USER MOD reduce.3.24.130724 H: found=0, std=0, add=959, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 957 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 83 ASN : amide:sc= -0.642 K(o=0.58,f=-3!) USER MOD Set 1.2: A 103 THR OG1 : rot 90:sc= 1.22 USER MOD Set 2.1: A 48 SER OG : rot 112:sc= 0.346 USER MOD Set 2.2: A 49 GLN : amide:sc= -7.19! C(o=-10!,f=-9!) USER MOD Set 2.3: A 50 ASN : amide:sc= -3.64! C(o=-10!,f=-11!) USER MOD Single : A 1 GLY N :NH3+ -137:sc= 0.0702 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= -0.93 K(o=-0.93,f=-0.17) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= -0.0599 K(o=-0.06,f=-1.8!) USER MOD Single : A 19 GLN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 20 MET CE :methyl 171:sc= 0 (180deg=-0.148) USER MOD Single : A 22 GLN : amide:sc= -1.08 K(o=-1.1,f=-2.2!) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ -175:sc= -0.248 (180deg=-0.295) USER MOD Single : A 59 LYS NZ :NH3+ -122:sc= -1.37! (180deg=-3.17!) USER MOD Single : A 62 GLN : amide:sc= -0.067 X(o=-0.067,f=0) USER MOD Single : A 65 SER OG : rot 120:sc= -1.11 USER MOD Single : A 71 GLN : amide:sc= -0.0185 X(o=-0.018,f=-0.0055) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 ASN : amide:sc= -0.415 X(o=-0.42,f=-0.031) USER MOD Single : A 78 GLN : amide:sc= 0.107 K(o=0.11,f=-2.2!) USER MOD Single : A 84 HIS : no HD1:sc= -0.129 X(o=-0.13,f=-0.032) USER MOD Single : A 85 THR OG1 : rot -6:sc= 1.07 USER MOD Single : A 89 GLN : amide:sc= -1.42 K(o=-1.4,f=-2.3) USER MOD Single : A 90 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 HIS : no HD1:sc= -3.15 X(o=-3.1,f=-2.9!) USER MOD Single : A 94 GLN : amide:sc= -0.134 K(o=-0.13,f=-2.1!) USER MOD Single : A 95 GLN : amide:sc= -1.18 X(o=-1.2,f=-1.6) USER MOD Single : A 101 GLN : amide:sc= -0.113 K(o=-0.11,f=-1.5!) USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0.0296 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 117 HIS : no HD1:sc= -0.386 X(o=-0.39,f=-0.064) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 180:sc= -0.0408 USER MOD Single : A 122 THR OG1 : rot -20:sc= 0.346 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 24.446 -3.820 -13.786 1.00 0.00 N ATOM 2 CA GLY A 1 23.072 -4.287 -13.743 1.00 0.00 C ATOM 3 C GLY A 1 22.574 -4.490 -12.326 1.00 0.00 C ATOM 4 O GLY A 1 23.218 -4.065 -11.367 1.00 0.00 O ATOM 0 H1 GLY A 1 24.534 -3.067 -14.497 1.00 0.00 H new ATOM 0 H2 GLY A 1 24.716 -3.448 -12.853 1.00 0.00 H new ATOM 0 H3 GLY A 1 25.073 -4.610 -14.039 1.00 0.00 H new ATOM 0 HA2 GLY A 1 22.430 -3.567 -14.251 1.00 0.00 H new ATOM 0 HA3 GLY A 1 22.993 -5.226 -14.291 1.00 0.00 H new ATOM 8 N SER A 2 21.422 -5.141 -12.193 1.00 0.00 N ATOM 9 CA SER A 2 20.834 -5.395 -10.883 1.00 0.00 C ATOM 10 C SER A 2 20.234 -6.796 -10.820 1.00 0.00 C ATOM 11 O SER A 2 20.193 -7.512 -11.820 1.00 0.00 O ATOM 12 CB SER A 2 19.758 -4.352 -10.573 1.00 0.00 C ATOM 13 OG SER A 2 19.565 -4.219 -9.175 1.00 0.00 O ATOM 0 H SER A 2 20.878 -5.502 -12.977 1.00 0.00 H new ATOM 0 HA SER A 2 21.625 -5.323 -10.136 1.00 0.00 H new ATOM 0 HB2 SER A 2 20.047 -3.390 -10.997 1.00 0.00 H new ATOM 0 HB3 SER A 2 18.820 -4.641 -11.047 1.00 0.00 H new ATOM 0 HG SER A 2 18.874 -3.546 -9.003 1.00 0.00 H new ATOM 19 N SER A 3 19.769 -7.180 -9.635 1.00 0.00 N ATOM 20 CA SER A 3 19.174 -8.497 -9.439 1.00 0.00 C ATOM 21 C SER A 3 17.709 -8.501 -9.865 1.00 0.00 C ATOM 22 O SER A 3 16.810 -8.347 -9.040 1.00 0.00 O ATOM 23 CB SER A 3 19.290 -8.919 -7.973 1.00 0.00 C ATOM 24 OG SER A 3 19.381 -10.328 -7.853 1.00 0.00 O ATOM 0 H SER A 3 19.793 -6.599 -8.797 1.00 0.00 H new ATOM 0 HA SER A 3 19.717 -9.209 -10.060 1.00 0.00 H new ATOM 0 HB2 SER A 3 20.170 -8.455 -7.527 1.00 0.00 H new ATOM 0 HB3 SER A 3 18.424 -8.559 -7.418 1.00 0.00 H new ATOM 0 HG SER A 3 19.456 -10.572 -6.907 1.00 0.00 H new ATOM 30 N GLY A 4 17.478 -8.677 -11.163 1.00 0.00 N ATOM 31 CA GLY A 4 16.121 -8.697 -11.678 1.00 0.00 C ATOM 32 C GLY A 4 16.025 -9.372 -13.032 1.00 0.00 C ATOM 33 O GLY A 4 16.799 -10.280 -13.337 1.00 0.00 O ATOM 0 H GLY A 4 18.206 -8.806 -11.866 1.00 0.00 H new ATOM 0 HA2 GLY A 4 15.475 -9.216 -10.970 1.00 0.00 H new ATOM 0 HA3 GLY A 4 15.751 -7.675 -11.758 1.00 0.00 H new ATOM 37 N SER A 5 15.073 -8.928 -13.847 1.00 0.00 N ATOM 38 CA SER A 5 14.875 -9.499 -15.174 1.00 0.00 C ATOM 39 C SER A 5 14.114 -8.531 -16.074 1.00 0.00 C ATOM 40 O SER A 5 13.090 -7.973 -15.678 1.00 0.00 O ATOM 41 CB SER A 5 14.117 -10.824 -15.075 1.00 0.00 C ATOM 42 OG SER A 5 14.444 -11.681 -16.155 1.00 0.00 O ATOM 0 H SER A 5 14.427 -8.175 -13.611 1.00 0.00 H new ATOM 0 HA SER A 5 15.856 -9.682 -15.613 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.358 -11.315 -14.132 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.044 -10.633 -15.070 1.00 0.00 H new ATOM 0 HG SER A 5 13.948 -12.522 -16.067 1.00 0.00 H new ATOM 48 N SER A 6 14.621 -8.336 -17.287 1.00 0.00 N ATOM 49 CA SER A 6 13.992 -7.432 -18.243 1.00 0.00 C ATOM 50 C SER A 6 12.474 -7.463 -18.101 1.00 0.00 C ATOM 51 O SER A 6 11.835 -6.427 -17.917 1.00 0.00 O ATOM 52 CB SER A 6 14.390 -7.810 -19.671 1.00 0.00 C ATOM 53 OG SER A 6 13.851 -6.894 -20.609 1.00 0.00 O ATOM 0 H SER A 6 15.466 -8.792 -17.631 1.00 0.00 H new ATOM 0 HA SER A 6 14.339 -6.420 -18.032 1.00 0.00 H new ATOM 0 HB2 SER A 6 15.476 -7.827 -19.757 1.00 0.00 H new ATOM 0 HB3 SER A 6 14.037 -8.816 -19.896 1.00 0.00 H new ATOM 0 HG SER A 6 14.121 -7.156 -21.514 1.00 0.00 H new ATOM 59 N GLY A 7 11.901 -8.660 -18.188 1.00 0.00 N ATOM 60 CA GLY A 7 10.462 -8.804 -18.067 1.00 0.00 C ATOM 61 C GLY A 7 10.053 -9.468 -16.768 1.00 0.00 C ATOM 62 O GLY A 7 10.890 -9.716 -15.898 1.00 0.00 O ATOM 0 H GLY A 7 12.408 -9.532 -18.340 1.00 0.00 H new ATOM 0 HA2 GLY A 7 9.995 -7.821 -18.132 1.00 0.00 H new ATOM 0 HA3 GLY A 7 10.087 -9.391 -18.905 1.00 0.00 H new ATOM 66 N LEU A 8 8.763 -9.755 -16.632 1.00 0.00 N ATOM 67 CA LEU A 8 8.244 -10.393 -15.427 1.00 0.00 C ATOM 68 C LEU A 8 8.633 -11.867 -15.381 1.00 0.00 C ATOM 69 O LEU A 8 9.504 -12.265 -14.609 1.00 0.00 O ATOM 70 CB LEU A 8 6.721 -10.254 -15.369 1.00 0.00 C ATOM 71 CG LEU A 8 6.188 -9.010 -14.659 1.00 0.00 C ATOM 72 CD1 LEU A 8 6.356 -9.140 -13.154 1.00 0.00 C ATOM 73 CD2 LEU A 8 6.892 -7.761 -15.170 1.00 0.00 C ATOM 0 H LEU A 8 8.057 -9.556 -17.341 1.00 0.00 H new ATOM 0 HA LEU A 8 8.682 -9.893 -14.563 1.00 0.00 H new ATOM 0 HB2 LEU A 8 6.337 -10.259 -16.389 1.00 0.00 H new ATOM 0 HB3 LEU A 8 6.314 -11.134 -14.871 1.00 0.00 H new ATOM 0 HG LEU A 8 5.124 -8.919 -14.878 1.00 0.00 H new ATOM 0 HD11 LEU A 8 5.971 -8.245 -12.666 1.00 0.00 H new ATOM 0 HD12 LEU A 8 5.805 -10.011 -12.800 1.00 0.00 H new ATOM 0 HD13 LEU A 8 7.413 -9.257 -12.915 1.00 0.00 H new ATOM 0 HD21 LEU A 8 6.500 -6.885 -14.653 1.00 0.00 H new ATOM 0 HD22 LEU A 8 7.962 -7.844 -14.982 1.00 0.00 H new ATOM 0 HD23 LEU A 8 6.719 -7.658 -16.241 1.00 0.00 H new ATOM 85 N GLY A 9 7.982 -12.673 -16.214 1.00 0.00 N ATOM 86 CA GLY A 9 8.276 -14.094 -16.253 1.00 0.00 C ATOM 87 C GLY A 9 7.158 -14.933 -15.667 1.00 0.00 C ATOM 88 O GLY A 9 5.982 -14.615 -15.832 1.00 0.00 O ATOM 0 H GLY A 9 7.256 -12.368 -16.862 1.00 0.00 H new ATOM 0 HA2 GLY A 9 8.451 -14.398 -17.285 1.00 0.00 H new ATOM 0 HA3 GLY A 9 9.197 -14.287 -15.703 1.00 0.00 H new ATOM 92 N ASN A 10 7.527 -16.010 -14.981 1.00 0.00 N ATOM 93 CA ASN A 10 6.546 -16.900 -14.370 1.00 0.00 C ATOM 94 C ASN A 10 5.370 -16.108 -13.807 1.00 0.00 C ATOM 95 O ASN A 10 4.225 -16.309 -14.210 1.00 0.00 O ATOM 96 CB ASN A 10 7.198 -17.725 -13.258 1.00 0.00 C ATOM 97 CG ASN A 10 8.505 -18.356 -13.698 1.00 0.00 C ATOM 98 OD1 ASN A 10 8.527 -19.477 -14.205 1.00 0.00 O ATOM 99 ND2 ASN A 10 9.604 -17.636 -13.503 1.00 0.00 N ATOM 0 H ASN A 10 8.498 -16.287 -14.834 1.00 0.00 H new ATOM 0 HA ASN A 10 6.172 -17.573 -15.142 1.00 0.00 H new ATOM 0 HB2 ASN A 10 7.379 -17.086 -12.394 1.00 0.00 H new ATOM 0 HB3 ASN A 10 6.510 -18.507 -12.938 1.00 0.00 H new ATOM 0 HD21 ASN A 10 10.513 -18.008 -13.777 1.00 0.00 H new ATOM 0 HD22 ASN A 10 9.539 -16.711 -13.079 1.00 0.00 H new ATOM 106 N GLU A 11 5.662 -15.207 -12.874 1.00 0.00 N ATOM 107 CA GLU A 11 4.628 -14.385 -12.256 1.00 0.00 C ATOM 108 C GLU A 11 4.628 -12.977 -12.844 1.00 0.00 C ATOM 109 O GLU A 11 5.684 -12.374 -13.037 1.00 0.00 O ATOM 110 CB GLU A 11 4.836 -14.318 -10.742 1.00 0.00 C ATOM 111 CG GLU A 11 6.160 -13.692 -10.337 1.00 0.00 C ATOM 112 CD GLU A 11 6.185 -13.271 -8.880 1.00 0.00 C ATOM 113 OE1 GLU A 11 5.097 -13.081 -8.298 1.00 0.00 O ATOM 114 OE2 GLU A 11 7.294 -13.131 -8.323 1.00 0.00 O ATOM 0 H GLU A 11 6.605 -15.028 -12.530 1.00 0.00 H new ATOM 0 HA GLU A 11 3.662 -14.846 -12.462 1.00 0.00 H new ATOM 0 HB2 GLU A 11 4.022 -13.746 -10.297 1.00 0.00 H new ATOM 0 HB3 GLU A 11 4.779 -15.326 -10.331 1.00 0.00 H new ATOM 0 HG2 GLU A 11 6.965 -14.404 -10.519 1.00 0.00 H new ATOM 0 HG3 GLU A 11 6.354 -12.823 -10.966 1.00 0.00 H new ATOM 121 N ASP A 12 3.438 -12.460 -13.127 1.00 0.00 N ATOM 122 CA ASP A 12 3.299 -11.123 -13.693 1.00 0.00 C ATOM 123 C ASP A 12 2.899 -10.117 -12.618 1.00 0.00 C ATOM 124 O ASP A 12 2.546 -10.495 -11.501 1.00 0.00 O ATOM 125 CB ASP A 12 2.263 -11.127 -14.817 1.00 0.00 C ATOM 126 CG ASP A 12 2.332 -12.382 -15.665 1.00 0.00 C ATOM 127 OD1 ASP A 12 3.376 -12.601 -16.315 1.00 0.00 O ATOM 128 OD2 ASP A 12 1.343 -13.144 -15.679 1.00 0.00 O ATOM 0 H ASP A 12 2.555 -12.947 -12.974 1.00 0.00 H new ATOM 0 HA ASP A 12 4.265 -10.826 -14.102 1.00 0.00 H new ATOM 0 HB2 ASP A 12 1.265 -11.037 -14.388 1.00 0.00 H new ATOM 0 HB3 ASP A 12 2.417 -10.254 -15.452 1.00 0.00 H new ATOM 133 N PHE A 13 2.958 -8.835 -12.964 1.00 0.00 N ATOM 134 CA PHE A 13 2.604 -7.775 -12.028 1.00 0.00 C ATOM 135 C PHE A 13 1.228 -8.025 -11.417 1.00 0.00 C ATOM 136 O PHE A 13 0.968 -7.653 -10.274 1.00 0.00 O ATOM 137 CB PHE A 13 2.621 -6.417 -12.733 1.00 0.00 C ATOM 138 CG PHE A 13 1.916 -5.334 -11.967 1.00 0.00 C ATOM 139 CD1 PHE A 13 2.146 -5.165 -10.611 1.00 0.00 C ATOM 140 CD2 PHE A 13 1.023 -4.487 -12.603 1.00 0.00 C ATOM 141 CE1 PHE A 13 1.499 -4.169 -9.903 1.00 0.00 C ATOM 142 CE2 PHE A 13 0.374 -3.489 -11.900 1.00 0.00 C ATOM 143 CZ PHE A 13 0.611 -3.331 -10.549 1.00 0.00 C ATOM 0 H PHE A 13 3.247 -8.506 -13.885 1.00 0.00 H new ATOM 0 HA PHE A 13 3.343 -7.771 -11.227 1.00 0.00 H new ATOM 0 HB2 PHE A 13 3.655 -6.117 -12.901 1.00 0.00 H new ATOM 0 HB3 PHE A 13 2.155 -6.520 -13.713 1.00 0.00 H new ATOM 0 HD1 PHE A 13 2.838 -5.819 -10.101 1.00 0.00 H new ATOM 0 HD2 PHE A 13 0.832 -4.608 -13.659 1.00 0.00 H new ATOM 0 HE1 PHE A 13 1.688 -4.046 -8.847 1.00 0.00 H new ATOM 0 HE2 PHE A 13 -0.318 -2.833 -12.407 1.00 0.00 H new ATOM 0 HZ PHE A 13 0.103 -2.553 -9.998 1.00 0.00 H new ATOM 153 N ASN A 14 0.351 -8.659 -12.189 1.00 0.00 N ATOM 154 CA ASN A 14 -0.999 -8.959 -11.725 1.00 0.00 C ATOM 155 C ASN A 14 -0.998 -10.165 -10.791 1.00 0.00 C ATOM 156 O ASN A 14 -1.840 -10.274 -9.900 1.00 0.00 O ATOM 157 CB ASN A 14 -1.923 -9.223 -12.915 1.00 0.00 C ATOM 158 CG ASN A 14 -2.235 -7.960 -13.696 1.00 0.00 C ATOM 159 OD1 ASN A 14 -3.280 -7.339 -13.501 1.00 0.00 O ATOM 160 ND2 ASN A 14 -1.328 -7.576 -14.586 1.00 0.00 N ATOM 0 H ASN A 14 0.551 -8.975 -13.138 1.00 0.00 H new ATOM 0 HA ASN A 14 -1.367 -8.094 -11.173 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -1.457 -9.952 -13.579 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -2.853 -9.666 -12.558 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -1.483 -6.735 -15.142 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -0.476 -8.122 -14.714 1.00 0.00 H new ATOM 167 N SER A 15 -0.045 -11.068 -11.000 1.00 0.00 N ATOM 168 CA SER A 15 0.065 -12.268 -10.180 1.00 0.00 C ATOM 169 C SER A 15 0.735 -11.954 -8.845 1.00 0.00 C ATOM 170 O SER A 15 0.270 -12.380 -7.788 1.00 0.00 O ATOM 171 CB SER A 15 0.857 -13.347 -10.920 1.00 0.00 C ATOM 172 OG SER A 15 0.457 -14.644 -10.511 1.00 0.00 O ATOM 0 H SER A 15 0.662 -10.991 -11.731 1.00 0.00 H new ATOM 0 HA SER A 15 -0.942 -12.637 -9.984 1.00 0.00 H new ATOM 0 HB2 SER A 15 0.708 -13.239 -11.994 1.00 0.00 H new ATOM 0 HB3 SER A 15 1.922 -13.215 -10.731 1.00 0.00 H new ATOM 0 HG SER A 15 0.977 -15.316 -11.000 1.00 0.00 H new ATOM 178 N VAL A 16 1.832 -11.205 -8.903 1.00 0.00 N ATOM 179 CA VAL A 16 2.567 -10.833 -7.700 1.00 0.00 C ATOM 180 C VAL A 16 1.650 -10.168 -6.680 1.00 0.00 C ATOM 181 O VAL A 16 1.630 -10.547 -5.508 1.00 0.00 O ATOM 182 CB VAL A 16 3.730 -9.878 -8.027 1.00 0.00 C ATOM 183 CG1 VAL A 16 3.237 -8.695 -8.847 1.00 0.00 C ATOM 184 CG2 VAL A 16 4.407 -9.406 -6.749 1.00 0.00 C ATOM 0 H VAL A 16 2.231 -10.844 -9.770 1.00 0.00 H new ATOM 0 HA VAL A 16 2.970 -11.753 -7.277 1.00 0.00 H new ATOM 0 HB VAL A 16 4.465 -10.420 -8.622 1.00 0.00 H new ATOM 0 HG11 VAL A 16 4.073 -8.032 -9.068 1.00 0.00 H new ATOM 0 HG12 VAL A 16 2.803 -9.055 -9.780 1.00 0.00 H new ATOM 0 HG13 VAL A 16 2.481 -8.150 -8.281 1.00 0.00 H new ATOM 0 HG21 VAL A 16 5.226 -8.732 -6.999 1.00 0.00 H new ATOM 0 HG22 VAL A 16 3.683 -8.881 -6.126 1.00 0.00 H new ATOM 0 HG23 VAL A 16 4.798 -10.266 -6.205 1.00 0.00 H new ATOM 194 N ILE A 17 0.891 -9.176 -7.132 1.00 0.00 N ATOM 195 CA ILE A 17 -0.030 -8.459 -6.258 1.00 0.00 C ATOM 196 C ILE A 17 -1.085 -9.398 -5.683 1.00 0.00 C ATOM 197 O ILE A 17 -1.369 -9.369 -4.486 1.00 0.00 O ATOM 198 CB ILE A 17 -0.734 -7.310 -7.003 1.00 0.00 C ATOM 199 CG1 ILE A 17 0.297 -6.310 -7.534 1.00 0.00 C ATOM 200 CG2 ILE A 17 -1.729 -6.615 -6.086 1.00 0.00 C ATOM 201 CD1 ILE A 17 1.050 -5.583 -6.442 1.00 0.00 C ATOM 0 H ILE A 17 0.895 -8.850 -8.099 1.00 0.00 H new ATOM 0 HA ILE A 17 0.566 -8.043 -5.445 1.00 0.00 H new ATOM 0 HB ILE A 17 -1.279 -7.726 -7.850 1.00 0.00 H new ATOM 0 HG12 ILE A 17 1.010 -6.837 -8.167 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -0.209 -5.579 -8.164 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -2.218 -5.805 -6.627 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -2.478 -7.333 -5.751 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -1.204 -6.208 -5.221 1.00 0.00 H new ATOM 0 HD11 ILE A 17 1.763 -4.891 -6.890 1.00 0.00 H new ATOM 0 HD12 ILE A 17 0.346 -5.028 -5.822 1.00 0.00 H new ATOM 0 HD13 ILE A 17 