USER MOD reduce.3.24.130724 H: found=0, std=0, add=1085, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1085 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 65 ASN : amide:sc= -0.305! C(o=-0.017!,f=-6.7!) USER MOD Set 1.2: A 68 SER OG : rot 61:sc= 0.287 USER MOD Set 2.1: A 1 ALA N :NH3+ 175:sc= 0.0431 (180deg=0) USER MOD Set 2.2: A 22 GLN : amide:sc= -3.42! C(o=-3.4!,f=-7.3!) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 LYS NZ :NH3+ -160:sc= -0.0949 (180deg=-0.526) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 19 ASN : amide:sc= -0.509 K(o=-0.51,f=-9.3!) USER MOD Single : A 23 LYS NZ :NH3+ -171:sc= 2.55 (180deg=2.36) USER MOD Single : A 25 SER OG : rot 180:sc= 0.0554 USER MOD Single : A 26 ASN : amide:sc= -0.686 K(o=-0.69,f=-0.053) USER MOD Single : A 30 LYS NZ :NH3+ -166:sc= -0.0266 (180deg=-0.228) USER MOD Single : A 34 SER OG : rot 44:sc= 0.126 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 47:sc= 0.709 USER MOD Single : A 43 HIS : no HE2:sc= 0.743 K(o=0.74,f=-2.5!) USER MOD Single : A 46 HIS : no HE2:sc= -3.44! C(o=-3.4!,f=-6!) USER MOD Single : A 48 HIS : no HE2:sc= -5.68! K(o=-5.7!,f=-3.9) USER MOD Single : A 53 ASN : amide:sc= -0.366 X(o=-0.37,f=-0.83) USER MOD Single : A 54 THR OG1 : rot -85:sc= 1.65 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0.143 USER MOD Single : A 63 HIS : no HE2:sc= 0.603 K(o=0.6,f=-6.7!) USER MOD Single : A 70 LYS NZ :NH3+ 134:sc= 1.23 (180deg=0.956) USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ -139:sc= 2.39 (180deg=1.04) USER MOD Single : A 80 HIS : no HE2:sc= -3.81! C(o=-3.8!,f=-3.1!) USER MOD Single : A 86 ASN : amide:sc= 1.38 K(o=1.4,f=-6.6!) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 148:sc= 1.19 (180deg=1.09) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot -39:sc= 1.21 USER MOD Single : A 105 SER OG : rot -145:sc=-0.00768 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HE2:sc= 0.0351 K(o=0.035,f=-6.8!) USER MOD Single : A 111 SER OG : rot 28:sc= 1.21 USER MOD Single : A 116 THR OG1 : rot 109:sc= 1.35 USER MOD Single : A 120 HIS : no HD1:sc= -1.62 X(o=-1.6,f=-2.1) USER MOD Single : A 122 LYS NZ :NH3+ -164:sc= 0.923 (180deg=0.214) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 ASN : amide:sc= -0.15 K(o=-0.15,f=-2.6!) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot -11:sc= 1.19 USER MOD Single : A 136 LYS NZ :NH3+ -128:sc= 1.19 (180deg=0.221) USER MOD Single : A 137 THR OG1 : rot 77:sc= 1.23 USER MOD Single : A 139 ASN : amide:sc= -2.05 K(o=-2.1,f=-3.2!) USER MOD Single : A 142 SER OG : rot 180:sc= 0.0124 USER MOD Single : A 153 GLN : amide:sc= 0.939 K(o=0.94,f=-0.0042) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 7.952 -13.050 1.015 1.00 0.00 N ATOM 2 CA ALA A 1 8.273 -13.651 -0.288 1.00 0.00 C ATOM 3 C ALA A 1 7.029 -14.156 -1.032 1.00 0.00 C ATOM 4 O ALA A 1 6.921 -13.981 -2.244 1.00 0.00 O ATOM 5 CB ALA A 1 9.276 -14.781 -0.124 1.00 0.00 C ATOM 0 H1 ALA A 1 8.833 -12.804 1.510 1.00 0.00 H new ATOM 0 H2 ALA A 1 7.384 -12.191 0.871 1.00 0.00 H new ATOM 0 H3 ALA A 1 7.412 -13.730 1.587 1.00 0.00 H new ATOM 0 HA ALA A 1 8.713 -12.860 -0.895 1.00 0.00 H new ATOM 0 HB1 ALA A 1 9.500 -15.213 -1.099 1.00 0.00 H new ATOM 0 HB2 ALA A 1 10.192 -14.393 0.320 1.00 0.00 H new ATOM 0 HB3 ALA A 1 8.856 -15.549 0.525 1.00 0.00 H new ATOM 13 N THR A 2 6.094 -14.770 -0.327 1.00 0.00 N ATOM 14 CA THR A 2 4.934 -15.353 -0.996 1.00 0.00 C ATOM 15 C THR A 2 3.609 -14.750 -0.487 1.00 0.00 C ATOM 16 O THR A 2 2.671 -14.520 -1.255 1.00 0.00 O ATOM 17 CB THR A 2 4.912 -16.880 -0.762 1.00 0.00 C ATOM 18 OG1 THR A 2 6.226 -17.422 -0.984 1.00 0.00 O ATOM 19 CG2 THR A 2 3.937 -17.562 -1.708 1.00 0.00 C ATOM 0 H THR A 2 6.109 -14.879 0.687 1.00 0.00 H new ATOM 0 HA THR A 2 5.024 -15.129 -2.059 1.00 0.00 H new ATOM 0 HB THR A 2 4.595 -17.060 0.265 1.00 0.00 H new ATOM 0 HG1 THR A 2 6.210 -18.390 -0.833 1.00 0.00 H new ATOM 0 HG21 THR A 2 3.941 -18.636 -1.522 1.00 0.00 H new ATOM 0 HG22 THR A 2 2.934 -17.169 -1.542 1.00 0.00 H new ATOM 0 HG23 THR A 2 4.236 -17.371 -2.739 1.00 0.00 H new ATOM 27 N LYS A 3 3.540 -14.475 0.795 1.00 0.00 N ATOM 28 CA LYS A 3 2.309 -14.020 1.391 1.00 0.00 C ATOM 29 C LYS A 3 2.521 -12.875 2.342 1.00 0.00 C ATOM 30 O LYS A 3 3.474 -12.878 3.151 1.00 0.00 O ATOM 31 CB LYS A 3 1.587 -15.170 2.119 1.00 0.00 C ATOM 32 CG LYS A 3 1.025 -16.236 1.191 1.00 0.00 C ATOM 33 CD LYS A 3 0.249 -17.290 1.954 1.00 0.00 C ATOM 34 CE LYS A 3 -0.411 -18.279 1.008 1.00 0.00 C ATOM 35 NZ LYS A 3 -1.359 -17.608 0.089 1.00 0.00 N ATOM 0 H LYS A 3 4.323 -14.559 1.444 1.00 0.00 H new ATOM 0 HA LYS A 3 1.685 -13.664 0.571 1.00 0.00 H new ATOM 0 HB2 LYS A 3 2.283 -15.639 2.815 1.00 0.00 H new ATOM 0 HB3 LYS A 3 0.773 -14.755 2.714 1.00 0.00 H new ATOM 0 HG2 LYS A 3 0.374 -15.769 0.452 1.00 0.00 H new ATOM 0 HG3 LYS A 3 1.841 -16.709 0.644 1.00 0.00 H new ATOM 0 HD2 LYS A 3 0.920 -17.821 2.630 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -0.511 -16.810 2.571 1.00 0.00 H new ATOM 0 HE2 LYS A 3 0.355 -18.795 0.428 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -0.939 -19.038 1.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -2.025 -18.308 -0.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -1.886 -16.877 0.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -0.832 -17.167 -0.692 1.00 0.00 H new ATOM 49 N ALA A 4 1.653 -11.892 2.233 1.00 0.00 N ATOM 50 CA ALA A 4 1.652 -10.755 3.101 1.00 0.00 C ATOM 51 C ALA A 4 0.286 -10.188 3.094 1.00 0.00 C ATOM 52 O ALA A 4 -0.059 -9.520 2.157 1.00 0.00 O ATOM 53 CB ALA A 4 2.640 -9.706 2.625 1.00 0.00 C ATOM 0 H ALA A 4 0.920 -11.869 1.524 1.00 0.00 H new ATOM 0 HA ALA A 4 1.947 -11.059 4.105 1.00 0.00 H new ATOM 0 HB1 ALA A 4 2.619 -8.852 3.303 1.00 0.00 H new ATOM 0 HB2 ALA A 4 3.643 -10.132 2.609 1.00 0.00 H new ATOM 0 HB3 ALA A 4 2.368 -9.379 1.621 1.00 0.00 H new ATOM 59 N VAL A 5 -0.478 -10.429 4.125 1.00 0.00 N ATOM 60 CA VAL A 5 -1.837 -9.983 4.145 1.00 0.00 C ATOM 61 C VAL A 5 -2.014 -8.883 5.161 1.00 0.00 C ATOM 62 O VAL A 5 -1.497 -8.946 6.282 1.00 0.00 O ATOM 63 CB VAL A 5 -2.872 -11.132 4.363 1.00 0.00 C ATOM 64 CG1 VAL A 5 -2.792 -12.162 3.252 1.00 0.00 C ATOM 65 CG2 VAL A 5 -2.716 -11.798 5.713 1.00 0.00 C ATOM 0 H VAL A 5 -0.179 -10.932 4.960 1.00 0.00 H new ATOM 0 HA VAL A 5 -2.048 -9.588 3.151 1.00 0.00 H new ATOM 0 HB VAL A 5 -3.859 -10.670 4.339 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -3.524 -12.949 3.432 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -3.002 -11.683 2.296 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -1.792 -12.595 3.229 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -3.458 -12.590 5.816 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -1.716 -12.225 5.795 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -2.861 -11.060 6.502 1.00 0.00 H new ATOM 75 N ALA A 6 -2.690 -7.876 4.751 1.00 0.00 N ATOM 76 CA ALA A 6 -2.890 -6.697 5.544 1.00 0.00 C ATOM 77 C ALA A 6 -4.330 -6.594 6.031 1.00 0.00 C ATOM 78 O ALA A 6 -5.240 -7.066 5.355 1.00 0.00 O ATOM 79 CB ALA A 6 -2.532 -5.502 4.702 1.00 0.00 C ATOM 0 H ALA A 6 -3.135 -7.836 3.834 1.00 0.00 H new ATOM 0 HA ALA A 6 -2.256 -6.742 6.429 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -2.676 -4.591 5.283 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -1.489 -5.574 4.393 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -3.171 -5.474 3.820 1.00 0.00 H new ATOM 85 N VAL A 7 -4.523 -5.979 7.186 1.00 0.00 N ATOM 86 CA VAL A 7 -5.849 -5.805 7.768 1.00 0.00 C ATOM 87 C VAL A 7 -6.020 -4.368 8.267 1.00 0.00 C ATOM 88 O VAL A 7 -5.257 -3.888 9.108 1.00 0.00 O ATOM 89 CB VAL A 7 -6.142 -6.863 8.897 1.00 0.00 C ATOM 90 CG1 VAL A 7 -5.088 -6.840 10.004 1.00 0.00 C ATOM 91 CG2 VAL A 7 -7.537 -6.676 9.482 1.00 0.00 C ATOM 0 H VAL A 7 -3.768 -5.586 7.748 1.00 0.00 H new ATOM 0 HA VAL A 7 -6.589 -5.984 6.988 1.00 0.00 H new ATOM 0 HB VAL A 7 -6.094 -7.844 8.423 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -5.336 -7.587 10.758 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -4.109 -7.063 9.579 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -5.066 -5.853 10.465 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -7.709 -7.421 10.259 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -7.620 -5.678 9.912 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -8.281 -6.795 8.694 1.00 0.00 H new ATOM 101 N LEU A 8 -6.992 -3.685 7.721 1.00 0.00 N ATOM 102 CA LEU A 8 -7.215 -2.288 8.043 1.00 0.00 C ATOM 103 C LEU A 8 -8.314 -2.132 9.087 1.00 0.00 C ATOM 104 O LEU A 8 -9.214 -2.973 9.185 1.00 0.00 O ATOM 105 CB LEU A 8 -7.566 -1.455 6.781 1.00 0.00 C ATOM 106 CG LEU A 8 -6.482 -1.303 5.679 1.00 0.00 C ATOM 107 CD1 LEU A 8 -6.233 -2.602 4.918 1.00 0.00 C ATOM 108 CD2 LEU A 8 -6.854 -0.185 4.720 1.00 0.00 C ATOM 0 H LEU A 8 -7.650 -4.072 7.045 1.00 0.00 H new ATOM 0 HA LEU A 8 -6.281 -1.907 8.455 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -8.448 -1.901 6.322 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.849 -0.455 7.110 1.00 0.00 H new ATOM 0 HG LEU A 8 -5.549 -1.048 6.182 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -5.467 -2.439 4.160 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -5.898 -3.372 5.613 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -7.156 -2.924 4.437 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -6.084 -0.092 3.954 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -7.810 -0.413 4.248 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -6.935 0.753 5.269 1.00 0.00 H new ATOM 120 N LYS A 9 -8.214 -1.071 9.870 1.00 0.00 N ATOM 121 CA LYS A 9 -9.183 -0.717 10.888 1.00 0.00 C ATOM 122 C LYS A 9 -9.571 0.728 10.572 1.00 0.00 C ATOM 123 O LYS A 9 -8.674 1.563 10.334 1.00 0.00 O ATOM 124 CB LYS A 9 -8.547 -0.821 12.288 1.00 0.00 C ATOM 125 CG LYS A 9 -7.741 -2.106 12.550 1.00 0.00 C ATOM 126 CD LYS A 9 -8.539 -3.386 12.305 1.00 0.00 C ATOM 127 CE LYS A 9 -9.676 -3.575 13.286 1.00 0.00 C ATOM 128 NZ LYS A 9 -10.462 -4.787 12.968 1.00 0.00 N ATOM 0 H LYS A 9 -7.435 -0.416 9.812 1.00 0.00 H new ATOM 0 HA LYS A 9 -10.049 -1.379 10.889 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -7.890 0.037 12.435 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -9.338 -0.749 13.035 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -6.859 -2.109 11.910 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -7.387 -2.100 13.581 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -8.941 -3.368 11.292 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -7.868 -4.243 12.367 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -9.278 -3.652 14.298 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -10.327 -2.701 13.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -11.234 -4.891 13.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -10.861 -4.701 12.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -9.844 -5.623 13.012 1.00 0.00 H new ATOM 142 N GLY A 10 -10.839 1.042 10.549 1.00 0.00 N ATOM 143 CA GLY A 10 -11.197 2.296 9.966 1.00 0.00 C ATOM 144 C GLY A 10 -12.057 3.239 10.763 1.00 0.00 C ATOM 145 O GLY A 10 -12.798 2.856 11.676 1.00 0.00 O ATOM 0 H GLY A 10 -11.606 0.474 10.910 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -10.275 2.820 9.715 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -11.712 2.090 9.028 1.00 0.00 H new ATOM 149 N ASP A 11 -11.875 4.509 10.393 1.00 0.00 N ATOM 150 CA ASP A 11 -12.704 5.635 10.811 1.00 0.00 C ATOM 151 C ASP A 11 -14.079 5.389 10.223 1.00 0.00 C ATOM 152 O ASP A 11 -15.114 5.558 10.874 1.00 0.00 O ATOM 153 CB ASP A 11 -12.106 6.927 10.216 1.00 0.00 C ATOM 154 CG ASP A 11 -12.902 8.180 10.519 1.00 0.00 C ATOM 155 OD1 ASP A 11 -13.823 8.533 9.736 1.00 0.00 O ATOM 156 OD2 ASP A 11 -12.614 8.850 11.532 1.00 0.00 O ATOM 0 H ASP A 11 -11.117 4.788 9.771 1.00 0.00 H new ATOM 0 HA ASP A 11 -12.753 5.734 11.895 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -11.093 7.053 10.597 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -12.028 6.813 9.135 1.00 0.00 H new ATOM 161 N GLY A 12 -14.049 4.994 8.977 1.00 0.00 N ATOM 162 CA GLY A 12 -15.189 4.484 8.281 1.00 0.00 C ATOM 163 C GLY A 12 -14.854 3.041 8.036 1.00 0.00 C ATOM 164 O GLY A 12 -13.653 2.733 7.989 1.00 0.00 O ATOM 0 H GLY A 12 -13.204 5.021 8.407 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -16.097 4.587 8.875 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -15.357 5.018 7.346 1.00 0.00 H new ATOM 168 N PRO A 13 -15.804 2.121 7.887 1.00 0.00 N ATOM 169 CA PRO A 13 -15.456 0.724 7.802 1.00 0.00 C ATOM 170 C PRO A 13 -14.764 0.403 6.491 1.00 0.00 C ATOM 171 O PRO A 13 -15.295 0.650 5.398 1.00 0.00 O ATOM 172 CB PRO A 13 -16.820 0.002 7.900 1.00 0.00 C ATOM 173 CG PRO A 13 -17.794 1.061 8.289 1.00 0.00 C ATOM 174 CD PRO A 13 -17.232 2.335 7.749 1.00 0.00 C ATOM 0 HA PRO A 13 -14.756 0.420 8.580 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -17.093 -0.455 6.949 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -16.790 -0.797 8.640 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -18.781 0.859 7.872 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -17.909 1.110 9.372 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -17.521 2.500 6.711 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -17.571 3.202 8.316 1.00 0.00 H new ATOM 182 N VAL A 14 -13.594 -0.153 6.627 1.00 0.00 N ATOM 183 CA VAL A 14 -12.774 -0.588 5.557 1.00 0.00 C ATOM 184 C VAL A 14 -12.307 -1.985 5.878 1.00 0.00 C ATOM 185 O VAL A 14 -11.549 -2.205 6.830 1.00 0.00 O ATOM 186 CB VAL A 14 -11.563 0.382 5.280 1.00 0.00 C ATOM 187 CG1 VAL A 14 -12.066 1.702 4.752 1.00 0.00 C ATOM 188 CG2 VAL A 14 -10.724 0.638 6.534 1.00 0.00 C ATOM 0 H VAL A 14 -13.173 -0.319 7.541 1.00 0.00 H new ATOM 0 HA VAL A 14 -13.355 -0.583 4.635 1.00 0.00 H new ATOM 0 HB VAL A 14 -10.929 -0.107 4.541 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -11.221 2.364 4.564 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -12.612 1.538 3.823 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -12.729 2.159 5.487 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.903 1.312 6.291 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -11.349 1.091 7.304 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -10.322 -0.306 6.902 1.00 0.00 H new ATOM 198 N GLN A 15 -12.802 -2.932 5.178 1.00 0.00 N ATOM 199 CA GLN A 15 -12.421 -4.290 5.445 1.00 0.00 C ATOM 200 C GLN A 15 -11.791 -4.855 4.213 1.00 0.00 C ATOM 201 O GLN A 15 -12.434 -4.928 3.175 1.00 0.00 O ATOM 202 CB GLN A 15 -13.624 -5.116 5.879 1.00 0.00 C ATOM 203 CG GLN A 15 -14.305 -4.576 7.119 1.00 0.00 C ATOM 204 CD GLN A 15 -15.564 -5.319 7.470 1.00 0.00 C ATOM 205 OE1 GLN A 15 -15.695 -6.521 7.223 1.00 0.00 O ATOM 206 NE2 GLN A 15 -16.515 -4.611 8.004 1.00 0.00 N ATOM 0 H GLN A 15 -13.469 -2.808 4.417 1.00 0.00 H new ATOM 0 HA GLN A 15 -11.704 -4.319 6.265 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -14.346 -5.151 5.063 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -13.304 -6.141 6.066 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -13.612 -4.629 7.959 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -14.542 -3.523 6.967 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -16.368 -3.620 8.193 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -17.408 -5.047 8.234 1.00 0.00 H new ATOM 215 N GLY A 16 -10.550 -5.250 4.317 1.00 0.00 N ATOM 216 CA GLY A 16 -9.824 -5.690 3.198 1.00 0.00 C ATOM 217 C GLY A 16 -8.656 -6.509 3.601 1.00 0.00 C ATOM 218 O GLY A 16 -8.212 -6.415 4.747 1.00 0.00 O ATOM 0 H GLY A 16 -10.028 -5.269 5.193 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -10.474 -6.275 2.547 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -9.486 -4.830 2.620 1.00 0.00 H new ATOM 222 N ILE A 17 -8.149 -7.298 2.678 1.00 0.00 N ATOM 223 CA ILE A 17 -7.035 -8.165 2.938 1.00 0.00 C ATOM 224 C ILE A 17 -6.280 -8.438 1.629 1.00 0.00 C ATOM 225 O ILE A 17 -6.726 -9.210 0.779 1.00 0.00 O ATOM 226 CB ILE A 17 -7.507 -9.484 3.659 1.00 0.00 C ATOM 227 CG1 ILE A 17 -6.337 -10.440 3.912 1.00 0.00 C ATOM 228 CG2 ILE A 17 -8.667 -10.174 2.922 1.00 0.00 C