 0 HA VAL A 50 22.479 27.259 24.268 1.00 0.00 H new ATOM 0 HB VAL A 50 20.980 29.756 25.037 1.00 0.00 H new ATOM 0 HG11 VAL A 50 23.169 30.711 25.772 1.00 0.00 H new ATOM 0 HG12 VAL A 50 22.673 29.333 26.784 1.00 0.00 H new ATOM 0 HG13 VAL A 50 23.925 29.117 25.538 1.00 0.00 H new ATOM 0 HG21 VAL A 50 22.596 30.818 23.439 1.00 0.00 H new ATOM 0 HG22 VAL A 50 23.314 29.219 23.134 1.00 0.00 H new ATOM 0 HG23 VAL A 50 21.632 29.545 22.653 1.00 0.00 H new ATOM 825 N ARG A 51 20.439 27.681 26.894 1.00 0.00 N ATOM 826 CA ARG A 51 20.308 27.361 28.327 1.00 0.00 C ATOM 827 C ARG A 51 20.127 25.866 28.575 1.00 0.00 C ATOM 828 O ARG A 51 20.711 25.363 29.524 1.00 0.00 O ATOM 829 CB ARG A 51 19.273 28.252 29.043 1.00 0.00 C ATOM 830 CG ARG A 51 17.875 28.303 28.411 1.00 0.00 C ATOM 831 CD ARG A 51 16.929 27.201 28.888 1.00 0.00 C ATOM 832 NE ARG A 51 16.437 27.471 30.246 1.00 0.00 N ATOM 833 CZ ARG A 51 15.936 26.582 31.081 1.00 0.00 C ATOM 834 NH1 ARG A 51 15.829 25.324 30.759 1.00 0.00 N ATOM 835 NH2 ARG A 51 15.502 26.956 32.249 1.00 0.00 N ATOM 0 H ARG A 51 19.683 28.254 26.519 1.00 0.00 H new ATOM 0 HA ARG A 51 21.260 27.612 28.796 1.00 0.00 H new ATOM 0 HB2 ARG A 51 19.173 27.903 30.071 1.00 0.00 H new ATOM 0 HB3 ARG A 51 19.667 29.267 29.088 1.00 0.00 H new ATOM 0 HG2 ARG A 51 17.425 29.272 28.629 1.00 0.00 H new ATOM 0 HG3 ARG A 51 17.976 28.235 27.328 1.00 0.00 H new ATOM 0 HD2 ARG A 51 16.085 27.121 28.202 1.00 0.00 H new ATOM 0 HD3 ARG A 51 17.446 26.242 28.870 1.00 0.00 H new ATOM 0 HE ARG A 51 16.488 28.436 30.573 1.00 0.00 H new ATOM 0 HH11 ARG A 51 16.137 25.005 29.840 1.00 0.00 H new ATOM 0 HH12 ARG A 51 15.437 24.659 31.425 1.00 0.00 H new ATOM 0 HH21 ARG A 51 15.549 27.938 32.520 1.00 0.00 H new ATOM 0 HH22 ARG A 51 15.115 26.267 32.894 1.00 0.00 H new ATOM 849 N ASP A 52 19.445 25.133 27.695 1.00 0.00 N ATOM 850 CA ASP A 52 19.342 23.674 27.803 1.00 0.00 C ATOM 851 C ASP A 52 20.697 22.980 27.557 1.00 0.00 C ATOM 852 O ASP A 52 21.048 22.050 28.283 1.00 0.00 O ATOM 853 CB ASP A 52 18.268 23.144 26.838 1.00 0.00 C ATOM 854 CG ASP A 52 16.823 23.517 27.204 1.00 0.00 C ATOM 855 OD1 ASP A 52 16.525 23.879 28.371 1.00 0.00 O ATOM 856 OD2 ASP A 52 15.934 23.342 26.335 1.00 0.00 O ATOM 0 H ASP A 52 18.952 25.527 26.894 1.00 0.00 H new ATOM 0 HA ASP A 52 19.045 23.436 28.824 1.00 0.00 H new ATOM 0 HB2 ASP A 52 18.482 23.521 25.838 1.00 0.00 H new ATOM 0 HB3 ASP A 52 18.346 22.058 26.793 1.00 0.00 H new ATOM 861 N ALA A 53 21.503 23.453 26.597 1.00 0.00 N ATOM 862 CA ALA A 53 22.846 22.926 26.336 1.00 0.00 C ATOM 863 C ALA A 53 23.816 23.156 27.515 1.00 0.00 C ATOM 864 O ALA A 53 24.578 22.255 27.887 1.00 0.00 O ATOM 865 CB ALA A 53 23.350 23.554 25.031 1.00 0.00 C ATOM 0 H ALA A 53 21.238 24.218 25.976 1.00 0.00 H new ATOM 0 HA ALA A 53 22.798 21.842 26.229 1.00 0.00 H new ATOM 0 HB1 ALA A 53 24.350 23.180 24.810 1.00 0.00 H new ATOM 0 HB2 ALA A 53 22.676 23.291 24.216 1.00 0.00 H new ATOM 0 HB3 ALA A 53 23.384 24.638 25.138 1.00 