1.584 -6.306 -5.825 1.00 0.00 H new ATOM 213 N GLN A 18 -1.660 -10.232 -6.544 1.00 0.00 N ATOM 214 CA GLN A 18 -2.683 -11.181 -6.121 1.00 0.00 C ATOM 215 C GLN A 18 -2.116 -12.182 -5.120 1.00 0.00 C ATOM 216 O GLN A 18 -2.812 -12.621 -4.205 1.00 0.00 O ATOM 217 CB GLN A 18 -3.255 -11.920 -7.331 1.00 0.00 C ATOM 218 CG GLN A 18 -4.063 -11.030 -8.261 1.00 0.00 C ATOM 219 CD GLN A 18 -5.483 -10.814 -7.775 1.00 0.00 C ATOM 220 OE1 GLN A 18 -5.940 -11.478 -6.844 1.00 0.00 O ATOM 221 NE2 GLN A 18 -6.189 -9.882 -8.403 1.00 0.00 N ATOM 0 H GLN A 18 -1.435 -10.270 -7.538 1.00 0.00 H new ATOM 0 HA GLN A 18 -3.483 -10.622 -5.635 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -2.436 -12.369 -7.892 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -3.888 -12.736 -6.982 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -3.565 -10.065 -8.357 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -4.087 -11.477 -9.255 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -5.770 -9.355 -9.170 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -7.150 -9.692 -8.119 1.00 0.00 H new ATOM 230 N GLN A 19 -0.848 -12.538 -5.300 1.00 0.00 N ATOM 231 CA GLN A 19 -0.188 -13.489 -4.413 1.00 0.00 C ATOM 232 C GLN A 19 0.090 -12.860 -3.052 1.00 0.00 C ATOM 233 O GLN A 19 0.018 -13.530 -2.022 1.00 0.00 O ATOM 234 CB GLN A 19 1.119 -13.980 -5.038 1.00 0.00 C ATOM 235 CG GLN A 19 0.916 -14.956 -6.185 1.00 0.00 C ATOM 236 CD GLN A 19 0.935 -16.402 -5.731 1.00 0.00 C ATOM 237 OE1 GLN A 19 0.214 -16.785 -4.809 1.00 0.00 O ATOM 238 NE2 GLN A 19 1.763 -17.215 -6.378 1.00 0.00 N ATOM 0 H GLN A 19 -0.257 -12.182 -6.052 1.00 0.00 H new ATOM 0 HA GLN A 19 -0.856 -14.339 -4.271 1.00 0.00 H new ATOM 0 HB2 GLN A 19 1.685 -13.121 -5.399 1.00 0.00 H new ATOM 0 HB3 GLN A 19 1.723 -14.459 -4.267 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -0.036 -14.745 -6.673 1.00 0.00 H new ATOM 0 HG3 GLN A 19 1.697 -14.803 -6.930 1.00 0.00 H new ATOM 0 HE21 GLN A 19 2.342 -16.855 -7.136 1.00 0.00 H new ATOM 0 HE22 GLN A 19 1.819 -18.199 -6.117 1.00 0.00 H new ATOM 247 N MET A 20 0.407 -11.570 -3.055 1.00 0.00 N ATOM 248 CA MET A 20 0.695 -10.851 -1.819 1.00 0.00 C ATOM 249 C MET A 20 -0.589 -10.553 -1.052 1.00 0.00 C ATOM 250 O MET A 20 -0.603 -10.557 0.179 1.00 0.00 O ATOM 251 CB MET A 20 1.435 -9.547 -2.123 1.00 0.00 C ATOM 252 CG MET A 20 2.724 -9.748 -2.904 1.00 0.00 C ATOM 253 SD MET A 20 3.121 -8.343 -3.962 1.00 0.00 S ATOM 254 CE MET A 20 3.868 -7.227 -2.777 1.00 0.00 C ATOM 0 H MET A 20 0.471 -11.001 -3.899 1.00 0.00 H new ATOM 0 HA MET A 20 1.329 -11.484 -1.199 1.00 0.00 H new ATOM 0 HB2 MET A 20 0.776 -8.888 -2.688 1.00 0.00 H new ATOM 0 HB3 MET A 20 1.663 -9.041 -1.185 1.00 0.00 H new ATOM 0 HG2 MET A 20 3.545 -9.916 -2.206 1.00 0.00 H new ATOM 0 HG3 MET A 20 2.637 -10.646 -3.516 1.00 0.00 H new ATOM 0 HE1 MET A 20 4.310 -6.381 -3.303 1.00 0.00 H new ATOM 0 HE2 MET A 20 3.106 -6.867 -2.086 1.00 0.00 H new ATOM 0 HE3 MET A 20 4.643 -7.753 -2.220 1.00 0.00 H new ATOM 264 N ALA A 21 -1.666 -10.295 -1.787 1.00 0.00 N ATOM 265 CA ALA A 21 -2.955 -9.997 -1.175 1.00 0.00 C ATOM 266 C ALA A 21 -3.526 -11.224 -0.473 1.00 0.00 C ATOM 267 O ALA A 21 -4.224 -11.105 0.534 1.00 0.00 O ATOM 268 CB ALA A 21 -3.931 -9.484 -2.223 1.00 0.00 C ATOM 0 H ALA A 21 -1.671 -10.286 -2.807 1.00 0.00 H new ATOM 0 HA ALA A 21 -2.803 -9.220 -0.426 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -4.889 -9.266 -1.752 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -3.534 -8.576 -2.676 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -4.070 -10.243 -2.993 1.00 0.00 H new ATOM 274 N GLN A 22 -3.226 -12.401 -1.011 1.00 0.00 N ATOM 275 CA GLN A 22 -3.712 -13.650 -0.436 1.00 0.00 C ATOM 276 C GLN A 22 -5.235 -13.658 -0.359 1.00 0.00 C ATOM 277 O GLN A 22 -5.813 -13.985 0.677 1.00 0.00 O ATOM 278 CB GLN A 22 -3.118 -13.859 0.958 1.00 0.00 C ATOM 279 CG GLN A 22 -1.610 -13.674 1.011 1.00 0.00 C ATOM 280 CD GLN A 22 -0.854 -14.949 0.696 1.00 0.00 C ATOM 281 OE1 GLN A 22 -1.389 -16.051 0.828 1.00 0.00 O ATOM 282 NE2 GLN A 22 0.397 -14.808 0.275 1.00 0.00 N ATOM 0 H GLN A 22 -2.649 -12.516 -1.844 1.00 0.00 H new ATOM 0 HA GLN A 22 -3.395 -14.467 -1.085 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -3.586 -13.160 1.652 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -3.365 -14.863 1.302 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -1.318 -12.899 0.303 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -1.326 -13.323 2.003 1.00 0.00 H new ATOM 0 HE21 GLN A 22 0.801 -13.876 0.180 1.00 0.00 H new ATOM 0 HE22 GLN A 22 0.954 -15.631 0.047 1.00 0.00 H new ATOM 291 N GLY A 23 -5.880 -13.294 -1.463 1.00 0.00 N ATOM 292 CA GLY A 23 -7.331 -13.265 -1.499 1.00 0.00 C ATOM 293 C GLY A 23 -7.894 -11.918 -1.094 1.00 0.00 C ATOM 294 O GLY A 23 -8.921 -11.484 -1.617 1.00 0.00 O ATOM 0 H GLY A 23 -5.424 -13.019 -2.333 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -7.671 -13.510 -2.505 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.723 -14.034 -0.834 1.00 0.00 H new ATOM 298 N ARG A 24 -7.223 -11.255 -0.157 1.00 0.00 N ATOM 299 CA ARG A 24 -7.665 -9.950 0.320 1.00 0.00 C ATOM 300 C ARG A 24 -8.038 -9.042 -0.848 1.00 0.00 C ATOM 301 O ARG A 24 -7.307 -8.951 -1.834 1.00 0.00 O ATOM 302 CB ARG A 24 -6.570 -9.293 1.161 1.00 0.00 C ATOM 303 CG ARG A 24 -6.434 -9.885 2.554 1.00 0.00 C ATOM 304 CD ARG A 24 -5.267 -9.269 3.310 1.00 0.00 C ATOM 305 NE ARG A 24 -4.008 -9.951 3.025 1.00 0.00 N ATOM 306 CZ ARG A 24 -2.818 -9.473 3.370 1.00 0.00 C ATOM 307 NH1 ARG A 24 -2.726 -8.315 4.010 1.00 0.00 N ATOM 308 NH2 ARG A 24 -1.717 -10.152 3.075 1.00 0.00 N ATOM 0 H ARG A 24 -6.372 -11.600 0.286 1.00 0.00 H new ATOM 0 HA ARG A 24 -8.550 -10.098 0.940 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -5.617 -9.389 0.640 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -6.780 -8.227 1.247 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -7.356 -9.722 3.111 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -6.292 -10.963 2.480 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -5.177 -8.216 3.042 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -5.467 -9.310 4.381 1.00 0.00 H new ATOM 0 HE ARG A 24 -4.044 -10.844 2.534 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -3.570 -7.790 4.238 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -1.811 -7.950 4.274 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -1.784 -11.043 2.582 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -0.804 -9.783 3.341 1.00 0.00 H new ATOM 322 N GLN A 25 -9.180 -8.372 -0.729 1.00 0.00 N ATOM 323 CA GLN A 25 -9.650 -7.472 -1.775 1.00 0.00 C ATOM 324 C GLN A 25 -8.683 -6.307 -1.967 1.00 0.00 C ATOM 325 O GLN A 25 -8.511 -5.478 -1.073 1.00 0.00 O ATOM 326 CB GLN A 25 -11.044 -6.942 -1.434 1.00 0.00 C ATOM 327 CG GLN A 25 -11.503 -5.811 -2.340 1.00 0.00 C ATOM 328 CD GLN A 25 -12.824 -5.211 -1.900 1.00 0.00 C ATOM 329 OE1 GLN A 25 -13.682 -5.904 -1.352 1.00 0.00 O ATOM 330 NE2 GLN A 25 -12.995 -3.916 -2.137 1.00 0.00 N ATOM 0 H GLN A 25 -9.796 -8.436 0.081 1.00 0.00 H new ATOM 0 HA GLN A 25 -9.701 -8.035 -2.707 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -11.761 -7.761 -1.498 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -11.049 -6.594 -0.401 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -10.741 -5.031 -2.356 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -11.599 -6.184 -3.360 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -12.258 -3.379 -2.594 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -13.864 -3.458 -1.862 1.00 0.00 H new ATOM 339 N ILE A 26 -8.056 -6.252 -3.136 1.00 0.00 N ATOM 340 CA ILE A 26 -7.107 -5.189 -3.444 1.00 0.00 C ATOM 341 C ILE A 26 -7.828 -3.927 -3.906 1.00 0.00 C ATOM 342 O ILE A 26 -8.854 -3.998 -4.580 1.00 0.00 O ATOM 343 CB ILE A 26 -6.108 -5.624 -4.532 1.00 0.00 C ATOM 344 CG1 ILE A 26 -5.466 -6.962 -4.161 1.00 0.00 C ATOM 345 CG2 ILE A 26 -5.043 -4.556 -4.730 1.00 0.00 C ATOM 346 CD1 ILE A 26 -5.058 -7.790 -5.359 1.00 0.00 C ATOM 0 H ILE A 26 -8.188 -6.931 -3.886 1.00 0.00 H new ATOM 0 HA ILE A 26 -6.560 -4.977 -2.525 1.00 0.00 H new ATOM 0 HB ILE A 26 -6.648 -5.750 -5.471 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -4.588 -6.775 -3.543 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -6.167 -7.536 -3.555 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -4.344 -4.878 -5.502 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -5.516 -3.623 -5.035 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -4.505 -4.401 -3.795 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -4.610 -8.724 -5.020 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -5.936 -8.008 -5.967 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -4.333 -7.235 -5.955 1.00 0.00 H new ATOM 358 N GLU A 27 -7.280 -2.772 -3.540 1.00 0.00 N ATOM 359 CA GLU A 27 -7.871 -1.493 -3.918 1.00 0.00 C ATOM 360 C GLU A 27 -6.794 -0.505 -4.357 1.00 0.00 C ATOM 361 O GLU A 27 -5.786 -0.324 -3.673 1.00 0.00 O ATOM 362 CB GLU A 27 -8.668 -0.909 -2.750 1.00 0.00 C ATOM 363 CG GLU A 27 -10.122 -1.353 -2.723 1.00 0.00 C ATOM 364 CD GLU A 27 -10.952 -0.696 -3.809 1.00 0.00 C ATOM 365 OE1 GLU A 27 -10.439 -0.548 -4.939 1.00 0.00 O ATOM 366 OE2 GLU A 27 -12.113 -0.331 -3.531 1.00 0.00 O ATOM 0 H GLU A 27 -6.429 -2.696 -2.983 1.00 0.00 H new ATOM 0 HA GLU A 27 -8.545 -1.667 -4.757 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -8.191 -1.199 -1.814 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -8.630 0.179 -2.803 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -10.170 -2.436 -2.839 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -10.552 -1.118 -1.749 1.00 0.00 H new ATOM 373 N TYR A 28 -7.014 0.130 -5.503 1.00 0.00 N ATOM 374 CA TYR A 28 -6.062 1.097 -6.036 1.00 0.00 C ATOM 375 C TYR A 28 -6.339 2.493 -5.487 1.00 0.00 C ATOM 376 O TYR A 28 -7.310 3.143 -5.876 1.00 0.00 O ATOM 377 CB TYR A 28 -6.124 1.116 -7.564 1.00 0.00 C ATOM 378 CG TYR A 28 -5.736 -0.199 -8.202 1.00 0.00 C ATOM 379 CD1 TYR A 28 -6.592 -1.292 -8.163 1.00 0.00 C ATOM 380 CD2 TYR A 28 -4.512 -0.348 -8.844 1.00 0.00 C ATOM 381 CE1 TYR A 28 -6.241 -2.495 -8.744 1.00 0.00 C ATOM 382 CE2 TYR A 28 -4.154 -1.547 -9.429 1.00 0.00 C ATOM 383 CZ TYR A 28 -5.021 -2.618 -9.376 1.00 0.00 C ATOM 384 OH TYR A 28 -4.669 -3.814 -9.957 1.00 0.00 O ATOM 0 H TYR A 28 -7.843 -0.008 -6.081 1.00 0.00 H new ATOM 0 HA TYR A 28 -5.062 0.795 -5.723 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -7.136 1.377 -7.875 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -5.464 1.900 -7.936 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -7.548 -1.200 -7.670 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -3.829 0.488 -8.886 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -6.918 -3.335 -8.704 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -3.200 -1.645 -9.925 1.00 0.00 H new ATOM 0 HH TYR A 28 -3.780 -3.733 -10.360 1.00 0.00 H new ATOM 394 N ILE A 29 -5.479 2.948 -4.582 1.00 0.00 N ATOM 395 CA ILE A 29 -5.629 4.267 -3.981 1.00 0.00 C ATOM 396 C ILE A 29 -4.938 5.336 -4.821 1.00 0.00 C ATOM 397 O ILE A 29 -3.778 5.186 -5.203 1.00 0.00 O ATOM 398 CB ILE A 29 -5.056 4.303 -2.552 1.00 0.00 C ATOM 399 CG1 ILE A 29 -5.415 3.019 -1.802 1.00 0.00 C ATOM 400 CG2 ILE A 29 -5.574 5.523 -1.804 1.00 0.00 C ATOM 401 CD1 ILE A 29 -6.900 2.851 -1.570 1.00 0.00 C ATOM 0 H ILE A 29 -4.671 2.422 -4.249 1.00 0.00 H new ATOM 0 HA ILE A 29 -6.698 4.475 -3.940 1.00 0.00 H new ATOM 0 HB ILE A 29 -3.970 4.373 -2.614 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -5.044 2.163 -2.365 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -4.902 3.014 -0.840 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -5.160 5.534 -0.796 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -5.272 6.428 -2.331 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -6.662 5.481 -1.749 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -7.081 1.920 -1.033 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -7.273 3.688 -0.980 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -7.417 2.824 -2.529 1.00 0.00 H new ATOM 413 N ASP A 30 -5.659 6.416 -5.104 1.00 0.00 N ATOM 414 CA ASP A 30 -5.115 7.512 -5.897 1.00 0.00 C ATOM 415 C ASP A 30 -4.965 8.772 -5.050 1.00 0.00 C ATOM 416 O ASP A 30 -5.954 9.419 -4.703 1.00 0.00 O ATOM 417 CB ASP A 30 -6.015 7.795 -7.101 1.00 0.00 C ATOM 418 CG ASP A 30 -5.593 9.038 -7.859 1.00 0.00 C ATOM 419 OD1 ASP A 30 -4.758 8.917 -8.779 1.00 0.00 O ATOM 420 OD2 ASP A 30 -6.098 10.133 -7.532 1.00 0.00 O ATOM 0 H ASP A 30 -6.621 6.555 -4.796 1.00 0.00 H new ATOM 0 HA ASP A 30 -4.128 7.216 -6.254 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -5.996 6.938 -7.775 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -7.044 7.911 -6.762 1.00 0.00 H new ATOM 425 N ILE A 31 -3.724 9.114 -4.722 1.00 0.00 N ATOM 426 CA ILE A 31 -3.446 10.297 -3.916 1.00 0.00 C ATOM 427 C ILE A 31 -2.832 11.407 -4.763 1.00 0.00 C ATOM 428 O ILE A 31 -1.934 11.162 -5.568 1.00 0.00 O ATOM 429 CB ILE A 31 -2.495 9.972 -2.749 1.00 0.00 C ATOM 430 CG1 ILE A 31 -3.174 9.022 -1.760 1.00 0.00 C ATOM 431 CG2 ILE A 31 -2.060 11.251 -2.049 1.00 0.00 C ATOM 432 CD1 ILE A 31 -2.201 8.291 -0.860 1.00 0.00 C ATOM 0 H ILE A 31 -2.895 8.589 -5.002 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.400 10.636 -3.513 1.00 0.00 H new ATOM 0 HB ILE A 31 -1.608 9.479 -3.148 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -3.871 9.590 -1.143 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -3.762 8.291 -2.316 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -1.388 11.005 -1.227 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -1.543 11.897 -2.759 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -2.936 11.769 -1.659 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -2.752 7.636 -0.185 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -1.520 7.696 -1.468 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -1.630 9.014 -0.278 1.00 0.00 H new ATOM 444 N GLU A 32 -3.322 12.628 -4.574 1.00 0.00 N ATOM 445 CA GLU A 32 -2.820 