ATOM 229 CD1 ILE A 17 -6.714 -11.707 4.663 1.00 0.00 C ATOM 0 H ILE A 17 -8.504 -7.351 1.723 1.00 0.00 H new ATOM 0 HA ILE A 17 -6.341 -7.677 3.622 1.00 0.00 H new ATOM 0 HB ILE A 17 -7.897 -9.187 4.633 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -5.896 -10.717 2.954 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -5.568 -9.913 4.476 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -8.954 -11.077 3.460 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -9.519 -9.497 2.870 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -8.351 -10.438 1.913 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -5.828 -12.327 4.799 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -7.126 -11.444 5.637 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -7.459 -12.261 4.092 1.00 0.00 H new ATOM 241 N ILE A 18 -5.165 -7.759 1.462 1.00 0.00 N ATOM 242 CA ILE A 18 -4.354 -7.852 0.250 1.00 0.00 C ATOM 243 C ILE A 18 -3.100 -8.651 0.555 1.00 0.00 C ATOM 244 O ILE A 18 -2.563 -8.506 1.636 1.00 0.00 O ATOM 245 CB ILE A 18 -3.963 -6.439 -0.372 1.00 0.00 C ATOM 246 CG1 ILE A 18 -3.279 -5.458 0.632 1.00 0.00 C ATOM 247 CG2 ILE A 18 -5.135 -5.765 -1.076 1.00 0.00 C ATOM 248 CD1 ILE A 18 -4.215 -4.768 1.622 1.00 0.00 C ATOM 0 H ILE A 18 -4.787 -7.121 2.163 1.00 0.00 H new ATOM 0 HA ILE A 18 -4.963 -8.352 -0.504 1.00 0.00 H new ATOM 0 HB ILE A 18 -3.208 -6.679 -1.121 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -2.526 -6.009 1.195 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -2.753 -4.692 0.062 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -4.813 -4.806 -1.481 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.487 -6.402 -1.887 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -5.944 -5.605 -0.363 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -3.637 -4.110 2.271 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -4.954 -4.181 1.076 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -4.723 -5.519 2.226 1.00 0.00 H new ATOM 260 N ASN A 19 -2.682 -9.512 -0.368 1.00 0.00 N ATOM 261 CA ASN A 19 -1.519 -10.383 -0.181 1.00 0.00 C ATOM 262 C ASN A 19 -0.409 -10.005 -1.132 1.00 0.00 C ATOM 263 O ASN A 19 -0.614 -10.053 -2.336 1.00 0.00 O ATOM 264 CB ASN A 19 -1.935 -11.836 -0.426 1.00 0.00 C ATOM 265 CG ASN A 19 -0.792 -12.799 -0.250 1.00 0.00 C ATOM 266 OD1 ASN A 19 -0.537 -13.256 0.840 1.00 0.00 O ATOM 267 ND2 ASN A 19 -0.116 -13.128 -1.320 1.00 0.00 N ATOM 0 H ASN A 19 -3.140 -9.628 -1.272 1.00 0.00 H new ATOM 0 HA ASN A 19 -1.152 -10.267 0.839 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -2.739 -12.101 0.261 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -2.334 -11.931 -1.436 1.00 0.00 H new ATOM 0 HD21 ASN A 19 0.656 -13.791 -1.252 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -0.361 -12.721 -2.223 1.00 0.00 H new ATOM 274 N PHE A 20 0.771 -9.645 -0.608 1.00 0.00 N ATOM 275 CA PHE A 20 1.875 -9.239 -1.479 1.00 0.00 C ATOM 276 C PHE A 20 3.111 -10.114 -1.351 1.00 0.00 C ATOM 277 O PHE A 20 3.541 -10.451 -0.251 1.00 0.00 O ATOM 278 CB PHE A 20 2.211 -7.748 -1.328 1.00 0.00 C ATOM 279 CG PHE A 20 1.314 -6.846 -2.141 1.00 0.00 C ATOM 280 CD1 PHE A 20 -0.018 -6.652 -1.801 1.00 0.00 C ATOM 281 CD2 PHE A 20 1.812 -6.199 -3.264 1.00 0.00 C ATOM 282 CE1 PHE A 20 -0.831 -5.839 -2.567 1.00 0.00 C ATOM 283 CE2 PHE A 20 1.003 -5.381 -4.031 1.00 0.00 C ATOM 284 CZ PHE A 20 -0.319 -5.202 -3.683 1.00 0.00 C ATOM 0 H PHE A 20 0.980 -9.627 0.390 1.00 0.00 H new ATOM 0 HA PHE A 20 1.512 -9.393 -2.495 1.00 0.00 H new ATOM 0 HB2 PHE A 20 2.136 -7.471 -0.277 1.00 0.00 H new ATOM 0 HB3 PHE A 20 3.246 -7.584 -1.627 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -0.423 -7.142 -0.928 1.00 0.00 H new ATOM 0 HD2 PHE A 20 2.846 -6.337 -3.543 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -1.867 -5.701 -2.294 1.00 0.00 H new ATOM 0 HE2 PHE A 20 1.406 -4.883 -4.901 1.00 0.00 H new ATOM 0 HZ PHE A 20 -0.954 -4.565 -4.281 1.00 0.00 H new ATOM 294 N GLU A 21 3.671 -10.472 -2.492 1.00 0.00 N ATOM 295 CA GLU A 21 4.844 -11.333 -2.559 1.00 0.00 C ATOM 296 C GLU A 21 6.120 -10.498 -2.842 1.00 0.00 C ATOM 297 O GLU A 21 6.296 -9.986 -3.938 1.00 0.00 O ATOM 298 CB GLU A 21 4.698 -12.307 -3.708 1.00 0.00 C ATOM 299 CG GLU A 21 3.335 -12.889 -3.946 1.00 0.00 C ATOM 300 CD GLU A 21 3.366 -13.816 -5.128 1.00 0.00 C ATOM 301 OE1 GLU A 21 3.475 -13.337 -6.281 1.00 0.00 O ATOM 302 OE2 GLU A 21 3.296 -15.037 -4.929 1.00 0.00 O ATOM 0 H GLU A 21 3.325 -10.174 -3.404 1.00 0.00 H new ATOM 0 HA GLU A 21 4.928 -11.851 -1.604 1.00 0.00 H new ATOM 0 HB2 GLU A 21 5.014 -11.802 -4.621 1.00 0.00 H new ATOM 0 HB3 GLU A 21 5.393 -13.131 -3.543 1.00 0.00 H new ATOM 0 HG2 GLU A 21 3.002 -13.429 -3.060 1.00 0.00 H new ATOM 0 HG3 GLU A 21 2.615 -12.089 -4.121 1.00 0.00 H new ATOM 309 N GLN A 22 6.944 -10.297 -1.860 1.00 0.00 N ATOM 310 CA GLN A 22 8.190 -9.597 -2.030 1.00 0.00 C ATOM 311 C GLN A 22 9.200 -10.615 -2.486 1.00 0.00 C ATOM 312 O GLN A 22 9.712 -11.404 -1.681 1.00 0.00 O ATOM 313 CB GLN A 22 8.671 -8.961 -0.697 1.00 0.00 C ATOM 314 CG GLN A 22 7.655 -8.074 0.035 1.00 0.00 C ATOM 315 CD GLN A 22 6.471 -8.861 0.562 1.00 0.00 C ATOM 316 OE1 GLN A 22 6.593 -10.060 0.894 1.00 0.00 O ATOM 317 NE2 GLN A 22 5.327 -8.248 0.599 1.00 0.00 N ATOM 0 H GLN A 22 6.773 -10.616 -0.906 1.00 0.00 H new ATOM 0 HA GLN A 22 8.067 -8.789 -2.752 1.00 0.00 H new ATOM 0 HB2 GLN A 22 8.973 -9.763 -0.024 1.00 0.00 H new ATOM 0 HB3 GLN A 22 9.560 -8.365 -0.903 1.00 0.00 H new ATOM 0 HG2 GLN A 22 8.150 -7.569 0.865 1.00 0.00 H new ATOM 0 HG3 GLN A 22 7.299 -7.299 -0.644 1.00 0.00 H new ATOM 0 HE21 GLN A 22 5.264 -7.269 0.321 1.00 0.00 H new ATOM 0 HE22 GLN A 22 4.491 -8.746 0.906 1.00 0.00 H new ATOM 326 N LYS A 23 9.444 -10.632 -3.760 1.00 0.00 N ATOM 327 CA LYS A 23 10.256 -11.635 -4.356 1.00 0.00 C ATOM 328 C LYS A 23 11.286 -11.034 -5.298 1.00 0.00 C ATOM 329 O LYS A 23 10.976 -10.547 -6.393 1.00 0.00 O ATOM 330 CB LYS A 23 9.368 -12.699 -5.045 1.00 0.00 C ATOM 331 CG LYS A 23 8.401 -12.139 -6.089 1.00 0.00 C ATOM 332 CD LYS A 23 7.420 -13.187 -6.565 1.00 0.00 C ATOM 333 CE LYS A 23 6.521 -12.630 -7.649 1.00 0.00 C ATOM 334 NZ LYS A 23 5.445 -13.573 -8.033 1.00 0.00 N ATOM 0 H LYS A 23 9.080 -9.942 -4.417 1.00 0.00 H new ATOM 0 HA LYS A 23 10.823 -12.137 -3.572 1.00 0.00 H new ATOM 0 HB2 LYS A 23 10.012 -13.437 -5.524 1.00 0.00 H new ATOM 0 HB3 LYS A 23 8.794 -13.224 -4.282 1.00 0.00 H new ATOM 0 HG2 LYS A 23 7.855 -11.297 -5.664 1.00 0.00 H new ATOM 0 HG3 LYS A 23 8.966 -11.757 -6.939 1.00 0.00 H new ATOM 0 HD2 LYS A 23 7.962 -14.053 -6.945 1.00 0.00 H new ATOM 0 HD3 LYS A 23 6.815 -13.533 -5.727 1.00 0.00 H new ATOM 0 HE2 LYS A 23 6.076 -11.697 -7.304 1.00 0.00 H new ATOM 0 HE3 LYS A 23 7.121 -12.391 -8.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 4.953 -13.214 -8.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 5.858 -14.504 -8.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 4.767 -13.664 -7.250 1.00 0.00 H new ATOM 348 N GLU A 24 12.517 -11.089 -4.862 1.00 0.00 N ATOM 349 CA GLU A 24 13.667 -10.600 -5.604 1.00 0.00 C ATOM 350 C GLU A 24 13.930 -11.503 -6.831 1.00 0.00 C ATOM 351 O GLU A 24 14.692 -11.151 -7.741 1.00 0.00 O ATOM 352 CB GLU A 24 14.853 -10.596 -4.646 1.00 0.00 C ATOM 353 CG GLU A 24 16.168 -10.124 -5.204 1.00 0.00 C ATOM 354 CD GLU A 24 17.239 -10.148 -4.160 1.00 0.00 C ATOM 355 OE1 GLU A 24 17.604 -11.238 -3.691 1.00 0.00 O ATOM 356 OE2 GLU A 24 17.742 -9.077 -3.784 1.00 0.00 O ATOM 0 H GLU A 24 12.763 -11.486 -3.955 1.00 0.00 H new ATOM 0 HA GLU A 24 13.495 -9.593 -5.983 1.00 0.00 H new ATOM 0 HB2 GLU A 24 14.600 -9.967 -3.793 1.00 0.00 H new ATOM 0 HB3 GLU A 24 14.988 -11.609 -4.266 1.00 0.00 H new ATOM 0 HG2 GLU A 24 16.459 -10.758 -6.042 1.00 0.00 H new ATOM 0 HG3 GLU A 24 16.059 -9.112 -5.593 1.00 0.00 H new ATOM 363 N SER A 25 13.244 -12.637 -6.852 1.00 0.00 N ATOM 364 CA SER A 25 13.304 -13.639 -7.897 1.00 0.00 C ATOM 365 C SER A 25 12.900 -13.072 -9.278 1.00 0.00 C ATOM 366 O SER A 25 13.172 -13.703 -10.306 1.00 0.00 O ATOM 367 CB SER A 25 12.350 -14.749 -7.502 1.00 0.00 C ATOM 368 OG SER A 25 12.499 -15.028 -6.118 1.00 0.00 O ATOM 0 H SER A 25 12.601 -12.892 -6.103 1.00 0.00 H new ATOM 0 HA SER A 25 14.329 -13.997 -7.995 1.00 0.00 H new ATOM 0 HB2 SER A 25 11.323 -14.454 -7.716 1.00 0.00 H new ATOM 0 HB3 SER A 25 12.554 -15.645 -8.089 1.00 0.00 H new ATOM 0 HG SER A 25 11.882 -15.744 -5.860 1.00 0.00 H new ATOM 374 N ASN A 26 12.230 -11.895 -9.277 1.00 0.00 N ATOM 375 CA ASN A 26 11.806 -11.184 -10.501 1.00 0.00 C ATOM 376 C ASN A 26 10.605 -11.842 -11.167 1.00 0.00 C ATOM 377 O ASN A 26 10.669 -12.996 -11.604 1.00 0.00 O ATOM 378 CB ASN A 26 12.980 -11.010 -11.508 1.00 0.00 C ATOM 379 CG ASN A 26 12.551 -10.441 -12.852 1.00 0.00 C ATOM 380 OD1 ASN A 26 12.208 -11.177 -13.777 1.00 0.00 O ATOM 381 ND2 ASN A 26 12.611 -9.154 -12.992 1.00 0.00 N ATOM 0 H ASN A 26 11.968 -11.411 -8.418 1.00 0.00 H new ATOM 0 HA ASN A 26 11.493 -10.190 -10.183 1.00 0.00 H new ATOM 0 HB2 ASN A 26 13.731 -10.353 -11.068 1.00 0.00 H new ATOM 0 HB3 ASN A 26 13.457 -11.977 -11.668 1.00 0.00 H new ATOM 0 HD21 ASN A 26 12.371 -8.727 -13.886 1.00 0.00 H new ATOM 0 HD22 ASN A 26 12.899 -8.569 -12.208 1.00 0.00 H new ATOM 388 N GLY A 27 9.503 -11.130 -11.218 1.00 0.00 N ATOM 389 CA GLY A 27 8.345 -11.643 -11.873 1.00 0.00 C ATOM 390 C GLY A 27 7.124 -10.914 -11.428 1.00 0.00 C ATOM 391 O GLY A 27 7.206 -10.120 -10.483 1.00 0.00 O ATOM 0 H GLY A 27 9.394 -10.200 -10.813 1.00 0.00 H new ATOM 0 HA2 GLY A 27 8.459 -11.547 -12.953 1.00 0.00 H new ATOM 0 HA3 GLY A 27 8.239 -12.706 -11.657 1.00 0.00 H new ATOM 395 N PRO A 28 5.985 -11.123 -12.093 1.00 0.00 N ATOM 396 CA PRO A 28 4.732 -10.501 -11.709 1.00 0.00 C ATOM 397 C PRO A 28 4.312 -10.944 -10.324 1.00 0.00 C ATOM 398 O PRO A 28 4.219 -12.150 -10.034 1.00 0.00 O ATOM 399 CB PRO A 28 3.734 -11.022 -12.756 1.00 0.00 C ATOM 400 CG PRO A 28 4.576 -11.435 -13.901 1.00 0.00 C ATOM 401 CD PRO A 28 5.832 -11.965 -13.291 1.00 0.00 C ATOM 0 HA PRO A 28 4.796 -9.413 -11.678 1.00 0.00 H new ATOM 0 HB2 PRO A 28 3.154 -11.859 -12.368 1.00 0.00 H new ATOM 0 HB3 PRO A 28 3.023 -10.248 -13.045 1.00 0.00 H new ATOM 0 HG2 PRO A 28 4.078 -12.196 -14.502 1.00 0.00 H new ATOM 0 HG3 PRO A 28 4.784 -10.593 -14.561 1.00 0.00 H new ATOM 0 HD2 PRO A 28 5.745 -13.021 -13.036 1.00 0.00 H new ATOM 0 HD3 PRO A 28 6.683 -11.869 -13.966 1.00 0.00 H new ATOM 409 N VAL A 29 4.108 -9.991 -9.459 1.00 0.00 N ATOM 410 CA VAL A 29 3.653 -10.282 -8.139 1.00 0.00 C ATOM 411 C VAL A 29 2.141 -10.621 -8.187 1.00 0.00 C ATOM 412 O VAL A 29 1.324 -9.847 -8.700 1.00 0.00 O ATOM 413 CB VAL A 29 3.977 -9.093 -7.173 1.00 0.00 C ATOM 414 CG1 VAL A 29 3.199 -7.828 -7.475 1.00 0.00 C ATOM 415 CG2 VAL A 29 3.837 -9.489 -5.743 1.00 0.00 C ATOM 0 H VAL A 29 4.252 -9.000 -9.651 1.00 0.00 H new ATOM 0 HA VAL A 29 4.178 -11.151 -7.743 1.00 0.00 H new ATOM 0 HB VAL A 29 5.023 -8.848 -7.357 1.00 0.00 H new ATOM 0 HG11 VAL A 29 3.478 -7.051 -6.764 1.00 0.00 H new ATOM 0 HG12 VAL A 29 3.428 -7.493 -8.487 1.00 0.00 H new ATOM 0 HG13 VAL A 29 2.131 -8.029 -7.392 1.00 0.00 H new ATOM 0 HG21 VAL A 29 4.070 -8.637 -5.105 1.00 0.00 H new ATOM 0 HG22 VAL A 29 2.814 -9.815 -5.554 1.00 0.00 H new ATOM 0 HG23 VAL A 29 4.524 -10.306 -5.523 1.00 0.00 H new ATOM 425 N LYS A 30 1.795 -11.804 -7.733 1.00 0.00 N ATOM 426 CA LYS A 30 0.426 -12.265 -7.781 1.00 0.00 C ATOM 427 C LYS A 30 -0.272 -11.859 -6.522 1.00 0.00 C ATOM 428 O LYS A 30 -0.140 -12.518 -5.470 1.00 0.00 O ATOM 429 CB LYS A 30 0.354 -13.773 -7.992 1.00 0.00 C ATOM 430 CG LYS A 30 0.976 -14.224 -9.297 1.00 0.00 C ATOM 431 CD LYS A 30 0.891 -15.724 -9.459 1.00 0.00 C ATOM 432 CE LYS A 30 1.508 -16.171 -10.770 1.00 0.00 C ATOM 433 NZ LYS A 30 0.807 -15.614 -11.942 1.00 0.00 N ATOM 0 H LYS A 30 2.450 -12.470 -7.323 1.00 0.00 H new ATOM 0 HA LYS A 30 -0.075 -11.804 -8.632 1.00 0.00 H new ATOM 0 HB2 LYS A 30 0.858 -14.273 -7.165 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -0.689 -14.087 -7.967 1.00 0.00 H new ATOM 0 HG2 LYS A 30 0.470 -13.737 -10.131 1.00 0.00 H new ATOM 0 HG3 LYS A 30 2.020 -13.911 -9.332 1.00 0.00 H new ATOM 0 HD2 LYS A 30 1.402 -16.211 -8.629 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -0.152 -16.038 -9.419 1.00 0.00 H new ATOM 0 HE2 LYS A 30 2.554 -15.867 -10.798 1.00 0.00 H new ATOM 0 HE3 LYS A 30 1.491 -17.260 -10.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 1.104 -16.124 -12.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -0.220 -15.719 -11.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 1.042 -14.606 -12.040 1.00 0.00 H new ATOM 447 N VAL A 31 -0.985 -10.769 -6.601 1.00 0.00 N ATOM 448 CA VAL A 31 -1.554 -10.171 -5.447 1.00 0.00 C ATOM 449 C VAL A 31 -3.063 -10.038 -5.567 1.00 0.00 C ATOM 450 O VAL A 31 -3.584 -9.630 -6.597 1.00 0.00 O ATOM 451 CB VAL A 31 -0.893 -8.787 -5.171 1.00 0.00 C ATOM 452 CG1 VAL A 31 0.584 -8.947 -5.002 1.00 0.00 C ATOM 453 CG2 VAL A 31 -1.173 -7.775 -6.279 1.00 0.00 C ATOM 0 H VAL A 31 -1.182 -10.278 -7.473 1.00 0.00 H new ATOM 0 HA VAL A 31 -1.355 -10.827 -4.600 1.00 0.00 H new ATOM 0 HB VAL A 31 -1.335 -8.401 -4.253 1.00 0.00 H new ATOM 0 HG11 VAL A 31 1.036 -7.974 -4.810 1.00 0.00 H new ATOM 0 HG12 VAL A 31 0.784 -9.612 -4.162 1.00 0.00 H new ATOM 0 HG13 VAL A 31 1.010 -9.372 -5.911 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -0.690 -6.828 -6.037 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -0.781 -8.152 -7.224 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -2.248 -7.621 -6.368 1.00 0.00 H new ATOM 463 N TRP A 32 -3.750 -10.427 -4.532 1.00 0.00 N ATOM 464 CA TRP A 32 -5.184 -10.309 -4.489 1.00 0.00 C ATOM 465 C TRP A 32 -5.648 -9.769 -3.178 1.00 0.00 C ATOM 466 O TRP A 32 -5.080 -10.095 -2.130 1.00 0.00 O ATOM 467 CB TRP A 32 -5.910 -11.614 -4.832 1.00 0.00 C ATOM 468 CG TRP A 32 -6.047 -11.838 -6.308 1.00 0.00 C ATOM 469 CD1 TRP A 32 -6.947 -11.229 -7.139 1.00 0.00 C ATOM 470 CD2 TRP A 32 -5.278 -12.718 -7.130 1.00 0.00 C ATOM 471 NE1 TRP A 32 -6.781 -11.674 -8.420 1.00 0.00 N ATOM 472 CE2 TRP A 32 -5.770 -12.589 -8.445 1.00 0.00 C ATOM 473 CE3 TRP A 32 -4.225 -13.602 -6.886 1.00 0.00 C ATOM 474 CZ2 TRP A 32 -5.245 -13.306 -9.505 1.00 0.00 C ATOM 475 CZ3 TRP A 32 -3.707 -14.314 -7.945 1.00 0.00 C ATOM 476 CH2 TRP A 32 -4.220 -14.162 -9.238 1.00 0.00 C ATOM 0 H TRP A 32 -3.335 -10.835 -3.694 1.00 0.00 H new ATOM 0 HA TRP A 32 -5.448 -9.595 -5.269 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -5.368 -12.451 -4.392 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -6.901 -11.602 -4.378 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -7.682 -10.502 -6.828 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -7.325 -11.371 -9.227 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -3.826 -13.725 -5.890 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -5.633 -13.191 -10.506 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -2.891 -15.001 -7.775 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -3.792 -14.738 -10.045 1.00 0.00 H new ATOM 487 N GLY A 33 -6.594 -8.875 -3.242 1.00 0.00 N ATOM 488 CA GLY A 33 -7.204 -8.389 -2.050 1.00 0.00 C ATOM 489 C GLY A 33 -8.517 -7.737 -2.325 1.00 0.00 C ATOM 490 O GLY A 33 -8.678 -7.057 -3.333 1.00 0.00 O ATOM 0 H GLY A 33 -6.955 -8.473 -4.107 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -7.347 -9.214 -1.353 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -6.538 -7.675 -1.566 1.00 0.00 H new ATOM 494 N SER A 34 -9.446 -7.971 -1.456 1.00 0.00 N ATOM 495 CA SER A 34 -10.766 -7.478 -1.563 1.00 0.00 C ATOM 496 C SER A 34 -11.039 -6.511 -0.436 1.00 0.00 C ATOM 497 O SER A 34 -10.812 -6.854 0.720 1.00 0.00 O ATOM 498 CB SER A 34 -11.664 -8.686 -1.512 1.00 0.00 C ATOM 499 OG SER A 34 -11.274 -9.547 -0.439 1.00 0.00 O ATOM 0 H SER A 34 -9.292 -8.535 -0.620 1.00 0.00 H new ATOM 0 HA SER A 34 -10.936 -6.926 -2.488 1.00 0.00 H new ATOM 0 HB2 SER A 34 -12.699 -8.373 -1.379 1.00 0.00 H new ATOM 0 HB3 SER A 34 -11.614 -9.226 -2.458 1.00 0.00 H new ATOM 0 HG SER A 34 -11.089 -9.011 0.360 1.00 0.00 H new ATOM 505 N ILE A 35 -11.477 -5.312 -0.745 1.00 0.00 N ATOM 506 CA ILE A 35 -11.787 -4.350 0.292 1.00 0.00 C ATOM 507 C ILE A 35 -13.205 -3.850 0.089 1.00 0.00 C ATOM 508 O ILE A 35 -13.668 -3.717 -1.050 1.00 0.00 O ATOM 509 CB ILE A 35 -10.820 -3.087 0.336 1.00 0.00 C ATOM 510 CG1 ILE A 35 -9.327 -3.457 0.323 1.00 0.00 C ATOM 511 CG2 ILE A 35 -11.102 -2.205 1.554 1.00 0.00 C ATOM 512 CD1 ILE A 35 -8.777 -3.753 -1.038 1.00 0.00 C ATOM 0 H ILE A 35 -11.626 -4.980 -1.698 1.00 0.00 H new ATOM 0 HA ILE A 35 -11.657 -4.877 1.237 1.00 0.00 H new ATOM 0 HB ILE A 35 -11.035 -2.536 -0.579 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -8.758 -2.637 0.762 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -9.175 -4.328 0.961 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -10.423 -1.352 1.551 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -12.131 -1.849 1.515 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -10.953 -2.784 2.465 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -7.720 -4.004 -0.956 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -9.317 -4.593 -1.474 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -8.893 -2.877 -1.676 1.00 0.00 H new ATOM 524 N LYS A 36 -13.882 -3.638 1.164 1.00 0.00 N ATOM 525 CA LYS A 36 -15.161 -3.037 1.186 1.00 0.00 C ATOM 526 C LYS A 36 -15.000 -1.737 1.953 1.00 0.00 C ATOM 527 O LYS A 36 -14.355 -1.719 3.010 1.00 0.00 O ATOM 528 CB LYS A 36 -16.207 -3.979 1.781 1.00 0.00 C ATOM 529 CG LYS A 36 -15.874 -4.529 3.154 1.00 0.00 C ATOM 530 CD LYS A 36 -17.007 -5.371 3.716 1.00 0.00 C ATOM 531 CE LYS A 36 -17.237 -6.617 2.885 1.00 0.00 C ATOM 532 NZ LYS A 36 -18.356 -7.422 3.390 1.00 0.00 N ATOM 0 H LYS A 36 -13.540 -3.892 2.091 1.00 0.00 H new ATOM 0 HA LYS A 36 -15.533 -2.826 0.184 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -17.158 -3.449 1.840 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -16.350 -4.816 1.097 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -14.968 -5.133 3.094 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -15.663 -3.704 3.834 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -16.776 -5.655 4.743 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -17.922 -4.779 3.747 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -17.435 -6.331 1.852 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -16.330 -7.221 2.