USER MOD reduce.3.24.130724 H: found=0, std=0, add=907, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 905 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 62 GLN : amide:sc= -2.23! C(o=-2.3!,f=-4.3!) USER MOD Set 1.2: A 63 ASN : amide:sc= -0.0782 K(o=-2.3,f=-6.5!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0499 USER MOD Single : A 3 HIS : no HD1:sc= -0.149 X(o=-0.15,f=-0.0072) USER MOD Single : A 4 MET CE :methyl 142:sc= -0.282 (180deg=-1.11) USER MOD Single : A 5 GLN : amide:sc= -2.42! K(o=-2.4!,f=-1) USER MOD Single : A 10 ASN : amide:sc= -3.17! C(o=-3.2!,f=-5.4!) USER MOD Single : A 11 THR OG1 : rot -97:sc= -4.75! USER MOD Single : A 14 HIS : no HD1:sc= -9.95! C(o=-10!,f=-12!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 162:sc= -0.028 (180deg=-0.33) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0.0421 USER MOD Single : A 43 TYR OH : rot 0:sc=-0.00587 USER MOD Single : A 47 LYS NZ :NH3+ 155:sc= -0.0777 (180deg=-1.2) USER MOD Single : A 56 GLN : amide:sc= -3.81! C(o=-3.8!,f=-2.9!) USER MOD Single : A 58 THR OG1 : rot -63:sc= 1.15 USER MOD Single : A 64 GLN : amide:sc= -9.32! C(o=-9.3!,f=-25!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 CYS SG : rot -2:sc= 0.0342 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot -131:sc= -2.09! USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 5.563 38.249 -16.445 1.00 0.00 N ATOM 2 CA GLY A 1 5.909 37.443 -17.650 1.00 0.00 C ATOM 3 C GLY A 1 5.545 35.976 -17.406 1.00 0.00 C ATOM 4 O GLY A 1 4.445 35.544 -17.689 1.00 0.00 O ATOM 0 H1 GLY A 1 5.810 39.245 -16.611 1.00 0.00 H new ATOM 0 H2 GLY A 1 4.543 38.172 -16.257 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.094 37.893 -15.625 1.00 0.00 H new ATOM 0 HA2 GLY A 1 5.373 37.822 -18.520 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.973 37.533 -17.867 1.00 0.00 H new ATOM 10 N SER A 2 6.461 35.207 -16.884 1.00 0.00 N ATOM 11 CA SER A 2 6.166 33.767 -16.621 1.00 0.00 C ATOM 12 C SER A 2 6.735 33.351 -15.262 1.00 0.00 C ATOM 13 O SER A 2 7.057 34.180 -14.433 1.00 0.00 O ATOM 14 CB SER A 2 6.860 33.006 -17.748 1.00 0.00 C ATOM 15 OG SER A 2 6.995 33.856 -18.879 1.00 0.00 O ATOM 0 H SER A 2 7.400 35.512 -16.628 1.00 0.00 H new ATOM 0 HA SER A 2 5.095 33.564 -16.593 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.840 32.662 -17.419 1.00 0.00 H new ATOM 0 HB3 SER A 2 6.283 32.120 -18.012 1.00 0.00 H new ATOM 0 HG SER A 2 7.442 33.369 -19.603 1.00 0.00 H new ATOM 21 N HIS A 3 6.861 32.073 -15.026 1.00 0.00 N ATOM 22 CA HIS A 3 7.409 31.604 -13.720 1.00 0.00 C ATOM 23 C HIS A 3 6.539 32.117 -12.568 1.00 0.00 C ATOM 24 O HIS A 3 5.945 33.172 -12.651 1.00 0.00 O ATOM 25 CB HIS A 3 8.814 32.199 -13.642 1.00 0.00 C ATOM 26 CG HIS A 3 9.806 31.213 -14.195 1.00 0.00 C ATOM 27 ND1 HIS A 3 10.783 31.579 -15.108 1.00 0.00 N ATOM 28 CD2 HIS A 3 9.983 29.868 -13.977 1.00 0.00 C ATOM 29 CE1 HIS A 3 11.497 30.478 -15.401 1.00 0.00 C ATOM 30 NE2 HIS A 3 11.051 29.407 -14.740 1.00 0.00 N ATOM 0 H HIS A 3 6.608 31.333 -15.681 1.00 0.00 H new ATOM 0 HA HIS A 3 7.425 30.517 -13.644 1.00 0.00 H new ATOM 0 HB2 HIS A 3 8.858 33.131 -14.206 1.00 0.00 H new ATOM 0 HB3 HIS A 3 9.062 32.440 -12.608 1.00 0.00 H new ATOM 0 HD2 HIS A 3 9.384 29.261 -13.314 1.00 0.00 H new ATOM 0 HE1 HIS A 3 12.330 30.462 -16.088 1.00 0.00 H new ATOM 0 HE2 HIS A 3 11.415 28.455 -14.785 1.00 0.00 H new ATOM 38 N MET A 4 6.459 31.376 -11.496 1.00 0.00 N ATOM 39 CA MET A 4 5.624 31.819 -10.341 1.00 0.00 C ATOM 40 C MET A 4 4.196 32.118 -10.809 1.00 0.00 C ATOM 41 O MET A 4 3.942 33.101 -11.478 1.00 0.00 O ATOM 42 CB MET A 4 6.301 33.087 -9.822 1.00 0.00 C ATOM 43 CG MET A 4 7.164 32.747 -8.605 1.00 0.00 C ATOM 44 SD MET A 4 6.944 34.016 -7.333 1.00 0.00 S ATOM 45 CE MET A 4 5.206 33.670 -6.961 1.00 0.00 C ATOM 0 H MET A 4 6.935 30.483 -11.369 1.00 0.00 H new ATOM 0 HA MET A 4 5.550 31.056 -9.566 1.00 0.00 H new ATOM 0 HB2 MET A 4 6.917 33.529 -10.605 1.00 0.00 H new ATOM 0 HB3 MET A 4 5.549 33.828 -9.551 1.00 0.00 H new ATOM 0 HG2 MET A 4 6.886 31.770 -8.210 1.00 0.00 H new ATOM 0 HG3 MET A 4 8.213 32.686 -8.895 1.00 0.00 H new ATOM 0 HE1 MET A 4 5.035 33.778 -5.890 1.00 0.00 H new ATOM 0 HE2 MET A 4 4.571 34.371 -7.503 1.00 0.00 H new ATOM 0 HE3 MET A 4 4.964 32.652 -7.266 1.00 0.00 H new ATOM 55 N GLN A 5 3.262 31.273 -10.470 1.00 0.00 N ATOM 56 CA GLN A 5 1.853 31.503 -10.903 1.00 0.00 C ATOM 57 C GLN A 5 1.034 32.133 -9.773 1.00 0.00 C ATOM 58 O GLN A 5 1.431 32.130 -8.626 1.00 0.00 O ATOM 59 CB GLN A 5 1.314 30.111 -11.236 1.00 0.00 C ATOM 60 CG GLN A 5 1.349 29.900 -12.749 1.00 0.00 C ATOM 61 CD GLN A 5 -0.068 29.632 -13.259 1.00 0.00 C ATOM 62 OE1 GLN A 5 -0.754 30.540 -13.684 1.00 0.00 O ATOM 63 NE2 GLN A 5 -0.537 28.415 -13.235 1.00 0.00 N ATOM 0 H GLN A 5 3.413 30.433 -9.912 1.00 0.00 H new ATOM 0 HA GLN A 5 1.793 32.186 -11.751 1.00 0.00 H new ATOM 0 HB2 GLN A 5 1.913 29.349 -10.738 1.00 0.00 H new ATOM 0 HB3 GLN A 5 0.294 30.006 -10.867 1.00 0.00 H new ATOM 0 HG2 GLN A 5 1.763 30.780 -13.240 1.00 0.00 H new ATOM 0 HG3 GLN A 5 2.000 29.061 -12.995 1.00 0.00 H new ATOM 0 HE21 GLN A 5 0.040 27.653 -12.878 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -1.480 28.225 -13.573 1.00 0.00 H new ATOM 72 N VAL A 6 -0.114 32.667 -10.094 1.00 0.00 N ATOM 73 CA VAL A 6 -0.970 33.291 -9.046 1.00 0.00 C ATOM 74 C VAL A 6 -2.044 32.294 -8.602 1.00 0.00 C ATOM 75 O VAL A 6 -2.375 31.372 -9.321 1.00 0.00 O ATOM 76 CB VAL A 6 -1.606 34.505 -9.723 1.00 0.00 C ATOM 77 CG1 VAL A 6 -2.685 35.093 -8.814 1.00 0.00 C ATOM 78 CG2 VAL A 6 -0.531 35.562 -9.985 1.00 0.00 C ATOM 0 H VAL A 6 -0.496 32.698 -11.039 1.00 0.00 H new ATOM 0 HA VAL A 6 -0.407 33.577 -8.158 1.00 0.00 H new ATOM 0 HB VAL A 6 -2.056 34.198 -10.667 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -3.137 35.958 -9.299 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -3.451 34.341 -8.626 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -2.237 35.399 -7.869 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -0.983 36.429 -10.468 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -0.082 35.866 -9.040 1.00 0.00 H new ATOM 0 HG23 VAL A 6 0.239 35.145 -10.635 1.00 0.00 H new ATOM 88 N VAL A 7 -2.583 32.469 -7.422 1.00 0.00 N ATOM 89 CA VAL A 7 -3.631 31.527 -6.924 1.00 0.00 C ATOM 90 C VAL A 7 -4.562 31.101 -8.061 1.00 0.00 C ATOM 91 O VAL A 7 -5.433 31.839 -8.476 1.00 0.00 O ATOM 92 CB VAL A 7 -4.405 32.310 -5.865 1.00 0.00 C ATOM 93 CG1 VAL A 7 -5.470 31.407 -5.239 1.00 0.00 C ATOM 94 CG2 VAL A 7 -3.442 32.787 -4.776 1.00 0.00 C ATOM 0 H VAL A 7 -2.342 33.225 -6.781 1.00 0.00 H new ATOM 0 HA VAL A 7 -3.194 30.614 -6.519 1.00 0.00 H new ATOM 0 HB VAL A 7 -4.884 33.171 -6.331 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -6.022 31.966 -4.483 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -6.158 31.065 -6.013 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -4.990 30.546 -4.775 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -3.995 33.346 -4.021 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -2.962 31.925 -4.311 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -2.682 33.430 -5.219 1.00 0.00 H new ATOM 104 N LEU A 8 -4.380 29.912 -8.567 1.00 0.00 N ATOM 105 CA LEU A 8 -5.249 29.427 -9.677 1.00 0.00 C ATOM 106 C LEU A 8 -6.722 29.684 -9.349 1.00 0.00 C ATOM 107 O LEU A 8 -7.157 29.473 -8.235 1.00 0.00 O ATOM 108 CB LEU A 8 -4.973 27.927 -9.761 1.00 0.00 C ATOM 109 CG LEU A 8 -4.213 27.616 -11.053 1.00 0.00 C ATOM 110 CD1 LEU A 8 -2.946 28.473 -11.120 1.00 0.00 C ATOM 111 CD2 LEU A 8 -3.827 26.135 -11.071 1.00 0.00 C ATOM 0 H LEU A 8 -3.665 29.253 -8.259 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.042 29.936 -10.618 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -4.390 27.605 -8.898 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -5.911 27.372 -9.737 1.00 0.00 H new ATOM 0 HG LEU A 8 -4.848 27.839 -11.911 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -2.405 28.251 -12.040 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -3.219 29.528 -11.105 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -2.310 28.250 -10.263 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -3.286 25.911 -11.990 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.192 25.914 -10.213 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -4.728 25.524 -11.023 1.00 0.00 H new ATOM 123 N PRO A 9 -7.441 30.137 -10.339 1.00 0.00 N ATOM 124 CA PRO A 9 -8.884 30.429 -10.162 1.00 0.00 C ATOM 125 C PRO A 9 -9.691 29.131 -10.085 1.00 0.00 C ATOM 126 O PRO A 9 -10.226 28.665 -11.071 1.00 0.00 O ATOM 127 CB PRO A 9 -9.247 31.214 -11.419 1.00 0.00 C ATOM 128 CG PRO A 9 -8.241 30.791 -12.444 1.00 0.00 C ATOM 129 CD PRO A 9 -6.982 30.414 -11.704 1.00 0.00 C ATOM 0 HA PRO A 9 -9.098 30.975 -9.243 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -10.262 30.988 -11.746 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -9.201 32.288 -11.241 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -8.614 29.947 -13.024 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -8.046 31.600 -13.148 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -6.504 29.541 -12.149 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -6.251 31.222 -11.723 1.00 0.00 H new ATOM 137 N ASN A 10 -9.790 28.547 -8.922 1.00 0.00 N ATOM 138 CA ASN A 10 -10.570 27.282 -8.785 1.00 0.00 C ATOM 139 C ASN A 10 -10.032 26.211 -9.741 1.00 0.00 C ATOM 140 O ASN A 10 -10.784 25.572 -10.449 1.00 0.00 O ATOM 141 CB ASN A 10 -12.005 27.662 -9.162 1.00 0.00 C ATOM 142 CG ASN A 10 -12.646 28.444 -8.016 1.00 0.00 C ATOM 143 OD1 ASN A 10 -11.957 29.020 -7.197 1.00 0.00 O ATOM 144 ND2 ASN A 10 -13.946 28.489 -7.922 1.00 0.00 N ATOM 0 H ASN A 10 -9.365 28.890 -8.061 1.00 0.00 H new ATOM 0 HA ASN A 10 -10.504 26.867 -7.779 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -12.006 28.263 -10.071 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -12.586 26.764 -9.373 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -14.385 29.008 -7.161 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -14.524 28.006 -8.609 1.00 0.00 H new ATOM 151 N THR A 11 -8.743 26.005 -9.768 1.00 0.00 N ATOM 152 CA THR A 11 -8.176 24.969 -10.683 1.00 0.00 C ATOM 153 C THR A 11 -6.988 24.255 -10.024 1.00 0.00 C ATOM 154 O THR A 11 -6.507 24.657 -8.981 1.00 0.00 O ATOM 155 CB THR A 11 -7.713 25.739 -11.923 1.00 0.00 C ATOM 156 OG1 THR A 11 -6.694 26.659 -11.555 1.00 0.00 O ATOM 157 CG2 THR A 11 -8.890 26.501 -12.532 1.00 0.00 C ATOM 0 H THR A 11 -8.060 26.506 -9.200 1.00 0.00 H new ATOM 0 HA THR A 11 -8.909 24.200 -10.927 1.00 0.00 H new ATOM 0 HB THR A 11 -7.323 25.034 -12.658 1.00 0.00 H new ATOM 0 HG1 THR A 11 -7.088 27.546 -11.419 1.00 0.00 H new ATOM 0 HG21 THR A 11 -8.553 27.046 -13.414 1.00 0.00 H new ATOM 0 HG22 THR A 11 -9.671 25.796 -12.818 1.00 0.00 H new ATOM 0 HG23 THR A 11 -9.286 27.204 -11.800 1.00 0.00 H new ATOM 165 N ALA A 12 -6.511 23.203 -10.635 1.00 0.00 N ATOM 166 CA ALA A 12 -5.351 22.463 -10.058 1.00 0.00 C ATOM 167 C ALA A 12 -4.477 21.899 -11.179 1.00 0.00 C ATOM 168 O ALA A 12 -4.920 21.742 -12.298 1.00 0.00 O ATOM 169 CB ALA A 12 -5.956 21.318 -9.243 1.00 0.00 C ATOM 0 H ALA A 12 -6.875 22.824 -11.509 1.00 0.00 H new ATOM 0 HA ALA A 12 -4.724 23.111 -9.446 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -5.156 20.732 -8.790 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -6.595 21.727 -8.460 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -6.548 20.679 -9.898 1.00 0.00 H new ATOM 175 N LEU A 13 -3.244 21.585 -10.888 1.00 0.00 N ATOM 176 CA LEU A 13 -2.357 21.021 -11.945 1.00 0.00 C ATOM 177 C LEU A 13 -1.612 19.791 -11.404 1.00 0.00 C ATOM 178 O LEU A 13 -1.394 19.660 -10.216 1.00 0.00 O ATOM 179 CB LEU A 13 -1.415 22.174 -12.330 1.00 0.00 C ATOM 180 CG LEU A 13 -0.152 22.194 -11.463 1.00 0.00 C ATOM 181 CD1 LEU A 13 1.076 22.131 -12.373 1.00 0.00 C ATOM 182 CD2 LEU A 13 -0.113 23.492 -10.652 1.00 0.00 C ATOM 0 H LEU A 13 -2.814 21.694 -9.969 1.00 0.00 H new ATOM 0 HA LEU A 13 -2.900 20.667 -12.821 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -1.134 22.078 -13.379 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.941 23.123 -12.226 1.00 0.00 H new ATOM 0 HG LEU A 13 -0.156 21.341 -10.785 1.00 0.00 H new ATOM 0 HD11 LEU A 13 1.981 22.145 -11.765 1.00 0.00 H new ATOM 0 HD12 LEU A 13 1.047 21.213 -12.960 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.076 22.990 -13.043 1.00 0.00 H new ATOM 0 HD21 LEU A 13 0.785 23.508 -10.034 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -0.102 24.345 -11.331 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -0.994 23.548 -10.013 1.00 0.00 H new ATOM 194 N HIS A 14 -1.244 18.879 -12.263 1.00 0.00 N ATOM 195 CA HIS A 14 -0.546 17.646 -11.793 1.00 0.00 C ATOM 196 C HIS A 14 0.978 17.812 -11.834 1.00 0.00 C ATOM 197 O HIS A 14 1.540 18.265 -12.812 1.00 0.00 O ATOM 198 CB HIS A 14 -0.988 16.553 -12.768 1.00 0.00 C ATOM 199 CG HIS A 14 -2.489 16.547 -12.876 1.00 0.00 C ATOM 200 ND1 HIS A 14 -3.185 17.477 -13.635 1.00 0.00 N ATOM 201 CD2 HIS A 14 -3.442 15.727 -12.324 1.00 0.00 C ATOM 202 CE1 HIS A 14 -4.496 17.196 -13.518 1.00 0.00 C ATOM 203 NE2 HIS A 14 -4.709 16.140 -12.730 1.00 0.00 N ATOM 0 H HIS A 14 -1.396 18.934 -13.270 1.00 0.00 H new ATOM 0 HA HIS A 14 -0.797 17.414 -10.758 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -0.544 16.725 -13.748 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -0.635 15.581 -12.424 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -3.240 