13.776 -5.320 1.00 0.00 C ATOM 446 C GLU A 32 -1.816 14.569 -4.488 1.00 0.00 C ATOM 447 O GLU A 32 -2.192 15.464 -3.730 1.00 0.00 O ATOM 448 CB GLU A 32 -3.977 14.683 -5.743 1.00 0.00 C ATOM 449 CG GLU A 32 -4.567 14.325 -7.098 1.00 0.00 C ATOM 450 CD GLU A 32 -5.675 15.270 -7.519 1.00 0.00 C ATOM 451 OE1 GLU A 32 -5.508 16.495 -7.350 1.00 0.00 O ATOM 452 OE2 GLU A 32 -6.711 14.782 -8.019 1.00 0.00 O ATOM 0 H GLU A 32 -4.066 12.848 -3.911 1.00 0.00 H new ATOM 0 HA GLU A 32 -2.314 13.404 -6.211 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -4.762 14.631 -4.989 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -3.628 15.715 -5.769 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -3.777 14.339 -7.849 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -4.956 13.307 -7.063 1.00 0.00 H new ATOM 459 N ARG A 33 -0.539 14.234 -4.635 1.00 0.00 N ATOM 460 CA ARG A 33 0.519 14.913 -3.896 1.00 0.00 C ATOM 461 C ARG A 33 0.255 16.414 -3.824 1.00 0.00 C ATOM 462 O ARG A 33 0.445 17.150 -4.793 1.00 0.00 O ATOM 463 CB ARG A 33 1.876 14.654 -4.553 1.00 0.00 C ATOM 464 CG ARG A 33 2.590 13.426 -4.013 1.00 0.00 C ATOM 465 CD ARG A 33 3.483 13.774 -2.832 1.00 0.00 C ATOM 466 NE ARG A 33 4.294 14.960 -3.091 1.00 0.00 N ATOM 467 CZ ARG A 33 4.794 15.733 -2.133 1.00 0.00 C ATOM 468 NH1 ARG A 33 4.566 15.445 -0.859 1.00 0.00 N ATOM 469 NH2 ARG A 33 5.523 16.795 -2.448 1.00 0.00 N ATOM 0 H ARG A 33 -0.211 13.497 -5.259 1.00 0.00 H new ATOM 0 HA ARG A 33 0.532 14.515 -2.881 1.00 0.00 H new ATOM 0 HB2 ARG A 33 1.734 14.538 -5.627 1.00 0.00 H new ATOM 0 HB3 ARG A 33 2.513 15.527 -4.408 1.00 0.00 H new ATOM 0 HG2 ARG A 33 1.855 12.682 -3.707 1.00 0.00 H new ATOM 0 HG3 ARG A 33 3.190 12.976 -4.804 1.00 0.00 H new ATOM 0 HD2 ARG A 33 2.867 13.942 -1.949 1.00 0.00 H new ATOM 0 HD3 ARG A 33 4.136 12.930 -2.610 1.00 0.00 H new ATOM 0 HE ARG A 33 4.487 15.209 -4.061 1.00 0.00 H new ATOM 0 HH11 ARG A 33 4.006 14.629 -0.613 1.00 0.00 H new ATOM 0 HH12 ARG A 33 4.951 16.040 -0.125 1.00 0.00 H new ATOM 0 HH21 ARG A 33 5.701 17.020 -3.427 1.00 0.00 H new ATOM 0 HH22 ARG A 33 5.906 17.387 -1.711 1.00 0.00 H new ATOM 483 N PRO A 34 -0.195 16.880 -2.650 1.00 0.00 N ATOM 484 CA PRO A 34 -0.495 18.297 -2.423 1.00 0.00 C ATOM 485 C PRO A 34 0.763 19.159 -2.395 1.00 0.00 C ATOM 486 O PRO A 34 1.855 18.689 -2.713 1.00 0.00 O ATOM 487 CB PRO A 34 -1.176 18.300 -1.052 1.00 0.00 C ATOM 488 CG PRO A 34 -0.660 17.081 -0.370 1.00 0.00 C ATOM 489 CD PRO A 34 -0.445 16.060 -1.452 1.00 0.00 C ATOM 0 HA PRO A 34 -1.109 18.716 -3.220 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -0.931 19.201 -0.490 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -2.261 18.270 -1.149 1.00 0.00 H new ATOM 0 HG2 PRO A 34 0.270 17.293 0.157 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -1.371 16.719 0.372 1.00 0.00 H new ATOM 0 HD2 PRO A 34 0.400 15.408 -1.228 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -1.317 15.419 -1.579 1.00 0.00 H new ATOM 497 N SER A 35 0.601 20.421 -2.012 1.00 0.00 N ATOM 498 CA SER A 35 1.724 21.350 -1.946 1.00 0.00 C ATOM 499 C SER A 35 1.943 21.836 -0.517 1.00 0.00 C ATOM 500 O SER A 35 3.073 21.879 -0.028 1.00 0.00 O ATOM 501 CB SER A 35 1.481 22.544 -2.871 1.00 0.00 C ATOM 502 OG SER A 35 1.311 22.122 -4.214 1.00 0.00 O ATOM 0 H SER A 35 -0.296 20.824 -1.743 1.00 0.00 H new ATOM 0 HA SER A 35 2.620 20.822 -2.274 1.00 0.00 H new ATOM 0 HB2 SER A 35 0.596 23.088 -2.543 1.00 0.00 H new ATOM 0 HB3 SER A 35 2.322 23.235 -2.807 1.00 0.00 H new ATOM 0 HG SER A 35 1.155 22.903 -4.785 1.00 0.00 H new ATOM 508 N THR A 36 0.853 22.202 0.151 1.00 0.00 N ATOM 509 CA THR A 36 0.924 22.686 1.524 1.00 0.00 C ATOM 510 C THR A 36 1.653 21.692 2.421 1.00 0.00 C ATOM 511 O THR A 36 2.504 22.073 3.223 1.00 0.00 O ATOM 512 CB THR A 36 -0.480 22.948 2.101 1.00 0.00 C ATOM 513 OG1 THR A 36 -0.381 23.325 3.479 1.00 0.00 O ATOM 514 CG2 THR A 36 -1.357 21.712 1.970 1.00 0.00 C ATOM 0 H THR A 36 -0.090 22.172 -0.237 1.00 0.00 H new ATOM 0 HA THR A 36 1.479 23.624 1.500 1.00 0.00 H new ATOM 0 HB THR A 36 -0.936 23.760 1.535 1.00 0.00 H new ATOM 0 HG1 THR A 36 -1.278 23.491 3.838 1.00 0.00 H new ATOM 0 HG21 THR A 36 -2.344 21.920 2.384 1.00 0.00 H new ATOM 0 HG22 THR A 36 -1.454 21.445 0.918 1.00 0.00 H new ATOM 0 HG23 THR A 36 -0.903 20.884 2.514 1.00 0.00 H new ATOM 522 N GLY A 37 1.313 20.414 2.278 1.00 0.00 N ATOM 523 CA GLY A 37 1.946 19.385 3.082 1.00 0.00 C ATOM 524 C GLY A 37 2.516 18.260 2.240 1.00 0.00 C ATOM 525 O GLY A 37 3.436 18.471 1.451 1.00 0.00 O ATOM 0 H GLY A 37 0.611 20.074 1.620 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.744 19.831 3.675 1.00 0.00 H new ATOM 0 HA3 GLY A 37 1.218 18.977 3.783 1.00 0.00 H new ATOM 529 N GLY A 38 1.969 17.060 2.409 1.00 0.00 N ATOM 530 CA GLY A 38 2.443 15.916 1.653 1.00 0.00 C ATOM 531 C GLY A 38 1.416 14.803 1.580 1.00 0.00 C ATOM 532 O GLY A 38 0.224 15.035 1.784 1.00 0.00 O ATOM 0 H GLY A 38 1.206 16.860 3.056 1.00 0.00 H new ATOM 0 HA2 GLY A 38 2.702 16.234 0.643 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.356 15.535 2.111 1.00 0.00 H new ATOM 536 N LEU A 39 1.878 13.593 1.288 1.00 0.00 N ATOM 537 CA LEU A 39 0.990 12.439 1.186 1.00 0.00 C ATOM 538 C LEU A 39 -0.091 12.488 2.261 1.00 0.00 C ATOM 539 O LEU A 39 -1.175 11.931 2.091 1.00 0.00 O ATOM 540 CB LEU A 39 1.791 11.142 1.311 1.00 0.00 C ATOM 541 CG LEU A 39 3.241 11.199 0.828 1.00 0.00 C ATOM 542 CD1 LEU A 39 3.863 9.811 0.843 1.00 0.00 C ATOM 543 CD2 LEU A 39 3.314 11.803 -0.567 1.00 0.00 C ATOM 0 H LEU A 39 2.862 13.384 1.118 1.00 0.00 H new ATOM 0 HA LEU A 39 0.507 12.468 0.209 1.00 0.00 H new ATOM 0 HB2 LEU A 39 1.789 10.837 2.357 1.00 0.00 H new ATOM 0 HB3 LEU A 39 1.273 10.363 0.751 1.00 0.00 H new ATOM 0 HG LEU A 39 3.807 11.836 1.508 1.00 0.00 H new ATOM 0 HD11 LEU A 39 4.895 9.871 0.496 1.00 0.00 H new ATOM 0 HD12 LEU A 39 3.844 9.415 1.858 1.00 0.00 H new ATOM 0 HD13 LEU A 39 3.297 9.151 0.185 1.00 0.00 H new ATOM 0 HD21 LEU A 39 4.353 11.836 -0.895 1.00 0.00 H new ATOM 0 HD22 LEU A 39 2.734 11.192 -1.259 1.00 0.00 H new ATOM 0 HD23 LEU A 39 2.907 12.814 -0.547 1.00 0.00 H new ATOM 555 N GLY A 40 0.211 13.161 3.368 1.00 0.00 N ATOM 556 CA GLY A 40 -0.746 13.272 4.453 1.00 0.00 C ATOM 557 C GLY A 40 -0.932 11.965 5.198 1.00 0.00 C ATOM 558 O GLY A 40 -1.852 11.827 6.004 1.00 0.00 O ATOM 0 H GLY A 40 1.101 13.631 3.532 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -0.412 14.040 5.151 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -1.706 13.599 4.054 1.00 0.00 H new ATOM 562 N PHE A 41 -0.058 11.001 4.927 1.00 0.00 N ATOM 563 CA PHE A 41 -0.132 9.697 5.576 1.00 0.00 C ATOM 564 C PHE A 41 1.257 9.080 5.716 1.00 0.00 C ATOM 565 O PHE A 41 2.129 9.291 4.874 1.00 0.00 O ATOM 566 CB PHE A 41 -1.042 8.759 4.780 1.00 0.00 C ATOM 567 CG PHE A 41 -0.336 8.046 3.662 1.00 0.00 C ATOM 568 CD1 PHE A 41 -0.256 8.615 2.401 1.00 0.00 C ATOM 569 CD2 PHE A 41 0.246 6.806 3.872 1.00 0.00 C ATOM 570 CE1 PHE A 41 0.392 7.961 1.370 1.00 0.00 C ATOM 571 CE2 PHE A 41 0.896 6.148 2.845 1.00 0.00 C ATOM 572 CZ PHE A 41 0.968 6.726 1.592 1.00 0.00 C ATOM 0 H PHE A 41 0.710 11.098 4.262 1.00 0.00 H new ATOM 0 HA PHE A 41 -0.550 9.838 6.573 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -1.471 8.021 5.457 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -1.871 9.334 4.368 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -0.705 9.581 2.222 1.00 0.00 H new ATOM 0 HD2 PHE A 41 0.191 6.349 4.849 1.00 0.00 H new ATOM 0 HE1 PHE A 41 0.448 8.416 0.392 1.00 0.00 H new ATOM 0 HE2 PHE A 41 1.347 5.183 3.022 1.00 0.00 H new ATOM 0 HZ PHE A 41 1.474 6.213 0.788 1.00 0.00 H new ATOM 582 N SER A 42 1.453 8.316 6.786 1.00 0.00 N ATOM 583 CA SER A 42 2.736 7.671 7.040 1.00 0.00 C ATOM 584 C SER A 42 2.628 6.160 6.863 1.00 0.00 C ATOM 585 O SER A 42 1.535 5.619 6.697 1.00 0.00 O ATOM 586 CB SER A 42 3.224 7.998 8.453 1.00 0.00 C ATOM 587 OG SER A 42 3.895 9.245 8.485 1.00 0.00 O ATOM 0 H SER A 42 0.740 8.129 7.491 1.00 0.00 H new ATOM 0 HA SER A 42 3.457 8.053 6.317 1.00 0.00 H new ATOM 0 HB2 SER A 42 2.376 8.020 9.138 1.00 0.00 H new ATOM 0 HB3 SER A 42 3.894 7.212 8.801 1.00 0.00 H new ATOM 0 HG SER A 42 4.195 9.432 9.399 1.00 0.00 H new ATOM 593 N VAL A 43 3.772 5.483 6.900 1.00 0.00 N ATOM 594 CA VAL A 43 3.808 4.034 6.745 1.00 0.00 C ATOM 595 C VAL A 43 4.860 3.410 7.655 1.00 0.00 C ATOM 596 O VAL A 43 5.877 4.031 7.963 1.00 0.00 O ATOM 597 CB VAL A 43 4.103 3.632 5.288 1.00 0.00 C ATOM 598 CG1 VAL A 43 2.946 4.026 4.381 1.00 0.00 C ATOM 599 CG2 VAL A 43 5.402 4.265 4.813 1.00 0.00 C ATOM 0 H VAL A 43 4.686 5.915 7.036 1.00 0.00 H new ATOM 0 HA VAL A 43 2.822 3.662 7.024 1.00 0.00 H new ATOM 0 HB VAL A 43 4.216 2.549 5.244 1.00 0.00 H new ATOM 0 HG11 VAL A 43 3.172 3.734 3.355 1.00 0.00 H new ATOM 0 HG12 VAL A 43 2.038 3.521 4.710 1.00 0.00 H new ATOM 0 HG13 VAL A 43 2.799 5.105 4.427 1.00 0.00 H new ATOM 0 HG21 VAL A 43 5.595 3.970 3.781 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.320 5.350 4.871 1.00 0.00 H new ATOM 0 HG23 VAL A 43 6.223 3.929 5.446 1.00 0.00 H new ATOM 609 N VAL A 44 4.608 2.177 8.083 1.00 0.00 N ATOM 610 CA VAL A 44 5.534 1.467 8.957 1.00 0.00 C ATOM 611 C VAL A 44 6.203 0.309 8.225 1.00 0.00 C ATOM 612 O VAL A 44 5.730 -0.133 7.178 1.00 0.00 O ATOM 613 CB VAL A 44 4.820 0.924 10.209 1.00 0.00 C ATOM 614 CG1 VAL A 44 4.595 2.037 11.221 1.00 0.00 C ATOM 615 CG2 VAL A 44 3.502 0.266 9.827 1.00 0.00 C ATOM 0 H VAL A 44 3.770 1.649 7.839 1.00 0.00 H new ATOM 0 HA VAL A 44 6.293 2.186 9.264 1.00 0.00 H new ATOM 0 HB VAL A 44 5.457 0.169 10.670 1.00 0.00 H new ATOM 0 HG11 VAL A 44 4.089 1.634 12.099 1.00 0.00 H new ATOM 0 HG12 VAL A 44 5.555 2.459 11.517 1.00 0.00 H new ATOM 0 HG13 VAL A 44 3.979 2.817 10.773 1.00 0.00 H new ATOM 0 HG21 VAL A 44 3.011 -0.112 10.724 1.00 0.00 H new ATOM 0 HG22 VAL A 44 2.857 0.998 9.341 1.00 0.00 H new ATOM 0 HG23 VAL A 44 3.693 -0.560 9.142 1.00 0.00 H new ATOM 625 N ALA A 45 7.307 -0.177 8.783 1.00 0.00 N ATOM 626 CA ALA A 45 8.041 -1.286 8.184 1.00 0.00 C ATOM 627 C ALA A 45 8.101 -2.479 9.131 1.00 0.00 C ATOM 628 O ALA A 45 8.504 -2.347 10.288 1.00 0.00 O ATOM 629 CB ALA A 45 9.444 -0.843 7.799 1.00 0.00 C ATOM 0 H ALA A 45 7.713 0.179 9.648 1.00 0.00 H new ATOM 0 HA ALA A 45 7.511 -1.597 7.284 1.00 0.00 H new ATOM 0 HB1 ALA A 45 9.981 -1.681 7.353 1.00 0.00 H new ATOM 0 HB2 ALA A 45 9.383 -0.027 7.079 1.00 0.00 H new ATOM 0 HB3 ALA A 45 9.975 -0.504 8.688 1.00 0.00 H new ATOM 635 N LEU A 46 7.698 -3.643 8.635 1.00 0.00 N ATOM 636 CA LEU A 46 7.706 -4.862 9.437 1.00 0.00 C ATOM 637 C LEU A 46 8.012 -6.081 8.574 1.00 0.00 C ATOM 638 O LEU A 46 7.257 -6.413 7.660 1.00 0.00 O ATOM 639 CB LEU A 46 6.357 -5.044 10.137 1.00 0.00 C ATOM 640 CG LEU A 46 5.827 -3.829 10.899 1.00 0.00 C ATOM 641 CD1 LEU A 46 4.335 -3.970 11.157 1.00 0.00 C ATOM 642 CD2 LEU A 46 6.582 -3.650 12.208 1.00 0.00 C ATOM 0 H LEU A 46 7.361 -3.769 7.680 1.00 0.00 H new ATOM 0 HA LEU A 46 8.489 -4.767 10.189 1.00 0.00 H new ATOM 0 HB2 LEU A 46 5.618 -5.329 9.389 1.00 0.00 H new ATOM 0 HB3 LEU A 46 6.442 -5.877 10.835 1.00 0.00 H new ATOM 0 HG LEU A 46 5.986 -2.942 10.286 1.00 0.00 H new ATOM 0 HD11 LEU A 46 3.976 -3.096 11.700 1.00 0.00 H new ATOM 0 HD12 LEU A 46 3.807 -4.049 10.207 1.00 0.00 H new ATOM 0 HD13 LEU A 46 4.151 -4.866 11.749 1.00 0.00 H new ATOM 0 HD21 LEU A 46 6.192 -2.781 12.737 1.00 0.00 H new ATOM 0 HD22 LEU A 46 6.454 -4.539 12.826 1.00 0.00 H new ATOM 0 HD23 LEU A 46 7.642 -3.502 12.000 1.00 0.00 H new ATOM 654 N ARG A 47 9.124 -6.745 8.870 1.00 0.00 N ATOM 655 CA ARG A 47 9.530 -7.928 8.122 1.00 0.00 C ATOM 656 C ARG A 47 8.452 -9.007 8.183 1.00 0.00 C ATOM 657 O ARG A 47 8.072 -9.458 9.263 1.00 0.00 O ATOM 658 CB ARG A 47 10.848 -8.478 8.671 1.00 0.00 C ATOM 659 CG ARG A 47 11.704 -9.170 7.622 1.00 0.00 C ATOM 660 CD ARG A 47 11.093 -10.495 7.191 1.00 0.00 C ATOM 661 NE ARG A 47 10.799 -11.359 8.331 1.00 0.00 N ATOM 662 CZ ARG A 47 11.701 -12.143 8.910 1.00 0.00 C ATOM 663 NH1 ARG A 47 12.947 -12.172 8.459 1.00 0.00 N ATOM 664 NH2 ARG A 47 11.356 -12.901 9.944 1.00 0.00 N ATOM 0 H ARG A 47 9.760 -6.484 9.623 1.00 0.00 H new ATOM 0 HA ARG A 47 9.671 -7.637 7.081 1.00 0.00 H new ATOM 0 HB2 ARG A 47 11.418 -7.660 9.111 1.00 0.00 H new ATOM 0 HB3 ARG A 47 10.631 -9.183 9.474 1.00 0.00 H new ATOM 0 HG2 ARG A 47 11.815 -8.520 6.754 1.00 0.00 H new ATOM 0 HG3 ARG A 47 12.703 -9.342 8.022 1.00 0.00 H new ATOM 0 HD2 ARG A 47 10.176 -10.307 6.633 1.00 0.00 H new ATOM 0 HD3 ARG A 47 11.778 -11.007 6.515 1.00 0.00 H new ATOM 0 HE ARG A 47 9.849 -11.360 8.703 1.00 0.00 H new ATOM 0 HH11 ARG A 47 13.216 -11.591 7.665 1.00 0.00 H new ATOM 0 HH12 ARG A 47 13.637 -12.775 8.906 1.00 0.00 H new ATOM 0 HH21 ARG A 47 10.398 -12.881 10.294 1.00 0.00 H new ATOM 0 HH22 ARG A 47 12.049 -13.503 10.389 1.00 0.00 H new ATOM 678 N SER A 48 7.963 -9.414 7.016 1.00 0.00 N ATOM 679 CA SER A 48 6.926 -10.436 6.936 1.00 0.00 C ATOM 680 C SER A 48 7.514 -11.825 7.163 1.00 0.00 C ATOM 681 O SER A 48 8.571 -12.158 6.628 1.00 0.00 O ATOM 682 CB SER A 48 6.229 -10.380 5.576 1.00 0.00 C ATOM 683 OG SER A 48 4.894 -10.847 5.667 1.00 0.00 O ATOM 0 H SER A 48 8.268 -9.052 6.113 1.00 0.00 H new ATOM 0 HA SER A 48 6.194 -10.238 7.719 1.00 0.00 H new ATOM 0 HB2 SER A 48 6.235 -9.356 5.203 1.00 0.00 H new ATOM 0 HB3 SER A 48 6.781 -10.984 4.856 1.00 0.00 H new ATOM 0 HG SER A 48 4.276 -10.100 5.527 1.00 0.00 H new ATOM 689 N GLN A 49 6.820 -12.631 7.961 1.00 0.00 N ATOM 690 CA GLN A 49 7.273 -13.984 8.260 1.00 0.00 C ATOM 691 C GLN A 49 7.849 -14.653 7.015 1.00 0.00 C ATOM 692 O GLN A 49 8.813 -15.412 7.097 1.00 0.00 O ATOM 693 CB GLN A 49 6.119 -14.821 8.815 1.00 0.00 C ATOM 694 CG GLN A 49 4.987 -15.031 7.822 1.00 0.00 C ATOM 695 CD GLN A 49 5.268 -16.158 6.847 1.00 0.00 C ATOM 696 OE1 GLN A 49 6.179 -16.960 7.054 1.00 0.00 O ATOM 697 NE2 GLN A 49 4.485 -16.224 5.776 1.00 0.00 N ATOM 0 H GLN A 49 5.943 -12.370 8.411 1.00 0.00 H new ATOM 0 HA GLN A 49 8.059 -13.918 9.012 1.00 0.00 H new ATOM 0 HB2 GLN A 49 6.503 -15.792 9.126 1.00 0.00 H new ATOM 0 HB3 GLN A 49 