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -18.476 -8.264 2.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -18.158 -7.718 4.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -19.228 -6.856 3.370 1.00 0.00 H new ATOM 546 N GLY A 37 -15.536 -0.690 1.416 1.00 0.00 N ATOM 547 CA GLY A 37 -15.216 0.623 1.863 1.00 0.00 C ATOM 548 C GLY A 37 -16.209 1.606 1.344 1.00 0.00 C ATOM 549 O GLY A 37 -17.119 1.217 0.576 1.00 0.00 O ATOM 0 H GLY A 37 -16.211 -0.723 0.652 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -15.204 0.650 2.953 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -14.216 0.895 1.526 1.00 0.00 H new ATOM 553 N LEU A 38 -16.070 2.850 1.760 1.00 0.00 N ATOM 554 CA LEU A 38 -16.991 3.922 1.378 1.00 0.00 C ATOM 555 C LEU A 38 -16.821 4.140 -0.123 1.00 0.00 C ATOM 556 O LEU A 38 -15.719 4.014 -0.644 1.00 0.00 O ATOM 557 CB LEU A 38 -16.621 5.193 2.144 1.00 0.00 C ATOM 558 CG LEU A 38 -16.553 5.057 3.673 1.00 0.00 C ATOM 559 CD1 LEU A 38 -16.108 6.358 4.313 1.00 0.00 C ATOM 560 CD2 LEU A 38 -17.893 4.610 4.242 1.00 0.00 C ATOM 0 H LEU A 38 -15.315 3.154 2.375 1.00 0.00 H new ATOM 0 HA LEU A 38 -18.025 3.668 1.611 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -15.652 5.541 1.786 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -17.348 5.967 1.899 1.00 0.00 H new ATOM 0 HG LEU A 38 -15.813 4.291 3.907 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -16.068 6.236 5.395 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -15.119 6.627 3.941 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -16.817 7.148 4.063 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -17.817 4.522 5.326 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -18.658 5.344 3.991 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -18.164 3.643 3.817 1.00 0.00 H new ATOM 572 N THR A 39 -17.890 4.445 -0.831 1.00 0.00 N ATOM 573 CA THR A 39 -17.813 4.297 -2.241 1.00 0.00 C ATOM 574 C THR A 39 -17.275 5.500 -2.999 1.00 0.00 C ATOM 575 O THR A 39 -18.002 6.399 -3.354 1.00 0.00 O ATOM 576 CB THR A 39 -19.228 4.013 -2.703 1.00 0.00 C ATOM 577 OG1 THR A 39 -20.083 5.083 -2.258 1.00 0.00 O ATOM 578 CG2 THR A 39 -19.718 2.779 -2.048 1.00 0.00 C ATOM 0 H THR A 39 -18.779 4.781 -0.460 1.00 0.00 H new ATOM 0 HA THR A 39 -17.100 3.501 -2.454 1.00 0.00 H new ATOM 0 HB THR A 39 -19.237 3.913 -3.788 1.00 0.00 H new ATOM 0 HG1 THR A 39 -19.662 5.944 -2.462 1.00 0.00 H new ATOM 0 HG21 THR A 39 -20.736 2.571 -2.378 1.00 0.00 H new ATOM 0 HG22 THR A 39 -19.072 1.943 -2.317 1.00 0.00 H new ATOM 0 HG23 THR A 39 -19.707 2.912 -0.966 1.00 0.00 H new ATOM 586 N GLU A 40 -16.069 5.343 -3.396 1.00 0.00 N ATOM 587 CA GLU A 40 -15.254 6.238 -4.214 1.00 0.00 C ATOM 588 C GLU A 40 -14.057 5.430 -4.457 1.00 0.00 C ATOM 589 O GLU A 40 -13.641 4.746 -3.558 1.00 0.00 O ATOM 590 CB GLU A 40 -14.757 7.554 -3.534 1.00 0.00 C ATOM 591 CG GLU A 40 -15.781 8.641 -3.219 1.00 0.00 C ATOM 592 CD GLU A 40 -16.298 8.600 -1.805 1.00 0.00 C ATOM 593 OE1 GLU A 40 -15.489 8.728 -0.860 1.00 0.00 O ATOM 594 OE2 GLU A 40 -17.535 8.559 -1.592 1.00 0.00 O ATOM 0 H GLU A 40 -15.549 4.503 -3.143 1.00 0.00 H new ATOM 0 HA GLU A 40 -15.848 6.569 -5.066 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -14.266 7.280 -2.600 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -13.995 7.993 -4.178 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -15.330 9.616 -3.402 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -16.622 8.545 -3.906 1.00 0.00 H new ATOM 601 N GLY A 41 -13.484 5.442 -5.574 1.00 0.00 N ATOM 602 CA GLY A 41 -12.309 4.633 -5.657 1.00 0.00 C ATOM 603 C GLY A 41 -11.736 4.539 -6.991 1.00 0.00 C ATOM 604 O GLY A 41 -12.361 3.975 -7.880 1.00 0.00 O ATOM 0 H GLY A 41 -13.764 5.957 -6.409 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -11.557 5.036 -4.979 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -12.548 3.629 -5.306 1.00 0.00 H new ATOM 608 N LEU A 42 -10.523 5.048 -7.137 1.00 0.00 N ATOM 609 CA LEU A 42 -9.857 5.026 -8.414 1.00 0.00 C ATOM 610 C LEU A 42 -8.349 4.774 -8.298 1.00 0.00 C ATOM 611 O LEU A 42 -7.788 4.049 -9.108 1.00 0.00 O ATOM 612 CB LEU A 42 -10.094 6.313 -9.215 1.00 0.00 C ATOM 613 CG LEU A 42 -11.526 6.609 -9.672 1.00 0.00 C ATOM 614 CD1 LEU A 42 -11.595 7.983 -10.316 1.00 0.00 C ATOM 615 CD2 LEU A 42 -12.003 5.556 -10.666 1.00 0.00 C ATOM 0 H LEU A 42 -9.987 5.479 -6.384 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.303 4.187 -8.949 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -9.754 7.153 -8.610 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -9.459 6.280 -10.100 1.00 0.00 H new ATOM 0 HG LEU A 42 -12.175 6.586 -8.797 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -12.617 8.183 -10.637 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -11.287 8.739 -9.594 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -10.931 8.014 -11.180 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -13.022 5.785 -10.978 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.348 5.555 -11.538 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -11.980 4.574 -10.194 1.00 0.00 H new ATOM 627 N HIS A 43 -7.680 5.358 -7.303 1.00 0.00 N ATOM 628 CA HIS A 43 -6.215 5.247 -7.243 1.00 0.00 C ATOM 629 C HIS A 43 -5.692 4.710 -5.915 1.00 0.00 C ATOM 630 O HIS A 43 -6.185 5.058 -4.849 1.00 0.00 O ATOM 631 CB HIS A 43 -5.512 6.577 -7.609 1.00 0.00 C ATOM 632 CG HIS A 43 -5.508 6.911 -9.086 1.00 0.00 C ATOM 633 ND1 HIS A 43 -5.345 8.193 -9.583 1.00 0.00 N ATOM 634 CD2 HIS A 43 -5.573 6.108 -10.176 1.00 0.00 C ATOM 635 CE1 HIS A 43 -5.310 8.153 -10.898 1.00 0.00 C ATOM 636 NE2 HIS A 43 -5.445 6.904 -11.282 1.00 0.00 N ATOM 0 H HIS A 43 -8.107 5.896 -6.549 1.00 0.00 H new ATOM 0 HA HIS A 43 -5.961 4.505 -8.000 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -5.999 7.389 -7.069 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -4.481 6.534 -7.258 1.00 0.00 H new ATOM 0 HD1 HIS A 43 -5.264 9.038 -9.017 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -5.702 5.036 -10.172 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -5.190 9.004 -11.552 1.00 0.00 H new ATOM 645 N GLY A 44 -4.667 3.889 -6.008 1.00 0.00 N ATOM 646 CA GLY A 44 -4.064 3.271 -4.855 1.00 0.00 C ATOM 647 C GLY A 44 -2.743 3.906 -4.510 1.00 0.00 C ATOM 648 O GLY A 44 -1.687 3.445 -4.934 1.00 0.00 O ATOM 0 H GLY A 44 -4.229 3.633 -6.893 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -4.740 3.352 -4.004 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -3.918 2.208 -5.047 1.00 0.00 H new ATOM 652 N PHE A 45 -2.787 4.936 -3.705 1.00 0.00 N ATOM 653 CA PHE A 45 -1.591 5.674 -3.369 1.00 0.00 C ATOM 654 C PHE A 45 -0.909 5.122 -2.111 1.00 0.00 C ATOM 655 O PHE A 45 -0.956 5.766 -0.923 1.00 0.00 O ATOM 656 CB PHE A 45 -1.956 7.152 -3.206 1.00 0.00 C ATOM 657 CG PHE A 45 -3.352 7.396 -2.641 1.00 0.00 C ATOM 658 CD1 PHE A 45 -3.714 6.934 -1.385 1.00 0.00 C ATOM 659 CD2 PHE A 45 -4.288 8.103 -3.373 1.00 0.00 C ATOM 660 CE1 PHE A 45 -4.967 7.173 -0.876 1.00 0.00 C ATOM 661 CE2 PHE A 45 -5.548 8.339 -2.862 1.00 0.00 C ATOM 662 CZ PHE A 45 -5.881 7.872 -1.608 1.00 0.00 C ATOM 0 H PHE A 45 -3.639 5.286 -3.267 1.00 0.00 H new ATOM 0 HA PHE A 45 -0.868 5.564 -4.177 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -1.224 7.625 -2.551 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.879 7.642 -4.176 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -2.999 6.377 -0.797 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -4.031 8.474 -4.354 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -5.229 6.807 0.106 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -6.273 8.889 -3.444 1.00 0.00 H new ATOM 0 HZ PHE A 45 -6.865 8.060 -1.206 1.00 0.00 H new ATOM 672 N HIS A 46 -0.113 4.124 -2.340 1.00 0.00 N ATOM 673 CA HIS A 46 0.487 3.358 -1.359 1.00 0.00 C ATOM 674 C HIS A 46 1.882 3.832 -1.199 1.00 0.00 C ATOM 675 O HIS A 46 2.622 3.747 -2.104 1.00 0.00 O ATOM 676 CB HIS A 46 0.353 1.832 -1.748 1.00 0.00 C ATOM 677 CG HIS A 46 0.946 1.329 -3.078 1.00 0.00 C ATOM 678 ND1 HIS A 46 2.033 0.489 -3.148 1.00 0.00 N ATOM 679 CD2 HIS A 46 0.470 1.401 -4.353 1.00 0.00 C ATOM 680 CE1 HIS A 46 2.182 0.058 -4.382 1.00 0.00 C ATOM 681 NE2 HIS A 46 1.254 0.595 -5.131 1.00 0.00 N ATOM 0 H HIS A 46 0.133 3.826 -3.284 1.00 0.00 H new ATOM 0 HA HIS A 46 0.003 3.463 -0.388 1.00 0.00 H new ATOM 0 HB2 HIS A 46 0.810 1.250 -0.947 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -0.710 1.589 -1.753 1.00 0.00 H new ATOM 0 HD1 HIS A 46 2.633 0.238 -2.362 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -0.373 1.988 -4.688 1.00 0.00 H new ATOM 0 HE1 HIS A 46 2.945 -0.627 -4.721 1.00 0.00 H new ATOM 690 N VAL A 47 2.164 4.410 -0.031 1.00 0.00 N ATOM 691 CA VAL A 47 3.481 4.985 0.344 1.00 0.00 C ATOM 692 C VAL A 47 3.505 5.202 1.880 1.00 0.00 C ATOM 693 O VAL A 47 2.995 6.228 2.362 1.00 0.00 O ATOM 694 CB VAL A 47 3.801 6.424 -0.280 1.00 0.00 C ATOM 695 CG1 VAL A 47 5.195 6.896 0.121 1.00 0.00 C ATOM 696 CG2 VAL A 47 3.657 6.510 -1.790 1.00 0.00 C ATOM 0 H VAL A 47 1.470 4.500 0.711 1.00 0.00 H new ATOM 0 HA VAL A 47 4.214 4.273 -0.036 1.00 0.00 H new ATOM 0 HB VAL A 47 3.039 7.080 0.140 1.00 0.00 H new ATOM 0 HG11 VAL A 47 5.387 7.876 -0.316 1.00 0.00 H new ATOM 0 HG12 VAL A 47 5.258 6.965 1.207 1.00 0.00 H new ATOM 0 HG13 VAL A 47 5.938 6.185 -0.241 1.00 0.00 H new ATOM 0 HG21 VAL A 47 3.894 7.521 -2.121 1.00 0.00 H new ATOM 0 HG22 VAL A 47 4.341 5.804 -2.261 1.00 0.00 H new ATOM 0 HG23 VAL A 47 2.633 6.266 -2.072 1.00 0.00 H new ATOM 706 N HIS A 48 3.904 4.192 2.618 1.00 0.00 N ATOM 707 CA HIS A 48 4.315 4.303 4.022 1.00 0.00 C ATOM 708 C HIS A 48 5.374 3.268 4.310 1.00 0.00 C ATOM 709 O HIS A 48 5.614 2.371 3.489 1.00 0.00 O ATOM 710 CB HIS A 48 3.158 4.037 4.985 1.00 0.00 C ATOM 711 CG HIS A 48 2.453 5.224 5.529 1.00 0.00 C ATOM 712 ND1 HIS A 48 2.680 6.515 5.117 1.00 0.00 N ATOM 713 CD2 HIS A 48 1.517 5.304 6.496 1.00 0.00 C ATOM 714 CE1 HIS A 48 1.916 7.330 5.805 1.00 0.00 C ATOM 715 NE2 HIS A 48 1.197 6.620 6.652 1.00 0.00 N ATOM 0 H HIS A 48 3.958 3.239 2.260 1.00 0.00 H new ATOM 0 HA HIS A 48 4.679 5.320 4.170 1.00 0.00 H new ATOM 0 HB2 HIS A 48 2.426 3.413 4.472 1.00 0.00 H new ATOM 0 HB3 HIS A 48 3.541 3.456 5.824 1.00 0.00 H new ATOM 0 HD1 HIS A 48 3.339 6.796 4.391 1.00 0.00 H new ATOM 0 HD2 HIS A 48 1.097 4.476 7.047 1.00 0.00 H new ATOM 0 HE1 HIS A 48 1.882 8.404 5.696 1.00 0.00 H new ATOM 724 N GLU A 49 6.018 3.402 5.445 1.00 0.00 N ATOM 725 CA GLU A 49 6.911 2.402 5.941 1.00 0.00 C ATOM 726 C GLU A 49 7.169 2.697 7.394 1.00 0.00 C ATOM 727 O GLU A 49 6.796 3.781 7.863 1.00 0.00 O ATOM 728 CB GLU A 49 8.226 2.278 5.128 1.00 0.00 C ATOM 729 CG GLU A 49 9.407 3.155 5.551 1.00 0.00 C ATOM 730 CD GLU A 49 9.157 4.623 5.512 1.00 0.00 C ATOM 731 OE1 GLU A 49 8.841 5.138 4.451 1.00 0.00 O ATOM 732 OE2 GLU A 49 9.326 5.284 6.556 1.00 0.00 O ATOM 0 H GLU A 49 5.931 4.219 6.050 1.00 0.00 H new ATOM 0 HA GLU A 49 6.439 1.426 5.828 1.00 0.00 H new ATOM 0 HB2 GLU A 49 8.549 1.238 5.168 1.00 0.00 H new ATOM 0 HB3 GLU A 49 7.999 2.501 4.086 1.00 0.00 H new ATOM 0 HG2 GLU A 49 9.698 2.880 6.565 1.00 0.00 H new ATOM 0 HG3 GLU A 49 10.255 2.930 4.904 1.00 0.00 H new ATOM 739 N PHE A 50 7.711 1.731 8.085 1.00 0.00 N ATOM 740 CA PHE A 50 8.042 1.825 9.492 1.00 0.00 C ATOM 741 C PHE A 50 6.736 1.762 10.236 1.00 0.00 C ATOM 742 O PHE A 50 6.307 2.681 10.925 1.00 0.00 O ATOM 743 CB PHE A 50 8.897 3.085 9.822 1.00 0.00 C ATOM 744 CG PHE A 50 9.427 3.148 11.228 1.00 0.00 C ATOM 745 CD1 PHE A 50 10.489 2.356 11.609 1.00 0.00 C ATOM 746 CD2 PHE A 50 8.865 3.998 12.161 1.00 0.00 C ATOM 747 CE1 PHE A 50 10.981 2.410 12.895 1.00 0.00 C ATOM 748 CE2 PHE A 50 9.356 4.054 13.445 1.00 0.00 C ATOM 749 CZ PHE A 50 10.412 3.260 13.813 1.00 0.00 C ATOM 0 H PHE A 50 7.944 0.826 7.677 1.00 0.00 H new ATOM 0 HA PHE A 50 8.685 1.001 9.803 1.00 0.00 H new ATOM 0 HB2 PHE A 50 9.739 3.124 9.131 1.00 0.00 H new ATOM 0 HB3 PHE A 50 8.292 3.973 9.638 1.00 0.00 H new ATOM 0 HD1 PHE A 50 10.940 1.686 10.892 1.00 0.00 H new ATOM 0 HD2 PHE A 50 8.032 4.625 11.880 1.00 0.00 H new ATOM 0 HE1 PHE A 50 11.814 1.785 13.181 1.00 0.00 H new ATOM 0 HE2 PHE A 50 8.909 4.724 14.164 1.00 0.00 H new ATOM 0 HZ PHE A 50 10.796 3.303 14.822 1.00 0.00 H new ATOM 759 N GLY A 51 6.066 0.673 9.990 1.00 0.00 N ATOM 760 CA GLY A 51 4.767 0.469 10.525 1.00 0.00 C ATOM 761 C GLY A 51 4.820 -0.220 11.827 1.00 0.00 C ATOM 762 O GLY A 51 5.851 -0.796 12.191 1.00 0.00 O ATOM 0 H GLY A 51 6.412 -0.093 9.412 1.00 0.00 H new ATOM 0 HA2 GLY A 51 4.265 1.430 10.641 1.00 0.00 H new ATOM 0 HA3 GLY A 51 4.173 -0.119 9.825 1.00 0.00 H new ATOM 766 N ASP A 52 3.726 -0.199 12.514 1.00 0.00 N ATOM 767 CA ASP A 52 3.660 -0.785 13.848 1.00 0.00 C ATOM 768 C ASP A 52 2.259 -1.277 14.176 1.00 0.00 C ATOM 769 O ASP A 52 2.009 -2.475 14.187 1.00 0.00 O ATOM 770 CB ASP A 52 4.122 0.219 14.914 1.00 0.00 C ATOM 771 CG ASP A 52 4.291 -0.414 16.281 1.00 0.00 C ATOM 772 OD1 ASP A 52 3.308 -0.500 17.057 1.00 0.00 O ATOM 773 OD2 ASP A 52 5.429 -0.819 16.611 1.00 0.00 O ATOM 0 H ASP A 52 2.853 0.215 12.188 1.00 0.00 H new ATOM 0 HA ASP A 52 4.333 -1.642 13.854 1.00 0.00 H new ATOM 0 HB2 ASP A 52 5.068 0.662 14.604 1.00 0.00 H new ATOM 0 HB3 ASP A 52 3.397 1.030 14.981 1.00 0.00 H new ATOM 778 N ASN A 53 1.350 -0.351 14.412 1.00 0.00 N ATOM 779 CA ASN A 53 -0.020 -0.682 14.809 1.00 0.00 C ATOM 780 C ASN A 53 -0.937 -0.728 13.596 1.00 0.00 C ATOM 781 O ASN A 53 -1.006 0.222 12.829 1.00 0.00 O ATOM 782 CB ASN A 53 -0.526 0.335 15.849 1.00 0.00 C ATOM 783 CG ASN A 53 -1.966 0.119 16.289 1.00 0.00 C ATOM 784 OD1 ASN A 53 -2.492 -0.999 16.278 1.00 0.00 O ATOM 785 ND2 ASN A 53 -2.613 1.178 16.690 1.00 0.00 N ATOM 0 H ASN A 53 1.531 0.650 14.337 1.00 0.00 H new ATOM 0 HA ASN A 53 -0.025 -1.673 15.264 1.00 