14.889 -11.674 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -5.281 17.757 -14.003 1.00 0.00 H new ATOM 0 HE2 HIS A 14 -5.606 15.725 -12.479 1.00 0.00 H new ATOM 211 N LEU A 15 1.651 17.419 -10.780 1.00 0.00 N ATOM 212 CA LEU A 15 3.143 17.521 -10.750 1.00 0.00 C ATOM 213 C LEU A 15 3.737 16.144 -10.455 1.00 0.00 C ATOM 214 O LEU A 15 3.116 15.318 -9.815 1.00 0.00 O ATOM 215 CB LEU A 15 3.528 18.472 -9.599 1.00 0.00 C ATOM 216 CG LEU A 15 2.422 19.482 -9.283 1.00 0.00 C ATOM 217 CD1 LEU A 15 1.908 20.111 -10.571 1.00 0.00 C ATOM 218 CD2 LEU A 15 1.273 18.787 -8.548 1.00 0.00 C ATOM 0 H LEU A 15 1.229 17.031 -9.936 1.00 0.00 H new ATOM 0 HA LEU A 15 3.516 17.887 -11.706 1.00 0.00 H new ATOM 0 HB2 LEU A 15 3.748 17.887 -8.706 1.00 0.00 H new ATOM 0 HB3 LEU A 15 4.440 19.007 -9.863 1.00 0.00 H new ATOM 0 HG LEU A 15 2.830 20.265 -8.644 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.121 20.828 -10.337 1.00 0.00 H new ATOM 0 HD12 LEU A 15 2.726 20.622 -11.078 1.00 0.00 H new ATOM 0 HD13 LEU A 15 1.508 19.333 -11.221 1.00 0.00 H new ATOM 0 HD21 LEU A 15 0.490 19.513 -8.327 1.00 0.00 H new ATOM 0 HD22 LEU A 15 0.866 17.994 -9.176 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.643 18.358 -7.617 1.00 0.00 H new ATOM 230 N LYS A 16 4.943 15.894 -10.882 1.00 0.00 N ATOM 231 CA LYS A 16 5.568 14.577 -10.580 1.00 0.00 C ATOM 232 C LYS A 16 6.659 14.766 -9.528 1.00 0.00 C ATOM 233 O LYS A 16 7.634 15.456 -9.750 1.00 0.00 O ATOM 234 CB LYS A 16 6.174 14.085 -11.894 1.00 0.00 C ATOM 235 CG LYS A 16 6.347 12.566 -11.830 1.00 0.00 C ATOM 236 CD LYS A 16 7.393 12.126 -12.855 1.00 0.00 C ATOM 237 CE LYS A 16 6.694 11.467 -14.046 1.00 0.00 C ATOM 238 NZ LYS A 16 7.794 10.871 -14.854 1.00 0.00 N ATOM 0 H LYS A 16 5.519 16.539 -11.423 1.00 0.00 H new ATOM 0 HA LYS A 16 4.846 13.860 -10.189 1.00 0.00 H new ATOM 0 HB2 LYS A 16 5.528 14.355 -12.730 1.00 0.00 H new ATOM 0 HB3 LYS A 16 7.137 14.566 -12.067 1.00 0.00 H new ATOM 0 HG2 LYS A 16 6.656 12.267 -10.828 1.00 0.00 H new ATOM 0 HG3 LYS A 16 5.396 12.073 -12.031 1.00 0.00 H new ATOM 0 HD2 LYS A 16 7.973 12.986 -13.190 1.00 0.00 H new ATOM 0 HD3 LYS A 16 8.094 11.427 -12.398 1.00 0.00 H new ATOM 0 HE2 LYS A 16 5.988 10.705 -13.717 1.00 0.00 H new ATOM 0 HE3 LYS A 16 6.129 12.197 -14.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 7.394 10.400 -15.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 8.447 11.621 -15.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 8.310 10.175 -14.278 1.00 0.00 H new ATOM 252 N ALA A 17 6.500 14.167 -8.382 1.00 0.00 N ATOM 253 CA ALA A 17 7.528 14.322 -7.320 1.00 0.00 C ATOM 254 C ALA A 17 8.723 13.418 -7.610 1.00 0.00 C ATOM 255 O ALA A 17 8.640 12.207 -7.534 1.00 0.00 O ATOM 256 CB ALA A 17 6.832 13.906 -6.023 1.00 0.00 C ATOM 0 H ALA A 17 5.704 13.578 -8.136 1.00 0.00 H new ATOM 0 HA ALA A 17 7.911 15.341 -7.260 1.00 0.00 H new ATOM 0 HB1 ALA A 17 7.530 13.994 -5.191 1.00 0.00 H new ATOM 0 HB2 ALA A 17 5.974 14.554 -5.847 1.00 0.00 H new ATOM 0 HB3 ALA A 17 6.495 12.873 -6.106 1.00 0.00 H new ATOM 262 N LEU A 18 9.833 14.010 -7.946 1.00 0.00 N ATOM 263 CA LEU A 18 11.052 13.213 -8.248 1.00 0.00 C ATOM 264 C LEU A 18 11.964 13.180 -7.021 1.00 0.00 C ATOM 265 O LEU A 18 12.674 14.124 -6.735 1.00 0.00 O ATOM 266 CB LEU A 18 11.729 13.963 -9.398 1.00 0.00 C ATOM 267 CG LEU A 18 10.804 13.979 -10.614 1.00 0.00 C ATOM 268 CD1 LEU A 18 11.376 14.922 -11.673 1.00 0.00 C ATOM 269 CD2 LEU A 18 10.698 12.567 -11.192 1.00 0.00 C ATOM 0 H LEU A 18 9.949 15.020 -8.025 1.00 0.00 H new ATOM 0 HA LEU A 18 10.826 12.179 -8.510 1.00 0.00 H new ATOM 0 HB2 LEU A 18 11.963 14.983 -9.093 1.00 0.00 H new ATOM 0 HB3 LEU A 18 12.673 13.482 -9.653 1.00 0.00 H new ATOM 0 HG LEU A 18 9.814 14.324 -10.315 1.00 0.00 H new ATOM 0 HD11 LEU A 18 10.718 14.935 -12.542 1.00 0.00 H new ATOM 0 HD12 LEU A 18 11.453 15.928 -11.261 1.00 0.00 H new ATOM 0 HD13 LEU A 18 12.365 14.576 -11.972 1.00 0.00 H new ATOM 0 HD21 LEU A 18 10.038 12.578 -12.060 1.00 0.00 H new ATOM 0 HD22 LEU A 18 11.687 12.222 -11.493 1.00 0.00 H new ATOM 0 HD23 LEU A 18 10.293 11.894 -10.436 1.00 0.00 H new ATOM 281 N LEU A 19 11.945 12.102 -6.287 1.00 0.00 N ATOM 282 CA LEU A 19 12.805 12.011 -5.075 1.00 0.00 C ATOM 283 C LEU A 19 12.919 10.555 -4.620 1.00 0.00 C ATOM 284 O LEU A 19 11.947 9.827 -4.588 1.00 0.00 O ATOM 285 CB LEU A 19 12.077 12.845 -4.019 1.00 0.00 C ATOM 286 CG LEU A 19 13.096 13.568 -3.138 1.00 0.00 C ATOM 287 CD1 LEU A 19 14.061 12.551 -2.527 1.00 0.00 C ATOM 288 CD2 LEU A 19 13.882 14.572 -3.985 1.00 0.00 C ATOM 0 H LEU A 19 11.371 11.280 -6.475 1.00 0.00 H new ATOM 0 HA LEU A 19 13.819 12.369 -5.255 1.00 0.00 H new ATOM 0 HB2 LEU A 19 11.422 13.569 -4.503 1.00 0.00 H new ATOM 0 HB3 LEU A 19 11.445 12.202 -3.407 1.00 0.00 H new ATOM 0 HG LEU A 19 12.573 14.095 -2.340 1.00 0.00 H new ATOM 0 HD11 LEU A 19 14.786 13.069 -1.900 1.00 0.00 H new ATOM 0 HD12 LEU A 19 13.502 11.837 -1.922 1.00 0.00 H new ATOM 0 HD13 LEU A 19 14.583 12.021 -3.323 1.00 0.00 H new ATOM 0 HD21 LEU A 19 14.609 15.088 -3.357 1.00 0.00 H new ATOM 0 HD22 LEU A 19 14.403 14.045 -4.784 1.00 0.00 H new ATOM 0 HD23 LEU A 19 13.195 15.300 -4.417 1.00 0.00 H new ATOM 300 N ASP A 20 14.098 10.124 -4.266 1.00 0.00 N ATOM 301 CA ASP A 20 14.263 8.715 -3.811 1.00 0.00 C ATOM 302 C ASP A 20 13.785 8.581 -2.365 1.00 0.00 C ATOM 303 O ASP A 20 14.452 8.998 -1.439 1.00 0.00 O ATOM 304 CB ASP A 20 15.763 8.438 -3.912 1.00 0.00 C ATOM 305 CG ASP A 20 16.205 8.548 -5.372 1.00 0.00 C ATOM 306 OD1 ASP A 20 15.386 8.286 -6.239 1.00 0.00 O ATOM 307 OD2 ASP A 20 17.354 8.890 -5.599 1.00 0.00 O ATOM 0 H ASP A 20 14.951 10.684 -4.272 1.00 0.00 H new ATOM 0 HA ASP A 20 13.683 8.011 -4.408 1.00 0.00 H new ATOM 0 HB2 ASP A 20 16.317 9.149 -3.299 1.00 0.00 H new ATOM 0 HB3 ASP A 20 15.987 7.443 -3.527 1.00 0.00 H new ATOM 312 N PHE A 21 12.628 8.010 -2.161 1.00 0.00 N ATOM 313 CA PHE A 21 12.110 7.863 -0.773 1.00 0.00 C ATOM 314 C PHE A 21 11.723 6.408 -0.494 1.00 0.00 C ATOM 315 O PHE A 21 10.955 5.807 -1.221 1.00 0.00 O ATOM 316 CB PHE A 21 10.880 8.770 -0.714 1.00 0.00 C ATOM 317 CG PHE A 21 11.007 9.711 0.459 1.00 0.00 C ATOM 318 CD1 PHE A 21 10.560 9.318 1.725 1.00 0.00 C ATOM 319 CD2 PHE A 21 11.576 10.976 0.277 1.00 0.00 C ATOM 320 CE1 PHE A 21 10.683 10.191 2.812 1.00 0.00 C ATOM 321 CE2 PHE A 21 11.699 11.850 1.364 1.00 0.00 C ATOM 322 CZ PHE A 21 11.254 11.457 2.631 1.00 0.00 C ATOM 0 H PHE A 21 12.022 7.641 -2.894 1.00 0.00 H new ATOM 0 HA PHE A 21 12.855 8.135 -0.025 1.00 0.00 H new ATOM 0 HB2 PHE A 21 10.788 9.337 -1.641 1.00 0.00 H new ATOM 0 HB3 PHE A 21 9.976 8.169 -0.616 1.00 0.00 H new ATOM 0 HD1 PHE A 21 10.120 8.341 1.864 1.00 0.00 H new ATOM 0 HD2 PHE A 21 11.920 11.278 -0.701 1.00 0.00 H new ATOM 0 HE1 PHE A 21 10.338 9.889 3.790 1.00 0.00 H new ATOM 0 HE2 PHE A 21 12.137 12.827 1.225 1.00 0.00 H new ATOM 0 HZ PHE A 21 11.351 12.130 3.470 1.00 0.00 H new ATOM 332 N GLU A 22 12.249 5.840 0.558 1.00 0.00 N ATOM 333 CA GLU A 22 11.914 4.426 0.893 1.00 0.00 C ATOM 334 C GLU A 22 11.272 4.354 2.283 1.00 0.00 C ATOM 335 O GLU A 22 11.820 4.837 3.254 1.00 0.00 O ATOM 336 CB GLU A 22 13.254 3.686 0.882 1.00 0.00 C ATOM 337 CG GLU A 22 14.254 4.419 1.779 1.00 0.00 C ATOM 338 CD GLU A 22 15.253 5.186 0.911 1.00 0.00 C ATOM 339 OE1 GLU A 22 15.621 4.672 -0.132 1.00 0.00 O ATOM 340 OE2 GLU A 22 15.634 6.276 1.306 1.00 0.00 O ATOM 0 H GLU A 22 12.897 6.295 1.201 1.00 0.00 H new ATOM 0 HA GLU A 22 11.204 3.991 0.190 1.00 0.00 H new ATOM 0 HB2 GLU A 22 13.118 2.663 1.232 1.00 0.00 H new ATOM 0 HB3 GLU A 22 13.639 3.626 -0.136 1.00 0.00 H new ATOM 0 HG2 GLU A 22 13.728 5.107 2.441 1.00 0.00 H new ATOM 0 HG3 GLU A 22 14.780 3.706 2.413 1.00 0.00 H new ATOM 347 N ASP A 23 10.115 3.760 2.386 1.00 0.00 N ATOM 348 CA ASP A 23 9.445 3.667 3.716 1.00 0.00 C ATOM 349 C ASP A 23 10.242 2.759 4.653 1.00 0.00 C ATOM 350 O ASP A 23 11.134 2.047 4.237 1.00 0.00 O ATOM 351 CB ASP A 23 8.070 3.063 3.429 1.00 0.00 C ATOM 352 CG ASP A 23 6.986 3.948 4.048 1.00 0.00 C ATOM 353 OD1 ASP A 23 7.212 4.455 5.133 1.00 0.00 O ATOM 354 OD2 ASP A 23 5.948 4.103 3.424 1.00 0.00 O ATOM 0 H ASP A 23 9.605 3.336 1.611 1.00 0.00 H new ATOM 0 HA ASP A 23 9.371 4.638 4.205 1.00 0.00 H new ATOM 0 HB2 ASP A 23 7.915 2.978 2.353 1.00 0.00 H new ATOM 0 HB3 ASP A 23 8.010 2.055 3.840 1.00 0.00 H new ATOM 359 N LYS A 24 9.924 2.779 5.919 1.00 0.00 N ATOM 360 CA LYS A 24 10.660 1.918 6.890 1.00 0.00 C ATOM 361 C LYS A 24 10.621 0.457 6.437 1.00 0.00 C ATOM 362 O LYS A 24 11.478 -0.333 6.783 1.00 0.00 O ATOM 363 CB LYS A 24 9.910 2.088 8.210 1.00 0.00 C ATOM 364 CG LYS A 24 10.882 1.907 9.374 1.00 0.00 C ATOM 365 CD LYS A 24 10.833 3.144 10.272 1.00 0.00 C ATOM 366 CE LYS A 24 9.637 3.039 11.222 1.00 0.00 C ATOM 367 NZ LYS A 24 8.964 4.367 11.144 1.00 0.00 N ATOM 0 H LYS A 24 9.186 3.355 6.324 1.00 0.00 H new ATOM 0 HA LYS A 24 11.711 2.195 6.976 1.00 0.00 H new ATOM 0 HB2 LYS A 24 9.451 3.076 8.255 1.00 0.00 H new ATOM 0 HB3 LYS A 24 9.103 1.358 8.279 1.00 0.00 H new ATOM 0 HG2 LYS A 24 10.620 1.017 9.947 1.00 0.00 H new ATOM 0 HG3 LYS A 24 11.894 1.757 8.998 1.00 0.00 H new ATOM 0 HD2 LYS A 24 11.758 3.229 10.843 1.00 0.00 H new ATOM 0 HD3 LYS A 24 10.750 4.045 9.664 1.00 0.00 H new ATOM 0 HE2 LYS A 24 8.963 2.237 10.921 1.00 0.00 H new ATOM 0 HE3 LYS A 24 9.960 2.819 12.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 8.133 4.372 11.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 9.627 5.110 11.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 8.662 4.546 10.165 1.00 0.00 H new ATOM 381 N ASP A 25 9.634 0.094 5.669 1.00 0.00 N ATOM 382 CA ASP A 25 9.538 -1.313 5.196 1.00 0.00 C ATOM 383 C ASP A 25 10.760 -1.669 4.344 1.00 0.00 C ATOM 384 O ASP A 25 11.158 -2.814 4.261 1.00 0.00 O ATOM 385 CB ASP A 25 8.264 -1.356 4.352 1.00 0.00 C ATOM 386 CG ASP A 25 7.043 -1.164 5.255 1.00 0.00 C ATOM 387 OD1 ASP A 25 6.744 -0.026 5.577 1.00 0.00 O ATOM 388 OD2 ASP A 25 6.429 -2.157 5.607 1.00 0.00 O ATOM 0 H ASP A 25 8.889 0.712 5.348 1.00 0.00 H new ATOM 0 HA ASP A 25 9.508 -2.027 6.019 1.00 0.00 H new ATOM 0 HB2 ASP A 25 8.293 -0.575 3.592 1.00 0.00 H new ATOM 0 HB3 ASP A 25 8.195 -2.309 3.828 1.00 0.00 H new ATOM 393 N GLY A 26 11.362 -0.696 3.714 1.00 0.00 N ATOM 394 CA GLY A 26 12.558 -0.983 2.872 1.00 0.00 C ATOM 395 C GLY A 26 12.582 -0.043 1.665 1.00 0.00 C ATOM 396 O GLY A 26 13.552 0.644 1.421 1.00 0.00 O ATOM 0 H GLY A 26 11.078 0.283 3.746 1.00 0.00 H new ATOM 0 HA2 GLY A 26 13.467 -0.857 3.460 1.00 0.00 H new ATOM 0 HA3 GLY A 26 12.537 -2.020 2.536 1.00 0.00 H new ATOM 400 N ASP A 27 11.519 -0.008 0.906 1.00 0.00 N ATOM 401 CA ASP A 27 11.482 0.890 -0.286 1.00 0.00 C ATOM 402 C ASP A 27 10.033 1.228 -0.650 1.00 0.00 C ATOM 403 O ASP A 27 9.133 0.438 -0.447 1.00 0.00 O ATOM 404 CB ASP A 27 12.142 0.091 -1.411 1.00 0.00 C ATOM 405 CG ASP A 27 13.072 1.007 -2.207 1.00 0.00 C ATOM 406 OD1 ASP A 27 12.587 1.671 -3.108 1.00 0.00 O ATOM 407 OD2 ASP A 27 14.254 1.030 -1.903 1.00 0.00 O ATOM 0 H ASP A 27 10.676 -0.561 1.059 1.00 0.00 H new ATOM 0 HA ASP A 27 11.994 1.835 -0.103 1.00 0.00 H new ATOM 0 HB2 ASP A 27 12.705 -0.745 -0.996 1.00 0.00 H new ATOM 0 HB3 ASP A 27 11.381 -0.331 -2.067 1.00 0.00 H new ATOM 412 N LYS A 28 9.802 2.396 -1.185 1.00 0.00 N ATOM 413 CA LYS A 28 8.411 2.782 -1.559 1.00 0.00 C ATOM 414 C LYS A 28 8.420 3.681 -2.797 1.00 0.00 C ATOM 415 O LYS A 28 8.061 3.266 -3.881 1.00 0.00 O ATOM 416 CB LYS A 28 7.873 3.542 -0.349 1.00 0.00 C ATOM 417 CG LYS A 28 6.425 3.959 -0.611 1.00 0.00 C ATOM 418 CD LYS A 28 5.520 2.728 -0.538 1.00 0.00 C ATOM 419 CE LYS A 28 4.543 2.742 -1.716 1.00 0.00 C ATOM 420 NZ LYS A 28 5.328 2.227 -2.873 1.00 0.00 N ATOM 0 H LYS A 28 10.515 3.099 -1.379 1.00 0.00 H new ATOM 0 HA LYS A 28 7.797 1.916 -1.804 1.00 0.00 H new ATOM 0 HB2 LYS A 28 7.927 2.915 0.541 1.00 0.00 H new ATOM 0 HB3 LYS A 28 8.487 4.422 -0.156 1.00 0.00 H new ATOM 0 HG2 LYS A 28 6.110 4.700 0.124 1.00 0.00 H new ATOM 0 HG3 LYS A 28 6.342 4.427 -1.592 1.00 0.00 H new ATOM 0 HD2 LYS A 28 6.122 1.819 -0.562 1.00 0.00 H new ATOM 0 HD3 LYS A 28 4.971 2.722 0.404 1.00 0.00 H new ATOM 0 HE2 LYS A 28 3.675 2.113 -1.517 1.00 0.00 H new ATOM 0 HE3 LYS A 28 4.171 3.748 -1.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 4.678 1.919 -3.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 5.945 2.981 -3.