5.724 -14.334 9.706 1.00 0.00 H new ATOM 0 HG2 GLN A 49 4.067 -15.247 8.366 1.00 0.00 H new ATOM 0 HG3 GLN A 49 4.820 -14.108 7.267 1.00 0.00 H new ATOM 0 HE21 GLN A 49 3.742 -15.538 5.645 1.00 0.00 H new ATOM 0 HE22 GLN A 49 4.627 -16.961 5.085 1.00 0.00 H new ATOM 706 N ASN A 50 7.249 -14.366 5.864 1.00 0.00 N ATOM 707 CA ASN A 50 7.701 -14.940 4.603 1.00 0.00 C ATOM 708 C ASN A 50 9.164 -14.594 4.341 1.00 0.00 C ATOM 709 O ASN A 50 9.831 -13.991 5.182 1.00 0.00 O ATOM 710 CB ASN A 50 6.832 -14.437 3.448 1.00 0.00 C ATOM 711 CG ASN A 50 5.366 -14.774 3.639 1.00 0.00 C ATOM 712 OD1 ASN A 50 4.659 -14.113 4.400 1.00 0.00 O ATOM 713 ND2 ASN A 50 4.902 -15.809 2.948 1.00 0.00 N ATOM 0 H ASN A 50 6.449 -13.739 5.779 1.00 0.00 H new ATOM 0 HA ASN A 50 7.609 -16.024 4.673 1.00 0.00 H new ATOM 0 HB2 ASN A 50 6.945 -13.357 3.356 1.00 0.00 H new ATOM 0 HB3 ASN A 50 7.184 -14.875 2.514 1.00 0.00 H new ATOM 0 HD21 ASN A 50 3.924 -16.084 3.037 1.00 0.00 H new ATOM 0 HD22 ASN A 50 5.524 -16.329 2.329 1.00 0.00 H new ATOM 720 N LEU A 51 9.657 -14.980 3.169 1.00 0.00 N ATOM 721 CA LEU A 51 11.040 -14.710 2.795 1.00 0.00 C ATOM 722 C LEU A 51 11.457 -13.307 3.224 1.00 0.00 C ATOM 723 O LEU A 51 10.614 -12.458 3.511 1.00 0.00 O ATOM 724 CB LEU A 51 11.221 -14.868 1.284 1.00 0.00 C ATOM 725 CG LEU A 51 12.637 -14.650 0.751 1.00 0.00 C ATOM 726 CD1 LEU A 51 13.578 -15.720 1.283 1.00 0.00 C ATOM 727 CD2 LEU A 51 12.640 -14.645 -0.771 1.00 0.00 C ATOM 0 H LEU A 51 9.119 -15.481 2.462 1.00 0.00 H new ATOM 0 HA LEU A 51 11.676 -15.431 3.309 1.00 0.00 H new ATOM 0 HB2 LEU A 51 10.899 -15.871 1.003 1.00 0.00 H new ATOM 0 HB3 LEU A 51 10.554 -14.167 0.783 1.00 0.00 H new ATOM 0 HG LEU A 51 12.989 -13.679 1.098 1.00 0.00 H new ATOM 0 HD11 LEU A 51 14.581 -15.549 0.893 1.00 0.00 H new ATOM 0 HD12 LEU A 51 13.600 -15.677 2.372 1.00 0.00 H new ATOM 0 HD13 LEU A 51 13.228 -16.702 0.966 1.00 0.00 H new ATOM 0 HD21 LEU A 51 13.656 -14.489 -1.132 1.00 0.00 H new ATOM 0 HD22 LEU A 51 12.267 -15.601 -1.139 1.00 0.00 H new ATOM 0 HD23 LEU A 51 11.998 -13.842 -1.133 1.00 0.00 H new ATOM 739 N GLY A 52 12.765 -13.070 3.265 1.00 0.00 N ATOM 740 CA GLY A 52 13.271 -11.768 3.658 1.00 0.00 C ATOM 741 C GLY A 52 12.570 -10.632 2.940 1.00 0.00 C ATOM 742 O GLY A 52 13.018 -10.183 1.885 1.00 0.00 O ATOM 0 H GLY A 52 13.483 -13.757 3.033 1.00 0.00 H new ATOM 0 HA2 GLY A 52 13.149 -11.644 4.734 1.00 0.00 H new ATOM 0 HA3 GLY A 52 14.340 -11.720 3.451 1.00 0.00 H new ATOM 746 N LYS A 53 11.464 -10.166 3.511 1.00 0.00 N ATOM 747 CA LYS A 53 10.698 -9.076 2.919 1.00 0.00 C ATOM 748 C LYS A 53 10.073 -8.200 4.001 1.00 0.00 C ATOM 749 O LYS A 53 9.935 -8.619 5.150 1.00 0.00 O ATOM 750 CB LYS A 53 9.605 -9.631 2.004 1.00 0.00 C ATOM 751 CG LYS A 53 8.453 -10.277 2.754 1.00 0.00 C ATOM 752 CD LYS A 53 7.285 -10.580 1.830 1.00 0.00 C ATOM 753 CE LYS A 53 7.743 -11.301 0.572 1.00 0.00 C ATOM 754 NZ LYS A 53 8.416 -12.592 0.886 1.00 0.00 N ATOM 0 H LYS A 53 11.078 -10.527 4.384 1.00 0.00 H new ATOM 0 HA LYS A 53 11.381 -8.464 2.329 1.00 0.00 H new ATOM 0 HB2 LYS A 53 9.216 -8.823 1.385 1.00 0.00 H new ATOM 0 HB3 LYS A 53 10.046 -10.365 1.330 1.00 0.00 H new ATOM 0 HG2 LYS A 53 8.795 -11.199 3.224 1.00 0.00 H new ATOM 0 HG3 LYS A 53 8.122 -9.615 3.555 1.00 0.00 H new ATOM 0 HD2 LYS A 53 6.553 -11.193 2.356 1.00 0.00 H new ATOM 0 HD3 LYS A 53 6.785 -9.651 1.557 1.00 0.00 H new ATOM 0 HE2 LYS A 53 6.884 -11.487 -0.073 1.00 0.00 H new ATOM 0 HE3 LYS A 53 8.427 -10.661 0.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 8.788 -13.012 0.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 9.199 -12.423 1.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 7.731 -13.244 1.319 1.00 0.00 H new ATOM 768 N VAL A 54 9.696 -6.982 3.625 1.00 0.00 N ATOM 769 CA VAL A 54 9.084 -6.048 4.562 1.00 0.00 C ATOM 770 C VAL A 54 7.677 -5.664 4.116 1.00 0.00 C ATOM 771 O VAL A 54 7.421 -5.482 2.925 1.00 0.00 O ATOM 772 CB VAL A 54 9.929 -4.770 4.714 1.00 0.00 C ATOM 773 CG1 VAL A 54 9.430 -3.935 5.884 1.00 0.00 C ATOM 774 CG2 VAL A 54 11.399 -5.121 4.887 1.00 0.00 C ATOM 0 H VAL A 54 9.804 -6.619 2.678 1.00 0.00 H new ATOM 0 HA VAL A 54 9.031 -6.556 5.525 1.00 0.00 H new ATOM 0 HB VAL A 54 9.825 -4.177 3.806 1.00 0.00 H new ATOM 0 HG11 VAL A 54 10.040 -3.036 5.976 1.00 0.00 H new ATOM 0 HG12 VAL A 54 8.391 -3.653 5.713 1.00 0.00 H new ATOM 0 HG13 VAL A 54 9.501 -4.517 6.803 1.00 0.00 H new ATOM 0 HG21 VAL A 54 11.982 -4.206 4.993 1.00 0.00 H new ATOM 0 HG22 VAL A 54 11.524 -5.736 5.778 1.00 0.00 H new ATOM 0 HG23 VAL A 54 11.746 -5.673 4.014 1.00 0.00 H new ATOM 784 N ASP A 55 6.770 -5.543 5.078 1.00 0.00 N ATOM 785 CA ASP A 55 5.388 -5.179 4.785 1.00 0.00 C ATOM 786 C ASP A 55 5.105 -3.739 5.202 1.00 0.00 C ATOM 787 O ASP A 55 5.128 -3.411 6.389 1.00 0.00 O ATOM 788 CB ASP A 55 4.425 -6.129 5.499 1.00 0.00 C ATOM 789 CG ASP A 55 4.262 -7.446 4.767 1.00 0.00 C ATOM 790 OD1 ASP A 55 5.002 -7.676 3.787 1.00 0.00 O ATOM 791 OD2 ASP A 55 3.396 -8.247 5.174 1.00 0.00 O ATOM 0 H ASP A 55 6.966 -5.692 6.068 1.00 0.00 H new ATOM 0 HA ASP A 55 5.237 -5.263 3.709 1.00 0.00 H new ATOM 0 HB2 ASP A 55 4.790 -6.320 6.508 1.00 0.00 H new ATOM 0 HB3 ASP A 55 3.452 -5.649 5.598 1.00 0.00 H new ATOM 796 N ILE A 56 4.841 -2.885 4.219 1.00 0.00 N ATOM 797 CA ILE A 56 4.554 -1.481 4.485 1.00 0.00 C ATOM 798 C ILE A 56 3.074 -1.270 4.789 1.00 0.00 C ATOM 799 O ILE A 56 2.213 -1.533 3.949 1.00 0.00 O ATOM 800 CB ILE A 56 4.954 -0.589 3.295 1.00 0.00 C ATOM 801 CG1 ILE A 56 6.341 -0.979 2.781 1.00 0.00 C ATOM 802 CG2 ILE A 56 4.926 0.878 3.699 1.00 0.00 C ATOM 803 CD1 ILE A 56 7.446 -0.745 3.788 1.00 0.00 C ATOM 0 H ILE A 56 4.820 -3.141 3.232 1.00 0.00 H new ATOM 0 HA ILE A 56 5.145 -1.198 5.356 1.00 0.00 H new ATOM 0 HB ILE A 56 4.234 -0.738 2.490 1.00 0.00 H new ATOM 0 HG12 ILE A 56 6.333 -2.032 2.501 1.00 0.00 H new ATOM 0 HG13 ILE A 56 6.558 -0.410 1.877 1.00 0.00 H new ATOM 0 HG21 ILE A 56 5.211 1.495 2.847 1.00 0.00 H new ATOM 0 HG22 ILE A 56 3.920 1.147 4.022 1.00 0.00 H new ATOM 0 HG23 ILE A 56 5.626 1.043 4.518 1.00 0.00 H new ATOM 0 HD11 ILE A 56 8.401 -1.044 3.356 1.00 0.00 H new ATOM 0 HD12 ILE A 56 7.481 0.312 4.050 1.00 0.00 H new ATOM 0 HD13 ILE A 56 7.253 -1.335 4.684 1.00 0.00 H new ATOM 815 N PHE A 57 2.786 -0.792 5.995 1.00 0.00 N ATOM 816 CA PHE A 57 1.410 -0.544 6.410 1.00 0.00 C ATOM 817 C PHE A 57 1.172 0.944 6.644 1.00 0.00 C ATOM 818 O PHE A 57 1.996 1.628 7.252 1.00 0.00 O ATOM 819 CB PHE A 57 1.089 -1.330 7.683 1.00 0.00 C ATOM 820 CG PHE A 57 1.334 -2.807 7.553 1.00 0.00 C ATOM 821 CD1 PHE A 57 2.601 -3.332 7.746 1.00 0.00 C ATOM 822 CD2 PHE A 57 0.296 -3.669 7.239 1.00 0.00 C ATOM 823 CE1 PHE A 57 2.829 -4.690 7.628 1.00 0.00 C ATOM 824 CE2 PHE A 57 0.518 -5.028 7.120 1.00 0.00 C ATOM 825 CZ PHE A 57 1.786 -5.539 7.313 1.00 0.00 C ATOM 0 H PHE A 57 3.487 -0.569 6.702 1.00 0.00 H new ATOM 0 HA PHE A 57 0.750 -0.878 5.609 1.00 0.00 H new ATOM 0 HB2 PHE A 57 1.692 -0.940 8.503 1.00 0.00 H new ATOM 0 HB3 PHE A 57 0.045 -1.165 7.949 1.00 0.00 H new ATOM 0 HD1 PHE A 57 3.420 -2.673 7.992 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -0.698 -3.275 7.085 1.00 0.00 H new ATOM 0 HE1 PHE A 57 3.822 -5.087 7.782 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -0.300 -5.690 6.876 1.00 0.00 H new ATOM 0 HZ PHE A 57 1.962 -6.600 7.218 1.00 0.00 H new ATOM 835 N VAL A 58 0.039 1.441 6.157 1.00 0.00 N ATOM 836 CA VAL A 58 -0.309 2.848 6.314 1.00 0.00 C ATOM 837 C VAL A 58 -0.667 3.168 7.761 1.00 0.00 C ATOM 838 O VAL A 58 -1.645 2.650 8.300 1.00 0.00 O ATOM 839 CB VAL A 58 -1.490 3.238 5.406 1.00 0.00 C ATOM 840 CG1 VAL A 58 -1.876 4.693 5.627 1.00 0.00 C ATOM 841 CG2 VAL A 58 -1.146 2.985 3.946 1.00 0.00 C ATOM 0 H VAL A 58 -0.654 0.890 5.650 1.00 0.00 H new ATOM 0 HA VAL A 58 0.569 3.425 6.024 1.00 0.00 H new ATOM 0 HB VAL A 58 -2.347 2.616 5.667 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -2.712 4.950 4.977 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -2.167 4.838 6.667 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -1.026 5.334 5.395 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -1.992 3.266 3.319 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -0.275 3.580 3.669 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -0.924 1.928 3.803 1.00 0.00 H new ATOM 851 N LYS A 59 0.132 4.027 8.386 1.00 0.00 N ATOM 852 CA LYS A 59 -0.100 4.419 9.771 1.00 0.00 C ATOM 853 C LYS A 59 -0.171 5.937 9.901 1.00 0.00 C ATOM 854 O LYS A 59 0.245 6.667 9.001 1.00 0.00 O ATOM 855 CB LYS A 59 1.010 3.870 10.670 1.00 0.00 C ATOM 856 CG LYS A 59 1.212 2.370 10.541 1.00 0.00 C ATOM 857 CD LYS A 59 0.276 1.600 11.457 1.00 0.00 C ATOM 858 CE LYS A 59 0.540 1.921 12.920 1.00 0.00 C ATOM 859 NZ LYS A 59 -0.320 3.035 13.407 1.00 0.00 N ATOM 0 H LYS A 59 0.946 4.465 7.955 1.00 0.00 H new ATOM 0 HA LYS A 59 -1.055 4.000 10.087 1.00 0.00 H new ATOM 0 HB2 LYS A 59 1.945 4.376 10.429 1.00 0.00 H new ATOM 0 HB3 LYS A 59 0.777 4.109 11.708 1.00 0.00 H new ATOM 0 HG2 LYS A 59 1.042 2.067 9.508 1.00 0.00 H new ATOM 0 HG3 LYS A 59 2.245 2.119 10.781 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -0.758 1.843 11.211 1.00 0.00 H new ATOM 0 HD3 LYS A 59 0.400 0.530 11.290 1.00 0.00 H new ATOM 0 HE2 LYS A 59 0.360 1.032 13.525 1.00 0.00 H new ATOM 0 HE3 LYS A 59 1.589 2.188 13.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 0.280 3.805 13.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -0.907 3.388 12.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -0.934 2.690 14.172 1.00 0.00 H new ATOM 873 N ASP A 60 -0.698 6.405 11.027 1.00 0.00 N ATOM 874 CA ASP A 60 -0.820 7.837 11.277 1.00 0.00 C ATOM 875 C ASP A 60 -1.531 8.531 10.119 1.00 0.00 C ATOM 876 O ASP A 60 -1.013 9.487 9.543 1.00 0.00 O ATOM 877 CB ASP A 60 0.561 8.459 11.490 1.00 0.00 C ATOM 878 CG ASP A 60 0.505 9.715 12.337 1.00 0.00 C ATOM 879 OD1 ASP A 60 0.211 9.604 13.546 1.00 0.00 O ATOM 880 OD2 ASP A 60 0.756 10.810 11.791 1.00 0.00 O ATOM 0 H ASP A 60 -1.048 5.814 11.781 1.00 0.00 H new ATOM 0 HA ASP A 60 -1.414 7.974 12.180 1.00 0.00 H new ATOM 0 HB2 ASP A 60 1.215 7.730 11.969 1.00 0.00 H new ATOM 0 HB3 ASP A 60 1.003 8.696 10.522 1.00 0.00 H new ATOM 885 N VAL A 61 -2.721 8.043 9.784 1.00 0.00 N ATOM 886 CA VAL A 61 -3.504 8.616 8.695 1.00 0.00 C ATOM 887 C VAL A 61 -4.023 10.002 9.063 1.00 0.00 C ATOM 888 O VAL A 61 -5.193 10.165 9.408 1.00 0.00 O ATOM 889 CB VAL A 61 -4.696 7.714 8.326 1.00 0.00 C ATOM 890 CG1 VAL A 61 -5.516 8.343 7.210 1.00 0.00 C ATOM 891 CG2 VAL A 61 -4.212 6.328 7.926 1.00 0.00 C ATOM 0 H VAL A 61 -3.164 7.252 10.251 1.00 0.00 H new ATOM 0 HA VAL A 61 -2.840 8.696 7.835 1.00 0.00 H new ATOM 0 HB VAL A 61 -5.336 7.612 9.202 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -6.354 7.691 6.963 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -5.894 9.312 7.538 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -4.889 8.477 6.329 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -5.068 5.704 7.669 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.549 6.409 7.064 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -3.672 5.877 8.758 1.00 0.00 H new ATOM 901 N GLN A 62 -3.145 10.997 8.985 1.00 0.00 N ATOM 902 CA GLN A 62 -3.516 12.369 9.310 1.00 0.00 C ATOM 903 C GLN A 62 -4.959 12.653 8.906 1.00 0.00 C ATOM 904 O GLN A 62 -5.303 12.690 7.724 1.00 0.00 O ATOM 905 CB GLN A 62 -2.576 13.352 8.611 1.00 0.00 C ATOM 906 CG GLN A 62 -1.110 13.143 8.957 1.00 0.00 C ATOM 907 CD GLN A 62 -0.267 14.375 8.695 1.00 0.00 C ATOM 908 OE1 GLN A 62 0.630 14.360 7.851 1.00 0.00 O ATOM 909 NE2 GLN A 62 -0.550 15.451 9.419 1.00 0.00 N ATOM 0 H GLN A 62 -2.173 10.879 8.700 1.00 0.00 H new ATOM 0 HA GLN A 62 -3.428 12.497 10.389 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -2.703 13.259 7.532 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -2.863 14.369 8.879 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -1.025 12.866 10.008 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -0.719 12.309 8.374 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -1.302 15.419 10.107 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -0.016 16.310 9.287 1.00 0.00 H new ATOM 918 N PRO A 63 -5.826 12.857 9.909 1.00 0.00 N ATOM 919 CA PRO A 63 -7.246 13.142 9.683 1.00 0.00 C ATOM 920 C PRO A 63 -7.471 14.523 9.076 1.00 0.00 C ATOM 921 O PRO A 63 -8.564 14.833 8.604 1.00 0.00 O ATOM 922 CB PRO A 63 -7.850 13.070 11.088 1.00 0.00 C ATOM 923 CG PRO A 63 -6.717 13.381 12.004 1.00 0.00 C ATOM 924 CD PRO A 63 -5.485 12.828 11.342 1.00 0.00 C ATOM 0 HA PRO A 63 -7.694 12.445 8.975 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -8.663 13.786 11.207 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -8.263 12.082 11.291 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -6.626 14.456 12.161 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -6.871 12.927 12.983 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -4.606 13.435 11.558 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -5.266 11.816 11.683 1.00 0.00 H new ATOM 932 N GLY A 64 -6.429 15.349 9.093 1.00 0.00 N ATOM 933 CA GLY A 64 -6.535 16.687 8.541 1.00 0.00 C ATOM 934 C GLY A 64 -5.606 16.902 7.362 1.00 0.00 C ATOM 935 O GLY A 64 -5.161 18.022 7.111 1.00 0.00 O ATOM 0 H GLY A 64 -5.514 15.116 9.479 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -7.563 16.867 8.227 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -6.306 17.417 9.318 1.00 0.00 H new ATOM 939 N SER A 65 -5.313 15.827 6.638 1.00 0.00 N ATOM 940 CA SER A 65 -4.426 15.903 5.482 1.00 0.00 C ATOM 941 C SER A 65 -5.095 15.312 4.245 1.00 0.00 C ATOM 942 O SER A 65 -6.164 14.707 4.332 1.00 0.00 O ATOM 943 CB SER A 65 -3.116 15.167 5.768 1.00 0.00 C ATOM 944 OG SER A 65 -2.040 15.742 5.047 1.00 0.00 O ATOM 0 H SER A 65 -5.676 14.894 6.831 1.00 0.00 H new ATOM 0 HA SER A 65 -4.209 16.954 5.290 1.00 0.00 H new ATOM 0 HB2 SER A 65 -2.902 15.201 6.836 1.00 0.00 H new ATOM 0 HB3 SER A 65 -3.219 14.116 5.497 1.00 0.00 H new ATOM 0 HG SER A 65 -1.359 16.061 5.675 1.00 0.00 H new ATOM 950 N VAL A 66 -4.458 