0.00 H new ATOM 871 N ILE A 54 23.761 24.325 28.167 1.00 0.00 N ATOM 872 CA ILE A 54 24.527 24.555 29.400 1.00 0.00 C ATOM 873 C ILE A 54 23.961 23.693 30.535 1.00 0.00 C ATOM 874 O ILE A 54 24.653 22.844 31.090 1.00 0.00 O ATOM 875 CB ILE A 54 24.562 26.038 29.836 1.00 0.00 C ATOM 876 CG1 ILE A 54 25.019 27.014 28.735 1.00 0.00 C ATOM 877 CG2 ILE A 54 25.525 26.156 31.030 1.00 0.00 C ATOM 878 CD1 ILE A 54 24.823 28.490 29.110 1.00 0.00 C ATOM 0 H ILE A 54 23.199 25.121 27.865 1.00 0.00 H new ATOM 0 HA ILE A 54 25.556 24.270 29.183 1.00 0.00 H new ATOM 0 HB ILE A 54 23.540 26.321 30.087 1.00 0.00 H new ATOM 0 HG12 ILE A 54 26.073 26.838 28.519 1.00 0.00 H new ATOM 0 HG13 ILE A 54 24.466 26.803 27.820 1.00 0.00 H new ATOM 0 HG21 ILE A 54 25.570 27.194 31.360 1.00 0.00 H new ATOM 0 HG22 ILE A 54 25.168 25.530 31.848 1.00 0.00 H new ATOM 0 HG23 ILE A 54 26.520 25.828 30.729 1.00 0.00 H new ATOM 0 HD11 ILE A 54 25.165 29.122 28.291 1.00 0.00 H new ATOM 0 HD12 ILE A 54 23.766 28.680 29.298 1.00 0.00 H new ATOM 0 HD13 ILE A 54 25.398 28.717 30.008 1.00 0.00 H new ATOM 890 N GLU A 55 22.705 23.920 30.908 1.00 0.00 N ATOM 891 CA GLU A 55 22.143 23.457 32.177 1.00 0.00 C ATOM 892 C GLU A 55 21.899 21.948 32.216 1.00 0.00 C ATOM 893 O GLU A 55 21.962 21.353 33.292 1.00 0.00 O ATOM 894 CB GLU A 55 20.824 24.178 32.453 1.00 0.00 C ATOM 895 CG GLU A 55 20.974 25.690 32.682 1.00 0.00 C ATOM 896 CD GLU A 55 19.615 26.392 32.809 1.00 0.00 C ATOM 897 OE1 GLU A 55 18.557 25.752 32.598 1.00 0.00 O ATOM 898 OE2 GLU A 55 19.616 27.592 33.172 1.00 0.00 O ATOM 0 H GLU A 55 22.040 24.436 30.333 1.00 0.00 H new ATOM 0 HA GLU A 55 22.883 23.687 32.943 1.00 0.00 H new ATOM 0 HB2 GLU A 55 20.149 24.013 31.613 1.00 0.00 H new ATOM 0 HB3 GLU A 55 20.355 23.733 33.331 1.00 0.00 H new ATOM 0 HG2 GLU A 55 21.557 25.863 33.587 1.00 0.00 H new ATOM 0 HG3 GLU A 55 21.532 26.128 31.854 1.00 0.00 H new ATOM 905 N CYS A 56 21.629 21.318 31.070 1.00 0.00 N ATOM 906 CA CYS A 56 21.315 19.895 31.012 1.00 0.00 C ATOM 907 C CYS A 56 22.535 19.015 30.681 1.00 0.00 C ATOM 908 O CYS A 56 22.556 17.849 31.086 1.00 0.00 O ATOM 909 CB CYS A 56 20.146 19.695 30.045 1.00 0.00 C ATOM 910 SG CYS A 56 19.326 18.129 30.441 1.00 0.00 S ATOM 0 H CYS A 56 21.623 21.781 30.161 1.00 0.00 H new ATOM 0 HA CYS A 56 21.016 19.558 32.005 1.00 0.00 H new ATOM 0 HB2 CYS A 56 19.441 20.522 30.128 1.00 0.00 H new ATOM 0 HB3 CYS A 56 20.505 19.684 29.016 1.00 0.00 H new ATOM 0 HG CYS A 56 18.328 17.944 29.629 1.00 0.00 H new ATOM 916 N GLU A 57 23.563 19.550 30.005 1.00 0.00 N ATOM 917 CA GLU A 57 24.760 18.783 29.609 1.00 0.00 C ATOM 918 C GLU A 57 26.073 19.275 30.254 1.00 0.00 C ATOM 919 O GLU A 57 26.889 18.461 30.698 1.00 0.00 O ATOM 920 CB GLU A 57 24.880 18.732 28.069 1.00 0.00 C ATOM 921 CG GLU A 57 25.109 17.308 27.540 1.00 0.00 C ATOM 922 CD GLU A 57 26.321 16.623 28.173 1.00 0.00 C ATOM 923 OE1 GLU A 57 27.470 16.900 27.764 1.00 0.00 O ATOM 924 OE2 GLU A 57 26.129 15.815 29.116 1.00 0.00 O ATOM 