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 5.909 1.421 -2.567 1.00 0.00 H new ATOM 434 N VAL A 29 8.822 4.913 -2.644 1.00 0.00 N ATOM 435 CA VAL A 29 8.845 5.838 -3.818 1.00 0.00 C ATOM 436 C VAL A 29 10.289 6.011 -4.311 1.00 0.00 C ATOM 437 O VAL A 29 11.214 6.113 -3.529 1.00 0.00 O ATOM 438 CB VAL A 29 8.226 7.187 -3.341 1.00 0.00 C ATOM 439 CG1 VAL A 29 7.596 7.048 -1.946 1.00 0.00 C ATOM 440 CG2 VAL A 29 9.291 8.286 -3.279 1.00 0.00 C ATOM 0 H VAL A 29 9.135 5.320 -1.762 1.00 0.00 H new ATOM 0 HA VAL A 29 8.270 5.447 -4.657 1.00 0.00 H new ATOM 0 HB VAL A 29 7.457 7.456 -4.065 1.00 0.00 H new ATOM 0 HG11 VAL A 29 7.173 8.005 -1.641 1.00 0.00 H new ATOM 0 HG12 VAL A 29 6.808 6.296 -1.976 1.00 0.00 H new ATOM 0 HG13 VAL A 29 8.360 6.744 -1.230 1.00 0.00 H new ATOM 0 HG21 VAL A 29 8.834 9.217 -2.944 1.00 0.00 H new ATOM 0 HG22 VAL A 29 10.075 7.994 -2.580 1.00 0.00 H new ATOM 0 HG23 VAL A 29 9.723 8.430 -4.269 1.00 0.00 H new ATOM 450 N VAL A 30 10.485 6.042 -5.599 1.00 0.00 N ATOM 451 CA VAL A 30 11.865 6.206 -6.137 1.00 0.00 C ATOM 452 C VAL A 30 11.853 7.101 -7.378 1.00 0.00 C ATOM 453 O VAL A 30 11.809 6.630 -8.497 1.00 0.00 O ATOM 454 CB VAL A 30 12.313 4.792 -6.500 1.00 0.00 C ATOM 455 CG1 VAL A 30 12.346 3.935 -5.235 1.00 0.00 C ATOM 456 CG2 VAL A 30 11.325 4.188 -7.500 1.00 0.00 C ATOM 0 H VAL A 30 9.751 5.961 -6.302 1.00 0.00 H new ATOM 0 HA VAL A 30 12.535 6.678 -5.418 1.00 0.00 H new ATOM 0 HB VAL A 30 13.307 4.824 -6.946 1.00 0.00 H new ATOM 0 HG11 VAL A 30 12.665 2.924 -5.489 1.00 0.00 H new ATOM 0 HG12 VAL A 30 13.046 4.368 -4.520 1.00 0.00 H new ATOM 0 HG13 VAL A 30 11.350 3.901 -4.793 1.00 0.00 H new ATOM 0 HG21 VAL A 30 11.643 3.178 -7.761 1.00 0.00 H new ATOM 0 HG22 VAL A 30 10.331 4.152 -7.053 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.296 4.803 -8.400 1.00 0.00 H new ATOM 466 N ALA A 31 11.897 8.388 -7.183 1.00 0.00 N ATOM 467 CA ALA A 31 11.893 9.322 -8.346 1.00 0.00 C ATOM 468 C ALA A 31 10.795 8.935 -9.340 1.00 0.00 C ATOM 469 O ALA A 31 11.069 8.513 -10.446 1.00 0.00 O ATOM 470 CB ALA A 31 13.273 9.163 -8.984 1.00 0.00 C ATOM 0 H ALA A 31 11.936 8.836 -6.268 1.00 0.00 H new ATOM 0 HA ALA A 31 11.696 10.351 -8.046 1.00 0.00 H new ATOM 0 HB1 ALA A 31 13.351 9.820 -9.851 1.00 0.00 H new ATOM 0 HB2 ALA A 31 14.042 9.427 -8.258 1.00 0.00 H new ATOM 0 HB3 ALA A 31 13.411 8.129 -9.299 1.00 0.00 H new ATOM 476 N GLY A 32 9.553 9.077 -8.960 1.00 0.00 N ATOM 477 CA GLY A 32 8.450 8.718 -9.898 1.00 0.00 C ATOM 478 C GLY A 32 7.085 8.981 -9.251 1.00 0.00 C ATOM 479 O GLY A 32 6.100 8.359 -9.601 1.00 0.00 O ATOM 0 H GLY A 32 9.256 9.423 -8.048 1.00 0.00 H new ATOM 0 HA2 GLY A 32 8.542 9.299 -10.815 1.00 0.00 H new ATOM 0 HA3 GLY A 32 8.530 7.667 -10.177 1.00 0.00 H new ATOM 483 N ASP A 33 7.004 9.895 -8.321 1.00 0.00 N ATOM 484 CA ASP A 33 5.686 10.178 -7.679 1.00 0.00 C ATOM 485 C ASP A 33 4.923 11.237 -8.481 1.00 0.00 C ATOM 486 O ASP A 33 5.508 12.091 -9.114 1.00 0.00 O ATOM 487 CB ASP A 33 6.025 10.709 -6.286 1.00 0.00 C ATOM 488 CG ASP A 33 6.816 9.654 -5.511 1.00 0.00 C ATOM 489 OD1 ASP A 33 7.149 8.640 -6.100 1.00 0.00 O ATOM 490 OD2 ASP A 33 7.076 9.880 -4.340 1.00 0.00 O ATOM 0 H ASP A 33 7.786 10.454 -7.980 1.00 0.00 H new ATOM 0 HA ASP A 33 5.053 9.292 -7.635 1.00 0.00 H new ATOM 0 HB2 ASP A 33 6.607 11.627 -6.368 1.00 0.00 H new ATOM 0 HB3 ASP A 33 5.110 10.959 -5.749 1.00 0.00 H new ATOM 495 N GLU A 34 3.618 11.190 -8.456 1.00 0.00 N ATOM 496 CA GLU A 34 2.818 12.199 -9.210 1.00 0.00 C ATOM 497 C GLU A 34 1.532 12.529 -8.444 1.00 0.00 C ATOM 498 O GLU A 34 0.810 11.648 -8.020 1.00 0.00 O ATOM 499 CB GLU A 34 2.492 11.532 -10.547 1.00 0.00 C ATOM 500 CG GLU A 34 1.681 12.497 -11.415 1.00 0.00 C ATOM 501 CD GLU A 34 1.298 11.810 -12.727 1.00 0.00 C ATOM 502 OE1 GLU A 34 1.438 10.600 -12.803 1.00 0.00 O ATOM 503 OE2 GLU A 34 0.871 12.505 -13.635 1.00 0.00 O ATOM 0 H GLU A 34 3.071 10.496 -7.946 1.00 0.00 H new ATOM 0 HA GLU A 34 3.357 13.136 -9.347 1.00 0.00 H new ATOM 0 HB2 GLU A 34 3.412 11.251 -11.059 1.00 0.00 H new ATOM 0 HB3 GLU A 34 1.928 10.615 -10.380 1.00 0.00 H new ATOM 0 HG2 GLU A 34 0.784 12.814 -10.883 1.00 0.00 H new ATOM 0 HG3 GLU A 34 2.264 13.395 -11.620 1.00 0.00 H new ATOM 510 N TRP A 35 1.236 13.789 -8.262 1.00 0.00 N ATOM 511 CA TRP A 35 -0.006 14.157 -7.522 1.00 0.00 C ATOM 512 C TRP A 35 -0.652 15.403 -8.134 1.00 0.00 C ATOM 513 O TRP A 35 -0.050 16.106 -8.920 1.00 0.00 O ATOM 514 CB TRP A 35 0.446 14.414 -6.079 1.00 0.00 C ATOM 515 CG TRP A 35 1.031 15.783 -5.942 1.00 0.00 C ATOM 516 CD1 TRP A 35 0.357 16.870 -5.508 1.00 0.00 C ATOM 517 CD2 TRP A 35 2.392 16.224 -6.210 1.00 0.00 C ATOM 518 NE1 TRP A 35 1.214 17.955 -5.503 1.00 0.00 N ATOM 519 CE2 TRP A 35 2.480 17.608 -5.928 1.00 0.00 C ATOM 520 CE3 TRP A 35 3.544 15.566 -6.670 1.00 0.00 C ATOM 521 CZ2 TRP A 35 3.673 18.313 -6.094 1.00 0.00 C ATOM 522 CZ3 TRP A 35 4.745 16.272 -6.838 1.00 0.00 C ATOM 523 CH2 TRP A 35 4.810 17.643 -6.551 1.00 0.00 C ATOM 0 H TRP A 35 1.797 14.575 -8.592 1.00 0.00 H new ATOM 0 HA TRP A 35 -0.760 13.371 -7.570 1.00 0.00 H new ATOM 0 HB2 TRP A 35 -0.402 14.307 -5.403 1.00 0.00 H new ATOM 0 HB3 TRP A 35 1.184 13.667 -5.786 1.00 0.00 H new ATOM 0 HD1 TRP A 35 -0.682 16.889 -5.213 1.00 0.00 H new ATOM 0 HE1 TRP A 35 0.943 18.897 -5.220 1.00 0.00 H new ATOM 0 HE3 TRP A 35 3.505 14.511 -6.896 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 3.717 19.369 -5.871 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 5.626 15.756 -7.191 1.00 0.00 H new ATOM 0 HH2 TRP A 35 5.738 18.180 -6.683 1.00 0.00 H new ATOM 534 N LEU A 36 -1.879 15.676 -7.776 1.00 0.00 N ATOM 535 CA LEU A 36 -2.574 16.871 -8.334 1.00 0.00 C ATOM 536 C LEU A 36 -2.325 18.087 -7.436 1.00 0.00 C ATOM 537 O LEU A 36 -2.083 17.955 -6.256 1.00 0.00 O ATOM 538 CB LEU A 36 -4.056 16.501 -8.329 1.00 0.00 C ATOM 539 CG LEU A 36 -4.875 17.688 -8.836 1.00 0.00 C ATOM 540 CD1 LEU A 36 -4.399 18.076 -10.237 1.00 0.00 C ATOM 541 CD2 LEU A 36 -6.352 17.297 -8.891 1.00 0.00 C ATOM 0 H LEU A 36 -2.430 15.122 -7.120 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.220 17.130 -9.332 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -4.227 15.630 -8.961 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -4.372 16.231 -7.321 1.00 0.00 H new ATOM 0 HG LEU A 36 -4.745 18.535 -8.162 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -4.983 18.922 -10.598 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.345 18.352 -10.200 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -4.529 17.231 -10.913 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -6.939 18.142 -9.252 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -6.480 16.451 -9.567 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -6.692 17.019 -7.893 1.00 0.00 H new ATOM 553 N PHE A 37 -2.382 19.273 -7.977 1.00 0.00 N ATOM 554 CA PHE A 37 -2.140 20.477 -7.132 1.00 0.00 C ATOM 555 C PHE A 37 -3.364 21.386 -7.140 1.00 0.00 C ATOM 556 O PHE A 37 -3.668 22.015 -8.128 1.00 0.00 O ATOM 557 CB PHE A 37 -0.953 21.186 -7.782 1.00 0.00 C ATOM 558 CG PHE A 37 -0.163 21.910 -6.721 1.00 0.00 C ATOM 559 CD1 PHE A 37 -0.831 22.627 -5.722 1.00 0.00 C ATOM 560 CD2 PHE A 37 1.235 21.862 -6.734 1.00 0.00 C ATOM 561 CE1 PHE A 37 -0.099 23.297 -4.735 1.00 0.00 C ATOM 562 CE2 PHE A 37 1.967 22.531 -5.746 1.00 0.00 C ATOM 563 CZ PHE A 37 1.299 23.248 -4.746 1.00 0.00 C ATOM 0 H PHE A 37 -2.584 19.460 -8.959 1.00 0.00 H new ATOM 0 HA PHE A 37 -1.944 20.214 -6.093 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -0.318 20.463 -8.294 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.304 21.891 -8.535 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -1.910 22.663 -5.713 1.00 0.00 H new ATOM 0 HD2 PHE A 37 1.749 21.309 -7.506 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -0.614 23.852 -3.965 1.00 0.00 H new ATOM 0 HE2 PHE A 37 3.046 22.494 -5.755 1.00 0.00 H new ATOM 0 HZ PHE A 37 1.863 23.763 -3.983 1.00 0.00 H new ATOM 573 N GLU A 38 -4.062 21.466 -6.042 1.00 0.00 N ATOM 574 CA GLU A 38 -5.267 22.340 -5.987 1.00 0.00 C ATOM 575 C GLU A 38 -4.881 23.742 -5.512 1.00 0.00 C ATOM 576 O GLU A 38 -4.260 23.906 -4.482 1.00 0.00 O ATOM 577 CB GLU A 38 -6.188 21.668 -4.971 1.00 0.00 C ATOM 578 CG GLU A 38 -7.448 22.514 -4.784 1.00 0.00 C ATOM 579 CD GLU A 38 -7.193 23.573 -3.711 1.00 0.00 C ATOM 580 OE1 GLU A 38 -7.385 23.265 -2.546 1.00 0.00 O ATOM 581 OE2 GLU A 38 -6.807 24.673 -4.071 1.00 0.00 O ATOM 0 H GLU A 38 -3.850 20.964 -5.180 1.00 0.00 H new ATOM 0 HA GLU A 38 -5.742 22.454 -6.961 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -6.456 20.668 -5.313 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -5.672 21.551 -4.018 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -7.722 22.992 -5.725 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -8.285 21.880 -4.493 1.00 0.00 H new ATOM 588 N GLY A 39 -5.245 24.758 -6.249 1.00 0.00 N ATOM 589 CA GLY A 39 -4.890 26.137 -5.814 1.00 0.00 C ATOM 590 C GLY A 39 -3.372 26.247 -5.668 1.00 0.00 C ATOM 591 O GLY A 39 -2.879 26.750 -4.677 1.00 0.00 O ATOM 0 H GLY A 39 -5.767 24.693 -7.123 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -5.250 26.864 -6.542 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -5.376 26.368 -4.866 1.00 0.00 H new ATOM 595 N PRO A 40 -2.676 25.760 -6.660 1.00 0.00 N ATOM 596 CA PRO A 40 -1.190 25.789 -6.638 1.00 0.00 C ATOM 597 C PRO A 40 -0.693 27.235 -6.615 1.00 0.00 C ATOM 598 O PRO A 40 0.411 27.514 -6.192 1.00 0.00 O ATOM 599 CB PRO A 40 -0.803 25.075 -7.935 1.00 0.00 C ATOM 600 CG PRO A 40 -2.001 25.227 -8.814 1.00 0.00 C ATOM 601 CD PRO A 40 -3.190 25.161 -7.895 1.00 0.00 C ATOM 0 HA PRO A 40 -0.753 25.313 -5.760 1.00 0.00 H new ATOM 0 HB2 PRO A 40 0.081 25.524 -8.387 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -0.572 24.025 -7.757 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -1.974 26.174 -9.352 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -2.040 24.436 -9.563 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -4.040 25.717 -8.292 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -3.525 24.135 -7.739 1.00 0.00 H new ATOM 609 N GLY A 41 -1.522 28.148 -7.048 1.00 0.00 N ATOM 610 CA GLY A 41 -1.153 29.595 -7.048 1.00 0.00 C ATOM 611 C GLY A 41 0.353 29.789 -7.250 1.00 0.00 C ATOM 612 O GLY A 41 0.834 29.892 -8.360 1.00 0.00 O ATOM 0 H GLY A 41 -2.455 27.949 -7.408 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -1.697 30.111 -7.840 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -1.456 30.049 -6.105 1.00 0.00 H new ATOM 616 N THR A 42 1.095 29.866 -6.177 1.00 0.00 N ATOM 617 CA THR A 42 2.566 30.086 -6.296 1.00 0.00 C ATOM 618 C THR A 42 3.322 28.767 -6.477 1.00 0.00 C ATOM 619 O THR A 42 4.431 28.615 -6.004 1.00 0.00 O ATOM 620 CB THR A 42 2.970 30.748 -4.978 1.00 0.00 C ATOM 621 OG1 THR A 42 2.472 29.978 -3.893 1.00 0.00 O ATOM 622 CG2 THR A 42 2.390 32.163 -4.917 1.00 0.00 C ATOM 0 H THR A 42 0.745 29.786 -5.222 1.00 0.00 H new ATOM 0 HA THR A 42 2.807 30.695 -7.167 1.00 0.00 H new ATOM 0 HB THR A 42 4.057 30.803 -4.914 1.00 0.00 H new ATOM 0 HG1 THR A 42 2.731 30.399 -3.047 1.00 0.00 H new ATOM 0 HG21 THR A 42 2.678 32.634 -3.977 1.00 0.00 H new ATOM 0 HG22 THR A 42 2.775 32.750 -5.751 1.00 0.00 H new ATOM 0 HG23 THR A 42 1.303 32.114 -4.980 1.00 0.00 H new ATOM 630 N TYR A 43 2.753 27.815 -7.163 1.00 0.00 N ATOM 631 CA TYR A 43 3.482 26.529 -7.362 1.00 0.00 C ATOM 632 C TYR A 43 4.675 26.754 -8.297 1.00 0.00 C ATOM 633 O TYR A 43 4.514 27.005 -9.475 1.00 0.00 O ATOM 634 CB TYR A 43 2.470 25.575 -8.005 1.00 0.00 C ATOM 635 CG TYR A 43 3.215 24.444 -8.680 1.00 0.00 C ATOM 636 CD1 TYR A 43 3.979 23.554 -7.915 1.00 0.00 C ATOM 637 CD2 TYR A 43 3.155 24.298 -10.071 1.00 0.00 C ATOM 638 CE1 TYR A 43 4.682 22.518 -8.540 1.00 0.00 C ATOM 639 CE2 TYR A 43 3.857 23.260 -10.697 1.00 0.00 C ATOM 640 CZ TYR A 43 4.620 22.370 -9.931 1.00 0.00 C ATOM 641 OH TYR A 43 5.312 21.348 -10.547 1.00 0.00 O ATOM 0 H TYR A 43 1.828 27.868 -7.589 1.00 0.00 H new ATOM 0 HA TYR A 43 3.869 26.126 -6.426 1.00 0.00 H new ATOM 0 HB2 TYR A 43 1.792 25.180 -7.248 1.00 0.00 H new ATOM 0 HB3 TYR A 43 1.859 26.110 -8.732 1.00 0.00 H new ATOM 0 HD1 TYR A 43 4.026 23.667 -6.842 1.00 0.00 H new ATOM 0 HD2 TYR A 43 2.568 24.986 -10.661 1.00 0.00 H new ATOM 0 HE1 TYR A 43 5.272 21.833 -7.950 1.00 0.00 H new ATOM 0 HE2 TYR A 43 3.810 23.146 -11.770 1.00 0.00 H new ATOM 0 HH TYR A 43 5.791 20.824 -9.872 1.00 0.00 H new ATOM 651 N ILE A 44 5.870 26.657 -7.783 1.00 0.00 N ATOM 652 CA ILE A 44 7.068 26.856 -8.646 1.00 0.00 C ATOM 653 C ILE A 44 7.702 25.502 -8.975 1.00 0.00 C ATOM 654 O ILE A 44 7.732 24.613 -8.148 1.00 0.00 O ATOM 655 CB ILE A 44 8.020 27.715 -7.816 1.00 0.00 C ATOM 656 CG1 ILE A 44 7.412 29.105 -7.624 1.00 0.00 C ATOM 657 CG2 ILE A 44 9.360 27.843 -8.545 1.00 0.00 C ATOM 658 CD1 ILE A 44 7.009 29.291 -6.161 1.00 0.00 C ATOM 0 H ILE A 44 6.069 26.449 -6.804 1.00 0.00 H new ATOM 0 HA ILE A 44 6.824 27.333 -9.595 1.00 0.00 H new ATOM 0 HB ILE A 44 8.178 27.247 -6.844 1.00 0.00 H new ATOM 0 HG12 ILE A 44 8.131 29.871 -7.914 1.00 0.00 H new ATOM 0 HG13 ILE A 44 6.542 29.225 -8.269 1.00 0.00 H new ATOM 0 HG21 ILE A 44 10.039 28.456 -7.953 1.00 0.00 H new ATOM 0 HG22 ILE A 44 9.794 26.853 -8.686 1.00 0.00 H new ATOM 0 HG23 ILE A 44 9.202 28.311 -9.517 1.00 0.00 H new ATOM 0 HD11 ILE A 44 6.576 30.282 -6.026 1.00 0.00 H new ATOM 0 HD12 ILE A 44 6.275 28.534 -5.887 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.889 29.190 -5.526 1.00 0.00 H new ATOM 670 N PRO A 45 8.181 25.391 -10.183 1.00 0.00 N ATOM 671 CA PRO A 45 8.816 24.130 -10.640 1.00 0.00 C ATOM 672 C PRO A 45 10.170 23.923 -9.954 1.00 0.00 C ATOM 673 O PRO A 45 11.128 24.619 -10.227 1.00 0.00 O ATOM 674 CB PRO A 45 8.991 24.342 -12.142 1.00 0.00 C ATOM 675 CG PRO A 45 9.034 25.827 -12.317 1.00 0.00 C ATOM 676 CD PRO A 45 8.181 26.420 -11.227 1.00 0.00 C ATOM 0 HA PRO A 45 8.225 23.245 -10.404 1.00 0.00 H new ATOM 0 HB2 PRO A 45 9.907 23.875 -12.503 1.00 0.00 H new ATOM 0 HB3 PRO A 45 8.166 23.902 -12.702 1.00 0.00 H new ATOM 0 HG2 PRO A 45 10.058 26.194 -12.249 1.00 0.00 H new ATOM 0 HG3 PRO A 45 8.658 26.111 -13.300 1.00 0.00 H new ATOM 0 HD2 PRO A 45 8.595 27.360 -10.862 1.00 0.00 H new ATOM 0 HD3 PRO A 45 7.172 26.632 -11.580 1.00 0.00 H new ATOM 684 N ARG A 46 10.255 22.967 -9.070 1.00 0.00 N ATOM 685 CA ARG A 46 11.548 22.709 -8.369 1.00 0.00 C ATOM 686 C ARG A 46 12.124 21.360 -8.811 1.00 0.00 C ATOM 687 O ARG A 46 11.399 20.413 -9.045 1.00 0.00 O ATOM 688 CB ARG A 46 11.195 22.680 -6.880 1.00 0.00 C ATOM 689 CG ARG A 46 10.873 24.098 -6.401 1.00 0.00 C ATOM 690 CD ARG A 46 10.982 24.159 -4.875 1.00 0.00 C ATOM 691 NE ARG A 46 10.567 25.544 -4.515 1.00 0.00 N ATOM 692 CZ ARG A 46 10.322 25.852 -3.270 1.00 0.00 C ATOM 693 NH1 ARG A 46 10.611 25.009 -2.315 1.00 0.00 N ATOM 694 NH2 ARG A 46 9.786 27.006 -2.977 1.00 0.00 N ATOM 0 H ARG A 46 9.486 22.353 -8.802 1.00 0.00 H new ATOM 0 HA ARG A 46 12.299 23.467 -8.593 1.00 0.00 H new ATOM 0 HB2 ARG A 46 10.340 22.025 -6.711 1.00 0.00 H new ATOM 0 HB3 ARG A 46 12.027 22.272 -6.306 1.00 0.00 H new ATOM 0 HG2 ARG A 46 11.561 24.811 -6.854 1.00 0.00 H new ATOM 0 HG3 ARG A 46 9.868 24.380 -6.716 1.00 0.00 H new ATOM 0 HD2 ARG A 46 10.337 23.418 -4.403 1.00 0.00 H new ATOM 0 HD3 ARG A 46 12.000 23.953 -4.543 1.00 0.00 H new ATOM 0 HE ARG A 46 10.474 26.253 -5.243 1.00 0.00 H new ATOM 0 HH11 ARG A 46 11.030 24.107 -2.541 1.00 0.00 H new ATOM 0 HH12 ARG A 46 10.418 25.253 -1.344 1.00 0.00 H new ATOM 0 HH21 ARG A 46 9.559 27.666 -3.721 1.00 0.00 H new ATOM 0 HH22 ARG A 46 9.594 27.247 -2.005 1.00 0.00 H new ATOM 708 N LYS A 47 13.421 21.262 -8.929 1.00 0.00 N ATOM 709 CA LYS A 47 14.032 19.971 -9.358 1.00 0.00 C ATOM 710 C LYS A 47 13.364 18.804 -8.626 1.00 0.00 C ATOM 711 O LYS A 47 13.137 17.752 -9.190 1.00 0.00 O ATOM 712 CB LYS A 47 15.508 20.077 -8.967 1.00 0.00 C ATOM 713 CG LYS A 47 15.624 20.385 -7.473 1.00 0.00 C ATOM 714 CD LYS A 47 16.930 21.137 -7.206 1.00 0.00 C ATOM 715 CE LYS A 47 16.953 21.625 -5.755 1.00 0.00 C ATOM 716 NZ LYS A 47 16.790 20.396 -4.931 1.00 0.00 N ATOM 0 H LYS A 47 14.082 22.017 -8.748 1.00 0.00 H new ATOM 0 HA LYS A 47 13.908 19.790 -10.426 1.00 0.00 H new ATOM 0 HB2 LYS A 47 16.023 19.144 -9.197 1.00 0.00 H new ATOM 0 HB3 LYS A 47 15.993 20.861 -9.549 1.00 0.00 H new ATOM 0 HG2 LYS A 47 14.774 20.984 -7.147 1.00 0.00 H new ATOM 0 HG3 LYS A 47 15.601 19.460 -6.897 1.00 0.00 H new ATOM 0 HD2 LYS A 47 17.782 20.484 -7.395 1.00 0.00 H new ATOM 0 HD3 LYS A 47 17.020 21.984 -7.887 1.00 0.00 H new ATOM 0 HE2 LYS A 47 17.889 22.133 -5.525 1.00 0.00 H new ATOM 0 HE3 LYS A 47 16.149 22.336 -5.