0.00 H new ATOM 0 HB2 ASN A 53 0.120 0.291 16.726 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -0.432 1.338 15.434 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -3.579 1.096 17.006 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -2.153 2.088 16.688 1.00 0.00 H new ATOM 792 N THR A 54 -1.674 -1.813 13.457 1.00 0.00 N ATOM 793 CA THR A 54 -2.517 -2.053 12.297 1.00 0.00 C ATOM 794 C THR A 54 -3.808 -1.202 12.348 1.00 0.00 C ATOM 795 O THR A 54 -4.622 -1.237 11.440 1.00 0.00 O ATOM 796 CB THR A 54 -2.856 -3.589 12.168 1.00 0.00 C ATOM 797 OG1 THR A 54 -3.159 -3.920 10.811 1.00 0.00 O ATOM 798 CG2 THR A 54 -4.040 -4.002 13.053 1.00 0.00 C ATOM 0 H THR A 54 -1.706 -2.560 14.151 1.00 0.00 H new ATOM 0 HA THR A 54 -1.961 -1.748 11.410 1.00 0.00 H new ATOM 0 HB THR A 54 -1.972 -4.132 12.503 1.00 0.00 H new ATOM 0 HG1 THR A 54 -4.103 -3.730 10.631 1.00 0.00 H new ATOM 0 HG21 THR A 54 -4.233 -5.067 12.928 1.00 0.00 H new ATOM 0 HG22 THR A 54 -3.803 -3.796 14.097 1.00 0.00 H new ATOM 0 HG23 THR A 54 -4.926 -3.436 12.763 1.00 0.00 H new ATOM 806 N ALA A 55 -3.973 -0.451 13.414 1.00 0.00 N ATOM 807 CA ALA A 55 -5.142 0.382 13.572 1.00 0.00 C ATOM 808 C ALA A 55 -4.822 1.847 13.309 1.00 0.00 C ATOM 809 O ALA A 55 -5.729 2.686 13.236 1.00 0.00 O ATOM 810 CB ALA A 55 -5.739 0.206 14.959 1.00 0.00 C ATOM 0 H ALA A 55 -3.309 -0.401 14.187 1.00 0.00 H new ATOM 0 HA ALA A 55 -5.878 0.066 12.833 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -6.619 0.841 15.060 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -6.025 -0.836 15.102 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.001 0.486 15.711 1.00 0.00 H new ATOM 816 N GLY A 56 -3.551 2.165 13.160 1.00 0.00 N ATOM 817 CA GLY A 56 -3.195 3.531 12.938 1.00 0.00 C ATOM 818 C GLY A 56 -1.720 3.719 12.717 1.00 0.00 C ATOM 819 O GLY A 56 -0.897 3.108 13.399 1.00 0.00 O ATOM 0 H GLY A 56 -2.773 1.506 13.189 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -3.739 3.907 12.071 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -3.509 4.127 13.795 1.00 0.00 H new ATOM 823 N CYS A 57 -1.380 4.545 11.762 1.00 0.00 N ATOM 824 CA CYS A 57 -0.009 4.810 11.457 1.00 0.00 C ATOM 825 C CYS A 57 0.498 6.007 12.227 1.00 0.00 C ATOM 826 O CYS A 57 0.372 7.147 11.765 1.00 0.00 O ATOM 827 CB CYS A 57 0.134 5.114 9.974 1.00 0.00 C ATOM 828 SG CYS A 57 -0.486 3.811 8.862 1.00 0.00 S ATOM 0 H CYS A 57 -2.048 5.049 11.178 1.00 0.00 H new ATOM 0 HA CYS A 57 0.570 3.928 11.733 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -0.396 6.041 9.755 1.00 0.00 H new ATOM 0 HB3 CYS A 57 1.187 5.289 9.754 1.00 0.00 H new ATOM 833 N THR A 58 0.993 5.764 13.416 1.00 0.00 N ATOM 834 CA THR A 58 1.683 6.779 14.165 1.00 0.00 C ATOM 835 C THR A 58 3.116 6.883 13.631 1.00 0.00 C ATOM 836 O THR A 58 3.550 7.925 13.139 1.00 0.00 O ATOM 837 CB THR A 58 1.711 6.423 15.670 1.00 0.00 C ATOM 838 OG1 THR A 58 0.369 6.163 16.125 1.00 0.00 O ATOM 839 CG2 THR A 58 2.313 7.561 16.491 1.00 0.00 C ATOM 0 H THR A 58 0.928 4.862 13.887 1.00 0.00 H new ATOM 0 HA THR A 58 1.164 7.731 14.051 1.00 0.00 H new ATOM 0 HB THR A 58 2.331 5.536 15.803 1.00 0.00 H new ATOM 0 HG1 THR A 58 0.385 5.936 17.078 1.00 0.00 H new ATOM 0 HG21 THR A 58 2.321 7.285 17.545 1.00 0.00 H new ATOM 0 HG22 THR A 58 3.334 7.750 16.158 1.00 0.00 H new ATOM 0 HG23 THR A 58 1.715 8.462 16.357 1.00 0.00 H new ATOM 847 N SER A 59 3.802 5.756 13.696 1.00 0.00 N ATOM 848 CA SER A 59 5.185 5.607 13.321 1.00 0.00 C ATOM 849 C SER A 59 5.395 5.826 11.815 1.00 0.00 C ATOM 850 O SER A 59 6.300 6.515 11.397 1.00 0.00 O ATOM 851 CB SER A 59 5.563 4.187 13.695 1.00 0.00 C ATOM 852 OG SER A 59 4.814 3.787 14.847 1.00 0.00 O ATOM 0 H SER A 59 3.386 4.885 14.027 1.00 0.00 H new ATOM 0 HA SER A 59 5.801 6.348 13.829 1.00 0.00 H new ATOM 0 HB2 SER A 59 5.360 3.513 12.863 1.00 0.00 H new ATOM 0 HB3 SER A 59 6.631 4.125 13.902 1.00 0.00 H new ATOM 0 HG SER A 59 5.054 2.869 15.091 1.00 0.00 H new ATOM 858 N ALA A 60 4.518 5.245 11.038 1.00 0.00 N ATOM 859 CA ALA A 60 4.542 5.283 9.611 1.00 0.00 C ATOM 860 C ALA A 60 4.040 6.595 9.063 1.00 0.00 C ATOM 861 O ALA A 60 4.138 6.780 7.885 1.00 0.00 O ATOM 862 CB ALA A 60 3.776 4.117 9.030 1.00 0.00 C ATOM 0 H ALA A 60 3.733 4.709 11.408 1.00 0.00 H new ATOM 0 HA ALA A 60 5.584 5.195 9.305 1.00 0.00 H new ATOM 0 HB1 ALA A 60 3.808 4.167 7.942 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.227 3.183 9.364 1.00 0.00 H new ATOM 0 HB3 ALA A 60 2.740 4.159 9.365 1.00 0.00 H new ATOM 868 N GLY A 61 3.529 7.478 9.981 1.00 0.00 N ATOM 869 CA GLY A 61 2.849 8.807 9.732 1.00 0.00 C ATOM 870 C GLY A 61 3.320 9.596 8.499 1.00 0.00 C ATOM 871 O GLY A 61 3.324 9.082 7.444 1.00 0.00 O ATOM 0 H GLY A 61 3.581 7.273 10.979 1.00 0.00 H new ATOM 0 HA2 GLY A 61 1.778 8.630 9.635 1.00 0.00 H new ATOM 0 HA3 GLY A 61 2.990 9.433 10.613 1.00 0.00 H new ATOM 875 N PRO A 62 3.497 10.908 8.554 1.00 0.00 N ATOM 876 CA PRO A 62 3.966 11.690 7.377 1.00 0.00 C ATOM 877 C PRO A 62 5.401 11.283 6.901 1.00 0.00 C ATOM 878 O PRO A 62 6.293 12.129 6.728 1.00 0.00 O ATOM 879 CB PRO A 62 3.973 13.136 7.906 1.00 0.00 C ATOM 880 CG PRO A 62 3.090 13.104 9.100 1.00 0.00 C ATOM 881 CD PRO A 62 3.283 11.748 9.707 1.00 0.00 C ATOM 0 HA PRO A 62 3.330 11.529 6.506 1.00 0.00 H new ATOM 0 HB2 PRO A 62 4.981 13.457 8.167 1.00 0.00 H new ATOM 0 HB3 PRO A 62 3.600 13.834 7.156 1.00 0.00 H new ATOM 0 HG2 PRO A 62 3.356 13.891 9.806 1.00 0.00 H new ATOM 0 HG3 PRO A 62 2.048 13.264 8.822 1.00 0.00 H new ATOM 0 HD2 PRO A 62 4.135 11.727 10.386 1.00 0.00 H new ATOM 0 HD3 PRO A 62 2.411 11.434 10.280 1.00 0.00 H new ATOM 889 N HIS A 63 5.581 10.001 6.660 1.00 0.00 N ATOM 890 CA HIS A 63 6.786 9.441 6.140 1.00 0.00 C ATOM 891 C HIS A 63 6.706 9.327 4.661 1.00 0.00 C ATOM 892 O HIS A 63 5.880 8.564 4.133 1.00 0.00 O ATOM 893 CB HIS A 63 7.026 8.028 6.687 1.00 0.00 C ATOM 894 CG HIS A 63 7.601 7.945 8.052 1.00 0.00 C ATOM 895 ND1 HIS A 63 8.502 6.980 8.406 1.00 0.00 N ATOM 896 CD2 HIS A 63 7.381 8.676 9.160 1.00 0.00 C ATOM 897 CE1 HIS A 63 8.815 7.112 9.669 1.00 0.00 C ATOM 898 NE2 HIS A 63 8.144 8.138 10.161 1.00 0.00 N ATOM 0 H HIS A 63 4.857 9.304 6.832 1.00 0.00 H new ATOM 0 HA HIS A 63 7.598 10.103 6.440 1.00 0.00 H new ATOM 0 HB2 HIS A 63 6.077 7.492 6.682 1.00 0.00 H new ATOM 0 HB3 HIS A 63 7.692 7.503 6.002 1.00 0.00 H new ATOM 0 HD1 HIS A 63 8.874 6.265 7.780 1.00 0.00 H new ATOM 0 HD2 HIS A 63 6.724 9.529 9.244 1.00 0.00 H new ATOM 0 HE1 HIS A 63 9.505 6.488 10.217 1.00 0.00 H new ATOM 907 N PHE A 64 7.502 10.092 3.983 1.00 0.00 N ATOM 908 CA PHE A 64 7.676 9.856 2.601 1.00 0.00 C ATOM 909 C PHE A 64 8.734 8.789 2.545 1.00 0.00 C ATOM 910 O PHE A 64 9.736 8.868 3.281 1.00 0.00 O ATOM 911 CB PHE A 64 8.080 11.124 1.792 1.00 0.00 C ATOM 912 CG PHE A 64 9.424 11.740 2.101 1.00 0.00 C ATOM 913 CD1 PHE A 64 9.576 12.619 3.159 1.00 0.00 C ATOM 914 CD2 PHE A 64 10.527 11.454 1.311 1.00 0.00 C ATOM 915 CE1 PHE A 64 10.802 13.194 3.426 1.00 0.00 C ATOM 916 CE2 PHE A 64 11.753 12.024 1.574 1.00 0.00 C ATOM 917 CZ PHE A 64 11.891 12.895 2.634 1.00 0.00 C ATOM 0 H PHE A 64 8.032 10.875 4.366 1.00 0.00 H new ATOM 0 HA PHE A 64 6.740 9.553 2.131 1.00 0.00 H new ATOM 0 HB2 PHE A 64 8.061 10.869 0.732 1.00 0.00 H new ATOM 0 HB3 PHE A 64 7.315 11.884 1.951 1.00 0.00 H new ATOM 0 HD1 PHE A 64 8.727 12.857 3.782 1.00 0.00 H new ATOM 0 HD2 PHE A 64 10.423 10.775 0.478 1.00 0.00 H new ATOM 0 HE1 PHE A 64 10.909 13.878 4.255 1.00 0.00 H new ATOM 0 HE2 PHE A 64 12.604 11.789 0.952 1.00 0.00 H new ATOM 0 HZ PHE A 64 12.851 13.343 2.844 1.00 0.00 H new ATOM 927 N ASN A 65 8.528 7.787 1.773 1.00 0.00 N ATOM 928 CA ASN A 65 9.431 6.671 1.830 1.00 0.00 C ATOM 929 C ASN A 65 10.770 6.990 1.143 1.00 0.00 C ATOM 930 O ASN A 65 10.796 7.605 0.077 1.00 0.00 O ATOM 931 CB ASN A 65 8.726 5.447 1.233 1.00 0.00 C ATOM 932 CG ASN A 65 9.577 4.218 1.214 1.00 0.00 C ATOM 933 OD1 ASN A 65 10.204 3.907 0.217 1.00 0.00 O ATOM 934 ND2 ASN A 65 9.661 3.564 2.315 1.00 0.00 N ATOM 0 H ASN A 65 7.763 7.704 1.104 1.00 0.00 H new ATOM 0 HA ASN A 65 9.689 6.451 2.866 1.00 0.00 H new ATOM 0 HB2 ASN A 65 7.821 5.244 1.806 1.00 0.00 H new ATOM 0 HB3 ASN A 65 8.413 5.679 0.215 1.00 0.00 H new ATOM 0 HD21 ASN A 65 10.271 2.749 2.379 1.00 0.00 H new ATOM 0 HD22 ASN A 65 9.118 3.859 3.126 1.00 0.00 H new ATOM 941 N PRO A 66 11.907 6.525 1.721 1.00 0.00 N ATOM 942 CA PRO A 66 13.235 6.825 1.194 1.00 0.00 C ATOM 943 C PRO A 66 13.664 5.895 0.068 1.00 0.00 C ATOM 944 O PRO A 66 14.632 6.163 -0.628 1.00 0.00 O ATOM 945 CB PRO A 66 14.139 6.639 2.412 1.00 0.00 C ATOM 946 CG PRO A 66 13.470 5.586 3.221 1.00 0.00 C ATOM 947 CD PRO A 66 11.991 5.753 2.993 1.00 0.00 C ATOM 0 HA PRO A 66 13.273 7.820 0.750 1.00 0.00 H new ATOM 0 HB2 PRO A 66 15.143 6.334 2.117 1.00 0.00 H new ATOM 0 HB3 PRO A 66 14.240 7.567 2.975 1.00 0.00 H new ATOM 0 HG2 PRO A 66 13.801 4.593 2.916 1.00 0.00 H new ATOM 0 HG3 PRO A 66 13.715 5.693 4.278 1.00 0.00 H new ATOM 0 HD2 PRO A 66 11.489 4.789 2.909 1.00 0.00 H new ATOM 0 HD3 PRO A 66 11.518 6.288 3.817 1.00 0.00 H new ATOM 955 N LEU A 67 12.967 4.802 -0.099 1.00 0.00 N ATOM 956 CA LEU A 67 13.278 3.852 -1.133 1.00 0.00 C ATOM 957 C LEU A 67 12.519 4.319 -2.317 1.00 0.00 C ATOM 958 O LEU A 67 12.844 4.029 -3.449 1.00 0.00 O ATOM 959 CB LEU A 67 12.817 2.442 -0.665 1.00 0.00 C ATOM 960 CG LEU A 67 13.526 1.188 -1.236 1.00 0.00 C ATOM 961 CD1 LEU A 67 12.983 -0.060 -0.570 1.00 0.00 C ATOM 962 CD2 LEU A 67 13.379 1.064 -2.736 1.00 0.00 C ATOM 0 H LEU A 67 12.167 4.546 0.479 1.00 0.00 H new ATOM 0 HA LEU A 67 14.341 3.780 -1.362 1.00 0.00 H new ATOM 0 HB2 LEU A 67 12.914 2.408 0.420 1.00 0.00 H new ATOM 0 HB3 LEU A 67 11.755 2.351 -0.893 1.00 0.00 H new ATOM 0 HG LEU A 67 14.589 1.300 -1.022 1.00 0.00 H new ATOM 0 HD11 LEU A 67 13.486 -0.937 -0.976 1.00 0.00 H new ATOM 0 HD12 LEU A 67 13.160 -0.005 0.504 1.00 0.00 H new ATOM 0 HD13 LEU A 67 11.912 -0.136 -0.758 1.00 0.00 H new ATOM 0 HD21 LEU A 67 13.896 0.168 -3.079 1.00 0.00 H new ATOM 0 HD22 LEU A 67 12.322 0.995 -2.994 1.00 0.00 H new ATOM 0 HD23 LEU A 67 13.813 1.940 -3.218 1.00 0.00 H new ATOM 974 N SER A 68 11.545 5.166 -2.039 1.00 0.00 N ATOM 975 CA SER A 68 10.709 5.726 -3.023 1.00 0.00 C ATOM 976 C SER A 68 11.394 6.888 -3.746 1.00 0.00 C ATOM 977 O SER A 68 10.753 7.796 -4.222 1.00 0.00 O ATOM 978 CB SER A 68 9.363 6.101 -2.428 1.00 0.00 C ATOM 979 OG SER A 68 8.734 4.927 -1.928 1.00 0.00 O ATOM 0 H SER A 68 11.328 5.476 -1.092 1.00 0.00 H new ATOM 0 HA SER A 68 10.517 4.974 -3.788 1.00 0.00 H new ATOM 0 HB2 SER A 68 9.495 6.828 -1.626 1.00 0.00 H new ATOM 0 HB3 SER A 68 8.735 6.571 -3.185 1.00 0.00 H new ATOM 0 HG SER A 68 9.294 4.527 -1.230 1.00 0.00 H new ATOM 985 N ARG A 69 12.681 6.705 -4.010 1.00 0.00 N ATOM 986 CA ARG A 69 13.530 7.686 -4.658 1.00 0.00 C ATOM 987 C ARG A 69 13.374 7.588 -6.137 1.00 0.00 C ATOM 988 O ARG A 69 14.197 8.031 -6.910 1.00 0.00 O ATOM 989 CB ARG A 69 14.999 7.549 -4.240 1.00 0.00 C ATOM 990 CG ARG A 69 15.307 8.122 -2.867 1.00 0.00 C ATOM 991 CD ARG A 69 15.082 9.626 -2.851 1.00 0.00 C ATOM 992 NE ARG A 69 15.283 10.221 -1.534 1.00 0.00 N ATOM 993 CZ ARG A 69 15.087 11.520 -1.257 1.00 0.00 C ATOM 994 NH1 ARG A 69 14.795 12.378 -2.239 1.00 0.00 N ATOM 995 NH2 ARG A 69 15.193 11.954 -0.007 1.00 0.00 N ATOM 0 H ARG A 69 13.173 5.844 -3.771 1.00 0.00 H new ATOM 0 HA ARG A 69 13.211 8.676 -4.333 1.00 0.00 H new ATOM 0 HB2 ARG A 69 15.272 6.494 -4.252 1.00 0.00 H new ATOM 0 HB3 ARG A 69 15.625 8.049 -4.980 1.00 0.00 H new ATOM 0 HG2 ARG A 69 14.674 7.646 -2.118 1.00 0.00 H new ATOM 0 HG3 ARG A 69 16.340 7.901 -2.598 1.00 0.00 H new ATOM 0 HD2 ARG A 69 15.760 10.096 -3.563 1.00 0.00 H new ATOM 0 HD3 ARG A 69 14.068 9.839 -3.188 1.00 0.00 H new ATOM 0 HE ARG A 69 15.592 9.612 -0.776 1.00 0.00 H new ATOM 0 HH11 ARG A 69 14.721 12.046 -3.201 1.00 0.00 H new ATOM 0 HH12 ARG A 69 14.646 13.365 -2.027 1.00 0.00 H new ATOM 0 HH21 ARG A 69 15.423 11.301 0.742 1.00 0.00 H new ATOM 0 HH22 ARG A 69 15.044 12.941 0.205 1.00 0.00 H new ATOM 1009 N LYS A 70 12.310 7.014 -6.524 1.00 0.00 N ATOM 1010 CA LYS A 70 11.949 7.020 -7.873 1.00 0.00 C ATOM 1011 C LYS A 70 10.497 7.524 -7.973 1.00 0.00 C ATOM 1012 O LYS A 70 9.812 7.291 -8.948 1.00 0.00 O ATOM 1013 CB LYS A 70 12.170 5.643 -8.531 1.00 0.00 C ATOM 1014 CG LYS A 70 12.125 5.634 -10.069 1.00 0.00 C ATOM 1015 CD LYS A 70 13.190 6.559 -10.664 1.00 0.00 C ATOM 1016 CE LYS A 70 13.222 6.512 -12.195 1.00 0.00 C ATOM 1017 NZ LYS A 70 11.934 6.899 -12.806 1.00 0.00 N ATOM 0 H LYS A 70 11.661 6.524 -5.908 1.00 0.00 H new ATOM 0 HA LYS A 70 12.591 7.697 -8.436 1.00 0.00 H new ATOM 0 HB2 LYS A 70 13.137 5.256 -8.210 1.00 0.00 H new ATOM 0 HB3 LYS A 70 11.412 4.955 -8.158 1.00 0.00 H new ATOM 0 HG2 LYS A 70 12.279 4.618 -10.433 1.00 0.00 H new ATOM 0 HG3 LYS A 70 11.138 5.948 -10.408 1.00 0.00 H new ATOM 0 HD2 LYS A 70 13.000 7.582 -10.339 1.00 0.00 H new ATOM 0 HD3 LYS A 70 14.169 6.278 -10.275 1.00 0.00 H new ATOM 0 HE2 LYS A 70 14.006 7.177 -12.558 1.00 0.00 H new ATOM 0 HE3 LYS A 70 13.484 5.504 -12.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 12.106 7.565 -13.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 11.456 6.052 -13.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 11.332 7.353 -12.089 1.00 0.00 H new ATOM 1031 N HIS A 71 10.062 8.221 -6.899 1.00 0.00 N ATOM 1032 CA HIS A 71 8.718 8.879 -6.748 1.00 0.00 C ATOM 1033 C HIS A 71 7.533 7.933 -6.697 1.00 0.00 C ATOM 1034 O HIS A 71 6.705 8.030 -5.819 1.00 0.00 O ATOM 1035 CB HIS A 71 8.450 9.984 -7.792 1.00 0.00 C ATOM 1036 CG HIS A 71 9.119 11.300 -7.518 1.00 0.00 C ATOM 1037 ND1 HIS A 71 10.245 11.736 -8.177 1.00 0.00 N ATOM 1038 CD2 HIS A 71 8.776 12.304 -6.676 1.00 0.00 C ATOM 1039 CE1 HIS A 71 10.563 12.937 -7.755 1.00 0.00 C ATOM 1040 NE2 HIS A 71 9.693 13.306 -6.849 1.00 0.00 N ATOM 0 H HIS A 71 10.650 8.353 -6.076 1.00 0.00 H new ATOM 0 HA HIS A 71 8.799 9.337 -5.762 1.00 0.00 H new ATOM 0 HB2 HIS A 71 8.776 9.626 -8.768 1.00 0.00 H new ATOM 0 HB3 HIS A 71 7.374 10.148 -7.856 1.00 0.00 H new ATOM 0 HD2 HIS A 71 7.937 12.313 -5.996 1.00 0.00 H new ATOM 0 HE1 HIS A 71 11.403 13.523 -8.098 1.00 0.00 H new ATOM 0 HE2 HIS A 71 9.698 14.197 -6.352 1.00 0.00 H new ATOM 1049 N GLY A 72 7.482 7.025 -7.602 1.00 0.00 N ATOM 1050 CA GLY A 72 6.346 6.197 -7.760 1.00 0.00 C ATOM 1051 C GLY A 72 6.463 5.471 -9.052 1.00 0.00 C ATOM 1052 O GLY A 72 7.459 5.623 -9.749 1.00 0.00 O ATOM 0 H GLY A 72 8.237 6.835 -8.261 1.00 0.00 H new ATOM 0 HA2 GLY A 72 6.276 5.490 -6.934 1.00 0.00 H new ATOM 0 HA3 GLY A 72 5.436 6.797 -7.744 1.00 0.00 H new ATOM 1056 N GLY A 73 5.551 4.602 -9.304 1.00 0.00 N ATOM 1057 CA GLY A 73 5.479 3.939 -10.573 1.00 0.00 C ATOM 1058 C GLY A 73 4.190 3.223 -10.607 1.00 0.00 C ATOM 1059 O GLY A 73 3.815 2.678 -9.564 1.00 0.00 O ATOM 0 H GLY A 73 4.828 4.324 -8.640 1.00 0.00 H new ATOM 0 HA2 GLY A 73 5.543 4.658 -11.389 1.00 0.00 H new ATOM 0 HA3 GLY A 73 6.310 3.245 -10.694 1.00 0.00 H new ATOM 1063 N PRO A 74 3.494 3.155 -11.729 1.00 0.00 N ATOM 1064 CA PRO A 74 2.197 2.486 -11.781 1.00 0.00 C ATOM 1065 C PRO A 74 2.267 0.972 -11.517 1.00 0.00 C ATOM 1066 O PRO A 74 1.480 0.447 -10.721 1.00 0.00 O ATOM 1067 CB PRO A 74 1.691 2.773 -13.204 1.00 0.00 C ATOM 1068 CG PRO A 74 2.903 3.170 -13.985 1.00 0.00 C ATOM 1069 CD PRO A 74 3.845 3.805 -13.009 1.00 0.00 C ATOM 0 HA PRO A 74 1.537 2.856 -10.997 1.00 0.00 H new ATOM 0 HB2 PRO A 74 1.216 1.893 -13.637 1.00 0.00 H new ATOM 0 HB3 PRO A 74 0.946 3.569 -13.203 1.00 0.00 H new ATOM 0 HG2 PRO A 74 3.361 2.302 -14.459 1.00 0.00 H new ATOM 0 HG3 PRO A 74 2.641 3.867 -14.781 1.00 0.00 H new ATOM 0 HD2 PRO A 74 4.886 3.626 -13.279 1.00 0.00 H new ATOM 0 HD3 PRO A 74 3.709 4.885 -12.963 1.00 0.00 H new ATOM 1077 N LYS A 75 3.242 0.276 -12.097 1.00 0.00 N ATOM 1078 CA LYS A 75 3.311 -1.134 -11.900 1.00 0.00 C ATOM 1079 C LYS A 75 4.626 -1.564 -11.268 1.00 0.00 C ATOM 1080 O LYS A 75 4.627 -2.436 -10.431 1.00 0.00 O ATOM 1081 CB LYS A 75 3.064 -1.833 -13.258 1.00 0.00 C ATOM 1082 CG LYS A 75 3.950 -1.291 -14.385 1.00 0.00 C ATOM 1083 CD LYS A 75 3.568 -1.771 -15.792 1.00 0.00 C ATOM 1084 CE LYS A 75 3.630 -3.272 -15.947 1.00 0.00 C ATOM 1085 NZ LYS A 75 2.336 -3.944 -15.684 1.00 0.00 N ATOM 0 H LYS A 75 3.971 0.672 -12.691 1.00 0.00 H new ATOM 0 HA LYS A 75 2.538 -1.434 -11.193 1.00 0.00 H new ATOM 0 HB2 LYS A 75 3.242 -2.903 -13.147 1.00 0.00 H new ATOM 0 HB3 LYS A 75 2.017 -1.712 -13.537 1.00 0.00 H new ATOM 0 HG2 LYS A 75 3.913 -0.202 -14.365 1.00 0.00 H new ATOM 0 HG3 LYS A 75 4.983 -1.578 -14.186 1.00 0.00 H new ATOM 0 HD2 LYS A 75 2.559 -1.430 -16.023 1.00 0.00 H new ATOM 0 HD3 LYS A 75 4.235 -1.309 -16.520 1.00 0.00 H new ATOM 0 HE2 LYS A 75 3.957 -3.512 -16.959 1.00 0.00 H new ATOM 0 HE3 LYS A 75 4.383 -3.670 -15.