0 H GLU A 57 23.590 20.528 29.716 1.00 0.00 H new ATOM 0 HA GLU A 57 24.613 17.775 29.997 1.00 0.00 H new ATOM 0 HB2 GLU A 57 23.972 19.139 27.624 1.00 0.00 H new ATOM 0 HB3 GLU A 57 25.704 19.370 27.751 1.00 0.00 H new ATOM 0 HG2 GLU A 57 24.219 16.708 27.730 1.00 0.00 H new ATOM 0 HG3 GLU A 57 25.243 17.345 26.459 1.00 0.00 H new ATOM 931 N SER A 58 26.282 20.592 30.354 1.00 0.00 N ATOM 932 CA SER A 58 27.484 21.188 30.981 1.00 0.00 C ATOM 933 C SER A 58 27.381 21.275 32.511 1.00 0.00 C ATOM 934 O SER A 58 28.395 21.363 33.201 1.00 0.00 O ATOM 935 CB SER A 58 27.771 22.586 30.415 1.00 0.00 C ATOM 936 OG SER A 58 27.692 22.601 29.002 1.00 0.00 O ATOM 0 H SER A 58 25.622 21.286 30.002 1.00 0.00 H new ATOM 0 HA SER A 58 28.307 20.516 30.738 1.00 0.00 H new ATOM 0 HB2 SER A 58 27.058 23.300 30.828 1.00 0.00 H new ATOM 0 HB3 SER A 58 28.764 22.909 30.728 1.00 0.00 H new ATOM 0 HG SER A 58 26.758 22.495 28.725 1.00 0.00 H new ATOM 942 N GLN A 59 26.160 21.213 33.044 1.00 0.00 N ATOM 943 CA GLN A 59 25.829 21.237 34.468 1.00 0.00 C ATOM 944 C GLN A 59 25.077 19.954 34.870 1.00 0.00 C ATOM 945 O GLN A 59 24.301 19.409 34.085 1.00 0.00 O ATOM 946 CB GLN A 59 25.020 22.514 34.731 1.00 0.00 C ATOM 947 CG GLN A 59 24.567 22.740 36.178 1.00 0.00 C ATOM 948 CD GLN A 59 25.709 23.073 37.131 1.00 0.00 C ATOM 949 OE1 GLN A 59 26.672 22.330 37.279 1.00 0.00 O ATOM 950 NE2 GLN A 59 25.643 24.200 37.799 1.00 0.00 N ATOM 0 H GLN A 59 25.328 21.140 32.459 1.00 0.00 H new ATOM 0 HA GLN A 59 26.728 21.256 35.085 1.00 0.00 H new ATOM 0 HB2 GLN A 59 25.620 23.370 34.422 1.00 0.00 H new ATOM 0 HB3 GLN A 59 24.136 22.497 34.093 1.00 0.00 H new ATOM 0 HG2 GLN A 59 23.839 23.551 36.199 1.00 0.00 H new ATOM 0 HG3 GLN A 59 24.057 21.845 36.534 1.00 0.00 H new ATOM 0 HE21 GLN A 59 24.842 24.819 37.677 1.00 0.00 H new ATOM 0 HE22 GLN A 59 26.393 24.457 38.441 1.00 0.00 H new ATOM 959 N GLU A 60 25.294 19.468 36.095 1.00 0.00 N ATOM 960 CA GLU A 60 24.715 18.205 36.604 1.00 0.00 C ATOM 961 C GLU A 60 23.866 18.380 37.885 1.00 0.00 C ATOM 962 O GLU A 60 23.118 17.478 38.273 1.00 0.00 O ATOM 963 CB GLU A 60 25.870 17.203 36.783 1.00 0.00 C ATOM 964 CG GLU A 60 25.413 15.739 36.845 1.00 0.00 C ATOM 965 CD GLU A 60 26.582 14.754 36.976 1.00 0.00 C ATOM 966 OE1 GLU A 60 27.691 15.021 36.442 1.00 0.00 O ATOM 967 OE2 GLU A 60 26.383 13.677 37.591 1.00 0.00 O ATOM 0 H GLU A 60 25.885 19.942 36.778 1.00 0.00 H new ATOM 0 HA GLU A 60 23.998 17.823 35.877 1.00 0.00 H new ATOM 0 HB2 GLU A 60 26.572 17.320 35.958 1.00 0.00 H new ATOM 0 HB3 GLU A 60 26.410 17.445 37.698 1.00 0.00 H new ATOM 0 HG2 GLU A 60 24.739 15.610 37.692 1.00 0.00 H new ATOM 0 HG3 GLU A 60 24.844 15.503 35.946 1.00 0.00 H new ATOM 974 N MET A 61 23.925 19.557 38.517 1.00 0.00 N ATOM 975 CA MET A 61 23.191 19.908 39.739 1.00 0.00 C ATOM 976 C MET A 61 22.753 21.379 39.724 1.00 0.00 C ATOM 977 O MET A 61 23.365 22.213 39.055 1.00 0.00 O ATOM 978 CB MET A 61 24.078 19.567 40.950 1.00 0.00 C ATOM 979 CG MET A 