15.491 3.092 1.00 0.00 N ATOM 951 CA VAL A 66 -4.989 14.976 1.836 1.00 0.00 C ATOM 952 C VAL A 66 -5.536 13.563 2.010 1.00 0.00 C ATOM 953 O VAL A 66 -6.659 13.267 1.601 1.00 0.00 O ATOM 954 CB VAL A 66 -3.913 14.965 0.734 1.00 0.00 C ATOM 955 CG1 VAL A 66 -2.658 14.257 1.220 1.00 0.00 C ATOM 956 CG2 VAL A 66 -4.451 14.309 -0.528 1.00 0.00 C ATOM 0 H VAL A 66 -3.573 15.989 3.002 1.00 0.00 H new ATOM 0 HA VAL A 66 -5.798 15.643 1.537 1.00 0.00 H new ATOM 0 HB VAL A 66 -3.650 15.996 0.496 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.909 14.259 0.428 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.263 14.775 2.094 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.901 13.228 1.487 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -3.678 14.310 -1.296 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -4.743 13.282 -0.308 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -5.318 14.864 -0.885 1.00 0.00 H new ATOM 966 N ALA A 67 -4.736 12.695 2.620 1.00 0.00 N ATOM 967 CA ALA A 67 -5.142 11.314 2.851 1.00 0.00 C ATOM 968 C ALA A 67 -6.585 11.240 3.337 1.00 0.00 C ATOM 969 O ALA A 67 -7.443 10.653 2.677 1.00 0.00 O ATOM 970 CB ALA A 67 -4.210 10.651 3.854 1.00 0.00 C ATOM 0 H ALA A 67 -3.803 12.924 2.963 1.00 0.00 H new ATOM 0 HA ALA A 67 -5.078 10.779 1.904 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -4.525 9.620 4.017 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -3.191 10.662 3.467 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -4.245 11.195 4.798 1.00 0.00 H new ATOM 976 N ASP A 68 -6.846 11.836 4.495 1.00 0.00 N ATOM 977 CA ASP A 68 -8.186 11.838 5.069 1.00 0.00 C ATOM 978 C ASP A 68 -9.223 12.249 4.029 1.00 0.00 C ATOM 979 O ASP A 68 -10.260 11.601 3.882 1.00 0.00 O ATOM 980 CB ASP A 68 -8.248 12.783 6.270 1.00 0.00 C ATOM 981 CG ASP A 68 -9.611 12.786 6.934 1.00 0.00 C ATOM 982 OD1 ASP A 68 -10.506 13.508 6.447 1.00 0.00 O ATOM 983 OD2 ASP A 68 -9.783 12.068 7.942 1.00 0.00 O ATOM 0 H ASP A 68 -6.147 12.324 5.055 1.00 0.00 H new ATOM 0 HA ASP A 68 -8.413 10.825 5.401 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -7.493 12.490 6.999 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -8.003 13.794 5.946 1.00 0.00 H new ATOM 988 N ARG A 69 -8.937 13.329 3.310 1.00 0.00 N ATOM 989 CA ARG A 69 -9.845 13.828 2.285 1.00 0.00 C ATOM 990 C ARG A 69 -9.441 13.317 0.905 1.00 0.00 C ATOM 991 O ARG A 69 -9.755 13.934 -0.113 1.00 0.00 O ATOM 992 CB ARG A 69 -9.863 15.358 2.289 1.00 0.00 C ATOM 993 CG ARG A 69 -8.498 15.983 2.051 1.00 0.00 C ATOM 994 CD ARG A 69 -8.291 16.329 0.584 1.00 0.00 C ATOM 995 NE ARG A 69 -9.457 16.996 0.010 1.00 0.00 N ATOM 996 CZ ARG A 69 -9.817 18.238 0.315 1.00 0.00 C ATOM 997 NH1 ARG A 69 -9.106 18.943 1.184 1.00 0.00 N ATOM 998 NH2 ARG A 69 -10.890 18.776 -0.250 1.00 0.00 N ATOM 0 H ARG A 69 -8.083 13.876 3.419 1.00 0.00 H new ATOM 0 HA ARG A 69 -10.845 13.459 2.512 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -10.552 15.707 1.520 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -10.251 15.706 3.246 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -8.399 16.884 2.656 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -7.719 15.293 2.377 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -7.418 16.974 0.483 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -8.081 15.418 0.023 1.00 0.00 H new ATOM 0 HE ARG A 69 -10.026 16.480 -0.661 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -8.281 18.532 1.620 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -9.384 19.896 1.416 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -11.439 18.236 -0.919 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -11.166 19.730 -0.015 1.00 0.00 H new ATOM 1012 N ASP A 70 -8.745 12.186 0.879 1.00 0.00 N ATOM 1013 CA ASP A 70 -8.298 11.591 -0.375 1.00 0.00 C ATOM 1014 C ASP A 70 -9.395 10.726 -0.987 1.00 0.00 C ATOM 1015 O ASP A 70 -10.439 10.506 -0.373 1.00 0.00 O ATOM 1016 CB ASP A 70 -7.039 10.754 -0.147 1.00 0.00 C ATOM 1017 CG ASP A 70 -6.392 10.316 -1.446 1.00 0.00 C ATOM 1018 OD1 ASP A 70 -6.310 11.144 -2.378 1.00 0.00 O ATOM 1019 OD2 ASP A 70 -5.967 9.145 -1.532 1.00 0.00 O ATOM 0 H ASP A 70 -8.478 11.662 1.713 1.00 0.00 H new ATOM 0 HA ASP A 70 -8.067 12.398 -1.070 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -6.322 11.333 0.436 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -7.293 9.874 0.444 1.00 0.00 H new ATOM 1024 N GLN A 71 -9.151 10.240 -2.200 1.00 0.00 N ATOM 1025 CA GLN A 71 -10.120 9.401 -2.895 1.00 0.00 C ATOM 1026 C GLN A 71 -10.617 8.279 -1.989 1.00 0.00 C ATOM 1027 O GLN A 71 -11.819 8.141 -1.759 1.00 0.00 O ATOM 1028 CB GLN A 71 -9.498 8.811 -4.162 1.00 0.00 C ATOM 1029 CG GLN A 71 -10.413 7.843 -4.895 1.00 0.00 C ATOM 1030 CD GLN A 71 -11.672 8.509 -5.414 1.00 0.00 C ATOM 1031 OE1 GLN A 71 -12.726 8.450 -4.780 1.00 0.00 O ATOM 1032 NE2 GLN A 71 -11.569 9.150 -6.572 1.00 0.00 N ATOM 0 H GLN A 71 -8.291 10.413 -2.721 1.00 0.00 H new ATOM 0 HA GLN A 71 -10.971 10.024 -3.172 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -9.228 9.624 -4.836 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -8.575 8.296 -3.897 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -9.871 7.398 -5.730 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -10.687 7.029 -4.224 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -10.676 9.174 -7.064 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -12.383 9.619 -6.970 1.00 0.00 H new ATOM 1041 N ARG A 72 -9.686 7.481 -1.477 1.00 0.00 N ATOM 1042 CA ARG A 72 -10.031 6.371 -0.598 1.00 0.00 C ATOM 1043 C ARG A 72 -8.778 5.761 0.025 1.00 0.00 C ATOM 1044 O ARG A 72 -7.935 5.198 -0.675 1.00 0.00 O ATOM 1045 CB ARG A 72 -10.802 5.300 -1.371 1.00 0.00 C ATOM 1046 CG ARG A 72 -10.927 3.981 -0.625 1.00 0.00 C ATOM 1047 CD ARG A 72 -12.235 3.278 -0.953 1.00 0.00 C ATOM 1048 NE ARG A 72 -13.298 3.637 -0.017 1.00 0.00 N ATOM 1049 CZ ARG A 72 -14.570 3.294 -0.184 1.00 0.00 C ATOM 1050 NH1 ARG A 72 -14.936 2.587 -1.245 1.00 0.00 N ATOM 1051 NH2 ARG A 72 -15.480 3.658 0.711 1.00 0.00 N ATOM 0 H ARG A 72 -8.687 7.583 -1.656 1.00 0.00 H new ATOM 0 HA ARG A 72 -10.663 6.757 0.202 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -11.800 5.675 -1.598 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -10.304 5.123 -2.324 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -10.089 3.334 -0.885 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -10.869 4.162 0.448 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -12.542 3.537 -1.967 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -12.082 2.199 -0.932 1.00 0.00 H new ATOM 0 HE ARG A 72 -13.050 4.181 0.810 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -14.240 2.305 -1.935 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -15.914 2.325 -1.371 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -15.203 4.202 1.528 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -16.457 3.394 0.582 1.00 0.00 H new ATOM 1065 N LEU A 73 -8.662 5.877 1.343 1.00 0.00 N ATOM 1066 CA LEU A 73 -7.512 5.338 2.061 1.00 0.00 C ATOM 1067 C LEU A 73 -7.837 5.138 3.538 1.00 0.00 C ATOM 1068 O LEU A 73 -8.310 6.054 4.211 1.00 0.00 O ATOM 1069 CB LEU A 73 -6.310 6.273 1.913 1.00 0.00 C ATOM 1070 CG LEU A 73 -4.935 5.606 1.934 1.00 0.00 C ATOM 1071 CD1 LEU A 73 -3.867 6.568 1.438 1.00 0.00 C ATOM 1072 CD2 LEU A 73 -4.602 5.114 3.335 1.00 0.00 C ATOM 0 H LEU A 73 -9.350 6.340 1.937 1.00 0.00 H new ATOM 0 HA LEU A 73 -7.266 4.368 1.628 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -6.413 6.819 0.975 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -6.347 7.009 2.716 1.00 0.00 H new ATOM 0 HG LEU A 73 -4.960 4.746 1.264 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -2.895 6.075 1.460 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -4.097 6.872 0.417 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -3.843 7.448 2.081 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -3.620 4.642 3.331 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -4.596 5.958 4.025 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -5.351 4.389 3.654 1.00 0.00 H new ATOM 1084 N LYS A 74 -7.578 3.934 4.037 1.00 0.00 N ATOM 1085 CA LYS A 74 -7.839 3.613 5.435 1.00 0.00 C ATOM 1086 C LYS A 74 -6.549 3.235 6.157 1.00 0.00 C ATOM 1087 O LYS A 74 -5.504 3.065 5.529 1.00 0.00 O ATOM 1088 CB LYS A 74 -8.847 2.467 5.537 1.00 0.00 C ATOM 1089 CG LYS A 74 -10.262 2.865 5.154 1.00 0.00 C ATOM 1090 CD LYS A 74 -10.929 3.677 6.251 1.00 0.00 C ATOM 1091 CE LYS A 74 -11.500 2.782 7.339 1.00 0.00 C ATOM 1092 NZ LYS A 74 -11.656 3.508 8.630 1.00 0.00 N ATOM 0 H LYS A 74 -7.187 3.164 3.494 1.00 0.00 H new ATOM 0 HA LYS A 74 -8.256 4.499 5.913 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -8.522 1.650 4.893 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -8.850 2.086 6.558 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -10.241 3.446 4.232 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -10.851 1.970 4.953 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -10.205 4.365 6.687 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -11.726 4.284 5.822 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -12.468 2.396 7.020 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -10.845 1.922 7.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -12.048 2.863 9.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -10.728 3.855 8.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -12.301 4.314 8.500 1.00 0.00 H new ATOM 1106 N GLU A 75 -6.631 3.105 7.477 1.00 0.00 N ATOM 1107 CA GLU A 75 -5.469 2.747 8.282 1.00 0.00 C ATOM 1108 C GLU A 75 -5.128 1.268 8.118 1.00 0.00 C ATOM 1109 O GLU A 75 -5.947 0.481 7.645 1.00 0.00 O ATOM 1110 CB GLU A 75 -5.726 3.061 9.757 1.00 0.00 C ATOM 1111 CG GLU A 75 -4.459 3.148 10.591 1.00 0.00 C ATOM 1112 CD GLU A 75 -4.737 3.502 12.039 1.00 0.00 C ATOM 1113 OE1 GLU A 75 -5.432 4.510 12.281 1.00 0.00 O ATOM 1114 OE2 GLU A 75 -4.258 2.769 12.931 1.00 0.00 O ATOM 0 H GLU A 75 -7.489 3.242 8.011 1.00 0.00 H new ATOM 0 HA GLU A 75 -4.622 3.339 7.934 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -6.264 4.006 9.830 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -6.374 2.291 10.176 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -3.934 2.194 10.549 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -3.795 3.896 10.159 1.00 0.00 H new ATOM 1121 N ASN A 76 -3.914 0.900 8.512 1.00 0.00 N ATOM 1122 CA ASN A 76 -3.464 -0.484 8.408 1.00 0.00 C ATOM 1123 C ASN A 76 -3.646 -1.009 6.987 1.00 0.00 C ATOM 1124 O ASN A 76 -4.246 -2.064 6.777 1.00 0.00 O ATOM 1125 CB ASN A 76 -4.231 -1.367 9.393 1.00 0.00 C ATOM 1126 CG ASN A 76 -3.790 -1.151 10.828 1.00 0.00 C ATOM 1127 OD1 ASN A 76 -2.979 -1.909 11.361 1.00 0.00 O ATOM 1128 ND2 ASN A 76 -4.324 -0.113 11.461 1.00 0.00 N ATOM 0 H ASN A 76 -3.224 1.540 8.906 1.00 0.00 H new ATOM 0 HA ASN A 76 -2.403 -0.515 8.655 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -5.298 -1.159 9.308 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -4.088 -2.414 9.126 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -4.066 0.082 12.428 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -4.992 0.489 10.980 1.00 0.00 H new ATOM 1135 N ASP A 77 -3.125 -0.268 6.016 1.00 0.00 N ATOM 1136 CA ASP A 77 -3.229 -0.659 4.615 1.00 0.00 C ATOM 1137 C ASP A 77 -1.876 -1.114 4.077 1.00 0.00 C ATOM 1138 O ASP A 77 -0.963 -0.306 3.907 1.00 0.00 O ATOM 1139 CB ASP A 77 -3.762 0.503 3.777 1.00 0.00 C ATOM 1140 CG ASP A 77 -5.273 0.610 3.828 1.00 0.00 C ATOM 1141 OD1 ASP A 77 -5.882 -0.015 4.722 1.00 0.00 O ATOM 1142 OD2 ASP A 77 -5.847 1.319 2.976 1.00 0.00 O ATOM 0 H ASP A 77 -2.626 0.608 6.173 1.00 0.00 H new ATOM 0 HA ASP A 77 -3.926 -1.494 4.547 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -3.323 1.435 4.133 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -3.445 0.376 2.742 1.00 0.00 H new ATOM 1147 N GLN A 78 -1.756 -2.410 3.811 1.00 0.00 N ATOM 1148 CA GLN A 78 -0.513 -2.971 3.293 1.00 0.00 C ATOM 1149 C GLN A 78 -0.284 -2.545 1.847 1.00 0.00 C ATOM 1150 O GLN A 78 -1.072 -2.876 0.960 1.00 0.00 O ATOM 1151 CB GLN A 78 -0.539 -4.498 3.389 1.00 0.00 C ATOM 1152 CG GLN A 78 0.843 -5.127 3.453 1.00 0.00 C ATOM 1153 CD GLN A 78 0.874 -6.527 2.873 1.00 0.00 C ATOM 1154 OE1 GLN A 78 -0.040 -7.322 3.092 1.00 0.00 O ATOM 1155 NE2 GLN A 78 1.929 -6.837 2.129 1.00 0.00 N ATOM 0 H GLN A 78 -2.503 -3.091 3.945 1.00 0.00 H new ATOM 0 HA GLN A 78 0.309 -2.589 3.899 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -1.103 -4.788 4.276 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -1.072 -4.899 2.527 1.00 0.00 H new ATOM 0 HG2 GLN A 78 1.550 -4.498 2.912 1.00 0.00 H new ATOM 0 HG3 GLN A 78 1.175 -5.160 4.491 1.00 0.00 H new ATOM 0 HE21 GLN A 78 2.664 -6.147 1.973 1.00 0.00 H new ATOM 0 HE22 GLN A 78 2.005 -7.765 1.713 1.00 0.00 H new ATOM 1164 N ILE A 79 0.798 -1.809 1.617 1.00 0.00 N ATOM 1165 CA ILE A 79 1.130 -1.338 0.278 1.00 0.00 C ATOM 1166 C ILE A 79 1.676 -2.472 -0.584 1.00 0.00 C ATOM 1167 O ILE A 79 2.844 -2.845 -0.470 1.00 0.00 O ATOM 1168 CB ILE A 79 2.164 -0.198 0.322 1.00 0.00 C ATOM 1169 CG1 ILE A 79 1.781 0.826 1.392 1.00 0.00 C ATOM 1170 CG2 ILE A 79 2.277 0.469 -1.041 1.00 0.00 C ATOM 1171 CD1 ILE A 79 0.827 1.890 0.897 1.00 0.00 C ATOM 0 H ILE A 79 1.459 -1.526 2.340 1.00 0.00 H new ATOM 0 HA ILE A 79 0.206 -0.962 -0.162 1.00 0.00 H new ATOM 0 HB ILE A 79 3.136 -0.619 0.580 1.00 0.00 H new ATOM 0 HG12 ILE A 79 1.326 0.306 2.235 1.00 0.00 H new ATOM 0 HG13 ILE A 79 2.686 1.306 1.764 1.00 0.00 H new ATOM 0 HG21 ILE A 79 3.012 1.273 -0.993 1.00 0.00 H new ATOM 0 HG22 ILE A 79 2.592 -0.267 -1.781 1.00 0.00 H new ATOM 0 HG23 ILE A 79 1.309 0.880 -1.327 1.00 0.00 H new ATOM 0 HD11 ILE A 79 0.600 2.581 1.709 1.00 0.00 H new ATOM 0 HD12 ILE A 79 1.287 2.436 0.074 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -0.094 1.421 0.551 1.00 0.00 H new ATOM 1183 N LEU A 80 0.824 -3.014 -1.447 1.00 0.00 N ATOM 1184 CA LEU A 80 1.221 -4.105 -2.331 1.00 0.00 C ATOM 1185 C LEU A 80 2.080 -3.589 -3.481 1.00 