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 17.203 20.552 -3.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 15.778 20.176 -4.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 17.274 19.601 -5.394 1.00 0.00 H new ATOM 730 N GLU A 48 13.043 18.982 -7.374 1.00 0.00 N ATOM 731 CA GLU A 48 12.388 17.883 -6.609 1.00 0.00 C ATOM 732 C GLU A 48 11.276 17.245 -7.446 1.00 0.00 C ATOM 733 O GLU A 48 11.139 16.042 -7.494 1.00 0.00 O ATOM 734 CB GLU A 48 11.804 18.557 -5.367 1.00 0.00 C ATOM 735 CG GLU A 48 12.774 18.396 -4.193 1.00 0.00 C ATOM 736 CD GLU A 48 12.209 19.107 -2.961 1.00 0.00 C ATOM 737 OE1 GLU A 48 11.280 18.580 -2.371 1.00 0.00 O ATOM 738 OE2 GLU A 48 12.717 20.164 -2.627 1.00 0.00 O ATOM 0 H GLU A 48 13.206 19.840 -6.848 1.00 0.00 H new ATOM 0 HA GLU A 48 13.087 17.087 -6.350 1.00 0.00 H new ATOM 0 HB2 GLU A 48 11.627 19.614 -5.564 1.00 0.00 H new ATOM 0 HB3 GLU A 48 10.840 18.113 -5.119 1.00 0.00 H new ATOM 0 HG2 GLU A 48 12.928 17.339 -3.977 1.00 0.00 H new ATOM 0 HG3 GLU A 48 13.747 18.813 -4.452 1.00 0.00 H new ATOM 745 N VAL A 49 10.478 18.046 -8.100 1.00 0.00 N ATOM 746 CA VAL A 49 9.367 17.501 -8.932 1.00 0.00 C ATOM 747 C VAL A 49 9.302 18.245 -10.273 1.00 0.00 C ATOM 748 O VAL A 49 9.998 19.219 -10.484 1.00 0.00 O ATOM 749 CB VAL A 49 8.091 17.751 -8.111 1.00 0.00 C ATOM 750 CG1 VAL A 49 8.372 17.510 -6.624 1.00 0.00 C ATOM 751 CG2 VAL A 49 7.622 19.197 -8.304 1.00 0.00 C ATOM 0 H VAL A 49 10.549 19.063 -8.093 1.00 0.00 H new ATOM 0 HA VAL A 49 9.500 16.443 -9.160 1.00 0.00 H new ATOM 0 HB VAL A 49 7.315 17.066 -8.452 1.00 0.00 H new ATOM 0 HG11 VAL A 49 7.464 17.689 -6.048 1.00 0.00 H new ATOM 0 HG12 VAL A 49 8.697 16.480 -6.477 1.00 0.00 H new ATOM 0 HG13 VAL A 49 9.155 18.189 -6.287 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.718 19.367 -7.720 1.00 0.00 H new ATOM 0 HG22 VAL A 49 8.403 19.880 -7.971 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.411 19.373 -9.359 1.00 0.00 H new ATOM 761 N GLU A 50 8.469 17.803 -11.176 1.00 0.00 N ATOM 762 CA GLU A 50 8.361 18.499 -12.493 1.00 0.00 C ATOM 763 C GLU A 50 6.891 18.658 -12.898 1.00 0.00 C ATOM 764 O GLU A 50 6.088 17.764 -12.718 1.00 0.00 O ATOM 765 CB GLU A 50 9.087 17.591 -13.487 1.00 0.00 C ATOM 766 CG GLU A 50 10.584 17.909 -13.474 1.00 0.00 C ATOM 767 CD GLU A 50 11.114 17.912 -14.909 1.00 0.00 C ATOM 768 OE1 GLU A 50 10.982 16.895 -15.571 1.00 0.00 O ATOM 769 OE2 GLU A 50 11.642 18.931 -15.322 1.00 0.00 O ATOM 0 H GLU A 50 7.860 16.993 -11.061 1.00 0.00 H new ATOM 0 HA GLU A 50 8.792 19.500 -12.459 1.00 0.00 H new ATOM 0 HB2 GLU A 50 8.925 16.545 -13.225 1.00 0.00 H new ATOM 0 HB3 GLU A 50 8.683 17.735 -14.489 1.00 0.00 H new ATOM 0 HG2 GLU A 50 10.757 18.879 -13.008 1.00 0.00 H new ATOM 0 HG3 GLU A 50 11.119 17.170 -12.878 1.00 0.00 H new ATOM 776 N VAL A 51 6.534 19.788 -13.454 1.00 0.00 N ATOM 777 CA VAL A 51 5.117 19.993 -13.881 1.00 0.00 C ATOM 778 C VAL A 51 4.695 18.861 -14.816 1.00 0.00 C ATOM 779 O VAL A 51 5.387 18.533 -15.760 1.00 0.00 O ATOM 780 CB VAL A 51 5.110 21.331 -14.622 1.00 0.00 C ATOM 781 CG1 VAL A 51 3.666 21.756 -14.893 1.00 0.00 C ATOM 782 CG2 VAL A 51 5.799 22.394 -13.762 1.00 0.00 C ATOM 0 H VAL A 51 7.159 20.574 -13.630 1.00 0.00 H new ATOM 0 HA VAL A 51 4.424 19.997 -13.040 1.00 0.00 H new ATOM 0 HB VAL A 51 5.642 21.225 -15.567 1.00 0.00 H new ATOM 0 HG11 VAL A 51 3.660 22.710 -15.421 1.00 0.00 H new ATOM 0 HG12 VAL A 51 3.173 21.000 -15.504 1.00 0.00 H new ATOM 0 HG13 VAL A 51 3.134 21.862 -13.947 1.00 0.00 H new ATOM 0 HG21 VAL A 51 5.794 23.348 -14.290 1.00 0.00 H new ATOM 0 HG22 VAL A 51 5.266 22.499 -12.817 1.00 0.00 H new ATOM 0 HG23 VAL A 51 6.828 22.093 -13.566 1.00 0.00 H new ATOM 792 N VAL A 52 3.570 18.255 -14.559 1.00 0.00 N ATOM 793 CA VAL A 52 3.113 17.138 -15.433 1.00 0.00 C ATOM 794 C VAL A 52 1.901 17.568 -16.256 1.00 0.00 C ATOM 795 O VAL A 52 1.940 17.600 -17.470 1.00 0.00 O ATOM 796 CB VAL A 52 2.734 16.017 -14.471 1.00 0.00 C ATOM 797 CG1 VAL A 52 2.480 14.731 -15.259 1.00 0.00 C ATOM 798 CG2 VAL A 52 3.879 15.792 -13.483 1.00 0.00 C ATOM 0 H VAL A 52 2.948 18.484 -13.784 1.00 0.00 H new ATOM 0 HA VAL A 52 3.881 16.829 -16.142 1.00 0.00 H new ATOM 0 HB VAL A 52 1.830 16.292 -13.927 1.00 0.00 H new ATOM 0 HG11 VAL A 52 2.209 13.930 -14.571 1.00 0.00 H new ATOM 0 HG12 VAL A 52 1.666 14.892 -15.966 1.00 0.00 H new ATOM 0 HG13 VAL A 52 3.383 14.453 -15.802 1.00 0.00 H new ATOM 0 HG21 VAL A 52 3.612 14.991 -12.793 1.00 0.00 H new ATOM 0 HG22 VAL A 52 4.781 15.516 -14.029 1.00 0.00 H new ATOM 0 HG23 VAL A 52 4.061 16.709 -12.922 1.00 0.00 H new ATOM 808 N GLU A 53 0.821 17.893 -15.605 1.00 0.00 N ATOM 809 CA GLU A 53 -0.397 18.315 -16.355 1.00 0.00 C ATOM 810 C GLU A 53 -1.064 19.494 -15.649 1.00 0.00 C ATOM 811 O GLU A 53 -0.689 19.874 -14.559 1.00 0.00 O ATOM 812 CB GLU A 53 -1.342 17.103 -16.345 1.00 0.00 C ATOM 813 CG GLU A 53 -0.547 15.793 -16.305 1.00 0.00 C ATOM 814 CD GLU A 53 -1.381 14.670 -16.926 1.00 0.00 C ATOM 815 OE1 GLU A 53 -2.575 14.864 -17.082 1.00 0.00 O ATOM 816 OE2 GLU A 53 -0.810 13.637 -17.234 1.00 0.00 O ATOM 0 H GLU A 53 0.727 17.885 -14.589 1.00 0.00 H new ATOM 0 HA GLU A 53 -0.152 18.628 -17.370 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -2.003 17.159 -15.480 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -1.975 17.122 -17.232 1.00 0.00 H new ATOM 0 HG2 GLU A 53 0.391 15.908 -16.849 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -0.290 15.543 -15.276 1.00 0.00 H new ATOM 823 N ILE A 54 -2.063 20.064 -16.259 1.00 0.00 N ATOM 824 CA ILE A 54 -2.776 21.207 -15.622 1.00 0.00 C ATOM 825 C ILE A 54 -4.281 20.946 -15.703 1.00 0.00 C ATOM 826 O ILE A 54 -4.750 20.279 -16.605 1.00 0.00 O ATOM 827 CB ILE A 54 -2.393 22.462 -16.424 1.00 0.00 C ATOM 828 CG1 ILE A 54 -1.017 22.289 -17.085 1.00 0.00 C ATOM 829 CG2 ILE A 54 -2.346 23.662 -15.477 1.00 0.00 C ATOM 830 CD1 ILE A 54 0.061 22.117 -16.011 1.00 0.00 C ATOM 0 H ILE A 54 -2.419 19.788 -17.174 1.00 0.00 H new ATOM 0 HA ILE A 54 -2.508 21.334 -14.573 1.00 0.00 H new ATOM 0 HB ILE A 54 -3.137 22.620 -17.205 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -1.027 21.421 -17.744 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -0.790 23.157 -17.704 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -2.075 24.557 -16.037 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -3.325 23.803 -15.019 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -1.604 23.483 -14.699 1.00 0.00 H new ATOM 0 HD11 ILE A 54 1.034 21.995 -16.488 1.00 0.00 H new ATOM 0 HD12 ILE A 54 0.079 22.998 -15.370 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -0.162 21.235 -15.410 1.00 0.00 H new ATOM 842 N ILE A 55 -5.045 21.440 -14.771 1.00 0.00 N ATOM 843 CA ILE A 55 -6.514 21.180 -14.817 1.00 0.00 C ATOM 844 C ILE A 55 -7.302 22.405 -14.332 1.00 0.00 C ATOM 845 O ILE A 55 -6.886 23.115 -13.438 1.00 0.00 O ATOM 846 CB ILE A 55 -6.717 19.955 -13.900 1.00 0.00 C ATOM 847 CG1 ILE A 55 -7.439 18.857 -14.685 1.00 0.00 C ATOM 848 CG2 ILE A 55 -7.546 20.311 -12.660 1.00 0.00 C ATOM 849 CD1 ILE A 55 -8.870 19.303 -14.988 1.00 0.00 C ATOM 0 H ILE A 55 -4.723 22.007 -13.986 1.00 0.00 H new ATOM 0 HA ILE A 55 -6.878 20.988 -15.826 1.00 0.00 H new ATOM 0 HB ILE A 55 -5.737 19.612 -13.568 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -6.907 18.650 -15.614 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -7.449 17.931 -14.110 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -7.669 19.425 -12.038 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -7.034 21.086 -12.090 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -8.526 20.675 -12.970 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -9.384 18.521 -15.547 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -9.399 19.488 -14.053 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -8.848 20.218 -15.580 1.00 0.00 H new ATOM 861 N GLN A 56 -8.444 22.643 -14.917 1.00 0.00 N ATOM 862 CA GLN A 56 -9.278 23.804 -14.499 1.00 0.00 C ATOM 863 C GLN A 56 -10.602 23.306 -13.912 1.00 0.00 C ATOM 864 O GLN A 56 -10.931 22.139 -14.006 1.00 0.00 O ATOM 865 CB GLN A 56 -9.527 24.595 -15.785 1.00 0.00 C ATOM 866 CG GLN A 56 -8.262 25.369 -16.165 1.00 0.00 C ATOM 867 CD GLN A 56 -7.225 24.405 -16.746 1.00 0.00 C ATOM 868 OE1 GLN A 56 -7.436 23.825 -17.793 1.00 0.00 O ATOM 869 NE2 GLN A 56 -6.105 24.207 -16.106 1.00 0.00 N ATOM 0 H GLN A 56 -8.837 22.079 -15.671 1.00 0.00 H new ATOM 0 HA GLN A 56 -8.794 24.413 -13.735 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -9.807 23.918 -16.592 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -10.359 25.285 -15.644 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -8.502 26.143 -16.894 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -7.854 25.872 -15.288 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -5.927 24.693 -15.227 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -5.408 23.566 -16.485 1.00 0.00 H new ATOM 878 N ALA A 57 -11.366 24.176 -13.310 1.00 0.00 N ATOM 879 CA ALA A 57 -12.666 23.741 -12.724 1.00 0.00 C ATOM 880 C ALA A 57 -13.778 23.852 -13.771 1.00 0.00 C ATOM 881 O ALA A 57 -13.835 24.799 -14.530 1.00 0.00 O ATOM 882 CB ALA A 57 -12.922 24.702 -11.563 1.00 0.00 C ATOM 0 H ALA A 57 -11.148 25.166 -13.199 1.00 0.00 H new ATOM 0 HA ALA A 57 -12.643 22.703 -12.392 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -13.865 24.445 -11.079 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -12.110 24.624 -10.840 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -12.974 25.723 -11.941 1.00 0.00 H new ATOM 888 N THR A 58 -14.658 22.891 -13.822 1.00 0.00 N ATOM 889 CA THR A 58 -15.758 22.943 -14.826 1.00 0.00 C ATOM 890 C THR A 58 -16.793 21.854 -14.535 1.00 0.00 C ATOM 891 O THR A 58 -17.152 21.081 -15.400 1.00 0.00 O ATOM 892 CB THR A 58 -15.073 22.679 -16.167 1.00 0.00 C ATOM 893 OG1 THR A 58 -16.058 22.505 -17.176 1.00 0.00 O ATOM 894 CG2 THR A 58 -14.216 21.416 -16.062 1.00 0.00 C ATOM 0 H THR A 58 -14.663 22.073 -13.213 1.00 0.00 H new ATOM 0 HA THR A 58 -16.287 23.896 -14.812 1.00 0.00 H new ATOM 0 HB THR A 58 -14.438 23.526 -16.425 1.00 0.00 H new ATOM 0 HG1 THR A 58 -16.597 21.712 -16.973 1.00 0.00 H new ATOM 0 HG21 THR A 58 -13.727 21.227 -17.018 1.00 0.00 H new ATOM 0 HG22 THR A 58 -13.460 21.553 -15.289 1.00 0.00 H new ATOM 0 HG23 THR A 58 -14.849 20.567 -15.804 1.00 0.00 H new ATOM 902 N ILE A 59 -17.272 21.779 -13.323 1.00 0.00 N ATOM 903 CA ILE A 59 -18.274 20.728 -12.989 1.00 0.00 C ATOM 904 C ILE A 59 -19.265 21.241 -11.936 1.00 0.00 C ATOM 905 O ILE A 59 -20.353 21.671 -12.263 1.00 0.00 O ATOM 906 CB ILE A 59 -17.435 19.566 -12.459 1.00 0.00 C ATOM 907 CG1 ILE A 59 -16.858 18.788 -13.641 1.00 0.00 C ATOM 908 CG2 ILE A 59 -18.301 18.629 -11.621 1.00 0.00 C ATOM 909 CD1 ILE A 59 -17.990 18.070 -14.374 1.00 0.00 C ATOM 0 H ILE A 59 -17.014 22.397 -12.553 1.00 0.00 H new ATOM 0 HA ILE A 59 -18.882 20.433 -13.844 1.00 0.00 H new ATOM 0 HB ILE A 59 -16.631 19.960 -11.837 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -16.342 19.466 -14.321 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -16.121 18.066 -13.291 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -17.691 17.805 -11.249 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -18.721 19.178 -10.779 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -19.109 18.233 -12.236 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -17.582 17.514 -15.218 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -18.486 17.380 -13.691 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -18.711 18.803 -14.737 1.00 0.00 H new ATOM 921 N ILE A 60 -18.911 21.202 -10.678 1.00 0.00 N ATOM 922 CA ILE A 60 -19.861 21.695 -9.635 1.00 0.00 C ATOM 923 C ILE A 60 -19.332 22.980 -8.983 1.00 0.00 C ATOM 924 O ILE A 60 -19.430 24.052 -9.548 1.00 0.00 O ATOM 925 CB ILE A 60 -19.965 20.564 -8.613 1.00 0.00 C ATOM 926 CG1 ILE A 60 -20.488 19.301 -9.302 1.00 0.00 C ATOM 927 CG2 ILE A 60 -20.938 20.973 -7.505 1.00 0.00 C ATOM 928 CD1 ILE A 60 -19.876 18.066 -8.638 1.00 0.00 C ATOM 0 H ILE A 60 -18.017 20.855 -10.330 1.00 0.00 H new ATOM 0 HA ILE A 60 -20.835 21.944 -10.057 1.00 0.00 H new ATOM 0 HB ILE A 60 -18.982 20.367 -8.186 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -21.575 19.261 -9.235 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -20.234 19.321 -10.362 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -21.015 20.169 -6.773 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -20.573 21.875 -7.015 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -21.920 21.167 -7.936 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -20.249 17.167 -9.129 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -18.790 18.105 -8.728 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -20.152 18.045 -7.584 1.00 0.00 H new ATOM 940 N ARG A 61 -18.779 22.893 -7.800 1.00 0.00 N ATOM 941 CA ARG A 61 -18.262 24.125 -7.135 1.00 0.00 C ATOM 942 C ARG A 61 -17.570 23.780 -5.810 1.00 0.00 C ATOM 943 O ARG A 61 -16.915 22.764 -5.684 1.00 0.00 O ATOM 944 CB ARG A 61 -19.502 24.984 -6.880 1.00 0.00 C ATOM 945 CG ARG A 61 -19.170 26.455 -7.144 1.00 0.00 C ATOM 946 CD ARG A 61 -20.444 27.201 -7.552 1.00 0.00 C ATOM 947 NE ARG A 61 -20.934 27.838 -6.299 1.00 0.00 N ATOM 948 CZ ARG A 61 -20.484 29.009 -5.941 1.00 0.00 C ATOM 949 NH1 ARG A 61 -20.383 29.967 -6.821 1.00 0.00 N ATOM 950 NH2 ARG A 61 -20.134 29.222 -4.702 1.00 0.00 N ATOM 0 H ARG A 61 -18.664 22.029 -7.270 1.00 0.00 H new ATOM 0 HA ARG A 61 -17.521 24.638 -7.749 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -20.319 24.663 -7.527 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -19.841 24.856 -5.852 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -18.741 26.908 -6.250 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -18.421 26.534 -7.932 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -20.236 27.947 -8.319 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -21.187 26.518 -7.964 1.00 0.00 H new ATOM 0 HE ARG A 61 -21.623 27.358 -5.719 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -20.656 29.801 -7.790 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -20.031 30.882 -6.540 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -20.212 28.473 -4.014 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -19.782 30.137 -4.422 1.00 0.00 H new ATOM 964 N GLN A 62 -17.707 24.631 -4.827 1.00 0.00 N ATOM 965 CA GLN A 62 -17.055 24.375 -3.508 1.00 0.00 C ATOM 966 C GLN A 62 -17.963 23.542 -2.604 1.00 0.00 C ATOM 967 O GLN A 62 -17.651 22.416 -2.268 1.00 0.00 O ATOM 968 CB GLN A 62 -16.850 25.760 -2.903 1.00 0.00 C ATOM 969 CG GLN A 62 -16.342 25.622 -1.466 1.00 0.00 C ATOM 970 CD GLN A 62 -16.521 26.951 -0.733 1.00 0.00 C ATOM 971 OE1 GLN A 62 -15.595 27.459 -0.134 1.00 0.00 O ATOM 972 NE2 GLN A 62 -17.685 27.542 -0.754 1.00 0.00 N ATOM 0 H GLN A 62 -18.245 25.496 -4.881 1.00 0.00 H new ATOM 0 HA GLN A 62 -16.123 23.820 -3.617 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -16.135 26.326 -3.500 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -17.787 26.316 -2.916 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -16.889 24.833 -0.950 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -15.291 25.333 -1.467 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -18.464 27.117 -1.257 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -17.815 28.429 -0.268 1.00 0.00 H new ATOM 981 N ASN A 63 -19.075 24.106 -2.201 1.00 0.00 N ATOM 982 CA ASN A 63 -20.027 23.378 -1.302 1.00 0.00 C ATOM 983 C ASN A 63 -19.981 21.872 -1.568 1.00 0.00 C ATOM 984 O ASN A 63 -19.686 21.085 -0.691 1.00 0.00 O ATOM 985 CB ASN A 63 -21.405 23.938 -1.651 1.00 0.00 C ATOM 986 CG ASN A 63 -21.564 25.328 -1.031 1.00 0.00 C ATOM 987 OD1 ASN A 63 -20.637 26.113 -1.024 1.00 0.00 O ATOM 988 ND2 ASN A 63 -22.710 25.665 -0.506 1.00 0.00 N ATOM 0 H ASN A 63 -19.367 25.049 -2.458 1.00 0.00 H new ATOM 0 HA ASN A 63 -19.779 23.516 -0.250 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -21.522 23.995 -2.733 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -22.184 23.272 -1.281 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -22.828 26.588 -0.089 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -23.488 25.005 -0.512 1.00 0.00 H new ATOM 995 N GLN A 64 -20.261 21.466 -2.773 1.00 0.00 N ATOM 996 CA GLN A 64 -20.220 20.014 -3.092 1.00 0.00 C ATOM 997 C GLN A 64 -18.809 19.468 -2.833 1.00 0.00 C ATOM 998 O GLN A 64 -17.830 20.016 -3.297 1.00 0.00 O ATOM 999 CB GLN A 64 -20.583 19.929 -4.581 1.00 0.00 C ATOM 1000 CG GLN A 64 -20.010 18.647 -5.194 1.00 0.00 C ATOM 1001 CD GLN A 64 -20.591 17.432 -4.471 1.00 0.00 C ATOM 1002 OE1 GLN A 64 -19.865 16.548 -4.065 1.00 0.00 O ATOM 1003 NE2 GLN A 64 -21.879 17.350 -4.284 1.00 0.00 N ATOM 0 H GLN A 64 -20.516 22.076 -3.550 1.00 0.00 H new ATOM 0 HA GLN A 64 -20.903 19.425 -2.480 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -21.666 19.945 -4.700 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -20.192 20.799 -5.108 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -20.250 18.600 -6.256 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -18.923 18.647 -5.112 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -22.492 18.091 -4.624 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -22.274 16.545 -3.798 1.00 0.00 H new ATOM 1012 N ALA A 65 -18.693 18.393 -2.096 1.00 0.00 N ATOM 1013 CA ALA A 65 -17.339 17.829 -1.823 1.00 0.00 C ATOM 1014 C ALA A 65 -17.141 16.524 -2.601 1.00 0.00 C ATOM 1015 O ALA A 65 -18.069 15.771 -2.815 1.00 0.00 O ATOM 1016 CB ALA A 65 -17.316 17.567 -0.317 1.00 0.00 C ATOM 0 H ALA A 65 -19.471 17.886 -1.675 1.00 0.00 H new ATOM 0 HA ALA A 65 -16.540 18.504 -2.131 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -16.349 17.150 -0.035 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -17.477 18.503 0.218 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -18.105 16.861 -0.058 1.00 0.00 H new ATOM 1022 N LEU A 66 -15.938 16.251 -3.028 1.00 0.00 N ATOM 1023 CA LEU A 66 -15.682 14.994 -3.795 1.00 0.00 C ATOM 1024 C LEU A 66 -14.635 14.149 -3.073 1.00 0.00 C ATOM 1025 O LEU A 66 -13.499 14.550 -2.926 1.00 0.00 O ATOM 1026 CB LEU A 66 -15.148 15.456 -5.151 1.00 0.00 C ATOM 1027 CG LEU A 66 -16.310 15.618 -6.131 1.00 0.00 C ATOM 1028 CD1 LEU A 66 -17.032 14.279 -6.295 1.00 0.00 C ATOM 1029 CD2 LEU A 66 -17.289 16.660 -5.587 1.00 0.00 C ATOM 0 H LEU A 66 -15.120 16.843 -2.880 1.00 0.00 H new ATOM 0 HA LEU A 66 -16.578 14.382 -3.898 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -14.617 16.402 -5.041 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -14.431 14.731 -5.537 1.00 0.00 H new ATOM 0 HG LEU A 66 -15.928 15.944 -7.098 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -17.860 14.395 -6.994 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -16.335 13.534 -6.679 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -17.416 13.952 -5.329 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -18.119 16.778 -6.284 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -17.670 16.331 -4.620 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -16.776 17.614 -5.469 1.00 0.00 H new ATOM 1041 N ARG A 67 -15.000 12.981 -2.622 1.00 0.00 N ATOM 1042 CA ARG A 67 -14.012 12.127 -1.906 1.00 0.00 C ATOM 1043 C ARG A 67 -13.285 11.225 -2.899 1.00 0.00 C ATOM 1044 O ARG A 67 -13.891 10.606 -3.750 1.00 0.00 O ATOM 1045 CB ARG A 67 -14.840 11.297 -0.926 1.00 0.00 C ATOM 1046 CG ARG A 67 -13.908 10.556 0.032 1.00 0.00 C ATOM 1047 CD ARG A 67 -14.562 10.472 1.413 1.00 0.00 C ATOM 1048 NE ARG A 67 -15.711 9.539 1.235 1.00 0.00 N ATOM 1049 CZ ARG A 67 -16.324 9.052 2.280 1.00 0.00 C ATOM 1050 NH1 ARG A 67 -16.650 9.835 3.269 1.00 0.00 N ATOM 1051 NH2 ARG A 67 -16.610 7.779 2.333 1.00 0.00 N ATOM 0 H ARG A 67 -15.934 12.583 -2.717 1.00 0.00 H new ATOM 0 HA ARG A 67 -13.250 12.714 -1.393 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -15.515 11.944 -0.365 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -15.460 10.585 -1.470 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -13.701 9.555 -0.346 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -12.952 11.075 0.101 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -13.862 10.099 2.160 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -14.897 11.452 1.752 1.00 0.00 H new ATOM 0 HE ARG A 67 -16.018 9.281 0.297 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -16.426 10.829 3.227 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -17.129 9.454 4.085 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -16.355 7.166 1.559 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -17.089 7.397 3.149 1.00 0.00 H new ATOM 1065 N LEU A 68 -11.987 11.165 -2.809 1.00 0.00 N ATOM 1066 CA LEU A 68 -11.223 10.314 -3.771 1.00 0.00 C ATOM 1067 C LEU A 68 -10.343 9.290 -3.041 1.00 0.00 C ATOM 1068 O LEU A 68 -9.768 9.566 -2.006 1.00 0.00 O ATOM 1069 CB LEU A 68 -10.348 11.288 -4.561 1.00 0.00 C ATOM 1070 CG LEU A 68 -11.148 12.547 -4.906 1.00 0.00 C ATOM 1071 CD1 LEU A 68 -10.267 13.498 -5.715 1.00 0.00 C ATOM 1072 CD2 LEU A 68 -12.376 12.163 -5.733 1.00 0.00 C ATOM 0 H LEU A 68 -11.423 11.662 -2.119 1.00 0.00 H new ATOM 0 HA LEU A 68 -11.896 9.742 -4.410 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -9.468 11.555 -3.977 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -9.992 10.811 -5.474 1.00 0.00 H new ATOM 0 HG LEU A 68 -11.470 13.037 -3.987 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -10.833 14.396 -5.963 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -9.391 13.772 -5.127 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -9.948 13.005 -6.633 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -12.945 13.060 -5.978 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -12.057 11.673 -6.653 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -13.003 11.482 -5.158 1.00 0.00 H new ATOM 1084 N ARG A 69 -10.230 8.112 -3.597 1.00 0.00 N ATOM 1085 CA ARG A 69 -9.384 7.052 -2.974 1.00 0.00 C ATOM 1086 C ARG A 69 -8.242 6.681 -3.926 1.00 0.00 C ATOM 1087 O ARG A 69 -8.432 6.575 -5.125 1.00 0.00 O ATOM 1088 CB ARG A 69 -10.324 5.862 -2.778 1.00 0.00 C ATOM 1089 CG ARG A 69 -9.614 4.767 -1.978 1.00 0.00 C ATOM 1090 CD ARG A 69 -10.636 4.020 -1.119 1.00 0.00 C ATOM 1091 NE ARG A 69 -10.388 2.578 -1.396 1.00 0.00 N ATOM 1092 CZ ARG A 69 -11.052 1.664 -0.744 1.00 0.00 C ATOM 1093 NH1 ARG A 69 -11.698 1.976 0.347 1.00 0.00 N ATOM 1094 NH2 ARG A 69 -11.069 0.435 -1.183 1.00 0.00 N ATOM 0 H ARG A 69 -10.692 7.837 -4.464 1.00 0.00 H new ATOM 0 HA ARG A 69 -8.934 7.372 -2.034 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -11.225 6.181 -2.255 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -10.639 5.472 -3.746 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -9.115 4.073 -2.654 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -8.843 5.206 -1.345 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -10.505 4.247 -0.061 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -11.655 4.303 -1.382 1.00 0.00 H new ATOM 0 HE ARG A 69 -9.698 2.305 -2.096 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -11.684 2.936 0.691 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -12.217 1.260 0.855 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -10.564 0.191 -2.035 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -11.588 -0.281 -0.674 1.00 0.00 H new ATOM 1108 N ALA A 70 -7.060 6.488 -3.409 1.00 0.00 N ATOM 1109 CA ALA A 70 -5.906 6.131 -4.288 1.00 0.00 C ATOM 1110 C ALA A 70 -6.203 4.842 -5.060 1.00 0.00 C ATOM 1111 O ALA A 70 -6.969 4.009 -4.619 1.00 0.00 O ATOM 1112 CB ALA A 70 -4.727 5.927 -3.337 1.00 0.00 C ATOM 0 H ALA A 70 -6.841 6.562 -2.415 1.00 0.00 H new ATOM 0 HA ALA A 70 -5.701 6.903 -5.029 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -3.839 5.661 -3.910 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -4.541 6.849 -2.786 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -4.960 5.125 -2.636 1.00 0.00 H new ATOM 1118 N ARG A 71 -5.612 4.674 -6.215 1.00 0.00 N ATOM 1119 CA ARG A 71 -5.883 3.435 -7.005 1.00 0.00 C ATOM 1120 C ARG A 71 -4.625 2.940 -7.740 1.00 0.00 C ATOM 1121 O ARG A 71 -4.607 1.844 -8.264 1.00 0.00 O ATOM 1122 CB ARG A 71 -6.963 3.844 -8.009 1.00 0.00 C ATOM 1123 CG ARG A 71 -7.054 2.798 -9.124 1.00 0.00 C ATOM 1124 CD ARG A 71 -8.447 2.842 -9.757 1.00 0.00 C ATOM 1125 NE ARG A 71 -8.217 2.574 -11.205 1.00 0.00 N ATOM 1126 CZ ARG A 71 -9.225 2.317 -11.994 1.00 0.00 C ATOM 1127 NH1 ARG A 71 -10.370 1.935 -11.497 1.00 0.00 N ATOM 1128 NH2 ARG A 71 -9.086 2.441 -13.284 1.00 0.00 N ATOM 0 H ARG A 71 -4.961 5.333 -6.642 1.00 0.00 H new ATOM 0 HA ARG A 71 -6.194 2.612 -6.362 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -7.925 3.937 -7.505 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -6.729 4.821 -8.432 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -6.293 2.991 -9.881 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -6.858 1.804 -8.721 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -9.105 2.094 -9.316 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -8.920 3.812 -9.605 1.00 0.00 H new ATOM 0 HE ARG A 71 -7.269 2.591 -11.581 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -10.480 1.836 -10.488 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -11.154 1.735 -12.118 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -8.192 2.738 -13.674 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -9.872 2.241 -13.903 1.00 0.00 H new ATOM 1142 N LYS A 72 -3.582 3.725 -7.802 1.00 0.00 N ATOM 1143 CA LYS A 72 -2.360 3.262 -8.524 1.00 0.00 C ATOM 1144 C LYS A 72 -1.183 3.087 -7.557 1.00 0.00 C ATOM 1145 O LYS A 72 -0.122 2.636 -7.938 1.00 0.00 O ATOM 1146 CB LYS A 72 -2.064 4.372 -9.534 1.00 0.00 C ATOM 1147 CG LYS A 72 -0.643 4.206 -10.077 1.00 0.00 C ATOM 1148 CD LYS A 72 -0.522 2.856 -10.788 1.00 0.00 C ATOM 1149 CE LYS A 72 -0.820 3.037 -12.277 1.00 0.00 C ATOM 1150 NZ LYS A 72 0.084 2.076 -12.969 1.00 0.00 N ATOM 0 H LYS A 72 -3.522 4.656 -7.389 1.00 0.00 H new ATOM 0 HA LYS A 72 -2.510 2.293 -9.001 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -2.783 4.335 -10.352 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -2.171 5.347 -9.060 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -0.410 5.015 -10.769 1.00 0.00 H new ATOM 0 HG3 LYS A 72 0.078 4.266 -9.262 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.481 2.450 -10.653 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -1.217 2.139 -10.351 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -1.866 2.825 -12.499 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -0.627 4.061 -12.