61 23.455 19.889 42.309 1.00 0.00 C ATOM 980 SD MET A 61 24.291 19.079 43.696 1.00 0.00 S ATOM 981 CE MET A 61 23.241 19.696 45.034 1.00 0.00 C ATOM 0 H MET A 61 24.508 20.322 38.178 1.00 0.00 H new ATOM 0 HA MET A 61 22.270 19.328 39.804 1.00 0.00 H new ATOM 0 HB2 MET A 61 24.319 18.505 40.919 1.00 0.00 H new ATOM 0 HB3 MET A 61 25.019 20.110 40.859 1.00 0.00 H new ATOM 0 HG2 MET A 61 23.475 20.968 42.463 1.00 0.00 H new ATOM 0 HG3 MET A 61 22.407 19.588 42.300 1.00 0.00 H new ATOM 0 HE1 MET A 61 23.597 19.304 45.987 1.00 0.00 H new ATOM 0 HE2 MET A 61 23.279 20.785 45.053 1.00 0.00 H new ATOM 0 HE3 MET A 61 22.214 19.371 44.869 1.00 0.00 H new ATOM 991 N ASN A 62 21.685 21.723 40.444 1.00 0.00 N ATOM 992 CA ASN A 62 21.248 23.113 40.604 1.00 0.00 C ATOM 993 C ASN A 62 22.211 23.904 41.505 1.00 0.00 C ATOM 994 O ASN A 62 22.464 23.515 42.648 1.00 0.00 O ATOM 995 CB ASN A 62 19.820 23.114 41.144 1.00 0.00 C ATOM 996 CG ASN A 62 19.168 24.482 41.116 1.00 0.00 C ATOM 997 OD1 ASN A 62 19.538 25.366 40.355 1.00 0.00 O ATOM 998 ND2 ASN A 62 18.180 24.684 41.949 1.00 0.00 N ATOM 0 H ASN A 62 21.098 21.047 40.933 1.00 0.00 H new ATOM 0 HA ASN A 62 21.261 23.617 39.638 1.00 0.00 H new ATOM 0 HB2 ASN A 62 19.217 22.420 40.558 1.00 0.00 H new ATOM 0 HB3 ASN A 62 19.827 22.743 42.169 1.00 0.00 H new ATOM 0 HD21 ASN A 62 17.707 25.588 41.970 1.00 0.00 H new ATOM 0 HD22 ASN A 62 17.882 23.938 42.578 1.00 0.00 H new ATOM 1005 N PHE A 63 22.753 25.011 40.986 1.00 0.00 N ATOM 1006 CA PHE A 63 23.865 25.752 41.597 1.00 0.00 C ATOM 1007 C PHE A 63 25.095 24.850 41.864 1.00 0.00 C ATOM 1008 O PHE A 63 25.785 24.998 42.878 1.00 0.00 O ATOM 1009 CB PHE A 63 23.389 26.559 42.824 1.00 0.00 C ATOM 1010 CG PHE A 63 22.193 27.470 42.600 1.00 0.00 C ATOM 1011 CD1 PHE A 63 20.883 26.984 42.763 1.00 0.00 C ATOM 1012 CD2 PHE A 63 22.388 28.825 42.273 1.00 0.00 C ATOM 1013 CE1 PHE A 63 19.778 27.837 42.583 1.00 0.00 C ATOM 1014 CE2 PHE A 63 21.284 29.684 42.112 1.00 0.00 C ATOM 1015 CZ PHE A 63 19.978 29.189 42.258 1.00 0.00 C ATOM 0 H PHE A 63 22.426 25.426 40.113 1.00 0.00 H new ATOM 0 HA PHE A 63 24.219 26.489 40.876 1.00 0.00 H new ATOM 0 HB2 PHE A 63 23.142 25.858 43.621 1.00 0.00 H new ATOM 0 HB3 PHE A 63 24.221 27.166 43.180 1.00 0.00 H new ATOM 0 HD1 PHE A 63 20.724 25.949 43.028 1.00 0.00 H new ATOM 0 HD2 PHE A 63 23.390 29.208 42.145 1.00 0.00 H new ATOM 0 HE1 PHE A 63 18.775 27.452 42.695 1.00 0.00 H new ATOM 0 HE2 PHE A 63 21.442 30.726 41.876 1.00 0.00 H new ATOM 0 HZ PHE A 63 19.131 29.845 42.121 1.00 0.00 H new ATOM 1025 N GLY A 64 25.358 23.891 40.963 1.00 0.00 N ATOM 1026 CA GLY A 64 26.461 22.925 41.046 1.00 0.00 C ATOM 1027 C GLY A 64 27.853 23.572 41.085 1.00 0.00 C ATOM 1028 O GLY A 64 28.027 24.740 40.721 1.00 0.00 O ATOM 0 H GLY A 64 24.787 23.764 40.127 1.00 0.00 H new ATOM 0 HA2 GLY A 64 26.330 22.314 41.939 1.00 0.00 H new ATOM 0 HA3 GLY A 64 26.407 22.253 40.190 1.00 0.00 H new ATOM 1032 N LYS A 65 28.853 22.847 41.594 1.00 0.00 N ATOM 