0.00 C ATOM 1186 O LEU A 80 2.997 -4.270 -3.938 1.00 0.00 O ATOM 1187 CB LEU A 80 -0.016 -4.816 -2.882 1.00 0.00 C ATOM 1188 CG LEU A 80 -1.002 -5.352 -1.843 1.00 0.00 C ATOM 1189 CD1 LEU A 80 -2.156 -6.070 -2.524 1.00 0.00 C ATOM 1190 CD2 LEU A 80 -0.295 -6.280 -0.866 1.00 0.00 C ATOM 0 H LEU A 80 -0.146 -2.716 -1.554 1.00 0.00 H new ATOM 0 HA LEU A 80 1.812 -4.814 -1.751 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -0.548 -4.123 -3.534 1.00 0.00 H new ATOM 0 HB3 LEU A 80 0.315 -5.649 -3.503 1.00 0.00 H new ATOM 0 HG LEU A 80 -1.406 -4.508 -1.283 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -2.848 -6.445 -1.769 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -2.679 -5.376 -3.182 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -1.771 -6.905 -3.109 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -1.012 -6.652 -0.134 1.00 0.00 H new ATOM 0 HD22 LEU A 80 0.137 -7.120 -1.410 1.00 0.00 H new ATOM 0 HD23 LEU A 80 0.497 -5.734 -0.353 1.00 0.00 H new ATOM 1202 N ALA A 81 1.778 -2.379 -3.941 1.00 0.00 N ATOM 1203 CA ALA A 81 2.525 -1.770 -5.035 1.00 0.00 C ATOM 1204 C ALA A 81 2.421 -0.249 -4.990 1.00 0.00 C ATOM 1205 O ALA A 81 1.411 0.300 -4.547 1.00 0.00 O ATOM 1206 CB ALA A 81 2.027 -2.296 -6.372 1.00 0.00 C ATOM 0 H ALA A 81 1.022 -1.802 -3.573 1.00 0.00 H new ATOM 0 HA ALA A 81 3.575 -2.040 -4.920 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.594 -1.832 -7.179 1.00 0.00 H new ATOM 0 HB2 ALA A 81 2.160 -3.377 -6.410 1.00 0.00 H new ATOM 0 HB3 ALA A 81 0.970 -2.056 -6.487 1.00 0.00 H new ATOM 1212 N ILE A 82 3.469 0.425 -5.451 1.00 0.00 N ATOM 1213 CA ILE A 82 3.494 1.882 -5.464 1.00 0.00 C ATOM 1214 C ILE A 82 3.906 2.413 -6.833 1.00 0.00 C ATOM 1215 O ILE A 82 4.976 2.081 -7.342 1.00 0.00 O ATOM 1216 CB ILE A 82 4.457 2.438 -4.399 1.00 0.00 C ATOM 1217 CG1 ILE A 82 4.067 1.927 -3.010 1.00 0.00 C ATOM 1218 CG2 ILE A 82 4.457 3.960 -4.428 1.00 0.00 C ATOM 1219 CD1 ILE A 82 5.099 2.223 -1.945 1.00 0.00 C ATOM 0 H ILE A 82 4.312 -0.015 -5.820 1.00 0.00 H new ATOM 0 HA ILE A 82 2.482 2.217 -5.237 1.00 0.00 H new ATOM 0 HB ILE A 82 5.465 2.089 -4.624 1.00 0.00 H new ATOM 0 HG12 ILE A 82 3.118 2.377 -2.720 1.00 0.00 H new ATOM 0 HG13 ILE A 82 3.907 0.850 -3.060 1.00 0.00 H new ATOM 0 HG21 ILE A 82 5.142 4.338 -3.670 1.00 0.00 H new ATOM 0 HG22 ILE A 82 4.777 4.305 -5.411 1.00 0.00 H new ATOM 0 HG23 ILE A 82 3.451 4.328 -4.224 1.00 0.00 H new ATOM 0 HD11 ILE A 82 4.756 1.832 -0.987 1.00 0.00 H new ATOM 0 HD12 ILE A 82 6.044 1.750 -2.212 1.00 0.00 H new ATOM 0 HD13 ILE A 82 5.242 3.301 -1.867 1.00 0.00 H new ATOM 1231 N ASN A 83 3.050 3.241 -7.423 1.00 0.00 N ATOM 1232 CA ASN A 83 3.326 3.820 -8.733 1.00 0.00 C ATOM 1233 C ASN A 83 3.634 2.730 -9.755 1.00 0.00 C ATOM 1234 O ASN A 83 4.633 2.800 -10.473 1.00 0.00 O ATOM 1235 CB ASN A 83 4.500 4.798 -8.644 1.00 0.00 C ATOM 1236 CG ASN A 83 4.118 6.099 -7.967 1.00 0.00 C ATOM 1237 OD1 ASN A 83 4.583 6.400 -6.868 1.00 0.00 O ATOM 1238 ND2 ASN A 83 3.265 6.879 -8.622 1.00 0.00 N ATOM 0 H ASN A 83 2.160 3.526 -7.015 1.00 0.00 H new ATOM 0 HA ASN A 83 2.437 4.359 -9.060 1.00 0.00 H new ATOM 0 HB2 ASN A 83 5.317 4.331 -8.094 1.00 0.00 H new ATOM 0 HB3 ASN A 83 4.871 5.009 -9.647 1.00 0.00 H new ATOM 0 HD21 ASN A 83 2.971 7.767 -8.216 1.00 0.00 H new ATOM 0 HD22 ASN A 83 2.904 6.590 -9.531 1.00 0.00 H new ATOM 1245 N HIS A 84 2.770 1.722 -9.816 1.00 0.00 N ATOM 1246 CA HIS A 84 2.948 0.617 -10.751 1.00 0.00 C ATOM 1247 C HIS A 84 4.242 -0.137 -10.461 1.00 0.00 C ATOM 1248 O HIS A 84 5.089 -0.300 -11.340 1.00 0.00 O ATOM 1249 CB HIS A 84 2.958 1.135 -12.190 1.00 0.00 C ATOM 1250 CG HIS A 84 2.742 0.063 -13.214 1.00 0.00 C ATOM 1251 ND1 HIS A 84 3.659 -0.229 -14.201 1.00 0.00 N ATOM 1252 CD2 HIS A 84 1.707 -0.789 -13.398 1.00 0.00 C ATOM 1253 CE1 HIS A 84 3.196 -1.214 -14.950 1.00 0.00 C ATOM 1254 NE2 HIS A 84 2.014 -1.572 -14.484 1.00 0.00 N ATOM 0 H HIS A 84 1.939 1.648 -9.229 1.00 0.00 H new ATOM 0 HA HIS A 84 2.111 -0.070 -10.626 1.00 0.00 H new ATOM 0 HB2 HIS A 84 2.182 1.893 -12.300 1.00 0.00 H new ATOM 0 HB3 HIS A 84 3.912 1.625 -12.385 1.00 0.00 H new ATOM 0 HD2 HIS A 84 0.808 -0.843 -12.802 1.00 0.00 H new ATOM 0 HE1 HIS A 84 3.699 -1.652 -15.799 1.00 0.00 H new ATOM 0 HE2 HIS A 84 1.424 -2.310 -14.868 1.00 0.00 H new ATOM 1263 N THR A 85 4.390 -0.594 -9.221 1.00 0.00 N ATOM 1264 CA THR A 85 5.581 -1.329 -8.814 1.00 0.00 C ATOM 1265 C THR A 85 5.367 -2.027 -7.477 1.00 0.00 C ATOM 1266 O THR A 85 5.283 -1.394 -6.424 1.00 0.00 O ATOM 1267 CB THR A 85 6.805 -0.399 -8.704 1.00 0.00 C ATOM 1268 OG1 THR A 85 7.149 0.112 -9.997 1.00 0.00 O ATOM 1269 CG2 THR A 85 7.995 -1.138 -8.111 1.00 0.00 C ATOM 0 H THR A 85 3.699 -0.468 -8.481 1.00 0.00 H new ATOM 0 HA THR A 85 5.769 -2.076 -9.585 1.00 0.00 H new ATOM 0 HB THR A 85 6.547 0.429 -8.044 1.00 0.00 H new ATOM 0 HG1 THR A 85 6.596 -0.324 -10.679 1.00 0.00 H new ATOM 0 HG21 THR A 85 8.847 -0.461 -8.043 1.00 0.00 H new ATOM 0 HG22 THR A 85 7.739 -1.500 -7.115 1.00 0.00 H new ATOM 0 HG23 THR A 85 8.253 -1.983 -8.749 1.00 0.00 H new ATOM 1277 N PRO A 86 5.276 -3.365 -7.515 1.00 0.00 N ATOM 1278 CA PRO A 86 5.070 -4.179 -6.313 1.00 0.00 C ATOM 1279 C PRO A 86 6.295 -4.190 -5.404 1.00 0.00 C ATOM 1280 O PRO A 86 7.432 -4.166 -5.878 1.00 0.00 O ATOM 1281 CB PRO A 86 4.807 -5.579 -6.873 1.00 0.00 C ATOM 1282 CG PRO A 86 5.481 -5.588 -8.202 1.00 0.00 C ATOM 1283 CD PRO A 86 5.366 -4.186 -8.734 1.00 0.00 C ATOM 0 HA PRO A 86 4.260 -3.794 -5.694 1.00 0.00 H new ATOM 0 HB2 PRO A 86 5.213 -6.350 -6.218 1.00 0.00 H new ATOM 0 HB3 PRO A 86 3.739 -5.773 -6.970 1.00 0.00 H new ATOM 0 HG2 PRO A 86 6.525 -5.885 -8.108 1.00 0.00 H new ATOM 0 HG3 PRO A 86 5.006 -6.301 -8.876 1.00 0.00 H new ATOM 0 HD2 PRO A 86 6.231 -3.914 -9.339 1.00 0.00 H new ATOM 0 HD3 PRO A 86 4.485 -4.067 -9.365 1.00 0.00 H new ATOM 1291 N LEU A 87 6.057 -4.227 -4.098 1.00 0.00 N ATOM 1292 CA LEU A 87 7.141 -4.242 -3.122 1.00 0.00 C ATOM 1293 C LEU A 87 7.478 -5.670 -2.705 1.00 0.00 C ATOM 1294 O LEU A 87 7.740 -5.940 -1.533 1.00 0.00 O ATOM 1295 CB LEU A 87 6.759 -3.417 -1.893 1.00 0.00 C ATOM 1296 CG LEU A 87 6.090 -2.070 -2.170 1.00 0.00 C ATOM 1297 CD1 LEU A 87 5.766 -1.356 -0.867 1.00 0.00 C ATOM 1298 CD2 LEU A 87 6.980 -1.203 -3.048 1.00 0.00 C ATOM 0 H LEU A 87 5.122 -4.247 -3.690 1.00 0.00 H new ATOM 0 HA LEU A 87 8.022 -3.801 -3.588 1.00 0.00 H new ATOM 0 HB2 LEU A 87 6.088 -4.013 -1.274 1.00 0.00 H new ATOM 0 HB3 LEU A 87 7.660 -3.239 -1.306 1.00 0.00 H new ATOM 0 HG LEU A 87 5.156 -2.253 -2.702 1.00 0.00 H new ATOM 0 HD11 LEU A 87 5.291 -0.400 -1.085 1.00 0.00 H new ATOM 0 HD12 LEU A 87 5.089 -1.971 -0.274 1.00 0.00 H new ATOM 0 HD13 LEU A 87 6.686 -1.185 -0.307 1.00 0.00 H new ATOM 0 HD21 LEU A 87 6.488 -0.249 -3.235 1.00 0.00 H new ATOM 0 HD22 LEU A 87 7.930 -1.029 -2.543 1.00 0.00 H new ATOM 0 HD23 LEU A 87 7.160 -1.710 -3.996 1.00 0.00 H new ATOM 1310 N ASP A 88 7.473 -6.580 -3.673 1.00 0.00 N ATOM 1311 CA ASP A 88 7.781 -7.981 -3.407 1.00 0.00 C ATOM 1312 C ASP A 88 9.171 -8.124 -2.795 1.00 0.00 C ATOM 1313 O ASP A 88 9.920 -7.152 -2.700 1.00 0.00 O ATOM 1314 CB ASP A 88 7.692 -8.798 -4.697 1.00 0.00 C ATOM 1315 CG ASP A 88 7.766 -10.291 -4.442 1.00 0.00 C ATOM 1316 OD1 ASP A 88 7.125 -10.761 -3.478 1.00 0.00 O ATOM 1317 OD2 ASP A 88 8.463 -10.989 -5.207 1.00 0.00 O ATOM 0 H ASP A 88 7.259 -6.373 -4.649 1.00 0.00 H new ATOM 0 HA ASP A 88 7.049 -8.360 -2.694 1.00 0.00 H new ATOM 0 HB2 ASP A 88 6.757 -8.565 -5.207 1.00 0.00 H new ATOM 0 HB3 ASP A 88 8.502 -8.506 -5.366 1.00 0.00 H new ATOM 1322 N GLN A 89 9.507 -9.341 -2.380 1.00 0.00 N ATOM 1323 CA GLN A 89 10.806 -9.610 -1.775 1.00 0.00 C ATOM 1324 C GLN A 89 11.902 -8.798 -2.456 1.00 0.00 C ATOM 1325 O GLN A 89 12.832 -8.324 -1.804 1.00 0.00 O ATOM 1326 CB GLN A 89 11.132 -11.102 -1.860 1.00 0.00 C ATOM 1327 CG GLN A 89 11.590 -11.547 -3.240 1.00 0.00 C ATOM 1328 CD GLN A 89 11.486 -13.047 -3.433 1.00 0.00 C ATOM 1329 OE1 GLN A 89 10.504 -13.670 -3.030 1.00 0.00 O ATOM 1330 NE2 GLN A 89 12.502 -13.636 -4.054 1.00 0.00 N ATOM 0 H GLN A 89 8.898 -10.156 -2.452 1.00 0.00 H new ATOM 0 HA GLN A 89 10.759 -9.315 -0.727 1.00 0.00 H new ATOM 0 HB2 GLN A 89 11.911 -11.337 -1.134 1.00 0.00 H new ATOM 0 HB3 GLN A 89 10.249 -11.675 -1.577 1.00 0.00 H new ATOM 0 HG2 GLN A 89 10.989 -11.044 -3.998 1.00 0.00 H new ATOM 0 HG3 GLN A 89 12.623 -11.235 -3.394 1.00 0.00 H new ATOM 0 HE21 GLN A 89 13.297 -13.081 -4.372 1.00 0.00 H new ATOM 0 HE22 GLN A 89 12.488 -14.643 -4.213 1.00 0.00 H new ATOM 1339 N ASN A 90 11.786 -8.642 -3.771 1.00 0.00 N ATOM 1340 CA ASN A 90 12.769 -7.888 -4.540 1.00 0.00 C ATOM 1341 C ASN A 90 13.036 -6.530 -3.899 1.00 0.00 C ATOM 1342 O ASN A 90 14.170 -6.216 -3.535 1.00 0.00 O ATOM 1343 CB ASN A 90 12.284 -7.698 -5.979 1.00 0.00 C ATOM 1344 CG ASN A 90 12.528 -8.924 -6.838 1.00 0.00 C ATOM 1345 OD1 ASN A 90 11.644 -9.764 -7.005 1.00 0.00 O ATOM 1346 ND2 ASN A 90 13.732 -9.032 -7.386 1.00 0.00 N ATOM 0 H ASN A 90 11.022 -9.027 -4.326 1.00 0.00 H new ATOM 0 HA ASN A 90 13.700 -8.455 -4.548 1.00 0.00 H new ATOM 0 HB2 ASN A 90 11.219 -7.468 -5.973 1.00 0.00 H new ATOM 0 HB3 ASN A 90 12.793 -6.841 -6.421 1.00 0.00 H new ATOM 0 HD21 ASN A 90 13.955 -9.836 -7.973 1.00 0.00 H new ATOM 0 HD22 ASN A 90 14.434 -8.311 -7.220 1.00 0.00 H new ATOM 1353 N ILE A 91 11.985 -5.729 -3.763 1.00 0.00 N ATOM 1354 CA ILE A 91 12.106 -4.405 -3.164 1.00 0.00 C ATOM 1355 C ILE A 91 11.967 -4.474 -1.646 1.00 0.00 C ATOM 1356 O ILE A 91 11.114 -5.190 -1.123 1.00 0.00 O ATOM 1357 CB ILE A 91 11.047 -3.436 -3.721 1.00 0.00 C ATOM 1358 CG1 ILE A 91 11.587 -2.712 -4.957 1.00 0.00 C ATOM 1359 CG2 ILE A 91 10.631 -2.435 -2.654 1.00 0.00 C ATOM 1360 CD1 ILE A 91 10.650 -1.654 -5.495 1.00 0.00 C ATOM 0 H ILE A 91 11.040 -5.973 -4.059 1.00 0.00 H new ATOM 0 HA ILE A 91 13.098 -4.032 -3.420 1.00 0.00 H new ATOM 0 HB ILE A 91 10.168 -4.011 -4.014 1.00 0.00 H new ATOM 0 HG12 ILE A 91 12.541 -2.248 -4.708 1.00 0.00 H new ATOM 0 HG13 ILE A 91 11.783 -3.444 -5.740 1.00 0.00 H new ATOM 0 HG21 ILE A 91 9.882 -1.757 -3.063 1.00 0.00 H new ATOM 0 HG22 ILE A 91 10.211 -2.967 -1.800 1.00 0.00 H new ATOM 0 HG23 ILE A 91 11.501 -1.863 -2.333 1.00 0.00 H new ATOM 0 HD11 ILE A 91 11.097 -1.183 -6.370 1.00 0.00 H new ATOM 0 HD12 ILE A 91 9.703 -2.115 -5.776 1.00 0.00 H new ATOM 0 HD13 ILE A 91 10.473 -0.900 -4.728 1.00 0.00 H new ATOM 1372 N SER A 92 12.810 -3.723 -0.946 1.00 0.00 N ATOM 1373 CA SER A 92 12.783 -3.699 0.512 1.00 0.00 C ATOM 1374 C SER A 92 11.800 -2.650 1.020 1.00 0.00 C ATOM 1375 O SER A 92 11.086 -2.021 0.239 1.00 0.00 O ATOM 1376 CB SER A 92 14.181 -3.415 1.065 1.00 0.00 C ATOM 1377 OG SER A 92 14.909 -4.616 1.253 1.00 0.00 O ATOM 0 H SER A 92 13.521 -3.123 -1.365 1.00 0.00 H new ATOM 0 HA SER A 92 12.455 -4.678 0.860 1.00 0.00 H new ATOM 0 HB2 SER A 92 14.721 -2.762 0.379 1.00 0.00 H new ATOM 0 HB3 SER A 92 14.099 -2.883 2.013 1.00 0.00 H new ATOM 0 HG SER A 92 15.799 -4.407 1.605 1.00 0.00 H new ATOM 1383 N HIS A 93 11.768 -2.466 2.336 1.00 0.00 N ATOM 1384 CA HIS A 93 10.873 -1.492 2.951 1.00 0.00 C ATOM 1385 C HIS A 93 11.281 -0.069 2.580 1.00 0.00 C ATOM 1386 O HIS A 93 10.431 0.783 2.323 1.00 0.00 O ATOM 1387 CB HIS A 93 10.874 -1.655 4.471 1.00 0.00 C ATOM 1388 CG HIS A 93 11.870 -0.780 5.167 1.00 0.00 C ATOM 1389 ND1 HIS A 93 13.111 -1.227 5.571 1.00 0.00 N ATOM 1390 CD2 HIS A 93 11.805 0.522 5.529 1.00 0.00 C ATOM 1391 CE1 HIS A 93 13.764 -0.237 6.153 1.00 0.00 C ATOM 1392 NE2 HIS A 93 12.994 0.836 6.140 1.00 0.00 N ATOM 0 H HIS A 93 12.352 -2.979 2.997 1.00 0.00 H new ATOM 0 HA HIS A 93 9.866 -1.673 2.575 1.00 0.00 H new ATOM 0 HB2 HIS A 93 9.878 -1.432 4.853 1.00 0.00 H new ATOM 0 HB3 HIS A 93 11.084 -2.696 4.716 1.00 0.00 H new ATOM 0 HD2 HIS A 93 10.972 1.190 5.367 1.00 0.00 H new ATOM 0 HE1 HIS A 93 14.759 -0.295 6.569 1.00 0.00 H new ATOM 0 HE2 HIS A 93 13.242 1.749 6.522 1.00 0.00 H new ATOM 1401 N GLN A 94 12.587 0.180 2.557 1.00 0.00 N ATOM 1402 CA GLN A 94 13.106 1.500 2.219 1.00 0.00 C ATOM 1403 C GLN A 94 12.634 1.933 0.835 1.00 0.00 C ATOM 1404 O GLN A 94 11.897 2.909 0.699 1.00 0.00 O ATOM 1405 CB GLN A 94 14.635 1.498 2.272 1.00 0.00 C ATOM 1406 CG GLN A 94 15.197 1.780 3.656 1.00 0.00 C ATOM 1407 CD GLN A 94 15.427 3.258 3.902 1.00 0.00 C ATOM 1408 OE1 GLN A 94 15.312 4.077 2.989 1.00 0.00 O ATOM 1409 NE2 GLN A 94 15.754 3.609 5.140 1.00 0.00 N ATOM 0 H GLN A 94 13.304 -0.514 2.768 1.00 0.00 H new ATOM 0 HA GLN A 94 12.724 2.211 2.951 1.00 0.00 H new ATOM 0 HB2 GLN A 94 15.001 0.529 1.931 1.00 0.00 H new ATOM 0 HB3 GLN A 94 15.015 2.245 1.576 1.00 0.00 H new ATOM 0 HG2 GLN A 94 14.510 1.393 4.409 1.00 0.00 H new ATOM 0 HG3 GLN A 94 16.138 1.244 3.778 1.00 0.00 H new ATOM 0 HE21 GLN A 94 15.838 2.898 5.866 1.00 0.00 H new ATOM 0 HE22 GLN A 94 15.921 4.590 5.365 1.00 0.00 H new ATOM 1418 N GLN A 95 13.063 1.201 -0.188 1.00 0.00 N ATOM 1419 CA GLN A 95 12.684 1.512 -1.561 1.00 0.00 C ATOM 1420 C GLN A 95 11.220 1.931 -1.640 1.00 0.00 C ATOM 1421 O GLN A 95 10.881 2.918 -2.291 1.00 0.00 O ATOM 1422 CB GLN A 95 12.931 0.303 -2.466 1.00 0.00 C ATOM 1423 CG GLN A 95 14.319 0.280 -3.085 1.00 0.00 C ATOM 1424 CD GLN A 95 14.619 -1.024 -3.798 1.00 0.00 C ATOM 1425 OE1 GLN A 95 14.570 -1.098 -5.026 1.00 0.00 O ATOM 1426 NE2 GLN A 95 14.930 -2.061 -3.030 1.00 0.00 N ATOM 0 H GLN A 95 13.673 0.389 -0.092 1.00 0.00 H new ATOM 0 HA GLN A 95 13.300 2.344 -1.902 1.00 0.00 H new ATOM 0 HB2 GLN A 95 12.785 -0.609 -1.887 1.00 0.00 H new ATOM 0 HB3 GLN A 95 12.187 0.298 -3.262 1.00 0.00 H new ATOM 0 HG2 GLN A 95 14.411 1.105 -3.791 1.00 0.00 H new ATOM 0 HG3 GLN A 95 15.063 0.443 -2.305 1.00 0.00 H new ATOM 0 HE21 GLN A 95 14.959 -1.954 -2.016 1.00 0.00 H new ATOM 0 HE22 GLN A 95 15.140 -2.965 -3.454 1.00 0.00 H new ATOM 1435 N ALA A 96 10.356 1.172 -0.973 1.00 0.00 N ATOM 1436 CA ALA A 96 8.928 1.466 -0.967 1.00 0.00 C ATOM 1437 C ALA A 96 8.666 2.906 -0.538 1.00 0.00 C ATOM 1438 O ALA A 96 7.924 3.634 -1.198 1.00 0.00 O ATOM 1439 CB ALA A 96 8.194 0.498 -0.051 1.00 0.00 C ATOM 0 H ALA A 96 10.620 0.350 -0.430 1.00 0.00 H new ATOM 0 HA