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -0.062 2.141 -13.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 1.073 2.306 -12.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -0.127 1.109 -12.650 1.00 0.00 H new ATOM 1164 N GLU A 73 -1.352 3.441 -6.314 1.00 0.00 N ATOM 1165 CA GLU A 73 -0.227 3.291 -5.346 1.00 0.00 C ATOM 1166 C GLU A 73 1.012 4.015 -5.879 1.00 0.00 C ATOM 1167 O GLU A 73 1.988 3.403 -6.264 1.00 0.00 O ATOM 1168 CB GLU A 73 0.026 1.784 -5.256 1.00 0.00 C ATOM 1169 CG GLU A 73 1.394 1.529 -4.618 1.00 0.00 C ATOM 1170 CD GLU A 73 1.364 0.201 -3.858 1.00 0.00 C ATOM 1171 OE1 GLU A 73 0.873 -0.767 -4.415 1.00 0.00 O ATOM 1172 OE2 GLU A 73 1.834 0.176 -2.732 1.00 0.00 O ATOM 0 H GLU A 73 -2.214 3.825 -5.927 1.00 0.00 H new ATOM 0 HA GLU A 73 -0.456 3.719 -4.370 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -0.756 1.309 -4.664 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -0.011 1.339 -6.250 1.00 0.00 H new ATOM 0 HG2 GLU A 73 2.166 1.503 -5.387 1.00 0.00 H new ATOM 0 HG3 GLU A 73 1.648 2.343 -3.939 1.00 0.00 H new ATOM 1179 N CYS A 74 0.974 5.317 -5.909 1.00 0.00 N ATOM 1180 CA CYS A 74 2.145 6.089 -6.421 1.00 0.00 C ATOM 1181 C CYS A 74 1.933 7.590 -6.191 1.00 0.00 C ATOM 1182 O CYS A 74 2.872 8.335 -5.991 1.00 0.00 O ATOM 1183 CB CYS A 74 2.199 5.778 -7.917 1.00 0.00 C ATOM 1184 SG CYS A 74 3.904 5.932 -8.505 1.00 0.00 S ATOM 0 H CYS A 74 0.183 5.883 -5.601 1.00 0.00 H new ATOM 0 HA CYS A 74 3.071 5.819 -5.914 1.00 0.00 H new ATOM 0 HB2 CYS A 74 1.829 4.770 -8.103 1.00 0.00 H new ATOM 0 HB3 CYS A 74 1.551 6.462 -8.465 1.00 0.00 H new ATOM 0 HG CYS A 74 4.667 6.319 -7.526 1.00 0.00 H new ATOM 1190 N TRP A 75 0.708 8.040 -6.218 1.00 0.00 N ATOM 1191 CA TRP A 75 0.436 9.489 -6.003 1.00 0.00 C ATOM 1192 C TRP A 75 0.613 9.845 -4.521 1.00 0.00 C ATOM 1193 O TRP A 75 0.024 9.234 -3.650 1.00 0.00 O ATOM 1194 CB TRP A 75 -1.022 9.668 -6.463 1.00 0.00 C ATOM 1195 CG TRP A 75 -1.748 10.634 -5.580 1.00 0.00 C ATOM 1196 CD1 TRP A 75 -1.409 11.927 -5.424 1.00 0.00 C ATOM 1197 CD2 TRP A 75 -2.918 10.412 -4.737 1.00 0.00 C ATOM 1198 NE1 TRP A 75 -2.291 12.522 -4.544 1.00 0.00 N ATOM 1199 CE2 TRP A 75 -3.239 11.629 -4.090 1.00 0.00 C ATOM 1200 CE3 TRP A 75 -3.722 9.288 -4.472 1.00 0.00 C ATOM 1201 CZ2 TRP A 75 -4.318 11.729 -3.213 1.00 0.00 C ATOM 1202 CZ3 TRP A 75 -4.810 9.386 -3.588 1.00 0.00 C ATOM 1203 CH2 TRP A 75 -5.108 10.605 -2.961 1.00 0.00 C ATOM 0 H TRP A 75 -0.118 7.464 -6.380 1.00 0.00 H new ATOM 0 HA TRP A 75 1.116 10.142 -6.550 1.00 0.00 H new ATOM 0 HB2 TRP A 75 -1.041 10.026 -7.492 1.00 0.00 H new ATOM 0 HB3 TRP A 75 -1.532 8.705 -6.451 1.00 0.00 H new ATOM 0 HD1 TRP A 75 -0.580 12.420 -5.909 1.00 0.00 H new ATOM 0 HE1 TRP A 75 -2.247 13.502 -4.264 1.00 0.00 H new ATOM 0 HE3 TRP A 75 -3.502 8.345 -4.950 1.00 0.00 H new ATOM 0 HZ2 TRP A 75 -4.542 12.670 -2.732 1.00 0.00 H new ATOM 0 HZ3 TRP A 75 -5.421 8.517 -3.390 1.00 0.00 H new ATOM 0 HH2 TRP A 75 -5.947 10.674 -2.284 1.00 0.00 H new ATOM 1214 N ASP A 76 1.413 10.834 -4.229 1.00 0.00 N ATOM 1215 CA ASP A 76 1.616 11.231 -2.808 1.00 0.00 C ATOM 1216 C ASP A 76 0.779 12.474 -2.489 1.00 0.00 C ATOM 1217 O ASP A 76 1.052 13.558 -2.963 1.00 0.00 O ATOM 1218 CB ASP A 76 3.111 11.536 -2.689 1.00 0.00 C ATOM 1219 CG ASP A 76 3.503 12.606 -3.711 1.00 0.00 C ATOM 1220 OD1 ASP A 76 2.686 12.911 -4.562 1.00 0.00 O ATOM 1221 OD2 ASP A 76 4.614 13.101 -3.623 1.00 0.00 O ATOM 0 H ASP A 76 1.934 11.383 -4.913 1.00 0.00 H new ATOM 0 HA ASP A 76 1.308 10.453 -2.109 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.342 11.880 -1.681 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.691 10.629 -2.857 1.00 0.00 H new ATOM 1226 N ARG A 77 -0.241 12.319 -1.689 1.00 0.00 N ATOM 1227 CA ARG A 77 -1.104 13.485 -1.337 1.00 0.00 C ATOM 1228 C ARG A 77 -0.436 14.320 -0.243 1.00 0.00 C ATOM 1229 O ARG A 77 -0.499 15.534 -0.249 1.00 0.00 O ATOM 1230 CB ARG A 77 -2.409 12.868 -0.826 1.00 0.00 C ATOM 1231 CG ARG A 77 -3.484 13.951 -0.699 1.00 0.00 C ATOM 1232 CD ARG A 77 -3.549 14.772 -1.989 1.00 0.00 C ATOM 1233 NE ARG A 77 -2.829 16.039 -1.679 1.00 0.00 N ATOM 1234 CZ ARG A 77 -2.955 17.075 -2.466 1.00 0.00 C ATOM 1235 NH1 ARG A 77 -3.627 16.975 -3.580 1.00 0.00 N ATOM 1236 NH2 ARG A 77 -2.407 18.212 -2.134 1.00 0.00 N ATOM 0 H ARG A 77 -0.515 11.434 -1.263 1.00 0.00 H new ATOM 0 HA ARG A 77 -1.273 14.150 -2.184 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -2.745 12.089 -1.510 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -2.243 12.394 0.141 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -4.453 13.493 -0.500 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -3.259 14.602 0.146 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -3.077 14.243 -2.817 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -4.581 14.966 -2.281 1.00 0.00 H new ATOM 0 HE ARG A 77 -2.236 16.098 -0.851 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -4.056 16.086 -3.839 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -3.723 17.785 -4.192 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -1.882 18.290 -1.263 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -2.503 19.022 -2.746 1.00 0.00 H new ATOM 1250 N ASP A 78 0.205 13.680 0.694 1.00 0.00 N ATOM 1251 CA ASP A 78 0.879 14.438 1.787 1.00 0.00 C ATOM 1252 C ASP A 78 2.396 14.414 1.586 1.00 0.00 C ATOM 1253 O ASP A 78 3.158 14.565 2.521 1.00 0.00 O ATOM 1254 CB ASP A 78 0.496 13.701 3.070 1.00 0.00 C ATOM 1255 CG ASP A 78 -0.768 14.327 3.659 1.00 0.00 C ATOM 1256 OD1 ASP A 78 -1.848 13.904 3.279 1.00 0.00 O ATOM 1257 OD2 ASP A 78 -0.636 15.219 4.481 1.00 0.00 O ATOM 0 H ASP A 78 0.292 12.665 0.751 1.00 0.00 H new ATOM 0 HA ASP A 78 0.579 15.485 1.813 1.00 0.00 H new ATOM 0 HB2 ASP A 78 0.327 12.645 2.859 1.00 0.00 H new ATOM 0 HB3 ASP A 78 1.312 13.756 3.791 1.00 0.00 H new ATOM 1262 N GLY A 79 2.840 14.221 0.374 1.00 0.00 N ATOM 1263 CA GLY A 79 4.307 14.182 0.118 1.00 0.00 C ATOM 1264 C GLY A 79 4.829 12.769 0.382 1.00 0.00 C ATOM 1265 O GLY A 79 6.020 12.532 0.411 1.00 0.00 O ATOM 0 H GLY A 79 2.251 14.089 -0.448 1.00 0.00 H new ATOM 0 HA2 GLY A 79 4.516 14.473 -0.912 1.00 0.00 H new ATOM 0 HA3 GLY A 79 4.819 14.897 0.761 1.00 0.00 H new ATOM 1269 N LYS A 80 3.945 11.830 0.576 1.00 0.00 N ATOM 1270 CA LYS A 80 4.386 10.432 0.839 1.00 0.00 C ATOM 1271 C LYS A 80 3.640 9.464 -0.084 1.00 0.00 C ATOM 1272 O LYS A 80 2.602 8.936 0.263 1.00 0.00 O ATOM 1273 CB LYS A 80 4.019 10.168 2.301 1.00 0.00 C ATOM 1274 CG LYS A 80 4.411 11.375 3.157 1.00 0.00 C ATOM 1275 CD LYS A 80 4.224 11.033 4.637 1.00 0.00 C ATOM 1276 CE LYS A 80 5.415 10.206 5.122 1.00 0.00 C ATOM 1277 NZ LYS A 80 5.064 9.802 6.511 1.00 0.00 N ATOM 0 H LYS A 80 2.935 11.971 0.564 1.00 0.00 H new ATOM 0 HA LYS A 80 5.451 10.292 0.656 1.00 0.00 H new ATOM 0 HB2 LYS A 80 2.949 9.980 2.389 1.00 0.00 H new ATOM 0 HB3 LYS A 80 4.531 9.275 2.659 1.00 0.00 H new ATOM 0 HG2 LYS A 80 5.448 11.649 2.964 1.00 0.00 H new ATOM 0 HG3 LYS A 80 3.799 12.237 2.892 1.00 0.00 H new ATOM 0 HD2 LYS A 80 4.138 11.947 5.225 1.00 0.00 H new ATOM 0 HD3 LYS A 80 3.298 10.475 4.778 1.00 0.00 H new ATOM 0 HE2 LYS A 80 5.576 9.335 4.486 1.00 0.00 H new ATOM 0 HE3 LYS A 80 6.335 10.790 5.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 5.835 9.230 6.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 4.924 10.651 7.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 4.188 9.242 6.499 1.00 0.00 H new ATOM 1291 N GLU A 81 4.160 9.228 -1.258 1.00 0.00 N ATOM 1292 CA GLU A 81 3.480 8.295 -2.203 1.00 0.00 C ATOM 1293 C GLU A 81 2.994 7.053 -1.440 1.00 0.00 C ATOM 1294 O GLU A 81 3.772 6.321 -0.861 1.00 0.00 O ATOM 1295 CB GLU A 81 4.557 7.968 -3.260 1.00 0.00 C ATOM 1296 CG GLU A 81 4.812 6.458 -3.362 1.00 0.00 C ATOM 1297 CD GLU A 81 5.441 6.141 -4.720 1.00 0.00 C ATOM 1298 OE1 GLU A 81 5.542 7.047 -5.531 1.00 0.00 O ATOM 1299 OE2 GLU A 81 5.811 4.996 -4.925 1.00 0.00 O ATOM 0 H GLU A 81 5.026 9.641 -1.604 1.00 0.00 H new ATOM 0 HA GLU A 81 2.592 8.714 -2.676 1.00 0.00 H new ATOM 0 HB2 GLU A 81 4.242 8.350 -4.231 1.00 0.00 H new ATOM 0 HB3 GLU A 81 5.486 8.477 -3.003 1.00 0.00 H new ATOM 0 HG2 GLU A 81 5.473 6.134 -2.558 1.00 0.00 H new ATOM 0 HG3 GLU A 81 3.876 5.911 -3.245 1.00 0.00 H new ATOM 1306 N ARG A 82 1.708 6.823 -1.428 1.00 0.00 N ATOM 1307 CA ARG A 82 1.166 5.642 -0.693 1.00 0.00 C ATOM 1308 C ARG A 82 0.478 4.671 -1.657 1.00 0.00 C ATOM 1309 O ARG A 82 0.418 4.896 -2.850 1.00 0.00 O ATOM 1310 CB ARG A 82 0.155 6.224 0.292 1.00 0.00 C ATOM 1311 CG ARG A 82 0.168 5.400 1.582 1.00 0.00 C ATOM 1312 CD ARG A 82 -0.403 6.238 2.729 1.00 0.00 C ATOM 1313 NE ARG A 82 0.747 6.472 3.645 1.00 0.00 N ATOM 1314 CZ ARG A 82 0.711 7.458 4.500 1.00 0.00 C ATOM 1315 NH1 ARG A 82 0.438 8.666 4.091 1.00 0.00 N ATOM 1316 NH2 ARG A 82 0.949 7.236 5.764 1.00 0.00 N ATOM 0 H ARG A 82 1.009 7.401 -1.895 1.00 0.00 H new ATOM 0 HA ARG A 82 1.952 5.077 -0.192 1.00 0.00 H new ATOM 0 HB2 ARG A 82 0.400 7.264 0.509 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -0.843 6.216 -0.147 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -0.421 4.492 1.452 1.00 0.00 H new ATOM 0 HG3 ARG A 82 1.186 5.088 1.817 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -0.814 7.179 2.364 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -1.212 5.713 3.237 1.00 0.00 H new ATOM 0 HE ARG A 82 1.563 5.862 3.605 1.00 0.00 H new ATOM 0 HH11 ARG A 82 0.253 8.840 3.103 1.00 0.00 H new ATOM 0 HH12 ARG A 82 0.410 9.436 4.759 1.00 0.00 H new ATOM 0 HH21 ARG A 82 1.163 6.292 6.084 1.00 0.00 H new ATOM 0 HH22 ARG A 82 0.921 8.007 6.431 1.00 0.00 H new ATOM 1330 N VAL A 83 -0.036 3.587 -1.140 1.00 0.00 N ATOM 1331 CA VAL A 83 -0.720 2.584 -2.012 1.00 0.00 C ATOM 1332 C VAL A 83 -2.168 3.005 -2.286 1.00 0.00 C ATOM 1333 O VAL A 83 -2.671 3.950 -1.709 1.00 0.00 O ATOM 1334 CB VAL A 83 -0.693 1.290 -1.202 1.00 0.00 C ATOM 1335 CG1 VAL A 83 -1.379 1.521 0.147 1.00 0.00 C ATOM 1336 CG2 VAL A 83 -1.437 0.197 -1.970 1.00 0.00 C ATOM 0 H VAL A 83 -0.012 3.351 -0.148 1.00 0.00 H new ATOM 0 HA VAL A 83 -0.233 2.482 -2.982 1.00 0.00 H new ATOM 0 HB VAL A 83 0.340 0.983 -1.038 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -1.361 0.598 0.727 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -0.853 2.304 0.694 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -2.412 1.826 -0.018 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -1.420 -0.728 -1.394 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -2.470 0.505 -2.131 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -0.952 0.035 -2.933 1.00 0.00 H new ATOM 1346 N THR A 84 -2.843 2.303 -3.159 1.00 0.00 N ATOM 1347 CA THR A 84 -4.260 2.654 -3.468 1.00 0.00 C ATOM 1348 C THR A 84 -5.072 2.741 -2.173 1.00 0.00 C ATOM 1349 O THR A 84 -6.061 3.442 -2.096 1.00 0.00 O ATOM 1350 CB THR A 84 -4.775 1.511 -4.344 1.00 0.00 C ATOM 1351 OG1 THR A 84 -4.824 0.315 -3.580 1.00 0.00 O ATOM 1352 CG2 THR A 84 -3.840 1.319 -5.538 1.00 0.00 C ATOM 0 H THR A 84 -2.474 1.502 -3.671 1.00 0.00 H new ATOM 0 HA THR A 84 -4.346 3.619 -3.968 1.00 0.00 H new ATOM 0 HB THR A 84 -5.775 1.752 -4.705 1.00 0.00 H new ATOM 0 HG1 THR A 84 -5.156 -0.418 -4.140 1.00 0.00 H new ATOM 0 HG21 THR A 84 -4.208 0.504 -6.161 1.00 0.00 H new ATOM 0 HG22 THR A 84 -3.805 2.237 -6.124 1.00 0.00 H new ATOM 0 HG23 THR A 84 -2.839 1.079 -5.181 1.00 0.00 H new ATOM 1360 N GLY A 85 -4.658 2.037 -1.156 1.00 0.00 N ATOM 1361 CA GLY A 85 -5.403 2.086 0.133 1.00 0.00 C ATOM 1362 C GLY A 85 -5.497 3.540 0.592 1.00 0.00 C ATOM 1363 O GLY A 85 -6.535 4.001 1.024 1.00 0.00 O ATOM 0 H GLY A 85 -3.838 1.431 -1.162 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -6.400 1.664 0.009 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -4.894 1.485 0.886 1.00 0.00 H new ATOM 1367 N GLU A 86 -4.420 4.268 0.492 1.00 0.00 N ATOM 1368 CA GLU A 86 -4.441 5.697 0.909 1.00 0.00 