1033 CA LYS A 65 30.157 23.412 41.995 1.00 0.00 C ATOM 1034 C LYS A 65 31.229 23.271 40.914 1.00 0.00 C ATOM 1035 O LYS A 65 31.127 22.449 40.002 1.00 0.00 O ATOM 1036 CB LYS A 65 30.587 22.840 43.362 1.00 0.00 C ATOM 1037 CG LYS A 65 29.986 23.609 44.555 1.00 0.00 C ATOM 1038 CD LYS A 65 28.457 23.724 44.514 1.00 0.00 C ATOM 1039 CE LYS A 65 27.851 24.299 45.794 1.00 0.00 C ATOM 1040 NZ LYS A 65 26.373 24.231 45.725 1.00 0.00 N ATOM 0 H LYS A 65 28.785 21.840 41.743 1.00 0.00 H new ATOM 0 HA LYS A 65 30.034 24.489 42.113 1.00 0.00 H new ATOM 0 HB2 LYS A 65 30.286 21.794 43.423 1.00 0.00 H new ATOM 0 HB3 LYS A 65 31.674 22.863 43.433 1.00 0.00 H new ATOM 0 HG2 LYS A 65 30.278 23.111 45.480 1.00 0.00 H new ATOM 0 HG3 LYS A 65 30.415 24.611 44.582 1.00 0.00 H new ATOM 0 HD2 LYS A 65 28.171 24.354 43.672 1.00 0.00 H new ATOM 0 HD3 LYS A 65 28.032 22.737 44.332 1.00 0.00 H new ATOM 0 HE2 LYS A 65 28.210 23.741 46.659 1.00 0.00 H new ATOM 0 HE3 LYS A 65 28.171 25.333 45.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 25.962 24.891 46.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 26.058 24.491 44.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 26.059 23.263 45.942 1.00 0.00 H new ATOM 1054 N LYS A 66 32.245 24.135 41.008 1.00 0.00 N ATOM 1055 CA LYS A 66 33.346 24.325 40.043 1.00 0.00 C ATOM 1056 C LYS A 66 32.893 24.689 38.620 1.00 0.00 C ATOM 1057 O LYS A 66 33.692 24.616 37.691 1.00 0.00 O ATOM 1058 CB LYS A 66 34.332 23.136 40.098 1.00 0.00 C ATOM 1059 CG LYS A 66 34.983 22.990 41.485 1.00 0.00 C ATOM 1060 CD LYS A 66 35.922 21.781 41.609 1.00 0.00 C ATOM 1061 CE LYS A 66 37.127 21.867 40.667 1.00 0.00 C ATOM 1062 NZ LYS A 66 38.080 20.762 40.916 1.00 0.00 N ATOM 0 H LYS A 66 32.331 24.762 41.808 1.00 0.00 H new ATOM 0 HA LYS A 66 33.888 25.215 40.362 1.00 0.00 H new ATOM 0 HB2 LYS A 66 33.805 22.216 39.846 1.00 0.00 H new ATOM 0 HB3 LYS A 66 35.109 23.274 39.346 1.00 0.00 H new ATOM 0 HG2 LYS A 66 35.544 23.897 41.709 1.00 0.00 H new ATOM 0 HG3 LYS A 66 34.198 22.906 42.237 1.00 0.00 H new ATOM 0 HD2 LYS A 66 36.275 21.705 42.637 1.00 0.00 H new ATOM 0 HD3 LYS A 66 35.364 20.870 41.395 1.00 0.00 H new ATOM 0 HE2 LYS A 66 36.786 21.831 39.632 1.00 0.00 H new ATOM 0 HE3 LYS A 66 37.631 22.824 40.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 38.886 20.845 40.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 38.421 20.813 41.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 37.603 19.851 40.762 1.00 0.00 H new ATOM 1076 N LEU A 67 31.633 25.090 38.431 1.00 0.00 N ATOM 1077 CA LEU A 67 31.012 25.325 37.126 1.00 0.00 C ATOM 1078 C LEU A 67 30.303 26.684 37.122 1.00 0.00 C ATOM 1079 O LEU A 67 29.241 26.828 37.725 1.00 0.00 O ATOM 1080 CB LEU A 67 30.065 24.134 36.837 1.00 0.00 C ATOM 1081 CG LEU A 67 29.445 24.014 35.428 1.00 0.00 C ATOM 1082 CD1 LEU A 67 28.409 25.086 35.086 1.00 0.00 C ATOM 1083 CD2 LEU A 67 30.511 24.014 34.334 1.00 0.00 C ATOM 0 H LEU A 67 30.997 25.266 39.208 1.00 0.00 H new ATOM 0 