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 2.501 -4.815 -15.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 1.719 -3.308 -15.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 1.878 -4.181 -16.587 1.00 0.00 H new ATOM 1099 N ASP A 76 5.695 -0.832 -11.521 1.00 0.00 N ATOM 1100 CA ASP A 76 7.025 -1.207 -11.015 1.00 0.00 C ATOM 1101 C ASP A 76 8.019 -0.156 -11.387 1.00 0.00 C ATOM 1102 O ASP A 76 7.886 0.424 -12.434 1.00 0.00 O ATOM 1103 CB ASP A 76 7.502 -2.523 -11.642 1.00 0.00 C ATOM 1104 CG ASP A 76 8.829 -2.939 -11.087 1.00 0.00 C ATOM 1105 OD1 ASP A 76 8.936 -3.020 -9.870 1.00 0.00 O ATOM 1106 OD2 ASP A 76 9.782 -3.160 -11.845 1.00 0.00 O ATOM 0 H ASP A 76 5.680 0.026 -12.072 1.00 0.00 H new ATOM 0 HA ASP A 76 6.947 -1.315 -9.933 1.00 0.00 H new ATOM 0 HB2 ASP A 76 6.766 -3.305 -11.456 1.00 0.00 H new ATOM 0 HB3 ASP A 76 7.577 -2.407 -12.723 1.00 0.00 H new ATOM 1111 N GLU A 77 9.021 0.077 -10.545 1.00 0.00 N ATOM 1112 CA GLU A 77 10.056 1.074 -10.866 1.00 0.00 C ATOM 1113 C GLU A 77 11.352 0.843 -10.100 1.00 0.00 C ATOM 1114 O GLU A 77 12.213 0.118 -10.556 1.00 0.00 O ATOM 1115 CB GLU A 77 9.547 2.517 -10.663 1.00 0.00 C ATOM 1116 CG GLU A 77 9.006 3.195 -11.901 1.00 0.00 C ATOM 1117 CD GLU A 77 10.093 3.554 -12.869 1.00 0.00 C ATOM 1118 OE1 GLU A 77 10.577 2.680 -13.619 1.00 0.00 O ATOM 1119 OE2 GLU A 77 10.476 4.728 -12.900 1.00 0.00 O ATOM 0 H GLU A 77 9.145 -0.397 -9.650 1.00 0.00 H new ATOM 0 HA GLU A 77 10.282 0.942 -11.924 1.00 0.00 H new ATOM 0 HB2 GLU A 77 8.764 2.504 -9.905 1.00 0.00 H new ATOM 0 HB3 GLU A 77 10.364 3.120 -10.267 1.00 0.00 H new ATOM 0 HG2 GLU A 77 8.289 2.536 -12.390 1.00 0.00 H new ATOM 0 HG3 GLU A 77 8.466 4.097 -11.613 1.00 0.00 H new ATOM 1126 N GLU A 78 11.445 1.386 -8.897 1.00 0.00 N ATOM 1127 CA GLU A 78 12.651 1.304 -8.086 1.00 0.00 C ATOM 1128 C GLU A 78 12.202 1.606 -6.686 1.00 0.00 C ATOM 1129 O GLU A 78 12.372 0.815 -5.797 1.00 0.00 O ATOM 1130 CB GLU A 78 13.667 2.362 -8.601 1.00 0.00 C ATOM 1131 CG GLU A 78 15.076 2.361 -7.985 1.00 0.00 C ATOM 1132 CD GLU A 78 15.143 2.771 -6.527 1.00 0.00 C ATOM 1133 OE1 GLU A 78 14.970 3.970 -6.225 1.00 0.00 O ATOM 1134 OE2 GLU A 78 15.417 1.902 -5.670 1.00 0.00 O ATOM 0 H GLU A 78 10.683 1.899 -8.453 1.00 0.00 H new ATOM 0 HA GLU A 78 13.142 0.332 -8.132 1.00 0.00 H new ATOM 0 HB2 GLU A 78 13.772 2.229 -9.678 1.00 0.00 H new ATOM 0 HB3 GLU A 78 13.233 3.349 -8.442 1.00 0.00 H new ATOM 0 HG2 GLU A 78 15.498 1.361 -8.084 1.00 0.00 H new ATOM 0 HG3 GLU A 78 15.709 3.033 -8.564 1.00 0.00 H new ATOM 1141 N ARG A 79 11.509 2.761 -6.573 1.00 0.00 N ATOM 1142 CA ARG A 79 10.892 3.316 -5.420 1.00 0.00 C ATOM 1143 C ARG A 79 10.291 2.307 -4.439 1.00 0.00 C ATOM 1144 O ARG A 79 10.182 2.598 -3.267 1.00 0.00 O ATOM 1145 CB ARG A 79 9.773 4.312 -5.911 1.00 0.00 C ATOM 1146 CG ARG A 79 8.416 3.717 -6.361 1.00 0.00 C ATOM 1147 CD ARG A 79 8.486 2.659 -7.460 1.00 0.00 C ATOM 1148 NE ARG A 79 7.134 2.246 -7.946 1.00 0.00 N ATOM 1149 CZ ARG A 79 6.611 0.975 -7.964 1.00 0.00 C ATOM 1150 NH1 ARG A 79 7.303 -0.058 -7.481 1.00 0.00 N ATOM 1151 NH2 ARG A 79 5.385 0.758 -8.458 1.00 0.00 N ATOM 0 H ARG A 79 11.374 3.362 -7.386 1.00 0.00 H new ATOM 0 HA ARG A 79 11.680 3.809 -4.851 1.00 0.00 H new ATOM 0 HB2 ARG A 79 9.577 5.018 -5.104 1.00 0.00 H new ATOM 0 HB3 ARG A 79 10.179 4.886 -6.744 1.00 0.00 H new ATOM 0 HG2 ARG A 79 7.927 3.278 -5.491 1.00 0.00 H new ATOM 0 HG3 ARG A 79 7.780 4.532 -6.707 1.00 0.00 H new ATOM 0 HD2 ARG A 79 9.066 3.048 -8.297 1.00 0.00 H new ATOM 0 HD3 ARG A 79 9.016 1.784 -7.084 1.00 0.00 H new ATOM 0 HE ARG A 79 6.534 2.989 -8.304 1.00 0.00 H new ATOM 0 HH11 ARG A 79 8.234 0.089 -7.091 1.00 0.00 H new ATOM 0 HH12 ARG A 79 6.901 -0.995 -7.501 1.00 0.00 H new ATOM 0 HH21 ARG A 79 4.837 1.537 -8.822 1.00 0.00 H new ATOM 0 HH22 ARG A 79 5.000 -0.186 -8.470 1.00 0.00 H new ATOM 1165 N HIS A 80 9.800 1.164 -4.950 1.00 0.00 N ATOM 1166 CA HIS A 80 9.016 0.154 -4.165 1.00 0.00 C ATOM 1167 C HIS A 80 7.609 0.712 -3.855 1.00 0.00 C ATOM 1168 O HIS A 80 6.653 -0.030 -3.727 1.00 0.00 O ATOM 1169 CB HIS A 80 9.761 -0.268 -2.862 1.00 0.00 C ATOM 1170 CG HIS A 80 9.074 -1.314 -2.032 1.00 0.00 C ATOM 1171 ND1 HIS A 80 8.628 -1.097 -0.757 1.00 0.00 N ATOM 1172 CD2 HIS A 80 8.824 -2.604 -2.289 1.00 0.00 C ATOM 1173 CE1 HIS A 80 8.140 -2.206 -0.267 1.00 0.00 C ATOM 1174 NE2 HIS A 80 8.247 -3.149 -1.175 1.00 0.00 N ATOM 0 H HIS A 80 9.929 0.899 -5.927 1.00 0.00 H new ATOM 0 HA HIS A 80 8.910 -0.746 -4.770 1.00 0.00 H new ATOM 0 HB2 HIS A 80 10.750 -0.637 -3.134 1.00 0.00 H new ATOM 0 HB3 HIS A 80 9.910 0.619 -2.246 1.00 0.00 H new ATOM 0 HD1 HIS A 80 8.670 -0.205 -0.264 1.00 0.00 H new ATOM 0 HD2 HIS A 80 9.040 -3.122 -3.212 1.00 0.00 H new ATOM 0 HE1 HIS A 80 7.719 -2.327 0.720 1.00 0.00 H new ATOM 1183 N VAL A 81 7.564 2.041 -3.788 1.00 0.00 N ATOM 1184 CA VAL A 81 6.464 2.891 -3.519 1.00 0.00 C ATOM 1185 C VAL A 81 5.904 2.572 -2.185 1.00 0.00 C ATOM 1186 O VAL A 81 4.761 2.240 -2.022 1.00 0.00 O ATOM 1187 CB VAL A 81 5.448 3.123 -4.717 1.00 0.00 C ATOM 1188 CG1 VAL A 81 4.688 1.907 -5.137 1.00 0.00 C ATOM 1189 CG2 VAL A 81 4.541 4.314 -4.486 1.00 0.00 C ATOM 0 H VAL A 81 8.411 2.587 -3.943 1.00 0.00 H new ATOM 0 HA VAL A 81 6.832 3.915 -3.452 1.00 0.00 H new ATOM 0 HB VAL A 81 6.085 3.360 -5.569 1.00 0.00 H new ATOM 0 HG11 VAL A 81 4.020 2.162 -5.960 1.00 0.00 H new ATOM 0 HG12 VAL A 81 5.386 1.136 -5.462 1.00 0.00 H new ATOM 0 HG13 VAL A 81 4.103 1.535 -4.296 1.00 0.00 H new ATOM 0 HG21 VAL A 81 3.867 4.428 -5.335 1.00 0.00 H new ATOM 0 HG22 VAL A 81 3.959 4.157 -3.578 1.00 0.00 H new ATOM 0 HG23 VAL A 81 5.144 5.215 -4.379 1.00 0.00 H new ATOM 1199 N GLY A 82 6.874 2.539 -1.257 1.00 0.00 N ATOM 1200 CA GLY A 82 6.663 2.307 0.197 1.00 0.00 C ATOM 1201 C GLY A 82 5.778 1.106 0.561 1.00 0.00 C ATOM 1202 O GLY A 82 6.267 0.020 0.944 1.00 0.00 O ATOM 0 H GLY A 82 7.856 2.676 -1.495 1.00 0.00 H new ATOM 0 HA2 GLY A 82 7.636 2.173 0.669 1.00 0.00 H new ATOM 0 HA3 GLY A 82 6.220 3.205 0.628 1.00 0.00 H new ATOM 1206 N ASP A 83 4.510 1.316 0.424 1.00 0.00 N ATOM 1207 CA ASP A 83 3.464 0.371 0.725 1.00 0.00 C ATOM 1208 C ASP A 83 3.324 -0.614 -0.405 1.00 0.00 C ATOM 1209 O ASP A 83 3.920 -0.475 -1.457 1.00 0.00 O ATOM 1210 CB ASP A 83 2.107 1.048 0.891 1.00 0.00 C ATOM 1211 CG ASP A 83 1.953 1.947 2.055 1.00 0.00 C ATOM 1212 OD1 ASP A 83 2.554 1.693 3.062 1.00 0.00 O ATOM 1213 OD2 ASP A 83 1.171 2.969 1.946 1.00 0.00 O ATOM 0 H ASP A 83 4.146 2.204 0.078 1.00 0.00 H new ATOM 0 HA ASP A 83 3.746 -0.117 1.658 1.00 0.00 H new ATOM 0 HB2 ASP A 83 1.900 1.622 -0.012 1.00 0.00 H new ATOM 0 HB3 ASP A 83 1.345 0.272 0.957 1.00 0.00 H new ATOM 1218 N LEU A 84 2.508 -1.567 -0.197 1.00 0.00 N ATOM 1219 CA LEU A 84 2.210 -2.561 -1.192 1.00 0.00 C ATOM 1220 C LEU A 84 0.755 -2.910 -1.057 1.00 0.00 C ATOM 1221 O LEU A 84 0.394 -3.767 -0.298 1.00 0.00 O ATOM 1222 CB LEU A 84 3.084 -3.827 -1.027 1.00 0.00 C ATOM 1223 CG LEU A 84 4.584 -3.699 -1.335 1.00 0.00 C ATOM 1224 CD1 LEU A 84 5.299 -4.994 -0.992 1.00 0.00 C ATOM 1225 CD2 LEU A 84 4.807 -3.356 -2.806 1.00 0.00 C ATOM 0 H LEU A 84 2.008 -1.698 0.682 1.00 0.00 H new ATOM 0 HA LEU A 84 2.429 -2.161 -2.182 1.00 0.00 H new ATOM 0 HB2 LEU A 84 2.980 -4.176 0.000 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.674 -4.605 -1.671 1.00 0.00 H new ATOM 0 HG LEU A 84 4.991 -2.892 -0.726 1.00 0.00 H new ATOM 0 HD11 LEU A 84 6.361 -4.893 -1.214 1.00 0.00 H new ATOM 0 HD12 LEU A 84 5.169 -5.212 0.068 1.00 0.00 H new ATOM 0 HD13 LEU A 84 4.881 -5.808 -1.584 1.00 0.00 H new ATOM 0 HD21 LEU A 84 5.876 -3.270 -3.002 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.386 -4.143 -3.431 1.00 0.00 H new ATOM 0 HD23 LEU A 84 4.319 -2.409 -3.037 1.00 0.00 H new ATOM 1237 N GLY A 85 -0.072 -2.173 -1.723 1.00 0.00 N ATOM 1238 CA GLY A 85 -1.474 -2.428 -1.680 1.00 0.00 C ATOM 1239 C GLY A 85 -2.182 -1.398 -2.469 1.00 0.00 C ATOM 1240 O GLY A 85 -1.581 -0.386 -2.821 1.00 0.00 O ATOM 0 H GLY A 85 0.202 -1.383 -2.308 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -1.687 -3.419 -2.080 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -1.826 -2.418 -0.648 1.00 0.00 H new ATOM 1244 N ASN A 86 -3.404 -1.632 -2.777 1.00 0.00 N ATOM 1245 CA ASN A 86 -4.224 -0.663 -3.447 1.00 0.00 C ATOM 1246 C ASN A 86 -5.646 -1.008 -3.192 1.00 0.00 C ATOM 1247 O ASN A 86 -5.973 -2.178 -2.987 1.00 0.00 O ATOM 1248 CB ASN A 86 -3.940 -0.539 -4.974 1.00 0.00 C ATOM 1249 CG ASN A 86 -4.186 -1.803 -5.780 1.00 0.00 C ATOM 1250 OD1 ASN A 86 -5.294 -2.059 -6.224 1.00 0.00 O ATOM 1251 ND2 ASN A 86 -3.139 -2.575 -6.019 1.00 0.00 N ATOM 0 H ASN A 86 -3.880 -2.511 -2.573 1.00 0.00 H new ATOM 0 HA ASN A 86 -3.982 0.319 -3.042 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -4.562 0.259 -5.380 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -2.902 -0.235 -5.111 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -3.244 -3.414 -6.590 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -2.227 -2.332 -5.632 1.00 0.00 H new ATOM 1258 N VAL A 87 -6.469 -0.009 -3.136 1.00 0.00 N ATOM 1259 CA VAL A 87 -7.863 -0.186 -2.901 1.00 0.00 C ATOM 1260 C VAL A 87 -8.636 0.729 -3.841 1.00 0.00 C ATOM 1261 O VAL A 87 -8.312 1.909 -3.996 1.00 0.00 O ATOM 1262 CB VAL A 87 -8.219 0.064 -1.389 1.00 0.00 C ATOM 1263 CG1 VAL A 87 -7.684 1.386 -0.893 1.00 0.00 C ATOM 1264 CG2 VAL A 87 -9.705 -0.004 -1.149 1.00 0.00 C ATOM 0 H VAL A 87 -6.186 0.964 -3.254 1.00 0.00 H new ATOM 0 HA VAL A 87 -8.148 -1.217 -3.109 1.00 0.00 H new ATOM 0 HB VAL A 87 -7.736 -0.735 -0.826 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -7.953 1.517 0.155 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -6.599 1.400 -0.994 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -8.114 2.196 -1.482 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -9.912 0.174 -0.094 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -10.206 0.755 -1.750 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -10.074 -0.990 -1.430 1.00 0.00 H new ATOM 1274 N THR A 88 -9.569 0.164 -4.542 1.00 0.00 N ATOM 1275 CA THR A 88 -10.372 0.886 -5.471 1.00 0.00 C ATOM 1276 C THR A 88 -11.823 0.373 -5.374 1.00 0.00 C ATOM 1277 O THR A 88 -12.144 -0.661 -5.944 1.00 0.00 O ATOM 1278 CB THR A 88 -9.776 0.660 -6.905 1.00 0.00 C ATOM 1279 OG1 THR A 88 -8.403 1.123 -6.931 1.00 0.00 O ATOM 1280 CG2 THR A 88 -10.566 1.371 -7.984 1.00 0.00 C ATOM 0 H THR A 88 -9.796 -0.829 -4.482 1.00 0.00 H new ATOM 0 HA THR A 88 -10.375 1.954 -5.255 1.00 0.00 H new ATOM 0 HB THR A 88 -9.829 -0.408 -7.115 1.00 0.00 H new ATOM 0 HG1 THR A 88 -8.027 0.982 -7.825 1.00 0.00 H new ATOM 0 HG21 THR A 88 -10.109 1.180 -8.955 1.00 0.00 H new ATOM 0 HG22 THR A 88 -11.592 1.002 -7.987 1.00 0.00 H new ATOM 0 HG23 THR A 88 -10.567 2.443 -7.788 1.00 0.00 H new ATOM 1288 N ALA A 89 -12.667 1.038 -4.589 1.00 0.00 N ATOM 1289 CA ALA A 89 -14.054 0.634 -4.485 1.00 0.00 C ATOM 1290 C ALA A 89 -14.940 1.844 -4.551 1.00 0.00 C ATOM 1291 O ALA A 89 -15.112 2.534 -3.582 1.00 0.00 O ATOM 1292 CB ALA A 89 -14.278 -0.061 -3.154 1.00 0.00 C ATOM 0 H ALA A 89 -12.413 1.849 -4.024 1.00 0.00 H new ATOM 0 HA ALA A 89 -14.291 -0.043 -5.306 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -15.321 -0.366 -3.074 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -13.637 -0.940 -3.090 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -14.037 0.624 -2.341 1.00 0.00 H new ATOM 1298 N ASP A 90 -15.588 2.015 -5.636 1.00 0.00 N ATOM 1299 CA ASP A 90 -16.381 3.243 -5.820 1.00 0.00 C ATOM 1300 C ASP A 90 -17.803 2.949 -5.964 1.00 0.00 C ATOM 1301 O ASP A 90 -18.658 3.812 -5.794 1.00 0.00 O ATOM 1302 CB ASP A 90 -15.941 4.018 -7.036 1.00 0.00 C ATOM 1303 CG ASP A 90 -16.418 3.449 -8.351 1.00 0.00 C ATOM 1304 OD1 ASP A 90 -15.887 2.425 -8.787 1.00 0.00 O ATOM 1305 OD2 ASP A 90 -17.362 4.014 -8.949 1.00 0.00 O ATOM 0 H ASP A 90 -15.609 1.358 -6.416 1.00 0.00 H new ATOM 0 HA ASP A 90 -16.215 3.841 -4.924 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -16.301 5.043 -6.947 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -14.852 4.062 -7.048 1.00 0.00 H new ATOM 1310 N LYS A 91 -18.060 1.753 -6.287 1.00 0.00 N ATOM 1311 CA LYS A 91 -19.410 1.348 -6.549 1.00 0.00 C ATOM 1312 C LYS A 91 -20.158 1.205 -5.250 1.00 0.00 C ATOM 1313 O LYS A 91 -21.068 1.968 -4.948 1.00 0.00 O ATOM 1314 CB LYS A 91 -19.499 0.002 -7.325 1.00 0.00 C ATOM 1315 CG LYS A 91 -18.753 -0.096 -8.667 1.00 0.00 C ATOM 1316 CD LYS A 91 -17.291 -0.478 -8.486 1.00 0.00 C ATOM 1317 CE LYS A 91 -16.559 -0.651 -9.823 1.00 0.00 C ATOM 1318 NZ LYS A 91 -16.452 0.614 -10.585 1.00 0.00 N ATOM 0 H LYS A 91 -17.362 1.016 -6.383 1.00 0.00 H new ATOM 0 HA LYS A 91 -19.854 2.123 -7.174 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -19.124 -0.787 -6.673 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -20.552 -0.211 -7.509 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -19.244 -0.835 -9.300 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -18.815 0.861 -9.186 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -16.789 0.289 -7.897 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -17.229 -1.407 -7.919 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -15.559 -1.044 -9.637 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -17.085 -1.391 -10.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -15.570 0.614 -11.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -17.263 0.700 -11.