ALA A 96 8.552 1.343 -1.983 1.00 0.00 H new ATOM 0 HB1 ALA A 96 7.129 0.729 -0.056 1.00 0.00 H new ATOM 0 HB2 ALA A 96 8.346 -0.522 -0.403 1.00 0.00 H new ATOM 0 HB3 ALA A 96 8.581 0.593 0.964 1.00 0.00 H new ATOM 1445 N ILE A 97 9.278 3.309 0.570 1.00 0.00 N ATOM 1446 CA ILE A 97 9.110 4.662 1.086 1.00 0.00 C ATOM 1447 C ILE A 97 9.615 5.698 0.087 1.00 0.00 C ATOM 1448 O ILE A 97 9.010 6.756 -0.085 1.00 0.00 O ATOM 1449 CB ILE A 97 9.851 4.851 2.422 1.00 0.00 C ATOM 1450 CG1 ILE A 97 9.490 3.726 3.394 1.00 0.00 C ATOM 1451 CG2 ILE A 97 9.518 6.207 3.026 1.00 0.00 C ATOM 1452 CD1 ILE A 97 10.181 3.840 4.735 1.00 0.00 C ATOM 0 H ILE A 97 9.895 2.718 1.128 1.00 0.00 H new ATOM 0 HA ILE A 97 8.042 4.807 1.248 1.00 0.00 H new ATOM 0 HB ILE A 97 10.924 4.813 2.234 1.00 0.00 H new ATOM 0 HG12 ILE A 97 8.411 3.724 3.550 1.00 0.00 H new ATOM 0 HG13 ILE A 97 9.749 2.769 2.941 1.00 0.00 H new ATOM 0 HG21 ILE A 97 10.050 6.325 3.970 1.00 0.00 H new ATOM 0 HG22 ILE A 97 9.821 6.996 2.338 1.00 0.00 H new ATOM 0 HG23 ILE A 97 8.445 6.273 3.203 1.00 0.00 H new ATOM 0 HD11 ILE A 97 9.878 3.009 5.372 1.00 0.00 H new ATOM 0 HD12 ILE A 97 11.261 3.812 4.591 1.00 0.00 H new ATOM 0 HD13 ILE A 97 9.903 4.781 5.209 1.00 0.00 H new ATOM 1464 N ALA A 98 10.726 5.384 -0.571 1.00 0.00 N ATOM 1465 CA ALA A 98 11.310 6.286 -1.557 1.00 0.00 C ATOM 1466 C ALA A 98 10.300 6.643 -2.641 1.00 0.00 C ATOM 1467 O ALA A 98 9.944 7.810 -2.813 1.00 0.00 O ATOM 1468 CB ALA A 98 12.551 5.660 -2.175 1.00 0.00 C ATOM 0 H ALA A 98 11.240 4.513 -0.440 1.00 0.00 H new ATOM 0 HA ALA A 98 11.596 7.206 -1.047 1.00 0.00 H new ATOM 0 HB1 ALA A 98 12.977 6.344 -2.909 1.00 0.00 H new ATOM 0 HB2 ALA A 98 13.286 5.462 -1.395 1.00 0.00 H new ATOM 0 HB3 ALA A 98 12.281 4.724 -2.665 1.00 0.00 H new ATOM 1474 N LEU A 99 9.841 5.633 -3.372 1.00 0.00 N ATOM 1475 CA LEU A 99 8.871 5.840 -4.442 1.00 0.00 C ATOM 1476 C LEU A 99 7.872 6.930 -4.067 1.00 0.00 C ATOM 1477 O LEU A 99 7.352 7.635 -4.933 1.00 0.00 O ATOM 1478 CB LEU A 99 8.131 4.537 -4.746 1.00 0.00 C ATOM 1479 CG LEU A 99 9.008 3.314 -5.017 1.00 0.00 C ATOM 1480 CD1 LEU A 99 8.158 2.057 -5.109 1.00 0.00 C ATOM 1481 CD2 LEU A 99 9.815 3.509 -6.292 1.00 0.00 C ATOM 0 H LEU A 99 10.125 4.662 -3.243 1.00 0.00 H new ATOM 0 HA LEU A 99 9.412 6.159 -5.333 1.00 0.00 H new ATOM 0 HB2 LEU A 99 7.476 4.310 -3.905 1.00 0.00 H new ATOM 0 HB3 LEU A 99 7.491 4.700 -5.613 1.00 0.00 H new ATOM 0 HG LEU A 99 9.703 3.197 -4.185 1.00 0.00 H new ATOM 0 HD11 LEU A 99 8.800 1.197 -5.302 1.00 0.00 H new ATOM 0 HD12 LEU A 99 7.625 1.908 -4.170 1.00 0.00 H new ATOM 0 HD13 LEU A 99 7.439 2.163 -5.921 1.00 0.00 H new ATOM 0 HD21 LEU A 99 10.433 2.629 -6.469 1.00 0.00 H new ATOM 0 HD22 LEU A 99 9.137 3.652 -7.133 1.00 0.00 H new ATOM 0 HD23 LEU A 99 10.454 4.386 -6.188 1.00 0.00 H new ATOM 1493 N LEU A 100 7.611 7.065 -2.772 1.00 0.00 N ATOM 1494 CA LEU A 100 6.675 8.072 -2.281 1.00 0.00 C ATOM 1495 C LEU A 100 7.341 9.442 -2.204 1.00 0.00 C ATOM 1496 O LEU A 100 6.844 10.416 -2.768 1.00 0.00 O ATOM 1497 CB LEU A 100 6.142 7.673 -0.904 1.00 0.00 C ATOM 1498 CG LEU A 100 5.480 6.298 -0.813 1.00 0.00 C ATOM 1499 CD1 LEU A 100 5.334 5.870 0.639 1.00 0.00 C ATOM 1500 CD2 LEU A 100 4.125 6.312 -1.506 1.00 0.00 C ATOM 0 H LEU A 100 8.034 6.491 -2.043 1.00 0.00 H new ATOM 0 HA LEU A 100 5.843 8.132 -2.982 1.00 0.00 H new ATOM 0 HB2 LEU A 100 6.968 7.704 -0.194 1.00 0.00 H new ATOM 0 HB3 LEU A 100 5.419 8.424 -0.585 1.00 0.00 H new ATOM 0 HG LEU A 100 6.118 5.575 -1.320 1.00 0.00 H new ATOM 0 HD11 LEU A 100 4.861 4.889 0.683 1.00 0.00 H new ATOM 0 HD12 LEU A 100 6.318 5.819 1.104 1.00 0.00 H new ATOM 0 HD13 LEU A 100 4.718 6.594 1.172 1.00 0.00 H new ATOM 0 HD21 LEU A 100 3.668 5.325 -1.432 1.00 0.00 H new ATOM 0 HD22 LEU A 100 3.479 7.048 -1.027 1.00 0.00 H new ATOM 0 HD23 LEU A 100 4.256 6.573 -2.556 1.00 0.00 H new ATOM 1512 N GLN A 101 8.469 9.508 -1.503 1.00 0.00 N ATOM 1513 CA GLN A 101 9.203 10.759 -1.354 1.00 0.00 C ATOM 1514 C GLN A 101 9.821 11.189 -2.681 1.00 0.00 C ATOM 1515 O GLN A 101 10.285 12.320 -2.822 1.00 0.00 O ATOM 1516 CB GLN A 101 10.295 10.610 -0.294 1.00 0.00 C ATOM 1517 CG GLN A 101 9.761 10.248 1.083 1.00 0.00 C ATOM 1518 CD GLN A 101 10.712 10.636 2.198 1.00 0.00 C ATOM 1519 OE1 GLN A 101 11.445 11.620 2.090 1.00 0.00 O ATOM 1520 NE2 GLN A 101 10.706 9.863 3.278 1.00 0.00 N ATOM 0 H GLN A 101 8.894 8.710 -1.030 1.00 0.00 H new ATOM 0 HA GLN A 101 8.500 11.528 -1.036 1.00 0.00 H new ATOM 0 HB2 GLN A 101 10.999 9.842 -0.615 1.00 0.00 H new ATOM 0 HB3 GLN A 101 10.852 11.544 -0.224 1.00 0.00 H new ATOM 0 HG2 GLN A 101 8.803 10.744 1.239 1.00 0.00 H new ATOM 0 HG3 GLN A 101 9.575 9.175 1.126 1.00 0.00 H new ATOM 0 HE21 GLN A 101 10.082 9.057 3.325 1.00 0.00 H new ATOM 0 HE22 GLN A 101 11.325 10.075 4.060 1.00 0.00 H new ATOM 1529 N GLN A 102 9.823 10.279 -3.650 1.00 0.00 N ATOM 1530 CA GLN A 102 10.385 10.564 -4.964 1.00 0.00 C ATOM 1531 C GLN A 102 9.293 10.594 -6.028 1.00 0.00 C ATOM 1532 O GLN A 102 9.533 10.263 -7.190 1.00 0.00 O ATOM 1533 CB GLN A 102 11.441 9.519 -5.329 1.00 0.00 C ATOM 1534 CG GLN A 102 10.854 8.175 -5.728 1.00 0.00 C ATOM 1535 CD GLN A 102 11.721 7.432 -6.724 1.00 0.00 C ATOM 1536 OE1 GLN A 102 11.547 7.564 -7.936 1.00 0.00 O ATOM 1537 NE2 GLN A 102 12.663 6.644 -6.218 1.00 0.00 N ATOM 0 H GLN A 102 9.442 9.338 -3.549 1.00 0.00 H new ATOM 0 HA GLN A 102 10.856 11.546 -4.924 1.00 0.00 H new ATOM 0 HB2 GLN A 102 12.048 9.899 -6.151 1.00 0.00 H new ATOM 0 HB3 GLN A 102 12.108 9.377 -4.479 1.00 0.00 H new ATOM 0 HG2 GLN A 102 10.723 7.561 -4.837 1.00 0.00 H new ATOM 0 HG3 GLN A 102 9.864 8.328 -6.157 1.00 0.00 H new ATOM 0 HE21 GLN A 102 12.772 6.564 -5.207 1.00 0.00 H new ATOM 0 HE22 GLN A 102 13.277 6.119 -6.840 1.00 0.00 H new ATOM 1546 N THR A 103 8.090 10.993 -5.625 1.00 0.00 N ATOM 1547 CA THR A 103 6.961 11.065 -6.543 1.00 0.00 C ATOM 1548 C THR A 103 6.072 12.263 -6.229 1.00 0.00 C ATOM 1549 O THR A 103 5.318 12.252 -5.255 1.00 0.00 O ATOM 1550 CB THR A 103 6.111 9.781 -6.488 1.00 0.00 C ATOM 1551 OG1 THR A 103 6.821 8.697 -7.096 1.00 0.00 O ATOM 1552 CG2 THR A 103 4.780 9.983 -7.198 1.00 0.00 C ATOM 0 H THR A 103 7.873 11.271 -4.668 1.00 0.00 H new ATOM 0 HA THR A 103 7.375 11.176 -7.545 1.00 0.00 H new ATOM 0 HB THR A 103 5.916 9.545 -5.442 1.00 0.00 H new ATOM 0 HG1 THR A 103 7.353 8.232 -6.417 1.00 0.00 H new ATOM 0 HG21 THR A 103 4.197 9.064 -7.146 1.00 0.00 H new ATOM 0 HG22 THR A 103 4.229 10.790 -6.715 1.00 0.00 H new ATOM 0 HG23 THR A 103 4.960 10.240 -8.242 1.00 0.00 H new ATOM 1560 N THR A 104 6.165 13.296 -7.060 1.00 0.00 N ATOM 1561 CA THR A 104 5.370 14.503 -6.871 1.00 0.00 C ATOM 1562 C THR A 104 4.151 14.507 -7.787 1.00 0.00 C ATOM 1563 O THR A 104 3.985 13.617 -8.619 1.00 0.00 O ATOM 1564 CB THR A 104 6.202 15.772 -7.137 1.00 0.00 C ATOM 1565 OG1 THR A 104 7.177 15.514 -8.154 1.00 0.00 O ATOM 1566 CG2 THR A 104 6.898 16.239 -5.867 1.00 0.00 C ATOM 0 H THR A 104 6.783 13.321 -7.871 1.00 0.00 H new ATOM 0 HA THR A 104 5.041 14.505 -5.832 1.00 0.00 H new ATOM 0 HB THR A 104 5.527 16.559 -7.473 1.00 0.00 H new ATOM 0 HG1 THR A 104 7.701 16.326 -8.319 1.00 0.00 H new ATOM 0 HG21 THR A 104 7.479 17.136 -6.080 1.00 0.00 H new ATOM 0 HG22 THR A 104 6.152 16.462 -5.104 1.00 0.00 H new ATOM 0 HG23 THR A 104 7.562 15.454 -5.506 1.00 0.00 H new ATOM 1574 N GLY A 105 3.300 15.517 -7.627 1.00 0.00 N ATOM 1575 CA GLY A 105 2.107 15.618 -8.447 1.00 0.00 C ATOM 1576 C GLY A 105 1.066 14.577 -8.086 1.00 0.00 C ATOM 1577 O GLY A 105 0.130 14.859 -7.338 1.00 0.00 O ATOM 0 H GLY A 105 3.416 16.266 -6.945 1.00 0.00 H new ATOM 0 HA2 GLY A 105 1.676 16.613 -8.335 1.00 0.00 H new ATOM 0 HA3 GLY A 105 2.380 15.506 -9.496 1.00 0.00 H new ATOM 1581 N SER A 106 1.227 13.371 -8.621 1.00 0.00 N ATOM 1582 CA SER A 106 0.289 12.286 -8.355 1.00 0.00 C ATOM 1583 C SER A 106 1.016 11.064 -7.802 1.00 0.00 C ATOM 1584 O SER A 106 2.038 10.638 -8.341 1.00 0.00 O ATOM 1585 CB SER A 106 -0.464 11.910 -9.633 1.00 0.00 C ATOM 1586 OG SER A 106 -1.056 13.051 -10.230 1.00 0.00 O ATOM 0 H SER A 106 1.997 13.120 -9.241 1.00 0.00 H new ATOM 0 HA SER A 106 -0.426 12.631 -7.608 1.00 0.00 H new ATOM 0 HB2 SER A 106 0.222 11.441 -10.338 1.00 0.00 H new ATOM 0 HB3 SER A 106 -1.235 11.175 -9.402 1.00 0.00 H new ATOM 0 HG SER A 106 -1.530 12.785 -11.046 1.00 0.00 H new ATOM 1592 N LEU A 107 0.480 10.504 -6.722 1.00 0.00 N ATOM 1593 CA LEU A 107 1.076 9.330 -6.094 1.00 0.00 C ATOM 1594 C LEU A 107 0.096 8.161 -6.084 1.00 0.00 C ATOM 1595 O LEU A 107 -0.860 8.147 -5.308 1.00 0.00 O ATOM 1596 CB LEU A 107 1.511 9.658 -4.665 1.00 0.00 C ATOM 1597 CG LEU A 107 2.025 8.482 -3.833 1.00 0.00 C ATOM 1598 CD1 LEU A 107 3.270 7.883 -4.469 1.00 0.00 C ATOM 1599 CD2 LEU A 107 2.314 8.924 -2.406 1.00 0.00 C ATOM 0 H LEU A 107 -0.365 10.844 -6.264 1.00 0.00 H new ATOM 0 HA LEU A 107 1.951 9.041 -6.677 1.00 0.00 H new ATOM 0 HB2 LEU A 107 2.294 10.415 -4.710 1.00 0.00 H new ATOM 0 HB3 LEU A 107 0.665 10.105 -4.142 1.00 0.00 H new ATOM 0 HG LEU A 107 1.251 7.715 -3.805 1.00 0.00 H new ATOM 0 HD11 LEU A 107 3.622 7.048 -3.864 1.00 0.00 H new ATOM 0 HD12 LEU A 107 3.032 7.529 -5.472 1.00 0.00 H new ATOM 0 HD13 LEU A 107 4.050 8.642 -4.528 1.00 0.00 H new ATOM 0 HD21 LEU A 107 2.679 8.074 -1.829 1.00 0.00 H new ATOM 0 HD22 LEU A 107 3.071 9.709 -2.414 1.00 0.00 H new ATOM 0 HD23 LEU A 107 1.400 9.306 -1.951 1.00 0.00 H new ATOM 1611 N ARG A 108 0.342 7.183 -6.949 1.00 0.00 N ATOM 1612 CA ARG A 108 -0.518 6.009 -7.039 1.00 0.00 C ATOM 1613 C ARG A 108 -0.047 4.915 -6.085 1.00 0.00 C ATOM 1614 O ARG A 108 1.148 4.634 -5.988 1.00 0.00 O ATOM 1615 CB ARG A 108 -0.541 5.476 -8.472 1.00 0.00 C ATOM 1616 CG ARG A 108 -1.858 4.821 -8.858 1.00 0.00 C ATOM 1617 CD ARG A 108 -1.707 3.956 -10.099 1.00 0.00 C ATOM 1618 NE ARG A 108 -1.811 4.739 -11.328 1.00 0.00 N ATOM 1619 CZ ARG A 108 -0.783 5.369 -11.887 1.00 0.00 C ATOM 1620 NH1 ARG A 108 0.419 5.307 -11.330 1.00 0.00 N ATOM 1621 NH2 ARG A 108 -0.956 6.061 -13.005 1.00 0.00 N ATOM 0 H ARG A 108 1.129 7.180 -7.597 1.00 0.00 H new ATOM 0 HA ARG A 108 -1.527 6.306 -6.753 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -0.338 6.297 -9.159 1.00 0.00 H new ATOM 0 HB3 ARG A 108 0.265 4.752 -8.594 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -2.219 4.211 -8.030 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -2.609 5.590 -9.038 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -0.742 3.449 -10.073 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -2.474 3.182 -10.097 1.00 0.00 H new ATOM 0 HE ARG A 108 -2.722 4.806 -11.782 1.00 0.00 H new ATOM 0 HH11 ARG A 108 0.556 4.775 -10.471 1.00 0.00 H new ATOM 0 HH12 ARG A 108 1.206 5.791 -11.761 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -1.879 6.110 -13.437 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -0.166 6.544 -13.433 1.00 0.00 H new ATOM 1635 N LEU A 109 -0.993 4.302 -5.383 1.00 0.00 N ATOM 1636 CA LEU A 109 -0.675 3.239 -4.436 1.00 0.00 C ATOM 1637 C LEU A 109 -1.684 2.099 -4.538 1.00 0.00 C ATOM 1638 O LEU A 109 -2.747 2.250 -5.140 1.00 0.00 O ATOM 1639 CB LEU A 109 -0.653 3.789 -3.009 1.00 0.00 C ATOM 1640 CG LEU A 109 0.164 5.064 -2.794 1.00 0.00 C ATOM 1641 CD1 LEU A 109 -0.105 5.643 -1.414 1.00 0.00 C ATOM 1642 CD2 LEU A 109 1.648 4.783 -2.976 1.00 0.00 C ATOM 0 H LEU A 109 -1.987 4.523 -5.451 1.00 0.00 H new ATOM 0 HA LEU A 109 0.312 2.849 -4.684 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -1.680 3.983 -2.700 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -0.262 3.015 -2.349 1.00 0.00 H new ATOM 0 HG LEU A 109 -0.141 5.798 -3.540 1.00 0.00 H new ATOM 0 HD11 LEU A 109 0.485 6.550 -1.279 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -1.164 5.882 -1.320 1.00 0.00 H new ATOM 0 HD13 LEU A 109 0.172 4.913 -0.653 1.00 0.00 H new ATOM 0 HD21 LEU A 109 2.214 5.701 -2.819 1.00 0.00 H new ATOM 0 HD22 LEU A 109 1.967 4.032 -2.253 1.00 0.00 H new ATOM 0 HD23 LEU A 109 1.827 4.414 -3.986 1.00 0.00 H new ATOM 1654 N ILE A 110 -1.343 0.960 -3.944 1.00 0.00 N ATOM 1655 CA ILE A 110 -2.221 -0.204 -3.966 1.00 0.00 C ATOM 1656 C ILE A 110 -2.215 -0.922 -2.621 1.00 0.00 C ATOM 1657 O ILE A 110 -1.191 -1.456 -2.194 1.00 0.00 O ATOM 1658 CB ILE A 110 -1.810 -1.199 -5.068 1.00 0.00 C ATOM 1659 CG1 ILE A 110 -1.868 -0.526 -6.441 1.00 0.00 C ATOM 1660 CG2 ILE A 110 -2.708 -2.426 -5.035 1.00 0.00 C ATOM 1661 CD1 ILE A 110 -1.129 -1.287 -7.519 1.00 0.00 C ATOM 0 H ILE A 110 -0.466 0.818 -3.442 1.00 0.00 H new ATOM 0 HA ILE A 110 -3.226 0.163 -4.175 1.00 0.00 H new ATOM 0 HB ILE A 110 -0.784 -1.519 -4.884 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -2.911 -0.413 -6.737 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -1.448 0.477 -6.363 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -2.405 -3.120 -5.819 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -2.621 -2.915 -4.065 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -3.743 -2.124 -5.197 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -1.213 -0.752 -8.465 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -0.078 -1.378 -7.245 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -1.563 -2.281 -7.625 1.00 0.00 H new ATOM 1673 N VAL A 111 -3.366 -0.932 -1.957 1.00 0.00 N ATOM 1674 CA VAL A 111 -3.495 -1.588 -0.660 1.00 0.00 C ATOM 1675 C VAL A 111 -4.605 -2.633 -0.681 1.00 0.00 C ATOM 1676 O VAL A 111 -5.540 -2.545 -1.477 1.00 0.00 O ATOM 1677 CB VAL A 111 -3.786 -0.568 0.457 1.00 0.00 C ATOM 1678 CG1 VAL A 111 -2.729 0.526 0.470 1.00 0.00 C ATOM 1679 CG2 VAL A 111 -5.177 0.024 0.289 1.00 0.00 C ATOM 0 H VAL A 111 -4.223 -0.494 -2.295 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.543 -2.078 -0.456 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.750 -1.085 1.416 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -2.951 1.237 1.266 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.748 0.083 0.643 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -2.729 1.043 -0.489 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -5.365 0.742 1.087 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -5.244 