C ATOM 1369 C GLU A 86 -5.545 6.436 0.148 1.00 0.00 C ATOM 1370 O GLU A 86 -5.921 6.052 -0.941 1.00 0.00 O ATOM 1371 CB GLU A 86 -3.054 6.232 0.530 1.00 0.00 C ATOM 1372 CG GLU A 86 -3.102 7.754 0.358 1.00 0.00 C ATOM 1373 CD GLU A 86 -3.360 8.414 1.713 1.00 0.00 C ATOM 1374 OE1 GLU A 86 -2.902 7.878 2.708 1.00 0.00 O ATOM 1375 OE2 GLU A 86 -4.011 9.446 1.734 1.00 0.00 O ATOM 0 H GLU A 86 -3.524 3.933 0.138 1.00 0.00 H new ATOM 0 HA GLU A 86 -4.645 5.830 1.971 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -2.331 5.969 1.302 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -2.716 5.765 -0.395 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -2.161 8.113 -0.060 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -3.888 8.026 -0.346 1.00 0.00 H new ATOM 1382 N GLU A 87 -6.070 7.491 0.708 1.00 0.00 N ATOM 1383 CA GLU A 87 -7.149 8.239 0.003 1.00 0.00 C ATOM 1384 C GLU A 87 -7.262 9.662 0.549 1.00 0.00 C ATOM 1385 O GLU A 87 -6.884 9.942 1.670 1.00 0.00 O ATOM 1386 CB GLU A 87 -8.425 7.452 0.294 1.00 0.00 C ATOM 1387 CG GLU A 87 -8.663 7.406 1.805 1.00 0.00 C ATOM 1388 CD GLU A 87 -8.591 5.957 2.286 1.00 0.00 C ATOM 1389 OE1 GLU A 87 -8.980 5.082 1.530 1.00 0.00 O ATOM 1390 OE2 GLU A 87 -8.148 5.744 3.403 1.00 0.00 O ATOM 0 H GLU A 87 -5.801 7.866 1.618 1.00 0.00 H new ATOM 0 HA GLU A 87 -6.955 8.329 -1.066 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -9.274 7.919 -0.205 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -8.339 6.440 -0.102 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -7.916 8.009 2.321 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -9.637 7.832 2.044 1.00 0.00 H new ATOM 1397 N TRP A 88 -7.787 10.564 -0.234 1.00 0.00 N ATOM 1398 CA TRP A 88 -7.933 11.967 0.238 1.00 0.00 C ATOM 1399 C TRP A 88 -9.251 12.554 -0.290 1.00 0.00 C ATOM 1400 O TRP A 88 -9.739 12.170 -1.335 1.00 0.00 O ATOM 1401 CB TRP A 88 -6.693 12.701 -0.319 1.00 0.00 C ATOM 1402 CG TRP A 88 -7.083 13.749 -1.319 1.00 0.00 C ATOM 1403 CD1 TRP A 88 -7.587 13.499 -2.549 1.00 0.00 C ATOM 1404 CD2 TRP A 88 -7.009 15.200 -1.193 1.00 0.00 C ATOM 1405 NE1 TRP A 88 -7.827 14.703 -3.187 1.00 0.00 N ATOM 1406 CE2 TRP A 88 -7.487 15.780 -2.392 1.00 0.00 C ATOM 1407 CE3 TRP A 88 -6.578 16.058 -0.166 1.00 0.00 C ATOM 1408 CZ2 TRP A 88 -7.536 17.165 -2.565 1.00 0.00 C ATOM 1409 CZ3 TRP A 88 -6.626 17.452 -0.337 1.00 0.00 C ATOM 1410 CH2 TRP A 88 -7.104 18.004 -1.534 1.00 0.00 C ATOM 0 H TRP A 88 -8.121 10.388 -1.182 1.00 0.00 H new ATOM 0 HA TRP A 88 -7.979 12.058 1.323 1.00 0.00 H new ATOM 0 HB2 TRP A 88 -6.143 13.164 0.501 1.00 0.00 H new ATOM 0 HB3 TRP A 88 -6.021 11.981 -0.787 1.00 0.00 H new ATOM 0 HD1 TRP A 88 -7.772 12.520 -2.965 1.00 0.00 H new ATOM 0 HE1 TRP A 88 -8.208 14.785 -4.129 1.00 0.00 H new ATOM 0 HE3 TRP A 88 -6.208 15.643 0.760 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 -7.905 17.585 -3.489 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 -6.293 18.102 0.458 1.00 0.00 H new ATOM 0 HH2 TRP A 88 -7.138 19.076 -1.659 1.00 0.00 H new ATOM 1421 N LEU A 89 -9.825 13.477 0.426 1.00 0.00 N ATOM 1422 CA LEU A 89 -11.106 14.090 -0.028 1.00 0.00 C ATOM 1423 C LEU A 89 -10.837 15.470 -0.636 1.00 0.00 C ATOM 1424 O LEU A 89 -9.867 16.124 -0.310 1.00 0.00 O ATOM 1425 CB LEU A 89 -11.946 14.206 1.242 1.00 0.00 C ATOM 1426 CG LEU A 89 -13.434 14.063 0.909 1.00 0.00 C ATOM 1427 CD1 LEU A 89 -14.242 14.055 2.199 1.00 0.00 C ATOM 1428 CD2 LEU A 89 -13.893 15.238 0.054 1.00 0.00 C ATOM 0 H LEU A 89 -9.463 13.836 1.309 1.00 0.00 H new ATOM 0 HA LEU A 89 -11.609 13.502 -0.796 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -11.650 13.435 1.954 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -11.764 15.169 1.720 1.00 0.00 H new ATOM 0 HG LEU A 89 -13.585 13.132 0.363 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -15.302 13.953 1.964 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -13.926 13.217 2.821 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -14.078 14.989 2.737 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -14.952 15.127 -0.178 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -13.736 16.168 0.600 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -13.319 15.260 -0.873 1.00 0.00 H new ATOM 1440 N VAL A 90 -11.688 15.912 -1.517 1.00 0.00 N ATOM 1441 CA VAL A 90 -11.485 17.249 -2.150 1.00 0.00 C ATOM 1442 C VAL A 90 -12.603 18.211 -1.736 1.00 0.00 C ATOM 1443 O VAL A 90 -13.733 18.091 -2.170 1.00 0.00 O ATOM 1444 CB VAL A 90 -11.538 16.988 -3.657 1.00 0.00 C ATOM 1445 CG1 VAL A 90 -11.278 18.292 -4.412 1.00 0.00 C ATOM 1446 CG2 VAL A 90 -10.465 15.963 -4.034 1.00 0.00 C ATOM 0 H VAL A 90 -12.517 15.407 -1.828 1.00 0.00 H new ATOM 0 HA VAL A 90 -10.544 17.707 -1.846 1.00 0.00 H new ATOM 0 HB VAL A 90 -12.523 16.603 -3.923 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -11.316 18.105 -5.485 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -12.039 19.025 -4.144 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -10.294 18.677 -4.145 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -10.502 15.776 -5.107 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -9.482 16.350 -3.766 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -10.647 15.032 -3.497 1.00 0.00 H new ATOM 1456 N THR A 91 -12.295 19.168 -0.901 1.00 0.00 N ATOM 1457 CA THR A 91 -13.331 20.143 -0.460 1.00 0.00 C ATOM 1458 C THR A 91 -12.897 21.565 -0.823 1.00 0.00 C ATOM 1459 O THR A 91 -13.295 22.526 -0.195 1.00 0.00 O ATOM 1460 CB THR A 91 -13.409 19.978 1.058 1.00 0.00 C ATOM 1461 OG1 THR A 91 -13.607 18.608 1.374 1.00 0.00 O ATOM 1462 CG2 THR A 91 -14.572 20.803 1.603 1.00 0.00 C ATOM 0 H THR A 91 -11.367 19.315 -0.505 1.00 0.00 H new ATOM 0 HA THR A 91 -14.295 19.970 -0.938 1.00 0.00 H new ATOM 0 HB THR A 91 -12.479 20.324 1.510 1.00 0.00 H new ATOM 0 HG1 THR A 91 -13.655 18.500 2.347 1.00 0.00 H new ATOM 0 HG21 THR A 91 -14.627 20.684 2.685 1.00 0.00 H new ATOM 0 HG22 THR A 91 -14.417 21.854 1.360 1.00 0.00 H new ATOM 0 HG23 THR A 91 -15.504 20.460 1.153 1.00 0.00 H new ATOM 1470 N THR A 92 -12.079 21.703 -1.831 1.00 0.00 N ATOM 1471 CA THR A 92 -11.610 23.060 -2.237 1.00 0.00 C ATOM 1472 C THR A 92 -12.708 23.795 -3.010 1.00 0.00 C ATOM 1473 O THR A 92 -13.722 23.225 -3.361 1.00 0.00 O ATOM 1474 CB THR A 92 -10.406 22.806 -3.143 1.00 0.00 C ATOM 1475 OG1 THR A 92 -9.805 24.046 -3.487 1.00 0.00 O ATOM 1476 CG2 THR A 92 -10.867 22.090 -4.413 1.00 0.00 C ATOM 0 H THR A 92 -11.714 20.933 -2.392 1.00 0.00 H new ATOM 0 HA THR A 92 -11.356 23.680 -1.377 1.00 0.00 H new ATOM 0 HB THR A 92 -9.680 22.184 -2.620 1.00 0.00 H new ATOM 0 HG1 THR A 92 -9.661 24.082 -4.456 1.00 0.00 H new ATOM 0 HG21 THR A 92 -10.009 21.908 -5.060 1.00 0.00 H new ATOM 0 HG22 THR A 92 -11.329 21.139 -4.147 1.00 0.00 H new ATOM 0 HG23 THR A 92 -11.592 22.711 -4.938 1.00 0.00 H new ATOM 1484 N VAL A 93 -12.511 25.056 -3.282 1.00 0.00 N ATOM 1485 CA VAL A 93 -13.540 25.824 -4.038 1.00 0.00 C ATOM 1486 C VAL A 93 -13.235 25.774 -5.537 1.00 0.00 C ATOM 1487 O VAL A 93 -12.750 26.727 -6.113 1.00 0.00 O ATOM 1488 CB VAL A 93 -13.434 27.259 -3.519 1.00 0.00 C ATOM 1489 CG1 VAL A 93 -14.686 28.041 -3.921 1.00 0.00 C ATOM 1490 CG2 VAL A 93 -13.315 27.242 -1.993 1.00 0.00 C ATOM 0 H VAL A 93 -11.683 25.587 -3.014 1.00 0.00 H new ATOM 0 HA VAL A 93 -14.542 25.417 -3.899 1.00 0.00 H new ATOM 0 HB VAL A 93 -12.553 27.736 -3.949 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -14.611 29.064 -3.551 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -14.774 28.054 -5.007 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -15.567 27.564 -3.491 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -13.239 28.264 -1.623 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -14.197 26.765 -1.565 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -12.424 26.684 -1.704 1.00 0.00 H new ATOM 1500 N GLY A 94 -13.508 24.667 -6.173 1.00 0.00 N ATOM 1501 CA GLY A 94 -13.227 24.559 -7.633 1.00 0.00 C ATOM 1502 C GLY A 94 -14.482 24.079 -8.367 1.00 0.00 C ATOM 1503 O GLY A 94 -15.262 24.866 -8.866 1.00 0.00 O ATOM 0 H GLY A 94 -13.913 23.834 -5.745 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -12.913 25.526 -8.025 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -12.406 23.863 -7.804 1.00 0.00 H new ATOM 1507 N ALA A 95 -14.680 22.791 -8.435 1.00 0.00 N ATOM 1508 CA ALA A 95 -15.880 22.251 -9.134 1.00 0.00 C ATOM 1509 C ALA A 95 -15.908 20.727 -9.008 1.00 0.00 C ATOM 1510 O ALA A 95 -16.950 20.127 -8.833 1.00 0.00 O ATOM 1511 CB ALA A 95 -15.712 22.671 -10.595 1.00 0.00 C ATOM 0 H ALA A 95 -14.060 22.087 -8.035 1.00 0.00 H new ATOM 0 HA ALA A 95 -16.814 22.625 -8.714 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -16.559 22.309 -11.177 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -15.666 23.758 -10.658 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -14.791 22.245 -10.992 1.00 0.00 H new ATOM 1517 N TYR A 96 -14.762 20.104 -9.088 1.00 0.00 N ATOM 1518 CA TYR A 96 -14.693 18.618 -8.965 1.00 0.00 C ATOM 1519 C TYR A 96 -13.238 18.149 -9.097 1.00 0.00 C ATOM 1520 O TYR A 96 -12.953 17.155 -9.735 1.00 0.00 O ATOM 1521 CB TYR A 96 -15.548 18.073 -10.115 1.00 0.00 C ATOM 1522 CG TYR A 96 -14.779 18.149 -11.411 1.00 0.00 C ATOM 1523 CD1 TYR A 96 -14.395 19.390 -11.929 1.00 0.00 C ATOM 1524 CD2 TYR A 96 -14.458 16.974 -12.101 1.00 0.00 C ATOM 1525 CE1 TYR A 96 -13.691 19.458 -13.135 1.00 0.00 C ATOM 1526 CE2 TYR A 96 -13.754 17.041 -13.307 1.00 0.00 C ATOM 1527 CZ TYR A 96 -13.370 18.283 -13.826 1.00 0.00 C ATOM 1528 OH TYR A 96 -12.676 18.350 -15.016 1.00 0.00 O ATOM 0 H TYR A 96 -13.864 20.565 -9.234 1.00 0.00 H new ATOM 0 HA TYR A 96 -15.055 18.266 -7.999 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -15.831 17.040 -9.911 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -16.471 18.647 -10.196 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -14.643 20.297 -11.397 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -14.754 16.015 -11.702 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -13.395 20.417 -13.534 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -13.506 16.134 -13.838 1.00 0.00 H new ATOM 0 HH TYR A 96 -12.534 17.445 -15.364 1.00 0.00 H new ATOM 1538 N LEU A 97 -12.317 18.862 -8.504 1.00 0.00 N ATOM 1539 CA LEU A 97 -10.882 18.460 -8.601 1.00 0.00 C ATOM 1540 C LEU A 97 -10.748 16.943 -8.450 1.00 0.00 C ATOM 1541 O LEU A 97 -10.845 16.416 -7.360 1.00 0.00 O ATOM 1542 CB LEU A 97 -10.182 19.180 -7.447 1.00 0.00 C ATOM 1543 CG LEU A 97 -9.141 20.150 -8.009 1.00 0.00 C ATOM 1544 CD1 LEU A 97 -9.757 21.542 -8.142 1.00 0.00 C ATOM 1545 CD2 LEU A 97 -7.942 20.217 -7.060 1.00 0.00 C ATOM 0 H LEU A 97 -12.496 19.704 -7.957 1.00 0.00 H new ATOM 0 HA LEU A 97 -10.446 18.724 -9.564 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -10.912 19.721 -6.846 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -9.702 18.455 -6.789 1.00 0.00 H new ATOM 0 HG LEU A 97 -8.814 19.801 -8.989 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -9.014 22.232 -8.542 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -10.612 21.498 -8.816 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -10.084 21.890 -7.162 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -7.200 20.908 -7.460 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -8.272 20.565 -6.081 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -7.499 19.226 -6.962 1.00 0.00 H new ATOM 1557 N PRO A 98 -10.528 16.293 -9.559 1.00 0.00 N ATOM 1558 CA PRO A 98 -10.383 14.817 -9.559 1.00 0.00 C ATOM 1559 C PRO A 98 -9.041 14.414 -8.930 1.00 0.00 C ATOM 1560 O PRO A 98 -8.908 14.362 -7.724 1.00 0.00 O ATOM 1561 CB PRO A 98 -10.444 14.453 -11.041 1.00 0.00 C ATOM 1562 CG PRO A 98 -10.004 15.688 -11.761 1.00 0.00 C ATOM 1563 CD PRO A 98 -10.398 16.862 -10.904 1.00 0.00 C ATOM 0 HA PRO A 98 -11.148 14.303 -8.976 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -9.791 13.610 -11.268 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -11.453 14.163 -11.335 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -8.927 15.675 -11.925 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -10.475 15.751 -12.742 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -9.644 17.648 -10.933 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -11.335 17.306 -11.242 1.00 0.00 H new ATOM 1571 N ALA A 99 -8.043 14.130 -9.726 1.00 0.00 N ATOM 1572 CA ALA A 99 -6.722 13.734 -9.153 1.00 0.00 C ATOM 1573 C ALA A 99 -5.809 13.196 -10.256 1.00 0.00 C ATOM 1574 O ALA A 99 -5.970 13.514 -11.418 1.00 0.00 O ATOM 1575 CB ALA A 99 -7.035 12.636 -8.138 1.00 0.00 C ATOM 0 H ALA A 99 -8.085 14.155 -10.745 1.00 0.00 H new ATOM 0 HA ALA A 99 -6.207 14.577 -8.692 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -6.109 12.294 -7.675 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -7.702 13.029 -7.370 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -7.518 11.800 -8.644 1.00 0.00 H new ATOM 1581 N VAL A 100 -4.845 12.388 -9.903 1.00 0.00 N ATOM 1582 CA VAL A 100 -3.923 11.845 -10.939 1.00 0.00 C ATOM 1583 C VAL A 100 -3.828 10.310 -10.837 1.00 0.00 C ATOM 1584 O VAL A 100 -3.653 9.629 -11.829 1.00 0.00 O ATOM 1585 CB VAL A 100 -2.580 12.542 -10.654 1.00 0.00 C ATOM 1586 CG1 VAL A 100 -1.672 11.655 -9.797 1.00 0.00 C ATOM 1587 CG2 VAL A 100 -1.880 12.864 -11.977 1.00 0.00 C ATOM 0 H VAL A 100 -4.658 12.083 -8.948 1.00 0.00 H new ATOM 0 HA VAL A 100 -4.262 12.037 -11.957 1.00 0.00 H new ATOM 0 HB VAL A 100 -2.779 13.463 -10.105 