HA LEU A 67 31.752 25.374 36.327 1.00 0.00 H new ATOM 0 HB2 LEU A 67 30.617 23.215 37.036 1.00 0.00 H new ATOM 0 HB3 LEU A 67 29.248 24.178 37.557 1.00 0.00 H new ATOM 0 HG LEU A 67 28.926 23.056 35.462 1.00 0.00 H new ATOM 0 HD11 LEU A 67 28.031 24.918 34.077 1.00 0.00 H new ATOM 0 HD12 LEU A 67 27.584 25.034 35.796 1.00 0.00 H new ATOM 0 HD13 LEU A 67 28.873 26.071 35.140 1.00 0.00 H new ATOM 0 HD21 LEU A 67 30.032 23.928 33.359 1.00 0.00 H new ATOM 0 HD22 LEU A 67 31.078 24.944 34.379 1.00 0.00 H new ATOM 0 HD23 LEU A 67 31.185 23.170 34.483 1.00 0.00 H new ATOM 1095 N ILE A 68 30.876 27.666 36.424 1.00 0.00 N ATOM 1096 CA ILE A 68 30.245 28.964 36.130 1.00 0.00 C ATOM 1097 C ILE A 68 29.995 29.080 34.617 1.00 0.00 C ATOM 1098 O ILE A 68 30.692 28.474 33.798 1.00 0.00 O ATOM 1099 CB ILE A 68 31.049 30.152 36.725 1.00 0.00 C ATOM 1100 CG1 ILE A 68 31.301 29.952 38.238 1.00 0.00 C ATOM 1101 CG2 ILE A 68 30.287 31.476 36.518 1.00 0.00 C ATOM 1102 CD1 ILE A 68 32.204 31.011 38.886 1.00 0.00 C ATOM 0 H ILE A 68 31.815 27.583 36.036 1.00 0.00 H new ATOM 0 HA ILE A 68 29.276 29.015 36.626 1.00 0.00 H new ATOM 0 HB ILE A 68 32.006 30.192 36.206 1.00 0.00 H new ATOM 0 HG12 ILE A 68 30.341 29.948 38.754 1.00 0.00 H new ATOM 0 HG13 ILE A 68 31.749 28.970 38.391 1.00 0.00 H new ATOM 0 HG21 ILE A 68 30.864 32.298 36.941 1.00 0.00 H new ATOM 0 HG22 ILE A 68 30.139 31.648 35.452 1.00 0.00 H new ATOM 0 HG23 ILE A 68 29.318 31.420 37.015 1.00 0.00 H new ATOM 0 HD11 ILE A 68 32.323 30.788 39.946 1.00 0.00 H new ATOM 0 HD12 ILE A 68 33.180 31.002 38.401 1.00 0.00 H new ATOM 0 HD13 ILE A 68 31.751 31.996 38.771 1.00 0.00 H new ATOM 1114 N LEU A 69 28.951 29.821 34.251 1.00 0.00 N ATOM 1115 CA LEU A 69 28.375 29.895 32.911 1.00 0.00 C ATOM 1116 C LEU A 69 27.812 31.288 32.590 1.00 0.00 C ATOM 1117 O LEU A 69 27.641 32.122 33.484 1.00 0.00 O ATOM 1118 CB LEU A 69 27.308 28.786 32.774 1.00 0.00 C ATOM 1119 CG LEU A 69 25.996 28.829 33.606 1.00 0.00 C ATOM 1120 CD1 LEU A 69 26.181 28.948 35.120 1.00 0.00 C ATOM 1121 CD2 LEU A 69 25.004 29.904 33.153 1.00 0.00 C ATOM 0 H LEU A 69 28.459 30.417 34.917 1.00 0.00 H new ATOM 0 HA LEU A 69 29.162 29.731 32.175 1.00 0.00 H new ATOM 0 HB2 LEU A 69 27.019 28.750 31.724 1.00 0.00 H new ATOM 0 HB3 LEU A 69 27.800 27.840 33.002 1.00 0.00 H new ATOM 0 HG LEU A 69 25.580 27.843 33.398 1.00 0.00 H new ATOM 0 HD11 LEU A 69 25.205 28.970 35.605 1.00 0.00 H new ATOM 0 HD12 LEU A 69 26.749 28.092 35.486 1.00 0.00 H new ATOM 0 HD13 LEU A 69 26.721 29.867 35.349 1.00 0.00 H new ATOM 0 HD21 LEU A 69 24.116 29.868 33.784 1.00 0.00 H new ATOM 0 HD22 LEU A 69 25.469 30.886 33.236 1.00 0.00 H new ATOM 0 HD23 LEU A 69 24.720 29.724 32.116 1.00 0.00 H new ATOM 1133 N GLU A 70 27.464 31.515 31.322 1.00 0.00 N ATOM 1134 CA GLU A 70 26.591 32.618 30.900 1.00 0.00 C ATOM 1135 C GLU A 70 25.727 32.203 29.694 1.00 0.00 C ATOM 1136 O GLU A 70 26.251 31.698 28.696 1.00 0.00 O ATOM 1137 CB GLU A 70 27.432 33.873 30.590 1.00 0.00 C ATOM 1138 