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -16.448 1.418 -9.925 1.00 0.00 H new ATOM 1332 N ASP A 92 -19.629 0.366 -4.410 1.00 0.00 N ATOM 1333 CA ASP A 92 -20.379 -0.100 -3.252 1.00 0.00 C ATOM 1334 C ASP A 92 -19.472 -0.526 -2.113 1.00 0.00 C ATOM 1335 O ASP A 92 -19.847 -0.481 -0.940 1.00 0.00 O ATOM 1336 CB ASP A 92 -21.238 -1.269 -3.687 1.00 0.00 C ATOM 1337 CG ASP A 92 -21.999 -1.906 -2.574 1.00 0.00 C ATOM 1338 OD1 ASP A 92 -23.127 -1.466 -2.266 1.00 0.00 O ATOM 1339 OD2 ASP A 92 -21.515 -2.907 -2.008 1.00 0.00 O ATOM 0 H ASP A 92 -18.687 -0.016 -4.492 1.00 0.00 H new ATOM 0 HA ASP A 92 -20.991 0.722 -2.880 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -21.941 -0.928 -4.446 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -20.602 -2.020 -4.156 1.00 0.00 H new ATOM 1344 N GLY A 93 -18.275 -0.855 -2.446 1.00 0.00 N ATOM 1345 CA GLY A 93 -17.391 -1.396 -1.475 1.00 0.00 C ATOM 1346 C GLY A 93 -16.867 -2.696 -1.967 1.00 0.00 C ATOM 1347 O GLY A 93 -17.005 -3.729 -1.328 1.00 0.00 O ATOM 0 H GLY A 93 -17.884 -0.759 -3.383 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -16.569 -0.705 -1.289 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -17.912 -1.535 -0.528 1.00 0.00 H new ATOM 1351 N VAL A 94 -16.294 -2.639 -3.130 1.00 0.00 N ATOM 1352 CA VAL A 94 -15.710 -3.766 -3.771 1.00 0.00 C ATOM 1353 C VAL A 94 -14.478 -3.272 -4.443 1.00 0.00 C ATOM 1354 O VAL A 94 -14.526 -2.551 -5.441 1.00 0.00 O ATOM 1355 CB VAL A 94 -16.671 -4.479 -4.802 1.00 0.00 C ATOM 1356 CG1 VAL A 94 -17.748 -5.256 -4.080 1.00 0.00 C ATOM 1357 CG2 VAL A 94 -17.332 -3.480 -5.759 1.00 0.00 C ATOM 0 H VAL A 94 -16.220 -1.778 -3.672 1.00 0.00 H new ATOM 0 HA VAL A 94 -15.493 -4.532 -3.027 1.00 0.00 H new ATOM 0 HB VAL A 94 -16.052 -5.160 -5.387 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -18.399 -5.739 -4.809 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -17.287 -6.014 -3.446 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -18.336 -4.576 -3.463 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -17.984 -4.015 -6.450 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -17.920 -2.763 -5.187 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -16.562 -2.951 -6.322 1.00 0.00 H new ATOM 1367 N ALA A 95 -13.401 -3.555 -3.841 1.00 0.00 N ATOM 1368 CA ALA A 95 -12.156 -3.167 -4.342 1.00 0.00 C ATOM 1369 C ALA A 95 -11.504 -4.299 -5.016 1.00 0.00 C ATOM 1370 O ALA A 95 -11.104 -5.276 -4.373 1.00 0.00 O ATOM 1371 CB ALA A 95 -11.280 -2.629 -3.243 1.00 0.00 C ATOM 0 H ALA A 95 -13.359 -4.075 -2.965 1.00 0.00 H new ATOM 0 HA ALA A 95 -12.311 -2.370 -5.070 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -10.316 -2.334 -3.658 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -11.759 -1.763 -2.787 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -11.129 -3.400 -2.488 1.00 0.00 H new ATOM 1377 N ASP A 96 -11.462 -4.215 -6.293 1.00 0.00 N ATOM 1378 CA ASP A 96 -10.743 -5.156 -7.065 1.00 0.00 C ATOM 1379 C ASP A 96 -9.344 -4.662 -7.052 1.00 0.00 C ATOM 1380 O ASP A 96 -9.093 -3.499 -7.397 1.00 0.00 O ATOM 1381 CB ASP A 96 -11.272 -5.225 -8.492 1.00 0.00 C ATOM 1382 CG ASP A 96 -10.552 -6.260 -9.325 1.00 0.00 C ATOM 1383 OD1 ASP A 96 -10.936 -7.447 -9.266 1.00 0.00 O ATOM 1384 OD2 ASP A 96 -9.603 -5.903 -10.058 1.00 0.00 O ATOM 0 H ASP A 96 -11.928 -3.488 -6.835 1.00 0.00 H new ATOM 0 HA ASP A 96 -10.835 -6.164 -6.661 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -12.337 -5.457 -8.471 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -11.168 -4.247 -8.963 1.00 0.00 H new ATOM 1389 N VAL A 97 -8.443 -5.476 -6.634 1.00 0.00 N ATOM 1390 CA VAL A 97 -7.107 -5.025 -6.476 1.00 0.00 C ATOM 1391 C VAL A 97 -6.397 -5.086 -7.804 1.00 0.00 C ATOM 1392 O VAL A 97 -6.570 -6.041 -8.601 1.00 0.00 O ATOM 1393 CB VAL A 97 -6.333 -5.855 -5.410 1.00 0.00 C ATOM 1394 CG1 VAL A 97 -6.061 -7.258 -5.883 1.00 0.00 C ATOM 1395 CG2 VAL A 97 -5.047 -5.178 -4.971 1.00 0.00 C ATOM 0 H VAL A 97 -8.605 -6.455 -6.396 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.138 -3.995 -6.120 1.00 0.00 H new ATOM 0 HB VAL A 97 -6.985 -5.913 -4.538 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -5.519 -7.804 -5.110 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -7.005 -7.762 -6.089 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -5.461 -7.225 -6.792 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -4.545 -5.797 -4.227 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -4.393 -5.045 -5.833 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -5.278 -4.205 -4.537 1.00 0.00 H new ATOM 1405 N SER A 98 -5.685 -4.059 -8.083 1.00 0.00 N ATOM 1406 CA SER A 98 -4.911 -4.007 -9.235 1.00 0.00 C ATOM 1407 C SER A 98 -3.683 -4.880 -9.018 1.00 0.00 C ATOM 1408 O SER A 98 -2.767 -4.517 -8.268 1.00 0.00 O ATOM 1409 CB SER A 98 -4.540 -2.550 -9.520 1.00 0.00 C ATOM 1410 OG SER A 98 -5.724 -1.740 -9.548 1.00 0.00 O ATOM 0 H SER A 98 -5.632 -3.224 -7.499 1.00 0.00 H new ATOM 0 HA SER A 98 -5.454 -4.383 -10.102 1.00 0.00 H new ATOM 0 HB2 SER A 98 -3.856 -2.183 -8.754 1.00 0.00 H new ATOM 0 HB3 SER A 98 -4.018 -2.479 -10.474 1.00 0.00 H new ATOM 0 HG SER A 98 -5.479 -0.809 -9.729 1.00 0.00 H new ATOM 1416 N ILE A 99 -3.714 -6.057 -9.591 1.00 0.00 N ATOM 1417 CA ILE A 99 -2.585 -6.931 -9.540 1.00 0.00 C ATOM 1418 C ILE A 99 -1.756 -6.678 -10.780 1.00 0.00 C ATOM 1419 O ILE A 99 -2.145 -6.972 -11.895 1.00 0.00 O ATOM 1420 CB ILE A 99 -3.045 -8.439 -9.472 1.00 0.00 C ATOM 1421 CG1 ILE A 99 -1.886 -9.415 -9.737 1.00 0.00 C ATOM 1422 CG2 ILE A 99 -4.242 -8.730 -10.386 1.00 0.00 C ATOM 1423 CD1 ILE A 99 -2.297 -10.878 -9.742 1.00 0.00 C ATOM 0 H ILE A 99 -4.517 -6.427 -10.099 1.00 0.00 H new ATOM 0 HA ILE A 99 -1.996 -6.736 -8.644 1.00 0.00 H new ATOM 0 HB ILE A 99 -3.379 -8.605 -8.448 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -1.433 -9.172 -10.698 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -1.119 -9.267 -8.977 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -4.518 -9.781 -10.301 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -5.086 -8.108 -10.089 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -3.974 -8.508 -11.419 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -1.424 -11.501 -9.936 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -2.722 -11.140 -8.773 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -3.041 -11.044 -10.521 1.00 0.00 H new ATOM 1435 N GLU A 100 -0.588 -6.205 -10.539 1.00 0.00 N ATOM 1436 CA GLU A 100 0.321 -5.728 -11.541 1.00 0.00 C ATOM 1437 C GLU A 100 1.648 -6.291 -11.267 1.00 0.00 C ATOM 1438 O GLU A 100 1.924 -6.687 -10.137 1.00 0.00 O ATOM 1439 CB GLU A 100 0.421 -4.196 -11.483 1.00 0.00 C ATOM 1440 CG GLU A 100 -0.718 -3.449 -12.141 1.00 0.00 C ATOM 1441 CD GLU A 100 -0.695 -3.621 -13.634 1.00 0.00 C ATOM 1442 OE1 GLU A 100 0.194 -3.045 -14.297 1.00 0.00 O ATOM 1443 OE2 GLU A 100 -1.534 -4.347 -14.180 1.00 0.00 O ATOM 0 H GLU A 100 -0.212 -6.132 -9.594 1.00 0.00 H new ATOM 0 HA GLU A 100 -0.037 -6.028 -12.526 1.00 0.00 H new ATOM 0 HB2 GLU A 100 0.478 -3.891 -10.438 1.00 0.00 H new ATOM 0 HB3 GLU A 100 1.355 -3.891 -11.955 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -1.668 -3.809 -11.746 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -0.651 -2.389 -11.894 1.00 0.00 H new ATOM 1450 N ASP A 101 2.471 -6.357 -12.257 1.00 0.00 N ATOM 1451 CA ASP A 101 3.782 -6.822 -12.021 1.00 0.00 C ATOM 1452 C ASP A 101 4.620 -5.707 -11.431 1.00 0.00 C ATOM 1453 O ASP A 101 5.023 -4.733 -12.099 1.00 0.00 O ATOM 1454 CB ASP A 101 4.426 -7.444 -13.281 1.00 0.00 C ATOM 1455 CG ASP A 101 4.448 -6.542 -14.491 1.00 0.00 C ATOM 1456 OD1 ASP A 101 3.373 -6.280 -15.054 1.00 0.00 O ATOM 1457 OD2 ASP A 101 5.529 -6.130 -14.943 1.00 0.00 O ATOM 0 H ASP A 101 2.259 -6.098 -13.221 1.00 0.00 H new ATOM 0 HA ASP A 101 3.732 -7.634 -11.295 1.00 0.00 H new ATOM 0 HB2 ASP A 101 5.449 -7.735 -13.043 1.00 0.00 H new ATOM 0 HB3 ASP A 101 3.886 -8.356 -13.535 1.00 0.00 H new ATOM 1462 N SER A 102 4.729 -5.808 -10.130 1.00 0.00 N ATOM 1463 CA SER A 102 5.581 -5.020 -9.329 1.00 0.00 C ATOM 1464 C SER A 102 6.764 -5.868 -9.037 1.00 0.00 C ATOM 1465 O SER A 102 6.725 -6.710 -8.138 1.00 0.00 O ATOM 1466 CB SER A 102 4.877 -4.595 -8.031 1.00 0.00 C ATOM 1467 OG SER A 102 3.693 -3.864 -8.322 1.00 0.00 O ATOM 0 H SER A 102 4.189 -6.484 -9.589 1.00 0.00 H new ATOM 0 HA SER A 102 5.867 -4.100 -9.839 1.00 0.00 H new ATOM 0 HB2 SER A 102 4.631 -5.476 -7.439 1.00 0.00 H new ATOM 0 HB3 SER A 102 5.550 -3.984 -7.429 1.00 0.00 H new ATOM 0 HG SER A 102 3.854 -3.272 -9.086 1.00 0.00 H new ATOM 1473 N VAL A 103 7.765 -5.727 -9.842 1.00 0.00 N ATOM 1474 CA VAL A 103 8.928 -6.535 -9.716 1.00 0.00 C ATOM 1475 C VAL A 103 9.671 -6.168 -8.459 1.00 0.00 C ATOM 1476 O VAL A 103 9.947 -7.025 -7.658 1.00 0.00 O ATOM 1477 CB VAL A 103 9.845 -6.427 -10.957 1.00 0.00 C ATOM 1478 CG1 VAL A 103 11.106 -7.258 -10.771 1.00 0.00 C ATOM 1479 CG2 VAL A 103 9.094 -6.874 -12.208 1.00 0.00 C ATOM 0 H VAL A 103 7.798 -5.049 -10.604 1.00 0.00 H new ATOM 0 HA VAL A 103 8.611 -7.576 -9.650 1.00 0.00 H new ATOM 0 HB VAL A 103 10.139 -5.384 -11.077 1.00 0.00 H new ATOM 0 HG11 VAL A 103 11.736 -7.167 -11.656 1.00 0.00 H new ATOM 0 HG12 VAL A 103 11.652 -6.900 -9.898 1.00 0.00 H new ATOM 0 HG13 VAL A 103 10.835 -8.304 -10.625 1.00 0.00 H new ATOM 0 HG21 VAL A 103 9.750 -6.793 -13.075 1.00 0.00 H new ATOM 0 HG22 VAL A 103 8.774 -7.909 -12.090 1.00 0.00 H new ATOM 0 HG23 VAL A 103 8.220 -6.239 -12.354 1.00 0.00 H new ATOM 1489 N ILE A 104 9.874 -4.869 -8.244 1.00 0.00 N ATOM 1490 CA ILE A 104 10.629 -4.335 -7.107 1.00 0.00 C ATOM 1491 C ILE A 104 9.885 -4.494 -5.727 1.00 0.00 C ATOM 1492 O ILE A 104 10.050 -3.674 -4.810 1.00 0.00 O ATOM 1493 CB ILE A 104 11.155 -2.863 -7.361 1.00 0.00 C ATOM 1494 CG1 ILE A 104 12.272 -2.482 -6.367 1.00 0.00 C ATOM 1495 CG2 ILE A 104 10.036 -1.836 -7.302 1.00 0.00 C ATOM 1496 CD1 ILE A 104 13.502 -3.371 -6.448 1.00 0.00 C ATOM 0 H ILE A 104 9.513 -4.144 -8.864 1.00 0.00 H new ATOM 0 HA ILE A 104 11.516 -4.963 -7.025 1.00 0.00 H new ATOM 0 HB ILE A 104 11.567 -2.855 -8.370 1.00 0.00 H new ATOM 0 HG12 ILE A 104 12.570 -1.450 -6.550 1.00 0.00 H new ATOM 0 HG13 ILE A 104 11.872 -2.524 -5.354 1.00 0.00 H new ATOM 0 HG21 ILE A 104 10.445 -0.842 -7.482 1.00 0.00 H new ATOM 0 HG22 ILE A 104 9.291 -2.065 -8.064 1.00 0.00 H new ATOM 0 HG23 ILE A 104 9.569 -1.863 -6.318 1.00 0.00 H new ATOM 0 HD11 ILE A 104 14.240 -3.038 -5.718 1.00 0.00 H new ATOM 0 HD12 ILE A 104 13.220 -4.402 -6.235 1.00 0.00 H new ATOM 0 HD13 ILE A 104 13.929 -3.311 -7.449 1.00 0.00 H new ATOM 1508 N SER A 105 9.016 -5.493 -5.621 1.00 0.00 N ATOM 1509 CA SER A 105 8.413 -5.888 -4.357 1.00 0.00 C ATOM 1510 C SER A 105 9.499 -6.518 -3.579 1.00 0.00 C ATOM 1511 O SER A 105 9.828 -7.687 -3.721 1.00 0.00 O ATOM 1512 CB SER A 105 7.235 -6.854 -4.616 1.00 0.00 C ATOM 1513 OG SER A 105 6.531 -7.191 -3.427 1.00 0.00 O ATOM 0 H SER A 105 8.709 -6.054 -6.416 1.00 0.00 H new ATOM 0 HA SER A 105 7.995 -5.045 -3.807 1.00 0.00 H new ATOM 0 HB2 SER A 105 6.545 -6.397 -5.325 1.00 0.00 H new ATOM 0 HB3 SER A 105 7.613 -7.765 -5.081 1.00 0.00 H new ATOM 0 HG SER A 105 6.223 -8.120 -3.481 1.00 0.00 H new ATOM 1519 N LEU A 106 10.092 -5.717 -2.903 1.00 0.00 N ATOM 1520 CA LEU A 106 11.214 -6.000 -2.211 1.00 0.00 C ATOM 1521 C LEU A 106 10.779 -5.948 -0.836 1.00 0.00 C ATOM 1522 O LEU A 106 9.713 -5.337 -0.530 1.00 0.00 O ATOM 1523 CB LEU A 106 12.247 -4.895 -2.487 1.00 0.00 C ATOM 1524 CG LEU A 106 13.670 -5.119 -1.987 1.00 0.00 C ATOM 1525 CD1 LEU A 106 14.338 -6.246 -2.760 1.00 0.00 C ATOM 1526 CD2 LEU A 106 14.478 -3.835 -2.091 1.00 0.00 C ATOM 0 H LEU A 106 9.788 -4.749 -2.800 1.00 0.00 H new ATOM 0 HA LEU A 106 11.671 -6.955 -2.469 1.00 0.00 H new ATOM 0 HB2 LEU A 106 12.290 -4.737 -3.565 1.00 0.00 H new ATOM 0 HB3 LEU A 106 11.877 -3.970 -2.044 1.00 0.00 H new ATOM 0 HG LEU A 106 13.627 -5.410 -0.937 1.00 0.00 H new ATOM 0 HD11 LEU A 106 15.353 -6.391 -2.389 1.00 0.00 H new ATOM 0 HD12 LEU A 106 13.768 -7.166 -2.627 1.00 0.00 H new ATOM 0 HD13 LEU A 106 14.372 -5.990 -3.819 1.00 0.00 H new ATOM 0 HD21 LEU A 106 15.491 -4.012 -1.730 1.00 0.00 H new ATOM 0 HD22 LEU A 106 14.515 -3.512 -3.131 1.00 0.00 H new ATOM 0 HD23 LEU A 106 14.008 -3.059 -1.486 1.00 0.00 H new ATOM 1538 N SER A 107 11.477 -6.564 -0.038 1.00 0.00 N ATOM 1539 CA SER A 107 11.234 -6.502 1.329 1.00 0.00 C ATOM 1540 C SER A 107 11.592 -5.075 1.781 1.00 0.00 C ATOM 1541 O SER A 107 12.765 -4.702 1.911 1.00 0.00 O ATOM 1542 CB SER A 107 12.065 -7.569 2.010 1.00 0.00 C ATOM 1543 OG SER A 107 11.790 -8.851 1.434 1.00 0.00 O ATOM 0 H SER A 107 12.267 -7.153 -0.303 1.00 0.00 H new ATOM 0 HA SER A 107 10.194 -6.696 1.590 1.00 0.00 H new ATOM 0 HB2 SER A 107 13.125 -7.336 1.908 1.00 0.00 H new ATOM 0 HB3 SER A 107 11.844 -7.587 3.077 1.00 0.00 H new ATOM 0 HG SER A 107 12.334 -9.534 1.880 1.00 0.00 H new ATOM 1549 N GLY A 108 10.556 -4.284 1.947 1.00 0.00 N ATOM 1550 CA GLY A 108 10.695 -2.897 2.158 1.00 0.00 C ATOM 1551 C GLY A 108 10.674 -2.533 3.588 1.00 0.00 C ATOM 1552 O GLY A 108 9.842 -3.024 4.368 1.00 0.00 O ATOM 0 H GLY A 108 9.589 -4.609 1.936 1.00 0.00 H new ATOM 0 HA2 GLY A 108 11.632 -2.558 1.715 1.00 0.00 H new ATOM 0 HA3 GLY A 108 9.891 -2.373 1.642 1.00 0.00 H new ATOM 1556 N ASP A 109 11.570 -1.648 3.922 1.00 0.00 N ATOM 1557 CA ASP A 109 11.788 -1.089 5.265 1.00 0.00 C ATOM 1558 C ASP A 109 12.185 -2.121 6.311 1.00 0.00 C ATOM 1559 O ASP A 109 13.371 -2.339 6.525 1.00 0.00 O ATOM 1560 CB ASP A 109 10.630 -0.213 5.740 1.00 0.00 C ATOM 1561 CG ASP A 109 10.867 0.367 7.117 1.00 0.00 C ATOM 1562 OD1 ASP A 109 11.703 1.300 7.258 1.00 0.00 O ATOM 1563 OD2 ASP A 109 10.243 -0.118 8.070 1.00 0.00 O ATOM 0 H ASP A 109 12.218 -1.261 3.235 1.00 0.00 H new ATOM 0 HA ASP A 109 12.655 -0.438 5.151 1.00 0.00 H new ATOM 0 HB2 ASP A 109 10.478 0.599 5.029 1.00 0.00 H new ATOM 0 HB3 ASP A 109 9.714 -0.803 5.751 1.00 0.00 H new ATOM 1568 N HIS A 110 11.222 -2.775 6.946 1.00 0.00 N ATOM 1569 CA HIS A 110 11.570 -3.840 7.881 1.00 0.00 C ATOM 1570 C HIS A 110 11.791 -5.071 7.065 1.00 0.00 C ATOM 1571 O HIS A 110 12.833 -5.699 7.170 1.00 0.00 O ATOM 1572 CB HIS A 110 10.462 -4.100 8.915 1.00 0.00 C ATOM 1573 CG HIS A 110 10.408 -3.166 10.105 1.00 0.00 C ATOM 1574 ND1 HIS A 110 10.255 -1.800 10.020 1.00 0.00 N ATOM 1575 CD2 HIS A 110 10.461 -3.441 11.432 1.00 0.00 C ATOM 1576 CE1 HIS A 110 10.215 -1.288 11.227 1.00 0.00 C ATOM 1577 NE2 HIS A 110 10.336 -2.256 12.097 1.00 0.00 N ATOM 0 H HIS A 110 10.224 -2.597 6.838 1.00 0.00 H new ATOM 0 HA HIS A 110 12.458 -3.552 8.444 1.00 0.00 H new ATOM 0 HB2 HIS A 110 9.501 -4.054 8.403 1.00 0.00 H new ATOM 0 HB3 HIS A 110 10.576 -5.118 9.287 1.00 0.00 H new ATOM 0 HD1 HIS A 110 10.184 -1.268 9.152 1.00 0.00 H new ATOM 0 HD2 HIS A 110 10.580 -4.417 11.879 1.00 0.00 H new ATOM 0 HE1 HIS A 110 10.101 -0.240 11.463 1.00 0.00 H new ATOM 1586 N SER A 111 10.815 -5.325 6.185 1.00 0.00 N ATOM 1587 CA SER A 111 10.821 -6.387 5.144 1.00 0.00 C ATOM 1588 C SER A 111 9.435 -6.562 4.533 1.00 0.00 C ATOM 1589 O SER A 111 9.091 -5.945 3.525 1.00 0.00 O ATOM 1590 CB SER A 111 11.350 -7.782 5.612 1.00 0.00 C ATOM 1591 OG SER A 111 12.762 -7.824 5.734 1.00 0.00 O ATOM 0 H SER A 111 9.955 -4.776 6.170 1.00 0.00 H new ATOM 0 HA SER A 111 11.533 -6.024 4.403 1.00 0.00 H new ATOM 0 HB2 SER A 111 10.900 -8.032 6.573 1.00 0.00 H new ATOM 0 HB3 SER A 111 11.029 -8.544 4.902 1.00 0.00 H new ATOM 0 HG SER A 111 13.100 -6.926 5.935 1.00 0.00 H new ATOM 1597 N ILE A 112 8.628 -7.345 5.154 1.00 0.00 N ATOM 1598 CA ILE A 112 7.356 -7.617 4.653 1.00 0.00 C ATOM 1599 C ILE A 112 6.434 -6.921 5.583 1.00 0.00 C ATOM 1600 O ILE A 112 5.654 -6.067 5.174 1.00 0.00 O ATOM 1601 CB ILE A 112 7.081 -9.136 4.647 1.00 0.00 C ATOM 1602 CG1 ILE A 112 8.244 -9.896 3.986 1.00 0.00 C ATOM 1603 CG2 ILE A 112 5.808 -9.409 3.893 1.00 0.00 C ATOM 1604 CD1 ILE A 112 8.113 -11.403 4.048 1.00 0.00 C ATOM 0 H ILE A 112 8.847 -7.813 6.033 1.00 0.00 H new ATOM 0 HA ILE A 112 7.238 -7.282 3.623 1.00 0.00 H new ATOM 0 HB ILE A 112 6.983 -9.479 5.677 1.00 0.00 H new ATOM 0 HG12 ILE A 112 8.316 -9.591 2.942 1.00 0.00 H new ATOM 0 HG13 ILE A 112 9.176 -9.603 4.469 1.00 0.00 H new ATOM 0 HG21 ILE A 112 5.611 -10.481 3.887 1.00 0.00 H new ATOM 0 HG22 ILE A 112 4.980 -8.891 4.377 1.00 0.00 H new ATOM 0 HG23 ILE A 112 5.909 -9.053 2.868 1.00 0.00 H new ATOM 0 HD11 ILE A 112 8.972 -11.863 3.560 1.00 0.00 H new ATOM 0 HD12 ILE A 112 8.073 -11.722 5.089 1.00 0.00 H new ATOM 0 HD13 ILE A 112 7.199 -11.710 3.539 1.00 0.00 H new ATOM 1616 N ILE A 113 6.598 -7.246 6.857 1.00 0.00 N ATOM 1617 CA ILE A 113 5.894 -6.608 7.940 1.00 0.00 C ATOM 1618 C ILE A 113 6.679 -5.324 8.281 1.00 0.00 C ATOM 1619 O ILE A 113 7.740 -5.063 7.677 1.00 0.00 O ATOM 1620 CB ILE A 113 5.813 -7.581 9.192 1.00 0.00 C ATOM 1621 CG1 ILE A 113 4.793 -7.091 10.232 1.00 0.00 C ATOM 1622 CG2 ILE A 113 7.185 -7.757 9.853 1.00 0.00 C ATOM 1623 CD1 ILE A 113 4.607 -8.020 11.417 1.00 0.00 C ATOM 0 H ILE A 113 7.240 -7.977 7.164 1.00 0.00 H new ATOM 0 HA ILE A 113 4.869 -6.366 7.661 1.00 0.00 H new ATOM 0 HB ILE A 113 5.479 -8.547 8.814 1.00 0.00 H new ATOM 0 HG12 ILE A 113 5.108 -6.114 10.598 1.00 0.00 H new ATOM 0 HG13 ILE A 113 3.830 -6.952 9.741 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.094 -8.429 10.707 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.885 -8.179 9.132 1.00 0.00 H new ATOM 0 HG23 ILE A 113 7.553 -6.788 10.191 1.00 0.00 H new ATOM 0 HD11 ILE A 113 3.870 -7.596 12.100 1.00 0.00 H new ATOM 0 HD12 ILE A 113 4.260 -8.992 11.066 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.557 -8.140 11.938 1.00 0.00 H new ATOM 1635 N GLY A 114 6.181 -4.525 9.184 1.00 0.00 N ATOM 1636 CA GLY A 114 6.882 -3.345 9.558 1.00 0.00 C ATOM 1637 C GLY A 114 6.509 -2.191 8.714 1.00 0.00 C ATOM 1638 O GLY A 114 7.279 -1.254 8.572 1.00 0.00 O ATOM 0 H GLY A 114 5.296 -4.675 9.668 1.00 0.00 H new ATOM 0 HA2 GLY A 114 6.672 -3.114 10.602 1.00 0.00 H new ATOM 0 HA3 GLY A 114 7.955 -3.520 9.480 1.00 0.00 H new ATOM 1642 N ARG A 115 5.344 -2.259 8.117 1.00 0.00 N ATOM 1643 CA ARG A 115 4.805 -1.162 7.328 1.00 0.00 C ATOM 1644 C ARG A 115 3.295 -1.156 7.469 1.00 0.00 C ATOM 1645 O ARG A 115 2.673 -2.160 7.258 1.00 0.00 O ATOM 1646 CB ARG A 115 5.143 -1.334 5.841 1.00 0.00 C ATOM 1647 CG ARG A 115 6.626 -1.368 5.490 1.00 0.00 C ATOM 1648 CD ARG A 115 6.806 -1.738 4.042 1.00 0.00 C ATOM 1649 NE ARG A 115 6.205 -3.052 3.785 1.00 0.00 N ATOM 1650 CZ ARG A 115 5.390 -3.336 2.782 1.00 0.00 C ATOM 1651 NH1 ARG A 115 5.171 -2.444 1.809 1.00 0.00 N ATOM 1652 NH2 ARG A 115 4.788 -4.514 2.759 1.00 0.00 N ATOM 0 H ARG A 115 4.736 -3.077 8.161 1.00 0.00 H new ATOM 0 HA ARG A 115 5.242 -0.231 7.688 1.00 0.00 H new ATOM 0 HB2 ARG A 115 4.686 -2.259 5.490 1.00 0.00 H new ATOM 0 HB3 ARG A 115 4.678 -0.519 5.287 1.00 0.00 H new ATOM 0 HG2 ARG A 115 7.076 -0.394 5.683 1.00 0.00 H new ATOM 0 HG3 ARG A 115 7.142 -2.089 6.125 1.00 0.00 H new ATOM 0 HD2 ARG A 115 6.342 -0.985 3.405 1.00 0.00 H new ATOM 0 HD3 ARG A 115 7.867 -1.758 3.792 1.00 0.00 H new ATOM 0 HE ARG A 115 6.434 -3.807 4.432 1.00 0.00 H new ATOM 0 HH11 ARG A 115 5.634 -1.536 1.836 1.00 0.00 H new ATOM 0 HH12 ARG A 115 4.541 -2.672 1.040 1.00 0.00 H new ATOM 0 HH21 ARG A 115 4.955 -5.187 3.507 1.00 0.00 H new ATOM 0 HH22 ARG A 115 4.157 -4.749 1.993 1.00 0.00 H new ATOM 1666 N THR A 116 2.735 -0.077 7.905 1.00 0.00 N ATOM 1667 CA THR A 116 1.323 0.091 7.909 1.00 0.00 C ATOM 1668 C THR A 116 0.966 0.981 6.728 1.00 0.00 C ATOM 1669 O THR A 116 1.383 2.141 6.693 1.00 0.00 O ATOM 1670 CB THR A 116 0.870 0.704 9.244 1.00 0.00 C ATOM 1671 OG1 THR A 116 1.744 1.782 9.587 1.00 0.00 O ATOM 1672 CG2 THR A 116 0.906 -0.325 10.346 1.00 0.00 C ATOM 0 H THR A 116 3.253 0.721 8.273 1.00 0.00 H new ATOM 0 HA THR A 116 0.810 -0.866 7.810 1.00 0.00 H new ATOM 0 HB THR A 116 -0.153 1.064 9.132 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.271 2.634 9.479 1.00 0.00 H new ATOM 0 HG21 THR A 116 0.581 0.132 11.281 1.00 0.00 H new ATOM 0 HG22 THR A 116 0.240 -1.150 10.095 1.00 0.00 H new ATOM 0 HG23 THR A 116 1.923 -0.701 10.460 1.00 0.00 H new ATOM 1680 N LEU A 117 0.229 0.432 5.773 1.00 0.00 N ATOM 1681 CA LEU A 117 -0.020 1.111 4.501 1.00 0.00 C ATOM 1682 C LEU A 117 -0.947 2.289 4.650 1.00 0.00 C ATOM 1683 O LEU A 117 -1.811 2.289 5.526 1.00 0.00 O ATOM 1684 CB LEU A 117 -0.581 0.149 3.403 1.00 0.00 C ATOM 1685 CG LEU A 117 -2.089 -0.233 3.430 1.00 0.00 C ATOM 1686 CD1 LEU A 117 -2.447 -1.031 2.186 1.00 0.00 C ATOM 1687 CD2 LEU A 117 -2.461 -1.029 4.667 1.00 0.00 C ATOM 0 H LEU A 117 -0.210 -0.485 5.852 1.00 0.00 H new ATOM 0 HA LEU A 117 0.956 1.472 4.178 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -0.374 0.601 2.433 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -0.007 -0.776 3.452 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.655 0.698 3.453 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -3.504 -1.294 2.214 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -2.246 -0.431 1.298 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -1.848 -1.941 2.153 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -3.523 -1.271 4.638 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -1.880 -1.951 4.695 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -2.247 -0.438 5.558 1.00 0.00 H new ATOM 1699 N VAL A 118 -0.758 3.325 3.822 1.00 0.00 N ATOM 1700 CA VAL A 118 -1.749 4.384 3.851 1.00 0.00 C ATOM 1701 C VAL A 118 -2.348 4.687 2.439 1.00 0.00 C ATOM 1702 O VAL A 118 -1.697 5.464 1.503 1.00 0.00 O ATOM 1703 CB VAL A 118 -1.264 5.666 4.591 1.00 0.00 C ATOM 1704 CG1 VAL A 118 -0.433 6.617 3.741 1.00 0.00 C ATOM 1705 CG2 VAL A 118 -2.403 6.358 5.300 1.00 0.00 C ATOM 0 H VAL A 118 0.018 3.443 3.170 1.00 0.00 H new ATOM 0 HA VAL A 118 -2.571 3.998 4.454 1.00 0.00 H new ATOM 0 HB VAL A 118 -0.564 5.316 5.350 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.141 7.480 4.340 1.00 0.00 H new ATOM 0 HG12 VAL A 118 0.460 6.102 3.386 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -1.022 6.951 2.887 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -2.029 7.248 5.806 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -3.163 6.645 4.573 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -2.840 5.681 6.033 1.00 0.00 H new ATOM 1715 N VAL A 119 -3.542 4.114 2.239 1.00 0.00 N ATOM 1716 CA VAL A 119 -4.362 4.205 1.020 1.00 0.00 C ATOM 1717 C VAL A 119 -5.824 4.128 1.482 1.00 0.00 C ATOM 1718 O VAL A 119 -6.066 3.521 2.490 1.00 0.00 O ATOM 1719 CB VAL A 119 -4.141 2.983 0.059 1.00 0.00 C ATOM 1720 CG1 VAL A 119 -4.731 3.245 -1.311 1.00 0.00 C ATOM 1721 CG2 VAL A 119 -2.690 2.574 -0.056 1.00 0.00 C ATOM 0 H VAL A 119 -3.987 3.545 2.959 1.00 0.00 H new ATOM 0 HA VAL A 119 -4.100 5.120 0.489 1.00 0.00 H new ATOM 0 HB VAL A 119 -4.670 2.145 0.513 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -4.561 2.380 -1.952 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -5.802 3.423 -1.218 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -4.255 4.121 -1.751 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -2.604 1.725 -0.734 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -2.106 3.409 -0.444 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -2.312 2.293 0.927 1.00 0.00 H new ATOM 1731 N HIS A 120 -6.768 4.723 0.767 1.00 0.00 N ATOM 1732 CA HIS A 120 -8.188 4.591 1.112 1.00 0.00 C ATOM 1733 C HIS A 120 -8.955 4.558 -0.212 1.00 0.00 C ATOM 1734 O HIS A 120 -8.328 4.787 -1.260 1.00 0.00 O ATOM 1735 CB HIS A 120 -8.658 5.773 2.019 1.00 0.00 C ATOM 1736 CG HIS A 120 -10.070 5.627 2.545 1.00 0.00 C ATOM 1737 ND1 HIS A 120 -11.126 6.377 2.092 1.00 0.00 N ATOM 1738 CD2 HIS A 120 -10.595 4.753 3.425 1.00 0.00 C ATOM 1739 CE1 HIS A 120 -12.235 5.962 2.658 1.00 0.00 C ATOM 1740 NE2 HIS A 120 -11.950 4.967 3.468 1.00 0.00 N ATOM 0 H HIS A 120 -6.584 5.301 -0.053 1.00 0.00 H new ATOM 0 HA HIS A 120 -8.371 3.682 1.685 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -7.975 5.862 2.864 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -8.587 6.702 1.452 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -10.048 4.016 3.994 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -13.220 6.371 2.486 1.00 0.00 H new ATOM 0 HE2 HIS A 120 -12.620 4.444 4.031 1.00 0.00 H new ATOM 1749 N GLU A 121 -10.223 4.254 -0.185 1.00 0.00 N ATOM 1750 CA GLU A 121 -11.047 4.255 -1.371 1.00 0.00 C ATOM 1751 C GLU A 121 -11.177 5.714 -1.830 1.00 0.00 C ATOM 1752 O GLU A 121 -12.032 6.451 -1.357 1.00 0.00 O ATOM 1753 CB GLU A 121 -12.476 3.703 -1.065 1.00 0.00 C ATOM 1754 CG GLU A 121 -12.583 2.411 -0.240 1.00 0.00 C ATOM 1755 CD GLU A 121 -12.275 2.634 1.226 1.00 0.00 C ATOM 1756 OE1 GLU A 121 -13.188 3.039 2.006 1.00 0.00 O ATOM 1757 OE2 GLU A 121 -11.107 2.488 1.613 1.00 0.00 O ATOM 0 H GLU A 121 -10.722 3.996 0.666 1.00 0.00 H new ATOM 0 HA GLU A 121 -10.592 3.622 -2.133 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -13.031 4.482 -0.542 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -12.981 3.536 -2.016 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -13.589 2.002 -0.339 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -11.896 1.668 -0.644 1.00 0.00 H new ATOM 1764 N LYS A 122 -10.257 6.140 -2.675 1.00 0.00 N ATOM 1765 CA LYS A 122 -10.181 7.511 -3.110 1.00 0.00 C ATOM 1766 C LYS A 122 -9.307 7.574 -4.377 1.00 0.00 C ATOM 1767 O LYS A 122 -8.758 6.550 -4.819 1.00 0.00 O ATOM 1768 CB LYS A 122 -9.566 8.380 -1.987 1.00 0.00 C ATOM 1769 CG LYS A 122 -9.695 9.877 -2.202 1.00 0.00 C ATOM 1770 CD LYS A 122 -8.924 10.687 -1.189 1.00 0.00 C ATOM 1771 CE LYS A 122 -9.096 12.172 -1.466 1.00 0.00 C ATOM 1772 NZ LYS A 122 -8.716 12.519 -2.850 1.00 0.00 N ATOM 0 H LYS A 122 -9.540 5.537 -3.078 1.00 0.00 H new ATOM 0 HA LYS A 122 -11.177 7.893 -3.334 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -10.043 8.120 -1.042 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -8.509 8.130 -1.890 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -9.342 10.126 -3.203 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -10.748 10.156 -2.156 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -9.274 10.454 -0.183 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -7.867 10.422 -1.228 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -10.134 12.456 -1.292 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -8.487 12.745 -0.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -8.584 13.548 -2.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -7.828 12.037 -3.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -9.467 12.217 -3.502 1.00 0.00 H new ATOM 1786 N ALA A 123 -9.271 8.714 -5.000 1.00 0.00 N ATOM 1787 CA ALA A 123 -8.490 8.934 -6.186 1.00 0.00 C ATOM 1788 C ALA A 123 -7.485 10.099 -6.052 1.00 0.00 C ATOM 1789 O ALA A 123 -7.901 11.252 -5.999 1.00 0.00 O ATOM 1790 CB ALA A 123 -9.414 9.205 -7.352 1.00 0.00 C ATOM 0 H ALA A 123 -9.793 9.535 -4.694 1.00 0.00 H new ATOM 0 HA ALA A 123 -7.906 8.029 -6.350 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -8.824 9.372 -8.253 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -10.071 8.348 -7.502 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -10.015 10.090 -7.142 1.00 0.00 H new ATOM 1796 N ASP A 124 -6.194 9.809 -5.945 1.00 0.00 N ATOM 1797 CA ASP A 124 -5.178 10.872 -6.134 1.00 0.00 C ATOM 1798 C ASP A 124 -4.089 10.387 -7.066 1.00 0.00 C ATOM 1799 O ASP A 124 -4.253 10.475 -8.278 1.00 0.00 O ATOM 1800 CB ASP A 124 -4.566 11.439 -4.822 1.00 0.00 C ATOM 1801 CG ASP A 124 -5.468 12.418 -4.095 1.00 0.00 C ATOM 1802 OD1 ASP A 124 -5.439 13.644 -4.418 1.00 0.00 O ATOM 1803 OD2 ASP A 124 -6.206 12.007 -3.202 1.00 0.00 O ATOM 0 H ASP A 124 -5.820 8.883 -5.736 1.00 0.00 H new ATOM 0 HA ASP A 124 -5.712 11.712 -6.578 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -4.333 10.610 -4.154 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -3.624 11.934 -5.057 1.00 0.00 H new ATOM 1808 N ASP A 125 -3.062 9.747 -6.524 1.00 0.00 N ATOM 1809 CA ASP A 125 -1.965 9.146 -7.321 1.00 0.00 C ATOM 1810 C ASP A 125 -0.904 8.680 -6.364 1.00 0.00 C ATOM 1811 O ASP A 125 -0.856 9.157 -5.231 1.00 0.00 O ATOM 1812 CB ASP A 125 -1.339 10.133 -8.339 1.00 0.00 C ATOM 1813 CG ASP A 125 -0.379 9.447 -9.298 1.00 0.00 C ATOM 1814 OD1 ASP A 125 -0.850 8.811 -10.270 1.00 0.00 O ATOM 1815 OD2 ASP A 125 0.851 9.527 -9.095 1.00 0.00 O ATOM 0 H ASP A 125 -2.952 9.622 -5.518 1.00 0.00 H new ATOM 0 HA ASP A 125 -2.381 8.323 -7.902 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -2.133 10.616 -8.908 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -0.810 10.919 -7.800 1.00 0.00 H new ATOM 1820 N LEU A 126 -0.092 7.749 -6.775 1.00 0.00 N ATOM 1821 CA LEU A 126 0.928 7.201 -5.905 1.00 0.00 C ATOM 1822 C LEU A 126 2.274 7.946 -5.989 1.00 0.00 C ATOM 1823 O LEU A 126 2.993 8.003 -5.006 1.00 0.00 O ATOM 1824 CB LEU A 126 1.101 5.666 -6.088 1.00 0.00 C ATOM 1825 CG LEU A 126 1.747 5.115 -7.386 1.00 0.00 C ATOM 1826 CD1 LEU A 126 1.822 3.607 -7.302 1.00 0.00 C ATOM 1827 CD2 LEU A 126 0.978 5.509 -8.643 1.00 0.00 C ATOM 0 H LEU A 126 -0.111 7.346 -7.712 1.00 0.00 H new ATOM 0 HA LEU A 126 0.560 7.365 -4.892 1.00 0.00 H new ATOM 0 HB2 LEU A 126 1.695 5.303 -5.249 1.00 0.00 H new ATOM 0 HB3 LEU A 126 0.113 5.214 -5.999 1.00 0.00 H new ATOM 0 HG LEU A 126 2.742 5.553 -7.464 1.00 0.00 H new ATOM 0 HD11 LEU A 126 2.275 3.214 -8.212 1.00 0.00 H new ATOM 0 HD12 LEU A 126 2.427 3.320 -6.442 1.00 0.00 H new ATOM 0 HD13 LEU A 126 0.818 3.198 -7.191 1.00 0.00 H new ATOM 0 HD21 LEU A 126 1.477 5.095 -9.519 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -0.038 5.118 -8.585 1.00 0.00 H new ATOM 0 HD23 LEU A 126 0.945 6.596 -8.724 1.00 0.00 H new ATOM 1839 N GLY A 127 2.584 8.531 -7.147 1.00 0.00 N ATOM 1840 CA GLY A 127 3.862 9.222 -7.326 1.00 0.00 C ATOM 1841 C GLY A 127 3.695 10.728 -7.316 1.00 0.00 C ATOM 1842 O GLY A 127 4.628 11.476 -7.026 1.00 0.00 O ATOM 0 H GLY A 127 1.976 8.541 -7.966 1.00 0.00 H new ATOM 0 HA2 GLY A 127 4.549 8.927 -6.532 1.00 0.00 H new ATOM 0 HA3 GLY A 127 4.313 8.913 -8.269 1.00 0.00 H new ATOM 1846 N LYS A 128 2.508 11.165 -7.634 1.00 0.00 N ATOM 1847 CA LYS A 128 2.163 12.562 -7.617 1.00 0.00 C ATOM 1848 C LYS A 128 0.883 12.718 -6.792 1.00 0.00 C ATOM 1849 O LYS A 128 -0.115 13.285 -7.242 1.00 0.00 O ATOM 1850 CB LYS A 128 1.979 13.090 -9.049 1.00 0.00 C ATOM 1851 CG LYS A 128 1.892 14.611 -9.159 1.00 0.00 C ATOM 1852 CD LYS A 128 3.188 15.266 -8.715 1.00 0.00 C ATOM 1853 CE LYS A 128 3.102 16.773 -8.800 1.00 0.00 C ATOM 1854 NZ LYS A 128 4.381 17.411 -8.451 1.00 0.00 N ATOM 0 H LYS A 128 1.742 10.554 -7.916 1.00 0.00 H new ATOM 0 HA LYS A 128 2.963 13.149 -7.165 1.00 0.00 H new ATOM 0 HB2 LYS A 128 2.811 12.742 -9.661 1.00 0.00 H new ATOM 0 HB3 LYS A 128 1.071 12.656 -9.469 1.00 0.00 H new ATOM 0 HG2 LYS A 128 1.673 14.892 -10.189 1.00 0.00 H new ATOM 0 HG3 LYS A 128 1.068 14.976 -8.547 1.00 0.00 H new ATOM 0 HD2 LYS A 128 3.415 14.970 -7.691 1.00 0.00 H new ATOM 0 HD3 LYS A 128 4.009 14.911 -9.338 1.00 0.00 H new ATOM 0 HE2 LYS A 128 2.813 17.065 -9.810 1.00 0.00 H new ATOM 0 HE3 LYS A 128 2.321 17.132 -8.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 4.284 18.444 -8.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 4.644 17.153 -7.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 5.121 17.088 -9.107 1.00 0.00 H new ATOM 1868 N GLY A 129 0.913 12.168 -5.591 1.00 0.00 N ATOM 1869 CA GLY A 129 -0.255 12.140 -4.740 1.00 0.00 C ATOM 1870 C GLY A 129 -0.649 13.490 -4.175 1.00 0.00 C ATOM 1871 O GLY A 129 -0.293 13.824 -3.048 1.00 0.00 O ATOM 0 H GLY A 129 1.741 11.733 -5.184 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -1.094 11.738 -5.308 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -0.071 11.453 -3.914 1.00 0.00 H new ATOM 1875 N GLY A 130 -1.353 14.262 -4.955 1.00 0.00 N ATOM 1876 CA GLY A 130 -1.877 15.515 -4.491 1.00 0.00 C ATOM 1877 C GLY A 130 -0.902 16.649 -4.649 1.00 0.00 C ATOM 1878 O GLY A 130 -0.338 16.859 -5.736 1.00 0.00 O ATOM 0 H GLY A 130 -1.579 14.042 -5.925 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -2.790 15.747 -5.040 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -2.152 15.422 -3.440 1.00 0.00 H new ATOM 1882 N ASN A 131 -0.671 17.360 -3.573 1.00 0.00 N ATOM 1883 CA ASN A 131 0.190 18.530 -3.604 1.00 0.00 C ATOM 1884 C ASN A 131 1.589 18.141 -3.105 1.00 0.00 C ATOM 1885 O ASN A 131 1.811 16.968 -2.804 1.00 0.00 O ATOM 1886 CB ASN A 131 -0.416 19.647 -2.754 1.00 0.00 C ATOM 1887 CG ASN A 131 0.202 20.997 -3.044 1.00 0.00 C ATOM 1888 OD1 ASN A 131 0.631 21.270 -4.164 1.00 0.00 O ATOM 1889 ND2 ASN A 131 0.320 21.803 -2.050 1.00 0.00 N ATOM 0 H ASN A 131 -1.067 17.152 -2.656 1.00 0.00 H new ATOM 0 HA ASN A 131 0.278 18.901 -4.625 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -1.490 19.696 -2.936 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -0.282 19.409 -1.699 1.00 0.00 H new ATOM 0 HD21 ASN A 131 0.782 22.704 -2.176 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -0.048 21.542 -1.135 1.00 0.00 H new ATOM 1896 N GLU A 132 2.525 19.088 -2.993 1.00 0.00 N ATOM 1897 CA GLU A 132 3.887 18.745 -2.607 1.00 0.00 C ATOM 1898 C GLU A 132 3.974 18.117 -1.208 1.00 0.00 C ATOM 1899 O GLU A 132 4.549 17.029 -1.050 1.00 0.00 O ATOM 1900 CB GLU A 132 4.853 19.906 -2.758 1.00 0.00 C ATOM 1901 CG GLU A 132 6.285 19.463 -2.569 1.00 0.00 C ATOM 1902 CD GLU A 132 7.290 20.539 -2.781 1.00 0.00 C ATOM 1903 OE1 GLU A 132 7.266 21.187 -3.837 1.00 0.00 O ATOM 1904 OE2 GLU A 132 8.142 20.743 -1.898 1.00 0.00 O ATOM 0 H GLU A 132 2.364 20.081 -3.162 1.00 0.00 H new ATOM 0 HA GLU A 132 4.201 17.978 -3.315 1.00 0.00 H new ATOM 0 HB2 GLU A 132 4.736 20.352 -3.746 1.00 0.00 H new ATOM 0 HB3 GLU A 132 4.611 20.679 -2.029 1.00 0.00 H new ATOM 0 HG2 GLU A 132 6.401 19.067 -1.560 1.00 0.00 H new ATOM 0 HG3 GLU A 132 6.494 18.645 -3.258 1.00 0.00 H new ATOM 1911 N GLU A 133 3.387 18.747 -0.215 1.00 0.00 N ATOM 1912 CA GLU A 133 3.398 18.180 1.130 1.00 0.00 C ATOM 1913 C GLU A 133 2.630 16.867 1.160 1.00 0.00 C ATOM 1914 O GLU A 133 2.980 15.941 1.895 1.00 0.00 O ATOM 1915 CB GLU A 133 2.881 19.160 2.218 1.00 0.00 C ATOM 1916 CG GLU A 133 1.430 19.645 2.087 1.00 0.00 C ATOM 1917 CD GLU A 