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -0.730 12.171 -9.611 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -2.163 11.441 -8.848 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -1.476 10.720 -10.322 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -0.929 13.357 -11.775 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -1.700 11.941 -12.527 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -2.512 13.524 -12.572 1.00 0.00 H new ATOM 1597 N PHE A 101 -3.945 9.755 -9.655 1.00 0.00 N ATOM 1598 CA PHE A 101 -3.864 8.266 -9.517 1.00 0.00 C ATOM 1599 C PHE A 101 -5.037 7.729 -8.689 1.00 0.00 C ATOM 1600 O PHE A 101 -5.213 6.534 -8.556 1.00 0.00 O ATOM 1601 CB PHE A 101 -2.552 8.001 -8.781 1.00 0.00 C ATOM 1602 CG PHE A 101 -1.413 7.855 -9.761 1.00 0.00 C ATOM 1603 CD1 PHE A 101 -1.601 7.184 -10.976 1.00 0.00 C ATOM 1604 CD2 PHE A 101 -0.159 8.392 -9.447 1.00 0.00 C ATOM 1605 CE1 PHE A 101 -0.535 7.053 -11.873 1.00 0.00 C ATOM 1606 CE2 PHE A 101 0.905 8.261 -10.343 1.00 0.00 C ATOM 1607 CZ PHE A 101 0.718 7.593 -11.558 1.00 0.00 C ATOM 0 H PHE A 101 -4.092 10.265 -8.784 1.00 0.00 H new ATOM 0 HA PHE A 101 -3.905 7.774 -10.489 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -2.343 8.820 -8.092 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -2.642 7.095 -8.182 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -2.567 6.768 -11.220 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -0.014 8.909 -8.510 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -0.679 6.535 -12.810 1.00 0.00 H new ATOM 0 HE2 PHE A 101 1.872 8.675 -10.098 1.00 0.00 H new ATOM 0 HZ PHE A 101 1.539 7.494 -12.252 1.00 0.00 H new ATOM 1617 N GLU A 102 -5.832 8.593 -8.120 1.00 0.00 N ATOM 1618 CA GLU A 102 -6.977 8.113 -7.292 1.00 0.00 C ATOM 1619 C GLU A 102 -8.310 8.417 -7.984 1.00 0.00 C ATOM 1620 O GLU A 102 -8.403 9.295 -8.818 1.00 0.00 O ATOM 1621 CB GLU A 102 -6.862 8.889 -5.981 1.00 0.00 C ATOM 1622 CG GLU A 102 -7.261 10.344 -6.212 1.00 0.00 C ATOM 1623 CD GLU A 102 -6.152 11.261 -5.692 1.00 0.00 C ATOM 1624 OE1 GLU A 102 -5.017 11.071 -6.093 1.00 0.00 O ATOM 1625 OE2 GLU A 102 -6.459 12.137 -4.899 1.00 0.00 O ATOM 0 H GLU A 102 -5.740 9.606 -8.191 1.00 0.00 H new ATOM 0 HA GLU A 102 -6.948 7.035 -7.136 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -7.505 8.441 -5.223 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -5.841 8.837 -5.604 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -7.429 10.523 -7.274 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -8.198 10.562 -5.700 1.00 0.00 H new ATOM 1632 N GLU A 103 -9.342 7.697 -7.638 1.00 0.00 N ATOM 1633 CA GLU A 103 -10.673 7.942 -8.269 1.00 0.00 C ATOM 1634 C GLU A 103 -11.692 8.332 -7.197 1.00 0.00 C ATOM 1635 O GLU A 103 -11.453 8.172 -6.018 1.00 0.00 O ATOM 1636 CB GLU A 103 -11.057 6.612 -8.920 1.00 0.00 C ATOM 1637 CG GLU A 103 -10.784 5.466 -7.944 1.00 0.00 C ATOM 1638 CD GLU A 103 -11.886 4.411 -8.068 1.00 0.00 C ATOM 1639 OE1 GLU A 103 -13.043 4.796 -8.135 1.00 0.00 O ATOM 1640 OE2 GLU A 103 -11.556 3.237 -8.092 1.00 0.00 O ATOM 0 H GLU A 103 -9.322 6.949 -6.945 1.00 0.00 H new ATOM 0 HA GLU A 103 -10.646 8.753 -8.996 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -12.111 6.623 -9.199 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -10.486 6.466 -9.837 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -9.813 5.018 -8.156 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -10.744 5.846 -6.923 1.00 0.00 H new ATOM 1647 N VAL A 104 -12.823 8.847 -7.592 1.00 0.00 N ATOM 1648 CA VAL A 104 -13.846 9.250 -6.588 1.00 0.00 C ATOM 1649 C VAL A 104 -14.873 8.131 -6.391 1.00 0.00 C ATOM 1650 O VAL A 104 -15.125 7.342 -7.280 1.00 0.00 O ATOM 1651 CB VAL A 104 -14.508 10.491 -7.182 1.00 0.00 C ATOM 1652 CG1 VAL A 104 -15.283 10.107 -8.442 1.00 0.00 C ATOM 1653 CG2 VAL A 104 -15.471 11.091 -6.158 1.00 0.00 C ATOM 0 H VAL A 104 -13.083 9.006 -8.566 1.00 0.00 H new ATOM 0 HA VAL A 104 -13.409 9.447 -5.609 1.00 0.00 H new ATOM 0 HB VAL A 104 -13.741 11.223 -7.438 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -15.754 10.995 -8.864 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -14.598 9.677 -9.173 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -16.050 9.375 -8.189 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -15.945 11.977 -6.580 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -16.236 10.357 -5.904 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -14.920 11.367 -5.259 1.00 0.00 H new ATOM 1663 N LEU A 105 -15.472 8.064 -5.233 1.00 0.00 N ATOM 1664 CA LEU A 105 -16.488 7.003 -4.980 1.00 0.00 C ATOM 1665 C LEU A 105 -17.892 7.606 -5.077 1.00 0.00 C ATOM 1666 O LEU A 105 -18.826 6.970 -5.525 1.00 0.00 O ATOM 1667 CB LEU A 105 -16.216 6.505 -3.555 1.00 0.00 C ATOM 1668 CG LEU A 105 -14.734 6.142 -3.385 1.00 0.00 C ATOM 1669 CD1 LEU A 105 -14.219 5.420 -4.634 1.00 0.00 C ATOM 1670 CD2 LEU A 105 -13.916 7.417 -3.161 1.00 0.00 C ATOM 0 H LEU A 105 -15.302 8.698 -4.452 1.00 0.00 H new ATOM 0 HA LEU A 105 -16.428 6.191 -5.704 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -16.492 7.276 -2.835 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -16.836 5.634 -3.343 1.00 0.00 H new ATOM 0 HG LEU A 105 -14.629 5.482 -2.524 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -13.167 5.168 -4.501 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -14.794 4.507 -4.790 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -14.329 6.070 -5.502 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -12.864 7.158 -3.040 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -14.031 8.078 -4.020 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -14.270 7.923 -2.263 1.00 0.00 H new ATOM 1682 N ASP A 106 -18.039 8.834 -4.661 1.00 0.00 N ATOM 1683 CA ASP A 106 -19.372 9.498 -4.727 1.00 0.00 C ATOM 1684 C ASP A 106 -19.204 11.008 -4.542 1.00 0.00 C ATOM 1685 O ASP A 106 -18.116 11.537 -4.656 1.00 0.00 O ATOM 1686 CB ASP A 106 -20.172 8.898 -3.569 1.00 0.00 C ATOM 1687 CG ASP A 106 -21.102 7.808 -4.104 1.00 0.00 C ATOM 1688 OD1 ASP A 106 -22.023 8.147 -4.830 1.00 0.00 O ATOM 1689 OD2 ASP A 106 -20.878 6.654 -3.780 1.00 0.00 O ATOM 0 H ASP A 106 -17.289 9.409 -4.276 1.00 0.00 H new ATOM 0 HA ASP A 106 -19.871 9.343 -5.684 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -19.496 8.480 -2.823 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -20.753 9.675 -3.073 1.00 0.00 H new ATOM 1694 N LEU A 107 -20.265 11.707 -4.252 1.00 0.00 N ATOM 1695 CA LEU A 107 -20.146 13.181 -4.059 1.00 0.00 C ATOM 1696 C LEU A 107 -20.961 13.632 -2.845 1.00 0.00 C ATOM 1697 O LEU A 107 -21.809 12.917 -2.350 1.00 0.00 O ATOM 1698 CB LEU A 107 -20.667 13.833 -5.354 1.00 0.00 C ATOM 1699 CG LEU A 107 -21.979 13.189 -5.837 1.00 0.00 C ATOM 1700 CD1 LEU A 107 -21.697 11.808 -6.433 1.00 0.00 C ATOM 1701 CD2 LEU A 107 -22.971 13.055 -4.678 1.00 0.00 C ATOM 0 H LEU A 107 -21.204 11.326 -4.141 1.00 0.00 H new ATOM 0 HA LEU A 107 -19.114 13.475 -3.867 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -20.827 14.898 -5.185 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -19.911 13.744 -6.134 1.00 0.00 H new ATOM 0 HG LEU A 107 -22.416 13.831 -6.602 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -22.631 11.360 -6.772 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -21.015 11.909 -7.278 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -21.243 11.170 -5.675 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -23.892 12.598 -5.039 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -22.537 12.430 -3.898 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -23.191 14.042 -4.271 1.00 0.00 H new ATOM 1713 N VAL A 108 -20.702 14.813 -2.359 1.00 0.00 N ATOM 1714 CA VAL A 108 -21.450 15.318 -1.172 1.00 0.00 C ATOM 1715 C VAL A 108 -21.797 16.791 -1.357 1.00 0.00 C ATOM 1716 O VAL A 108 -21.082 17.519 -1.996 1.00 0.00 O ATOM 1717 CB VAL A 108 -20.479 15.168 -0.005 1.00 0.00 C ATOM 1718 CG1 VAL A 108 -20.987 15.983 1.186 1.00 0.00 C ATOM 1719 CG2 VAL A 108 -20.373 13.698 0.387 1.00 0.00 C ATOM 0 H VAL A 108 -20.002 15.454 -2.733 1.00 0.00 H new ATOM 0 HA VAL A 108 -22.383 14.776 -1.016 1.00 0.00 H new ATOM 0 HB VAL A 108 -19.495 15.532 -0.301 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -20.295 15.877 2.021 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -21.058 17.034 0.904 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -21.971 15.620 1.482 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -19.679 13.593 1.221 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -21.355 13.329 0.683 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -20.009 13.120 -0.463 1.00 0.00 H new ATOM 1729 N ASP A 109 -22.873 17.245 -0.787 1.00 0.00 N ATOM 1730 CA ASP A 109 -23.214 18.685 -0.927 1.00 0.00 C ATOM 1731 C ASP A 109 -23.067 19.389 0.430 1.00 0.00 C ATOM 1732 O ASP A 109 -23.772 19.092 1.374 1.00 0.00 O ATOM 1733 CB ASP A 109 -24.657 18.715 -1.431 1.00 0.00 C ATOM 1734 CG ASP A 109 -25.631 18.519 -0.266 1.00 0.00 C ATOM 1735 OD1 ASP A 109 -25.739 17.400 0.207 1.00 0.00 O ATOM 1736 OD2 ASP A 109 -26.251 19.491 0.132 1.00 0.00 O ATOM 0 H ASP A 109 -23.526 16.689 -0.235 1.00 0.00 H new ATOM 0 HA ASP A 109 -22.554 19.209 -1.618 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -24.857 19.666 -1.925 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -24.806 17.932 -2.174 1.00 0.00 H new ATOM 1741 N ALA A 110 -22.145 20.308 0.542 1.00 0.00 N ATOM 1742 CA ALA A 110 -21.954 21.009 1.846 1.00 0.00 C ATOM 1743 C ALA A 110 -23.033 22.079 2.046 1.00 0.00 C ATOM 1744 O ALA A 110 -23.866 22.305 1.192 1.00 0.00 O ATOM 1745 CB ALA A 110 -20.571 21.654 1.752 1.00 0.00 C ATOM 0 H ALA A 110 -21.519 20.603 -0.208 1.00 0.00 H new ATOM 0 HA ALA A 110 -22.030 20.325 2.692 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -20.356 22.190 2.676 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -19.819 20.881 1.598 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -20.551 22.351 0.915 1.00 0.00 H new ATOM 1751 N VAL A 111 -23.022 22.736 3.175 1.00 0.00 N ATOM 1752 CA VAL A 111 -24.042 23.790 3.442 1.00 0.00 C ATOM 1753 C VAL A 111 -23.348 25.144 3.662 1.00 0.00 C ATOM 1754 O VAL A 111 -22.170 25.207 3.953 1.00 0.00 O ATOM 1755 CB VAL A 111 -24.780 23.303 4.707 1.00 0.00 C ATOM 1756 CG1 VAL A 111 -24.974 24.445 5.712 1.00 0.00 C ATOM 1757 CG2 VAL A 111 -26.154 22.757 4.307 1.00 0.00 C ATOM 0 H VAL A 111 -22.348 22.587 3.926 1.00 0.00 H new ATOM 0 HA VAL A 111 -24.736 23.940 2.615 1.00 0.00 H new ATOM 0 HB VAL A 111 -24.178 22.526 5.177 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -25.497 24.070 6.592 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -24.001 24.839 6.008 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -25.562 25.239 5.252 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -26.681 22.411 5.196 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -26.733 23.545 3.826 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -26.027 21.925 3.614 1.00 0.00 H new ATOM 1767 N ILE A 112 -24.070 26.222 3.521 1.00 0.00 N ATOM 1768 CA ILE A 112 -23.454 27.567 3.719 1.00 0.00 C ATOM 1769 C ILE A 112 -23.174 27.809 5.206 1.00 0.00 C ATOM 1770 O ILE A 112 -23.984 27.503 6.058 1.00 0.00 O ATOM 1771 CB ILE A 112 -24.499 28.557 3.204 1.00 0.00 C ATOM 1772 CG1 ILE A 112 -24.665 28.382 1.692 1.00 0.00 C ATOM 1773 CG2 ILE A 112 -24.041 29.985 3.503 1.00 0.00 C ATOM 1774 CD1 ILE A 112 -23.414 28.898 0.977 1.00 0.00 C ATOM 0 H ILE A 112 -25.060 26.231 3.277 1.00 0.00 H new ATOM 0 HA ILE A 112 -22.502 27.667 3.197 1.00 0.00 H new ATOM 0 HB ILE A 112 -25.452 28.370 3.700 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -24.826 27.331 1.453 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -25.544 28.926 1.347 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -24.786 30.691 3.136 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -23.921 30.111 4.579 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -23.088 30.173 3.008 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -23.533 28.773 -0.099 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -23.273 29.954 1.207 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -22.544 28.335 1.314 1.00 0.00 H new ATOM 1786 N LEU A 113 -22.033 28.359 5.523 1.00 0.00 N ATOM 1787 CA LEU A 113 -21.704 28.623 6.954 1.00 0.00 C ATOM 1788 C LEU A 113 -22.534 29.795 7.481 1.00 0.00 C ATOM 1789 O LEU A 113 -23.681 29.572 7.833 1.00 0.00 O ATOM 1790 CB LEU A 113 -20.217 28.976 6.960 1.00 0.00 C ATOM 1791 CG LEU A 113 -19.387 27.693 7.013 1.00 0.00 C ATOM 1792 CD1 LEU A 113 -18.289 27.750 5.951 1.00 0.00 C ATOM 1793 CD2 LEU A 113 -18.750 27.555 8.397 1.00 0.00 C ATOM 1794 OXT LEU A 113 -22.007 30.895 7.525 1.00 0.00 O ATOM 0 H LEU A 113 -21.315 28.637 4.854 1.00 0.00 H new ATOM 0 HA LEU A 113 -21.923 27.767 7.592 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -19.965 29.548 6.067 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -19.986 29.607 7.818 1.00 0.00 H new ATOM 0 HG LEU A 113 -20.032 26.836 6.822 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -17.698 26.835 5.989 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -18.742 27.848 4.964 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -17.643 28.607 6.141 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -18.158 26.641 8.436 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -18.105 28.413 8.588 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -19.532 27.513 9.155 1.00 0.00 H new TER 1806 LEU A 113