CG GLU A 70 26.599 35.155 30.533 1.00 0.00 C ATOM 1139 CD GLU A 70 27.456 36.334 30.054 1.00 0.00 C ATOM 1140 OE1 GLU A 70 27.671 36.494 28.827 1.00 0.00 O ATOM 1141 OE2 GLU A 70 27.939 37.118 30.904 1.00 0.00 O ATOM 0 H GLU A 70 27.783 30.932 30.548 1.00 0.00 H new ATOM 0 HA GLU A 70 25.912 32.860 31.717 1.00 0.00 H new ATOM 0 HB2 GLU A 70 28.205 33.982 31.351 1.00 0.00 H new ATOM 0 HB3 GLU A 70 27.941 33.735 29.636 1.00 0.00 H new ATOM 0 HG2 GLU A 70 25.753 35.016 29.860 1.00 0.00 H new ATOM 0 HG3 GLU A 70 26.189 35.373 31.519 1.00 0.00 H new ATOM 1148 N VAL A 71 24.415 32.461 29.744 1.00 0.00 N ATOM 1149 CA VAL A 71 23.495 32.365 28.590 1.00 0.00 C ATOM 1150 C VAL A 71 23.174 33.771 28.100 1.00 0.00 C ATOM 1151 O VAL A 71 22.713 34.612 28.874 1.00 0.00 O ATOM 1152 CB VAL A 71 22.215 31.546 28.886 1.00 0.00 C ATOM 1153 CG1 VAL A 71 21.635 31.790 30.279 1.00 0.00 C ATOM 1154 CG2 VAL A 71 21.100 31.803 27.862 1.00 0.00 C ATOM 0 H VAL A 71 23.947 32.749 30.603 1.00 0.00 H new ATOM 0 HA VAL A 71 24.000 31.808 27.801 1.00 0.00 H new ATOM 0 HB VAL A 71 22.552 30.511 28.822 1.00 0.00 H new ATOM 0 HG11 VAL A 71 20.740 31.182 30.412 1.00 0.00 H new ATOM 0 HG12 VAL A 71 22.374 31.519 31.033 1.00 0.00 H new ATOM 0 HG13 VAL A 71 21.377 32.844 30.386 1.00 0.00 H new ATOM 0 HG21 VAL A 71 20.226 31.204 28.117 1.00 0.00 H new ATOM 0 HG22 VAL A 71 20.831 32.859 27.874 1.00 0.00 H new ATOM 0 HG23 VAL A 71 21.450 31.529 26.867 1.00 0.00 H new ATOM 1164 N SER A 72 23.421 34.036 26.818 1.00 0.00 N ATOM 1165 CA SER A 72 23.363 35.376 26.230 1.00 0.00 C ATOM 1166 C SER A 72 22.703 35.387 24.848 1.00 0.00 C ATOM 1167 O SER A 72 22.439 34.337 24.268 1.00 0.00 O ATOM 1168 CB SER A 72 24.767 36.003 26.203 1.00 0.00 C ATOM 1169 OG SER A 72 25.338 35.961 27.500 1.00 0.00 O ATOM 0 H SER A 72 23.672 33.312 26.145 1.00 0.00 H new ATOM 0 HA SER A 72 22.724 35.989 26.865 1.00 0.00 H new ATOM 0 HB2 SER A 72 25.402 35.465 25.499 1.00 0.00 H new ATOM 0 HB3 SER A 72 24.708 37.034 25.855 1.00 0.00 H new ATOM 0 HG SER A 72 26.271 36.257 27.456 1.00 0.00 H new ATOM 1175 N SER A 73 22.395 36.573 24.323 1.00 0.00 N ATOM 1176 CA SER A 73 21.702 36.760 23.038 1.00 0.00 C ATOM 1177 C SER A 73 22.575 37.447 21.981 1.00 0.00 C ATOM 1178 O SER A 73 23.758 37.705 22.206 1.00 0.00 O ATOM 1179 CB SER A 73 20.418 37.551 23.288 1.00 0.00 C ATOM 1180 OG SER A 73 20.736 38.876 23.659 1.00 0.00 O ATOM 0 H SER A 73 22.623 37.453 24.786 1.00 0.00 H new ATOM 0 HA SER A 73 21.467 35.777 22.631 1.00 0.00 H new ATOM 0 HB2 SER A 73 19.801 37.554 22.389 1.00 0.00 H new ATOM 0 HB3 SER A 73 19.834 37.074 24.075 1.00 0.00 H new ATOM 0 HG SER A 73 19.910 39.379 23.816 1.00 0.00 H new ATOM 1186 N SER A 74 21.995 37.802 20.831 1.00 0.00 N ATOM 1187 CA SER A 74 22.638 38.665 19.827 1.00 0.00 C ATOM 1188 C SER A 74 22.875 40.112 20.296 1.00 0.00 C ATOM 1189 O SER A 74 23.500 40.887 19.569 1.00 0.00 O ATOM 1190 CB SER A 74 21.829 38.632 18.526 1.00 0.00 C ATOM 1191 OG SER A 74 20.462 38.903 18.775 1.00 