133 1.175 20.487 0.862 1.00 0.00 C ATOM 1918 OE1 GLU A 133 2.119 21.104 0.333 1.00 0.00 O ATOM 1919 OE2 GLU A 133 0.025 20.564 0.414 1.00 0.00 O ATOM 0 H GLU A 133 2.901 19.639 -0.302 1.00 0.00 H new ATOM 0 HA GLU A 133 4.442 17.987 1.378 1.00 0.00 H new ATOM 0 HB2 GLU A 133 2.990 18.676 3.189 1.00 0.00 H new ATOM 0 HB3 GLU A 133 3.531 20.035 2.223 1.00 0.00 H new ATOM 0 HG2 GLU A 133 0.768 18.779 2.065 1.00 0.00 H new ATOM 0 HG3 GLU A 133 1.169 20.223 2.974 1.00 0.00 H new ATOM 1926 N SER A 134 1.621 16.759 0.313 1.00 0.00 N ATOM 1927 CA SER A 134 0.823 15.564 0.200 1.00 0.00 C ATOM 1928 C SER A 134 1.656 14.406 -0.407 1.00 0.00 C ATOM 1929 O SER A 134 1.542 13.253 0.037 1.00 0.00 O ATOM 1930 CB SER A 134 -0.387 15.863 -0.655 1.00 0.00 C ATOM 1931 OG SER A 134 -0.998 17.066 -0.236 1.00 0.00 O ATOM 0 H SER A 134 1.335 17.508 -0.318 1.00 0.00 H new ATOM 0 HA SER A 134 0.496 15.248 1.191 1.00 0.00 H new ATOM 0 HB2 SER A 134 -0.091 15.943 -1.701 1.00 0.00 H new ATOM 0 HB3 SER A 134 -1.101 15.042 -0.587 1.00 0.00 H new ATOM 0 HG SER A 134 -1.779 17.249 -0.799 1.00 0.00 H new ATOM 1937 N THR A 135 2.520 14.719 -1.395 1.00 0.00 N ATOM 1938 CA THR A 135 3.394 13.710 -1.995 1.00 0.00 C ATOM 1939 C THR A 135 4.405 13.193 -0.973 1.00 0.00 C ATOM 1940 O THR A 135 4.795 12.038 -1.001 1.00 0.00 O ATOM 1941 CB THR A 135 4.113 14.206 -3.303 1.00 0.00 C ATOM 1942 OG1 THR A 135 4.835 15.441 -3.092 1.00 0.00 O ATOM 1943 CG2 THR A 135 3.116 14.411 -4.424 1.00 0.00 C ATOM 0 H THR A 135 2.625 15.655 -1.786 1.00 0.00 H new ATOM 0 HA THR A 135 2.749 12.886 -2.301 1.00 0.00 H new ATOM 0 HB THR A 135 4.825 13.427 -3.577 1.00 0.00 H new ATOM 0 HG1 THR A 135 4.591 15.818 -2.221 1.00 0.00 H new ATOM 0 HG21 THR A 135 3.638 14.754 -5.317 1.00 0.00 H new ATOM 0 HG22 THR A 135 2.611 13.469 -4.638 1.00 0.00 H new ATOM 0 HG23 THR A 135 2.380 15.158 -4.125 1.00 0.00 H new ATOM 1951 N LYS A 136 4.718 14.027 -0.017 1.00 0.00 N ATOM 1952 CA LYS A 136 5.647 13.665 1.045 1.00 0.00 C ATOM 1953 C LYS A 136 4.924 12.922 2.183 1.00 0.00 C ATOM 1954 O LYS A 136 5.544 12.339 3.049 1.00 0.00 O ATOM 1955 CB LYS A 136 6.356 14.914 1.565 1.00 0.00 C ATOM 1956 CG LYS A 136 7.134 15.638 0.482 1.00 0.00 C ATOM 1957 CD LYS A 136 7.706 16.956 0.973 1.00 0.00 C ATOM 1958 CE LYS A 136 8.352 17.721 -0.174 1.00 0.00 C ATOM 1959 NZ LYS A 136 8.765 19.086 0.216 1.00 0.00 N ATOM 0 H LYS A 136 4.344 14.973 0.056 1.00 0.00 H new ATOM 0 HA LYS A 136 6.396 12.986 0.637 1.00 0.00 H new ATOM 0 HB2 LYS A 136 5.619 15.593 1.994 1.00 0.00 H new ATOM 0 HB3 LYS A 136 7.036 14.633 2.369 1.00 0.00 H new ATOM 0 HG2 LYS A 136 7.945 15.000 0.131 1.00 0.00 H new ATOM 0 HG3 LYS A 136 6.481 15.822 -0.371 1.00 0.00 H new ATOM 0 HD2 LYS A 136 6.914 17.558 1.419 1.00 0.00 H new ATOM 0 HD3 LYS A 136 8.443 16.770 1.754 1.00 0.00 H new ATOM 0 HE2 LYS A 136 9.222 17.169 -0.529 1.00 0.00 H new ATOM 0 HE3 LYS A 136 7.651 17.781 -1.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 8.376 19.773 -0.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 8.406 19.298 1.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 9.803 19.148 0.215 1.00 0.00 H new ATOM 1973 N THR A 137 3.624 13.022 2.204 1.00 0.00 N ATOM 1974 CA THR A 137 2.820 12.299 3.166 1.00 0.00 C ATOM 1975 C THR A 137 2.459 10.880 2.616 1.00 0.00 C ATOM 1976 O THR A 137 2.078 9.961 3.367 1.00 0.00 O ATOM 1977 CB THR A 137 1.535 13.109 3.497 1.00 0.00 C ATOM 1978 OG1 THR A 137 1.908 14.448 3.894 1.00 0.00 O ATOM 1979 CG2 THR A 137 0.740 12.471 4.636 1.00 0.00 C ATOM 0 H THR A 137 3.088 13.603 1.560 1.00 0.00 H new ATOM 0 HA THR A 137 3.393 12.169 4.084 1.00 0.00 H new ATOM 0 HB THR A 137 0.910 13.122 2.604 1.00 0.00 H new ATOM 0 HG1 THR A 137 2.136 14.973 3.099 1.00 0.00 H new ATOM 0 HG21 THR A 137 -0.150 13.067 4.837 1.00 0.00 H new ATOM 0 HG22 THR A 137 0.444 11.461 4.352 1.00 0.00 H new ATOM 0 HG23 THR A 137 1.358 12.429 5.533 1.00 0.00 H new ATOM 1987 N GLY A 138 2.601 10.702 1.298 1.00 0.00 N ATOM 1988 CA GLY A 138 2.159 9.471 0.673 1.00 0.00 C ATOM 1989 C GLY A 138 0.642 9.447 0.669 1.00 0.00 C ATOM 1990 O GLY A 138 -0.048 8.251 0.825 1.00 0.00 O ATOM 0 H GLY A 138 3.011 11.386 0.662 1.00 0.00 H new ATOM 0 HA2 GLY A 138 2.541 9.406 -0.346 1.00 0.00 H new ATOM 0 HA3 GLY A 138 2.549 8.610 1.216 1.00 0.00 H new ATOM 1994 N ASN A 139 0.120 10.608 0.205 1.00 0.00 N ATOM 1995 CA ASN A 139 -1.235 11.173 0.419 1.00 0.00 C ATOM 1996 C ASN A 139 -2.314 10.148 0.604 1.00 0.00 C ATOM 1997 O ASN A 139 -2.568 9.344 -0.266 1.00 0.00 O ATOM 1998 CB ASN A 139 -1.587 11.992 -0.824 1.00 0.00 C ATOM 1999 CG ASN A 139 -2.823 12.874 -0.697 1.00 0.00 C ATOM 2000 OD1 ASN A 139 -3.715 12.646 0.109 1.00 0.00 O ATOM 2001 ND2 ASN A 139 -2.885 13.870 -1.524 1.00 0.00 N ATOM 0 H ASN A 139 0.684 11.226 -0.378 1.00 0.00 H new ATOM 0 HA ASN A 139 -1.195 11.757 1.339 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -0.735 12.624 -1.075 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -1.734 11.308 -1.660 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -3.694 14.491 -1.515 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -2.124 14.033 -2.184 1.00 0.00 H new ATOM 2008 N ALA A 140 -2.736 10.045 1.840 1.00 0.00 N ATOM 2009 CA ALA A 140 -3.915 9.340 2.265 1.00 0.00 C ATOM 2010 C ALA A 140 -4.337 9.964 3.572 1.00 0.00 C ATOM 2011 O ALA A 140 -3.596 10.826 4.082 1.00 0.00 O ATOM 2012 CB ALA A 140 -3.658 7.873 2.429 1.00 0.00 C ATOM 0 H ALA A 140 -2.236 10.476 2.618 1.00 0.00 H new ATOM 0 HA ALA A 140 -4.701 9.423 1.514 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -4.574 7.377 2.751 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -3.332 7.452 1.478 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -2.881 7.721 3.178 1.00 0.00 H new ATOM 2018 N GLY A 141 -5.490 9.606 4.093 1.00 0.00 N ATOM 2019 CA GLY A 141 -5.801 9.972 5.465 1.00 0.00 C ATOM 2020 C GLY A 141 -4.794 9.277 6.381 1.00 0.00 C ATOM 2021 O GLY A 141 -4.777 8.049 6.423 1.00 0.00 O ATOM 0 H GLY A 141 -6.213 9.076 3.607 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -5.748 11.053 5.592 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -6.817 9.671 5.718 1.00 0.00 H new ATOM 2025 N SER A 142 -4.016 10.067 7.135 1.00 0.00 N ATOM 2026 CA SER A 142 -2.807 9.629 7.873 1.00 0.00 C ATOM 2027 C SER A 142 -2.925 8.270 8.593 1.00 0.00 C ATOM 2028 O SER A 142 -2.006 7.442 8.486 1.00 0.00 O ATOM 2029 CB SER A 142 -2.380 10.726 8.838 1.00 0.00 C ATOM 2030 OG SER A 142 -2.308 11.974 8.155 1.00 0.00 O ATOM 0 H SER A 142 -4.211 11.061 7.256 1.00 0.00 H new ATOM 0 HA SER A 142 -2.040 9.460 7.117 1.00 0.00 H new ATOM 0 HB2 SER A 142 -3.090 10.793 9.662 1.00 0.00 H new ATOM 0 HB3 SER A 142 -1.410 10.483 9.272 1.00 0.00 H new ATOM 0 HG SER A 142 -2.034 12.675 8.783 1.00 0.00 H new ATOM 2036 N ARG A 143 -3.974 8.039 9.303 1.00 0.00 N ATOM 2037 CA ARG A 143 -4.144 6.746 9.881 1.00 0.00 C ATOM 2038 C ARG A 143 -5.537 6.282 9.605 1.00 0.00 C ATOM 2039 O ARG A 143 -5.999 5.277 10.157 1.00 0.00 O ATOM 2040 CB ARG A 143 -3.839 6.734 11.402 1.00 0.00 C ATOM 2041 CG ARG A 143 -4.944 7.193 12.361 1.00 0.00 C ATOM 2042 CD ARG A 143 -5.287 8.660 12.285 1.00 0.00 C ATOM 2043 NE ARG A 143 -6.358 8.961 13.238 1.00 0.00 N ATOM 2044 CZ ARG A 143 -7.164 10.022 13.207 1.00 0.00 C ATOM 2045 NH1 ARG A 143 -6.983 10.982 12.315 1.00 0.00 N ATOM 2046 NH2 ARG A 143 -8.144 10.119 14.083 1.00 0.00 N ATOM 0 H ARG A 143 -4.716 8.712 9.497 1.00 0.00 H new ATOM 0 HA ARG A 143 -3.427 6.062 9.427 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -3.558 5.718 11.678 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -2.966 7.364 11.573 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -5.845 6.614 12.157 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -4.639 6.959 13.381 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -4.407 9.262 12.509 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -5.602 8.919 11.274 1.00 0.00 H new ATOM 0 HE ARG A 143 -6.500 8.295 13.998 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -6.220 10.915 11.641 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -7.606 11.789 12.301 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -8.281 9.385 14.778 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -8.765 10.928 14.066 1.00 0.00 H new ATOM 2060 N LEU A 144 -6.209 6.994 8.732 1.00 0.00 N ATOM 2061 CA LEU A 144 -7.629 6.784 8.516 1.00 0.00 C ATOM 2062 C LEU A 144 -7.885 5.496 7.798 1.00 0.00 C ATOM 2063 O LEU A 144 -9.002 4.970 7.819 1.00 0.00 O ATOM 2064 CB LEU A 144 -8.282 7.978 7.810 1.00 0.00 C ATOM 2065 CG LEU A 144 -8.262 9.303 8.595 1.00 0.00 C ATOM 2066 CD1 LEU A 144 -8.901 10.421 7.792 1.00 0.00 C ATOM 2067 CD2 LEU A 144 -8.966 9.156 9.940 1.00 0.00 C ATOM 0 H LEU A 144 -5.797 7.728 8.155 1.00 0.00 H new ATOM 0 HA LEU A 144 -8.101 6.706 9.495 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -7.779 8.133 6.856 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -9.318 7.724 7.586 1.00 0.00 H new ATOM 0 HG LEU A 144 -7.218 9.559 8.778 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -8.874 11.345 8.369 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -8.353 10.559 6.860 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -9.936 10.163 7.569 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -8.936 10.107 10.472 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -10.003 8.863 9.778 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -8.462 8.393 10.533 1.00 0.00 H new ATOM 2079 N ALA A 145 -6.860 4.977 7.192 1.00 0.00 N ATOM 2080 CA ALA A 145 -6.901 3.720 6.582 1.00 0.00 C ATOM 2081 C ALA A 145 -5.521 3.155 6.657 1.00 0.00 C ATOM 2082 O ALA A 145 -4.665 3.442 5.820 1.00 0.00 O ATOM 2083 CB ALA A 145 -7.408 3.811 5.164 1.00 0.00 C ATOM 0 H ALA A 145 -5.956 5.444 7.117 1.00 0.00 H new ATOM 0 HA ALA A 145 -7.601 3.061 7.096 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -7.427 2.816 4.720 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -8.415 4.228 5.164 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -6.749 4.455 4.582 1.00 0.00 H new ATOM 2089 N CYS A 146 -5.287 2.462 7.729 1.00 0.00 N ATOM 2090 CA CYS A 146 -4.024 1.862 8.001 1.00 0.00 C ATOM 2091 C CYS A 146 -4.204 0.438 8.393 1.00 0.00 C ATOM 2092 O CYS A 146 -5.274 0.037 8.877 1.00 0.00 O ATOM 2093 CB CYS A 146 -3.275 2.588 9.120 1.00 0.00 C ATOM 2094 SG CYS A 146 -2.499 4.179 8.665 1.00 0.00 S ATOM 0 H CYS A 146 -5.986 2.296 8.453 1.00 0.00 H new ATOM 0 HA CYS A 146 -3.435 1.932 7.087 1.00 0.00 H new ATOM 0 HB2 CYS A 146 -3.971 2.767 9.939 1.00 0.00 H new ATOM 0 HB3 CYS A 146 -2.499 1.924 9.501 1.00 0.00 H new ATOM 2099 N GLY A 147 -3.179 -0.311 8.148 1.00 0.00 N ATOM 2100 CA GLY A 147 -3.103 -1.670 8.512 1.00 0.00 C ATOM 2101 C GLY A 147 -1.706 -2.134 8.274 1.00 0.00 C ATOM 2102 O GLY A 147 -1.040 -1.591 7.401 1.00 0.00 O ATOM 0 H GLY A 147 -2.345 0.029 7.670 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -3.374 -1.799 9.560 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -3.806 -2.261 7.925 1.00 0.00 H new ATOM 2106 N VAL A 148 -1.230 -3.062 9.051 1.00 0.00 N ATOM 2107 CA VAL A 148 0.082 -3.616 8.851 1.00 0.00 C ATOM 2108 C VAL A 148 0.070 -4.433 7.583 1.00 0.00 C ATOM 2109 O VAL A 148 -0.525 -5.519 7.526 1.00 0.00 O ATOM 2110 CB VAL A 148 0.541 -4.521 10.037 1.00 0.00 C ATOM 2111 CG1 VAL A 148 1.897 -5.145 9.749 1.00 0.00 C ATOM 2112 CG2 VAL A 148 0.613 -3.735 11.329 1.00 0.00 C ATOM 0 H VAL A 148 -1.738 -3.458 9.842 1.00 0.00 H new ATOM 0 HA VAL A 148 0.787 -2.787 8.785 1.00 0.00 H new ATOM 0 HB VAL A 148 -0.201 -5.312 10.147 1.00 0.00 H new ATOM 0 HG11 VAL A 148 2.195 -5.771 10.590 1.00 0.00 H new ATOM 0 HG12 VAL A 148 1.833 -5.754 8.848 1.00 0.00 H new ATOM 0 HG13 VAL A 148 2.636 -4.357 9.603 1.00 0.00 H new ATOM 0 HG21 VAL A 148 0.935 -4.392 12.137 1.00 0.00 H new ATOM 0 HG22 VAL A 148 1.326 -2.918 11.219 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -0.371 -3.328 11.563 1.00 0.00 H new ATOM 2122 N ILE A 149 0.664 -3.895 6.566 1.00 0.00 N ATOM 2123 CA ILE A 149 0.754 -4.577 5.341 1.00 0.00 C ATOM 2124 C ILE A 149 2.019 -5.400 5.398 1.00 0.00 C ATOM 2125 O ILE A 149 3.148 -4.888 5.334 1.00 0.00 O ATOM 2126 CB ILE A 149 0.661 -3.606 4.081 1.00 0.00 C ATOM 2127 CG1 ILE A 149 0.421 -4.355 2.730 1.00 0.00 C ATOM 2128 CG2 ILE A 149 1.823 -2.615 3.976 1.00 0.00 C ATOM 2129 CD1 ILE A 149 1.496 -5.332 2.279 1.00 0.00 C ATOM 0 H ILE A 149 1.096 -2.971 6.574 1.00 0.00 H new ATOM 0 HA ILE A 149 -0.103 -5.236 5.199 1.00 0.00 H new ATOM 0 HB ILE A 149 -0.233 -3.012 4.272 1.00 0.00 H new ATOM 0 HG12 ILE A 149 -0.520 -4.900 2.808 1.00 0.00 H new ATOM 0 HG13 ILE A 149 0.293 -3.608 1.947 1.00 0.00 H new ATOM 0 HG21 ILE A 149 1.689 -1.989 3.094 1.00 0.00 H new ATOM 0 HG22 ILE A 149 1.847 -1.987 4.866 1.00 0.00 H new ATOM 0 HG23 ILE A 149 2.762 -3.163 3.893 1.00 0.00 H new ATOM 0 HD11 ILE A 149 1.204 -5.781 1.330 1.00 0.00 H new ATOM 0 HD12 ILE A 149 2.440 -4.802 2.155 1.00 0.00 H new ATOM 0 HD13 ILE A 149 1.615 -6.114 3.029 1.00 0.00 H new ATOM 2141 N GLY A 150 1.845 -6.648 5.612 1.00 0.00 N ATOM 2142 CA GLY A 150 2.950 -7.474 5.708 1.00 0.00 C ATOM 2143 C GLY A 150 2.583 -8.858 5.991 1.00 0.00 C ATOM 2144 O GLY A 150 1.417 -9.195 6.054 1.00 0.00 O ATOM 0 H GLY A 150 0.940 -7.106 5.722 1.00 0.00 H new ATOM 0 HA2 GLY A 150 3.514 -7.433 4.776 1.00 0.00 H new ATOM 0 HA3 GLY A 150 3.608 -7.107 6.495 1.00 0.00 H new ATOM 2148 N ILE A 151 3.589 -9.659 6.134 1.00 0.00 N ATOM 2149 CA ILE A 151 3.492 -11.077 6.402 1.00 0.00 C ATOM 2150 C ILE A 151 2.625 -11.401 7.614 1.00 0.00 C ATOM 2151 O ILE A 151 2.920 -11.025 8.753 1.00 0.00 O ATOM 2152 CB ILE A 151 4.906 -11.742 6.549 1.00 0.00 C ATOM 2153 CG1 ILE A 151 4.781 -13.253 6.831 1.00 0.00 C ATOM 2154 CG2 ILE A 151 5.755 -11.043 7.616 1.00 0.00 C ATOM 2155 CD1 ILE A 151 6.106 -13.976 6.941 1.00 0.00 C ATOM 0 H ILE A 151 4.554 -9.336 6.065 1.00 0.00 H new ATOM 0 HA ILE A 151 2.997 -11.504 5.530 1.00 0.00 H new ATOM 0 HB ILE A 151 5.424 -11.621 5.598 1.00 0.00 H new ATOM 0 HG12 ILE A 151 4.225 -13.393 7.758 1.00 0.00 H new ATOM 0 HG13 ILE A 151 4.194 -13.712 6.035 1.00 0.00 H new ATOM 0 HG21 ILE A 151 6.726 -11.533 7.687 1.00 0.00 H new ATOM 0 HG22 ILE A 151 5.896 -9.997 7.342 1.00 0.00 H new ATOM 0 HG23 ILE A 151 5.248 -11.100 8.579 1.00 0.00 H new ATOM 0 HD11 ILE A 151 5.928 -15.033 7.140 1.00 0.00 H new ATOM 0 HD12 ILE A 151 6.657 -13.870 6.006 1.00 0.00 H new ATOM 0 HD13 ILE A 151 6.688 -13.546 7.756 1.00 0.00 H new ATOM 2167 N ALA A 152 1.532 -12.018 7.329 1.00 0.00 N ATOM 2168 CA ALA A 152 0.663 -12.562 8.307 1.00 0.00 C ATOM 2169 C ALA A 152 0.206 -13.878 7.755 1.00 0.00 C ATOM 2170 O ALA A 152 -0.612 -13.928 6.840 1.00 0.00 O ATOM 2171 CB ALA A 152 -0.511 -11.636 8.580 1.00 0.00 C ATOM 0 H ALA A 152 1.209 -12.162 6.372 1.00 0.00 H new ATOM 0 HA ALA A 152 1.169 -12.687 9.265 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -1.159 -12.082 9.335 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -0.141 -10.676 8.941 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -1.076 -11.484 7.660 1.00 0.00 H new ATOM 2177 N GLN A 153 0.808 -14.922 8.209 1.00 0.00 N ATOM 2178 CA GLN A 153 0.502 -16.219 7.724 1.00 0.00 C ATOM 2179 C GLN A 153 0.485 -17.180 8.888 1.00 0.00 C ATOM 2180 O GLN A 153 -0.554 -17.791 9.131 1.00 0.00 O ATOM 2181 CB GLN A 153 1.450 -16.643 6.555 1.00 0.00 C ATOM 2182 CG GLN A 153 2.915 -16.881 6.909 1.00 0.00 C ATOM 2183 CD GLN A 153 3.247 -18.361 6.995 1.00 0.00 C ATOM 2184 OE1 GLN A 153 3.656 -18.978 6.006 1.00 0.00 O ATOM 2185 NE2 GLN A 153 3.026 -18.948 8.134 1.00 0.00 N ATOM 2186 OXT GLN A 153 1.477 -17.218 9.661 1.00 0.00 O ATOM 0 H GLN A 153 1.529 -14.898 8.930 1.00 0.00 H new ATOM 0 HA GLN A 153 -0.492 -16.227 7.276 1.00 0.00 H new ATOM 0 HB2 GLN A 153 1.055 -17.557 6.112 1.00 0.00 H new ATOM 0 HB3 GLN A 153 1.407 -15.872 5.786 1.00 0.00 H new ATOM 0 HG2 GLN A 153 3.550 -16.410 6.159 1.00 0.00 H new ATOM 0 HG3 GLN A 153 3.140 -16.403 7.863 1.00 0.00 H new ATOM 0 HE21 GLN A 153 2.688 -18.407 8.930 1.00 0.00 H new ATOM 0 HE22 GLN A 153 3.190 -19.950 8.232 1.00 0.00 H new TER 2195 GLN A 153 HETATM 2196 CU CU A 201 -0.721 6.667 0.551 1.00 0.00 CU