0.527 -0.676 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -5.919 -0.773 0.335 1.00 0.00 H new ATOM 1689 N ALA A 112 -4.495 -3.621 0.200 1.00 0.00 N ATOM 1690 CA ALA A 112 -5.491 -4.683 0.285 1.00 0.00 C ATOM 1691 C ALA A 112 -6.378 -4.506 1.513 1.00 0.00 C ATOM 1692 O ALA A 112 -6.047 -3.749 2.426 1.00 0.00 O ATOM 1693 CB ALA A 112 -4.811 -6.043 0.315 1.00 0.00 C ATOM 0 H ALA A 112 -3.727 -3.709 0.865 1.00 0.00 H new ATOM 0 HA ALA A 112 -6.124 -4.625 -0.600 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -5.566 -6.826 0.379 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -4.225 -6.177 -0.594 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -4.153 -6.102 1.182 1.00 0.00 H new ATOM 1699 N ARG A 113 -7.506 -5.209 1.528 1.00 0.00 N ATOM 1700 CA ARG A 113 -8.442 -5.128 2.643 1.00 0.00 C ATOM 1701 C ARG A 113 -9.062 -6.492 2.932 1.00 0.00 C ATOM 1702 O ARG A 113 -9.379 -7.247 2.014 1.00 0.00 O ATOM 1703 CB ARG A 113 -9.542 -4.109 2.341 1.00 0.00 C ATOM 1704 CG ARG A 113 -9.043 -2.874 1.609 1.00 0.00 C ATOM 1705 CD ARG A 113 -9.933 -1.670 1.876 1.00 0.00 C ATOM 1706 NE ARG A 113 -9.545 -0.513 1.074 1.00 0.00 N ATOM 1707 CZ ARG A 113 -9.846 0.740 1.397 1.00 0.00 C ATOM 1708 NH1 ARG A 113 -10.535 0.996 2.501 1.00 0.00 N ATOM 1709 NH2 ARG A 113 -9.458 1.739 0.616 1.00 0.00 N ATOM 0 H ARG A 113 -7.794 -5.841 0.781 1.00 0.00 H new ATOM 0 HA ARG A 113 -7.890 -4.805 3.525 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -10.315 -4.589 1.741 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -10.009 -3.802 3.277 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -8.023 -2.651 1.923 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -9.010 -3.073 0.538 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -10.969 -1.930 1.659 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -9.884 -1.411 2.934 1.00 0.00 H new ATOM 0 HE ARG A 113 -9.014 -0.676 0.219 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -10.835 0.230 3.104 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -10.765 1.959 2.747 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -8.928 1.546 -0.234 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -9.690 2.701 0.865 1.00 0.00 H new ATOM 1723 N GLU A 114 -9.232 -6.799 4.215 1.00 0.00 N ATOM 1724 CA GLU A 114 -9.814 -8.072 4.624 1.00 0.00 C ATOM 1725 C GLU A 114 -11.309 -8.108 4.324 1.00 0.00 C ATOM 1726 O GLU A 114 -12.032 -7.131 4.522 1.00 0.00 O ATOM 1727 CB GLU A 114 -9.575 -8.311 6.116 1.00 0.00 C ATOM 1728 CG GLU A 114 -10.249 -9.565 6.647 1.00 0.00 C ATOM 1729 CD GLU A 114 -9.360 -10.789 6.553 1.00 0.00 C ATOM 1730 OE1 GLU A 114 -8.127 -10.620 6.452 1.00 0.00 O ATOM 1731 OE2 GLU A 114 -9.897 -11.916 6.581 1.00 0.00 O ATOM 0 H GLU A 114 -8.975 -6.184 4.987 1.00 0.00 H new ATOM 0 HA GLU A 114 -9.328 -8.864 4.055 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -8.502 -8.381 6.297 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -9.937 -7.449 6.676 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -10.534 -9.407 7.687 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -11.167 -9.744 6.088 1.00 0.00 H new ATOM 1738 N PRO A 115 -11.786 -9.262 3.834 1.00 0.00 N ATOM 1739 CA PRO A 115 -13.200 -9.455 3.496 1.00 0.00 C ATOM 1740 C PRO A 115 -14.091 -9.498 4.733 1.00 0.00 C ATOM 1741 O PRO A 115 -13.617 -9.737 5.844 1.00 0.00 O ATOM 1742 CB PRO A 115 -13.212 -10.808 2.780 1.00 0.00 C ATOM 1743 CG PRO A 115 -12.018 -11.526 3.307 1.00 0.00 C ATOM 1744 CD PRO A 115 -10.983 -10.468 3.573 1.00 0.00 C ATOM 0 HA PRO A 115 -13.591 -8.635 2.893 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -14.129 -11.358 2.989 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -13.154 -10.684 1.699 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -12.262 -12.072 4.219 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -11.652 -12.257 2.586 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -10.356 -10.725 4.426 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -10.319 -10.332 2.719 1.00 0.00 H new ATOM 1752 N VAL A 116 -15.384 -9.267 4.533 1.00 0.00 N ATOM 1753 CA VAL A 116 -16.342 -9.281 5.633 1.00 0.00 C ATOM 1754 C VAL A 116 -15.713 -8.754 6.917 1.00 0.00 C ATOM 1755 O VAL A 116 -16.062 -9.186 8.016 1.00 0.00 O ATOM 1756 CB VAL A 116 -16.885 -10.701 5.885 1.00 0.00 C ATOM 1757 CG1 VAL A 116 -15.808 -11.583 6.499 1.00 0.00 C ATOM 1758 CG2 VAL A 116 -18.116 -10.649 6.778 1.00 0.00 C ATOM 0 H VAL A 116 -15.793 -9.068 3.620 1.00 0.00 H new ATOM 0 HA VAL A 116 -17.167 -8.630 5.343 1.00 0.00 H new ATOM 0 HB VAL A 116 -17.176 -11.136 4.929 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -16.209 -12.582 6.670 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -14.958 -11.645 5.820 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -15.484 -11.155 7.448 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -18.487 -11.660 6.946 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -17.853 -10.195 7.734 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -18.891 -10.054 6.295 1.00 0.00 H new ATOM 1768 N HIS A 117 -14.782 -7.816 6.772 1.00 0.00 N ATOM 1769 CA HIS A 117 -14.104 -7.227 7.921 1.00 0.00 C ATOM 1770 C HIS A 117 -15.104 -6.551 8.854 1.00 0.00 C ATOM 1771 O HIS A 117 -16.314 -6.609 8.633 1.00 0.00 O ATOM 1772 CB HIS A 117 -13.056 -6.214 7.458 1.00 0.00 C ATOM 1773 CG HIS A 117 -13.640 -4.909 7.013 1.00 0.00 C ATOM 1774 ND1 HIS A 117 -12.997 -3.701 7.180 1.00 0.00 N ATOM 1775 CD2 HIS A 117 -14.815 -4.627 6.403 1.00 0.00 C ATOM 1776 CE1 HIS A 117 -13.751 -2.732 6.693 1.00 0.00 C ATOM 1777 NE2 HIS A 117 -14.860 -3.267 6.215 1.00 0.00 N ATOM 0 H HIS A 117 -14.480 -7.448 5.870 1.00 0.00 H new ATOM 0 HA HIS A 117 -13.607 -8.028 8.468 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -12.356 -6.030 8.273 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -12.484 -6.645 6.637 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -15.575 -5.339 6.117 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -13.503 -1.681 6.687 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -15.625 -2.754 5.777 1.00 0.00 H new ATOM 1786 N THR A 118 -14.590 -5.911 9.900 1.00 0.00 N ATOM 1787 CA THR A 118 -15.437 -5.226 10.869 1.00 0.00 C ATOM 1788 C THR A 118 -15.289 -3.714 10.757 1.00 0.00 C ATOM 1789 O THR A 118 -14.496 -3.214 9.958 1.00 0.00 O ATOM 1790 CB THR A 118 -15.106 -5.658 12.310 1.00 0.00 C ATOM 1791 OG1 THR A 118 -13.711 -5.466 12.570 1.00 0.00 O ATOM 1792 CG2 THR A 118 -15.473 -7.117 12.536 1.00 0.00 C ATOM 0 H THR A 118 -13.591 -5.853 10.098 1.00 0.00 H new ATOM 0 HA THR A 118 -16.466 -5.505 10.642 1.00 0.00 H new ATOM 0 HB THR A 118 -15.691 -5.043 12.994 1.00 0.00 H new ATOM 0 HG1 THR A 118 -13.509 -5.741 13.489 1.00 0.00 H new ATOM 0 HG21 THR A 118 -15.230 -7.399 13.561 1.00 0.00 H new ATOM 0 HG22 THR A 118 -16.541 -7.254 12.365 1.00 0.00 H new ATOM 0 HG23 THR A 118 -14.911 -7.745 11.844 1.00 0.00 H new ATOM 1800 N LYS A 119 -16.055 -2.987 11.562 1.00 0.00 N ATOM 1801 CA LYS A 119 -16.008 -1.530 11.556 1.00 0.00 C ATOM 1802 C LYS A 119 -16.585 -0.961 12.848 1.00 0.00 C ATOM 1803 O LYS A 119 -17.787 -1.052 13.096 1.00 0.00 O ATOM 1804 CB LYS A 119 -16.780 -0.979 10.355 1.00 0.00 C ATOM 1805 CG LYS A 119 -16.320 0.400 9.916 1.00 0.00 C ATOM 1806 CD LYS A 119 -17.446 1.181 9.260 1.00 0.00 C ATOM 1807 CE LYS A 119 -17.014 2.599 8.916 1.00 0.00 C ATOM 1808 NZ LYS A 119 -16.220 2.647 7.657 1.00 0.00 N ATOM 0 H LYS A 119 -16.717 -3.384 12.228 1.00 0.00 H new ATOM 0 HA LYS A 119 -14.964 -1.226 11.480 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -16.676 -1.671 9.519 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -17.840 -0.937 10.604 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -15.948 0.952 10.779 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -15.489 0.302 9.218 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -17.767 0.667 8.354 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -18.306 1.214 9.929 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -17.895 3.232 8.814 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -16.421 3.007 9.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -15.945 3.630 7.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -15.366 2.063 7.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -16.794 2.282 6.870 1.00 0.00 H new ATOM 1822 N SER A 120 -15.720 -0.372 13.669 1.00 0.00 N ATOM 1823 CA SER A 120 -16.143 0.209 14.937 1.00 0.00 C ATOM 1824 C SER A 120 -16.836 1.550 14.715 1.00 0.00 C ATOM 1825 O SER A 120 -16.992 2.001 13.580 1.00 0.00 O ATOM 1826 CB SER A 120 -14.941 0.391 15.865 1.00 0.00 C ATOM 1827 OG SER A 120 -14.006 1.304 15.316 1.00 0.00 O ATOM 0 H SER A 120 -14.722 -0.285 13.478 1.00 0.00 H new ATOM 0 HA SER A 120 -16.852 -0.475 15.403 1.00 0.00 H new ATOM 0 HB2 SER A 120 -15.279 0.752 16.836 1.00 0.00 H new ATOM 0 HB3 SER A 120 -14.458 -0.572 16.033 1.00 0.00 H new ATOM 0 HG SER A 120 -13.248 1.404 15.929 1.00 0.00 H new ATOM 1833 N SER A 121 -17.250 2.183 15.808 1.00 0.00 N ATOM 1834 CA SER A 121 -17.930 3.471 15.734 1.00 0.00 C ATOM 1835 C SER A 121 -17.536 4.362 16.908 1.00 0.00 C ATOM 1836 O SER A 121 -17.128 3.875 17.963 1.00 0.00 O ATOM 1837 CB SER A 121 -19.447 3.271 15.718 1.00 0.00 C ATOM 1838 OG SER A 121 -20.126 4.508 15.845 1.00 0.00 O ATOM 0 H SER A 121 -17.126 1.825 16.755 1.00 0.00 H new ATOM 0 HA SER A 121 -17.625 3.962 14.810 1.00 0.00 H new ATOM 0 HB2 SER A 121 -19.743 2.784 14.789 1.00 0.00 H new ATOM 0 HB3 SER A 121 -19.738 2.608 16.532 1.00 0.00 H new ATOM 0 HG SER A 121 -21.094 4.353 15.830 1.00 0.00 H new ATOM 1844 N THR A 122 -17.659 5.672 16.717 1.00 0.00 N ATOM 1845 CA THR A 122 -17.315 6.632 17.757 1.00 0.00 C ATOM 1846 C THR A 122 -17.909 8.004 17.458 1.00 0.00 C ATOM 1847 O THR A 122 -17.866 8.475 16.322 1.00 0.00 O ATOM 1848 CB THR A 122 -15.789 6.769 17.913 1.00 0.00 C ATOM 1849 OG1 THR A 122 -15.203 5.485 18.151 1.00 0.00 O ATOM 1850 CG2 THR A 122 -15.444 7.710 19.057 1.00 0.00 C ATOM 0 H THR A 122 -17.995 6.092 15.850 1.00 0.00 H new ATOM 0 HA THR A 122 -17.735 6.252 18.688 1.00 0.00 H new ATOM 0 HB THR A 122 -15.388 7.185 16.989 1.00 0.00 H new ATOM 0 HG1 THR A 122 -15.891 4.866 18.473 1.00 0.00 H new ATOM 0 HG21 THR A 122 -14.361 7.791 19.148 1.00 0.00 H new ATOM 0 HG22 THR A 122 -15.866 8.695 18.858 1.00 0.00 H new ATOM 0 HG23 THR A 122 -15.858 7.319 19.987 1.00 0.00 H new ATOM 1858 N SER A 123 -18.464 8.640 18.485 1.00 0.00 N ATOM 1859 CA SER A 123 -19.071 9.957 18.331 1.00 0.00 C ATOM 1860 C SER A 123 -18.262 11.017 19.073 1.00 0.00 C ATOM 1861 O SER A 123 -17.357 10.698 19.843 1.00 0.00 O ATOM 1862 CB SER A 123 -20.510 9.943 18.848 1.00 0.00 C ATOM 1863 OG SER A 123 -21.414 9.545 17.832 1.00 0.00 O ATOM 0 H SER A 123 -18.506 8.265 19.432 1.00 0.00 H new ATOM 0 HA SER A 123 -19.077 10.205 17.270 1.00 0.00 H new ATOM 0 HB2 SER A 123 -20.588 9.262 19.696 1.00 0.00 H new ATOM 0 HB3 SER A 123 -20.779 10.935 19.210 1.00 0.00 H new ATOM 0 HG SER A 123 -22.327 9.543 18.189 1.00 0.00 H new ATOM 1869 N GLY A 124 -18.596 12.282 18.834 1.00 0.00 N ATOM 1870 CA GLY A 124 -17.892 13.371 19.485 1.00 0.00 C ATOM 1871 C GLY A 124 -18.219 14.720 18.876 1.00 0.00 C ATOM 1872 O GLY A 124 -17.624 15.136 17.882 1.00 0.00 O ATOM 0 H GLY A 124 -19.342 12.572 18.201 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -18.148 13.383 20.545 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -16.818 13.197 19.418 1.00 0.00 H new ATOM 1876 N PRO A 125 -19.188 15.426 19.477 1.00 0.00 N ATOM 1877 CA PRO A 125 -19.616 16.746 19.003 1.00 0.00 C ATOM 1878 C PRO A 125 -18.556 17.817 19.235 1.00 0.00 C ATOM 1879 O PRO A 125 -17.519 17.556 19.846 1.00 0.00 O ATOM 1880 CB PRO A 125 -20.863 17.037 19.842 1.00 0.00 C ATOM 1881 CG PRO A 125 -20.682 16.231 21.082 1.00 0.00 C ATOM 1882 CD PRO A 125 -19.940 14.991 20.666 1.00 0.00 C ATOM 0 HA PRO A 125 -19.797 16.754 17.928 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -20.948 18.100 20.069 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -21.772 16.751 19.313 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -20.120 16.789 21.831 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -21.644 15.979 21.527 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -19.276 14.637 21.454 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -20.622 14.174 20.433 1.00 0.00 H new ATOM 1890 N SER A 126 -18.822 19.023 18.745 1.00 0.00 N ATOM 1891 CA SER A 126 -17.889 20.133 18.897 1.00 0.00 C ATOM 1892 C SER A 126 -18.636 21.459 19.011 1.00 0.00 C ATOM 1893 O SER A 126 -19.503 21.768 18.194 1.00 0.00 O ATOM 1894 CB SER A 126 -16.922 20.180 17.712 1.00 0.00 C ATOM 1895 OG SER A 126 -16.046 19.066 17.724 1.00 0.00 O ATOM 0 H SER A 126 -19.676 19.257 18.239 1.00 0.00 H new ATOM 0 HA SER A 126 -17.322 19.975 19.814 1.00 0.00 H new ATOM 0 HB2 SER A 126 -17.486 20.193 16.779 1.00 0.00 H new ATOM 0 HB3 SER A 126 -16.343 21.103 17.748 1.00 0.00 H new ATOM 0 HG SER A 126 -15.440 19.118 16.956 1.00 0.00 H new ATOM 1901 N SER A 127 -18.292 22.238 20.031 1.00 0.00 N ATOM 1902 CA SER A 127 -18.932 23.529 20.256 1.00 0.00 C ATOM 1903 C SER A 127 -18.702 24.463 19.072 1.00 0.00 C ATOM 1904 O SER A 127 -17.626 24.476 18.477 1.00 0.00 O ATOM 1905 CB SER A 127 -18.397 24.171 21.538 1.00 0.00 C ATOM 1906 OG SER A 127 -19.244 25.219 21.975 1.00 0.00 O ATOM 0 H SER A 127 -17.574 21.998 20.715 1.00 0.00 H new ATOM 0 HA SER A 127 -20.004 23.362 20.362 1.00 0.00 H new ATOM 0 HB2 SER A 127 -18.315 23.416 22.320 1.00 0.00 H new ATOM 0 HB3 SER A 127 -17.394 24.559 21.363 1.00 0.00 H new ATOM 0 HG SER A 127 -18.881 25.612 22.796 1.00 0.00 H new ATOM 1912 N GLY A 128 -19.724 25.245 18.736 1.00 0.00 N ATOM 1913 CA GLY A 128 -19.614 26.171 17.624 1.00 0.00 C ATOM 1914 C GLY A 128 -19.608 25.468 16.282 1.00 0.00 C ATOM 1915 O GLY A 128 -18.790 24.580 16.042 1.00 0.00 O ATOM 0 H GLY A 128 -20.625 25.254 19.214 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -20.445 26.875 17.658 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -18.699 26.753 17.730 1.00 0.00 H new TER 1919 GLY A 128