0.00 O ATOM 0 H SER A 74 21.058 37.498 20.565 1.00 0.00 H new ATOM 0 HA SER A 74 23.634 38.257 19.658 1.00 0.00 H new ATOM 0 HB2 SER A 74 22.228 39.366 17.826 1.00 0.00 H new ATOM 0 HB3 SER A 74 21.930 37.654 18.055 1.00 0.00 H new ATOM 0 HG SER A 74 19.965 38.879 17.931 1.00 0.00 H new ATOM 1197 N ASN A 75 22.427 40.490 21.500 1.00 0.00 N ATOM 1198 CA ASN A 75 22.797 41.742 22.166 1.00 0.00 C ATOM 1199 C ASN A 75 24.295 41.746 22.547 1.00 0.00 C ATOM 1200 O ASN A 75 24.942 40.699 22.607 1.00 0.00 O ATOM 1201 CB ASN A 75 21.877 41.907 23.394 1.00 0.00 C ATOM 1202 CG ASN A 75 21.956 43.251 24.103 1.00 0.00 C ATOM 1203 OD1 ASN A 75 22.458 44.248 23.603 1.00 0.00 O ATOM 1204 ND2 ASN A 75 21.497 43.312 25.326 1.00 0.00 N ATOM 0 H ASN A 75 21.783 39.920 22.049 1.00 0.00 H new ATOM 0 HA ASN A 75 22.660 42.591 21.496 1.00 0.00 H new ATOM 0 HB2 ASN A 75 20.847 41.744 23.077 1.00 0.00 H new ATOM 0 HB3 ASN A 75 22.117 41.123 24.113 1.00 0.00 H new ATOM 0 HD21 ASN A 75 21.560 44.184 25.851 1.00 0.00 H new ATOM 0 HD22 ASN A 75 21.076 42.488 25.754 1.00 0.00 H new ATOM 1211 N ALA A 76 24.837 42.917 22.887 1.00 0.00 N ATOM 1212 CA ALA A 76 26.211 43.107 23.370 1.00 0.00 C ATOM 1213 C ALA A 76 26.451 42.663 24.834 1.00 0.00 C ATOM 1214 O ALA A 76 27.564 42.798 25.351 1.00 0.00 O ATOM 1215 CB ALA A 76 26.553 44.588 23.176 1.00 0.00 C ATOM 0 H ALA A 76 24.315 43.792 22.833 1.00 0.00 H new ATOM 0 HA ALA A 76 26.868 42.458 22.792 1.00 0.00 H new ATOM 0 HB1 ALA A 76 27.569 44.775 23.523 1.00 0.00 H new ATOM 0 HB2 ALA A 76 26.478 44.843 22.119 1.00 0.00 H new ATOM 0 HB3 ALA A 76 25.856 45.200 23.748 1.00 0.00 H new ATOM 1221 N ARG A 77 25.406 42.183 25.527 1.00 0.00 N ATOM 1222 CA ARG A 77 25.414 41.807 26.951 1.00 0.00 C ATOM 1223 C ARG A 77 24.724 40.473 27.177 1.00 0.00 C ATOM 1224 O ARG A 77 25.462 39.461 27.197 1.00 0.00 O ATOM 1225 CB ARG A 77 24.781 42.933 27.794 1.00 0.00 C ATOM 1226 CG ARG A 77 25.635 44.208 27.869 1.00 0.00 C ATOM 1227 CD ARG A 77 26.919 44.037 28.688 1.00 0.00 C ATOM 1228 NE ARG A 77 26.610 43.828 30.110 1.00 0.00 N ATOM 1229 CZ ARG A 77 27.255 43.080 30.974 1.00 0.00 C ATOM 1230 NH1 ARG A 77 28.317 42.405 30.672 1.00 0.00 N ATOM 1231 NH2 ARG A 77 26.822 43.016 32.194 1.00 0.00 N ATOM 0 H ARG A 77 24.494 42.040 25.093 1.00 0.00 H new ATOM 0 HA ARG A 77 26.447 41.680 27.273 1.00 0.00 H new ATOM 0 HB2 ARG A 77 23.807 43.184 27.375 1.00 0.00 H new ATOM 0 HB3 ARG A 77 24.607 42.563 28.805 1.00 0.00 H new ATOM 0 HG2 ARG A 77 25.897 44.520 26.858 1.00 0.00 H new ATOM 0 HG3 ARG A 77 25.039 45.010 28.306 1.00 0.00 H new ATOM 0 HD2 ARG A 77 27.488 43.189 28.307 1.00 0.00 H new ATOM 0 HD3 ARG A 77 27.548 44.920 28.574 1.00 0.00 H new ATOM 0 HE ARG A 77 25.795 44.325 30.469 1.00 0.00 H new ATOM 0 HH11 ARG A 77 28.691 42.439 29.724 1.00 0.00 H new ATOM 0 HH12 ARG A 77 28.780 41.839 31.382 1.00 0.00 H new ATOM 0 HH21 ARG A 77 25.992 43.542 32.469 1.00 0.00 H new ATOM 0 HH22 ARG A 77 27.311 42.440 32.879 1.00 0.00 H new TER 1245 ARG A 77