USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 828 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 74 SER OG : rot 180:sc= 0.294 USER MOD Set 1.2: A 75 ASN : amide:sc= 0.322 K(o=0.62,f=0) USER MOD Set 2.1: A 31 CYS SG : rot -92:sc= -3.02! USER MOD Set 2.2: A 54 SER OG : rot -153:sc= 0.386! USER MOD Single : A 1 GLY N :NH3+ -116:sc= 0.0956 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 ASN : amide:sc=-0.00968 X(o=-0.0097,f=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ -129:sc= 0 (180deg=-0.0578) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 180:sc= -1.03 USER MOD Single : A 26 SER OG : rot 57:sc= 1.17 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot -157:sc= 0.671 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= -0.0531 X(o=-0.053,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 180:sc= -1.27 USER MOD Single : A 47 HIS : no HD1:sc= -0.468 K(o=-0.47,f=-1.7) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot -98:sc= 1.59 USER MOD Single : A 64 GLN : amide:sc= -2.85! C(o=-2.9!,f=-3.9!) USER MOD Single : A 69 ASN : amide:sc= -6.92! C(o=-6.9!,f=-7!) USER MOD Single : A 78 HIS : no HE2:sc= -0.965 K(o=-0.96,f=-2.3!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN : amide:sc= -0.22 X(o=-0.22,f=-0.0026) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0.0663 USER MOD Single : A 92 THR OG1 : rot -83:sc= 0.613 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 105 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 5:sc= 0.622 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 24.141 0.487 -37.970 1.00 0.00 N ATOM 2 CA GLY A 1 24.129 -0.615 -37.024 1.00 0.00 C ATOM 3 C GLY A 1 23.527 -1.873 -37.654 1.00 0.00 C ATOM 4 O GLY A 1 22.900 -1.803 -38.710 1.00 0.00 O ATOM 0 H1 GLY A 1 25.124 0.758 -38.174 1.00 0.00 H new ATOM 0 H2 GLY A 1 23.673 0.193 -38.851 1.00 0.00 H new ATOM 0 H3 GLY A 1 23.635 1.299 -37.563 1.00 0.00 H new ATOM 0 HA2 GLY A 1 25.145 -0.822 -36.689 1.00 0.00 H new ATOM 0 HA3 GLY A 1 23.554 -0.335 -36.142 1.00 0.00 H new ATOM 8 N SER A 2 23.738 -2.993 -36.979 1.00 0.00 N ATOM 9 CA SER A 2 23.223 -4.264 -37.459 1.00 0.00 C ATOM 10 C SER A 2 22.857 -5.161 -36.275 1.00 0.00 C ATOM 11 O SER A 2 23.337 -4.953 -35.162 1.00 0.00 O ATOM 12 CB SER A 2 24.242 -4.965 -38.361 1.00 0.00 C ATOM 13 OG SER A 2 23.614 -5.833 -39.300 1.00 0.00 O ATOM 0 H SER A 2 24.259 -3.047 -36.104 1.00 0.00 H new ATOM 0 HA SER A 2 22.328 -4.070 -38.050 1.00 0.00 H new ATOM 0 HB2 SER A 2 24.829 -4.217 -38.894 1.00 0.00 H new ATOM 0 HB3 SER A 2 24.937 -5.537 -37.747 1.00 0.00 H new ATOM 0 HG SER A 2 24.297 -6.260 -39.858 1.00 0.00 H new ATOM 19 N SER A 3 22.009 -6.140 -36.556 1.00 0.00 N ATOM 20 CA SER A 3 21.573 -7.070 -35.528 1.00 0.00 C ATOM 21 C SER A 3 20.908 -6.307 -34.381 1.00 0.00 C ATOM 22 O SER A 3 21.592 -5.742 -33.529 1.00 0.00 O ATOM 23 CB SER A 3 22.746 -7.902 -35.004 1.00 0.00 C ATOM 24 OG SER A 3 22.341 -8.812 -33.985 1.00 0.00 O ATOM 0 H SER A 3 21.612 -6.309 -37.480 1.00 0.00 H new ATOM 0 HA SER A 3 20.848 -7.753 -35.970 1.00 0.00 H new ATOM 0 HB2 SER A 3 23.194 -8.457 -35.828 1.00 0.00 H new ATOM 0 HB3 SER A 3 23.516 -7.237 -34.612 1.00 0.00 H new ATOM 0 HG SER A 3 23.117 -9.325 -33.678 1.00 0.00 H new ATOM 30 N GLY A 4 19.583 -6.317 -34.396 1.00 0.00 N ATOM 31 CA GLY A 4 18.819 -5.633 -33.367 1.00 0.00 C ATOM 32 C GLY A 4 17.401 -5.325 -33.851 1.00 0.00 C ATOM 33 O GLY A 4 17.207 -4.911 -34.994 1.00 0.00 O ATOM 0 H GLY A 4 19.020 -6.788 -35.104 1.00 0.00 H new ATOM 0 HA2 GLY A 4 18.775 -6.251 -32.470 1.00 0.00 H new ATOM 0 HA3 GLY A 4 19.322 -4.706 -33.091 1.00 0.00 H new ATOM 37 N SER A 5 16.445 -5.538 -32.959 1.00 0.00 N ATOM 38 CA SER A 5 15.050 -5.288 -33.281 1.00 0.00 C ATOM 39 C SER A 5 14.397 -4.462 -32.172 1.00 0.00 C ATOM 40 O SER A 5 14.793 -4.552 -31.010 1.00 0.00 O ATOM 41 CB SER A 5 14.289 -6.599 -33.484 1.00 0.00 C ATOM 42 OG SER A 5 14.001 -7.247 -32.248 1.00 0.00 O ATOM 0 H SER A 5 16.609 -5.881 -32.013 1.00 0.00 H new ATOM 0 HA SER A 5 15.010 -4.727 -34.215 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.358 -6.399 -34.014 1.00 0.00 H new ATOM 0 HB3 SER A 5 14.878 -7.266 -34.114 1.00 0.00 H new ATOM 0 HG SER A 5 13.513 -8.079 -32.421 1.00 0.00 H new ATOM 48 N SER A 6 13.407 -3.675 -32.568 1.00 0.00 N ATOM 49 CA SER A 6 12.695 -2.833 -31.622 1.00 0.00 C ATOM 50 C SER A 6 11.480 -3.580 -31.069 1.00 0.00 C ATOM 51 O SER A 6 11.035 -3.308 -29.955 1.00 0.00 O ATOM 52 CB SER A 6 12.259 -1.519 -32.274 1.00 0.00 C ATOM 53 OG SER A 6 11.873 -0.546 -31.307 1.00 0.00 O ATOM 0 H SER A 6 13.081 -3.603 -33.532 1.00 0.00 H new ATOM 0 HA SER A 6 13.371 -2.593 -30.801 1.00 0.00 H new ATOM 0 HB2 SER A 6 13.076 -1.125 -32.878 1.00 0.00 H new ATOM 0 HB3 SER A 6 11.425 -1.709 -32.950 1.00 0.00 H new ATOM 0 HG SER A 6 11.603 0.279 -31.762 1.00 0.00 H new ATOM 59 N GLY A 7 10.978 -4.506 -31.872 1.00 0.00 N ATOM 60 CA GLY A 7 9.823 -5.294 -31.477 1.00 0.00 C ATOM 61 C GLY A 7 8.640 -4.392 -31.120 1.00 0.00 C ATOM 62 O GLY A 7 8.809 -3.190 -30.920 1.00 0.00 O ATOM 0 H GLY A 7 11.350 -4.729 -32.795 1.00 0.00 H new ATOM 0 HA2 GLY A 7 9.541 -5.965 -32.288 1.00 0.00 H new ATOM 0 HA3 GLY A 7 10.080 -5.919 -30.621 1.00 0.00 H new ATOM 66 N SER A 8 7.468 -5.006 -31.052 1.00 0.00 N ATOM 67 CA SER A 8 6.257 -4.273 -30.724 1.00 0.00 C ATOM 68 C SER A 8 5.868 -4.532 -29.267 1.00 0.00 C ATOM 69 O SER A 8 5.679 -5.680 -28.866 1.00 0.00 O ATOM 70 CB SER A 8 5.108 -4.661 -31.657 1.00 0.00 C ATOM 71 OG SER A 8 3.959 -3.842 -31.458 1.00 0.00 O ATOM 0 H SER A 8 7.331 -6.003 -31.218 1.00 0.00 H new ATOM 0 HA SER A 8 6.454 -3.209 -30.858 1.00 0.00 H new ATOM 0 HB2 SER A 8 5.438 -4.577 -32.693 1.00 0.00 H new ATOM 0 HB3 SER A 8 4.842 -5.705 -31.490 1.00 0.00 H new ATOM 0 HG SER A 8 3.249 -4.120 -32.073 1.00 0.00 H new ATOM 77 N PRO A 9 5.757 -3.419 -28.495 1.00 0.00 N ATOM 78 CA PRO A 9 5.393 -3.514 -27.091 1.00 0.00 C ATOM 79 C PRO A 9 3.902 -3.816 -26.930 1.00 0.00 C ATOM 80 O PRO A 9 3.528 -4.768 -26.247 1.00 0.00 O ATOM 81 CB PRO A 9 5.797 -2.178 -26.489 1.00 0.00 C ATOM 82 CG PRO A 9 5.941 -1.219 -27.659 1.00 0.00 C ATOM 83 CD PRO A 9 5.973 -2.044 -28.936 1.00 0.00 C ATOM 0 HA PRO A 9 5.897 -4.335 -26.580 1.00 0.00 H new ATOM 0 HB2 PRO A 9 5.045 -1.824 -25.784 1.00 0.00 H new ATOM 0 HB3 PRO A 9 6.734 -2.265 -25.938 1.00 0.00 H new ATOM 0 HG2 PRO A 9 5.109 -0.515 -27.680 1.00 0.00 H new ATOM 0 HG3 PRO A 9 6.854 -0.631 -27.561 1.00 0.00 H new ATOM 0 HD2 PRO A 9 5.198 -1.725 -29.633 1.00 0.00 H new ATOM 0 HD3 PRO A 9 6.928 -1.939 -29.451 1.00 0.00 H new ATOM 91 N GLY A 10 3.091 -2.988 -27.571 1.00 0.00 N ATOM 92 CA GLY A 10 1.649 -3.155 -27.507 1.00 0.00 C ATOM 93 C GLY A 10 1.109 -2.742 -26.136 1.00 0.00 C ATOM 94 O GLY A 10 1.341 -3.428 -25.142 1.00 0.00 O ATOM 0 H GLY A 10 3.405 -2.200 -28.137 1.00 0.00 H new ATOM 0 HA2 GLY A 10 1.175 -2.555 -28.284 1.00 0.00 H new ATOM 0 HA3 GLY A 10 1.391 -4.195 -27.705 1.00 0.00 H new ATOM 98 N ASN A 11 0.399 -1.623 -26.128 1.00 0.00 N ATOM 99 CA ASN A 11 -0.176 -1.111 -24.895 1.00 0.00 C ATOM 100 C ASN A 11 -1.659 -1.480 -24.837 1.00 0.00 C ATOM 101 O ASN A 11 -2.438 -1.072 -25.697 1.00 0.00 O ATOM 102 CB ASN A 11 -0.065 0.413 -24.828 1.00 0.00 C ATOM 103 CG ASN A 11 0.361 0.871 -23.431 1.00 0.00 C ATOM 104 OD1 ASN A 11 1.528 1.092 -23.151 1.00 0.00 O ATOM 105 ND2 ASN A 11 -0.647 1.000 -22.573 1.00 0.00 N ATOM 0 H ASN A 11 0.209 -1.057 -26.955 1.00 0.00 H new ATOM 0 HA ASN A 11 0.370 -1.550 -24.060 1.00 0.00 H new ATOM 0 HB2 ASN A 11 0.658 0.761 -25.565 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -1.024 0.863 -25.085 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -0.466 1.300 -21.615 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -1.601 0.799 -22.873 1.00 0.00 H new ATOM 112 N ARG A 12 -2.005 -2.249 -23.815 1.00 0.00 N ATOM 113 CA ARG A 12 -3.382 -2.678 -23.634 1.00 0.00 C ATOM 114 C ARG A 12 -3.487 -3.639 -22.448 1.00 0.00 C ATOM 115 O ARG A 12 -2.891 -4.715 -22.462 1.00 0.00 O ATOM 116 CB ARG A 12 -3.913 -3.370 -24.891 1.00 0.00 C ATOM 117 CG ARG A 12 -5.129 -2.630 -25.451 1.00 0.00 C ATOM 118 CD ARG A 12 -5.954 -3.541 -26.362 1.00 0.00 C ATOM 119 NE ARG A 12 -7.391 -3.429 -26.025 1.00 0.00 N ATOM 120 CZ ARG A 12 -7.990 -4.126 -25.050 1.00 0.00 C ATOM 121 NH1 ARG A 12 -7.282 -4.990 -24.311 1.00 0.00 N ATOM 122 NH2 ARG A 12 -9.299 -3.959 -24.814 1.00 0.00 N ATOM 0 H ARG A 12 -1.356 -2.586 -23.104 1.00 0.00 H new ATOM 0 HA ARG A 12 -3.983 -1.790 -23.441 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -3.128 -3.412 -25.647 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -4.185 -4.399 -24.657 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -5.750 -2.271 -24.630 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -4.800 -1.753 -26.009 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -5.794 -3.267 -27.405 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -5.626 -4.574 -26.250 1.00 0.00 H new ATOM 0 HE ARG A 12 -7.961 -2.781 -26.569 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -6.286 -5.118 -24.490 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -7.739 -5.520 -23.569 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -9.839 -3.301 -25.377 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -9.755 -4.490 -24.072 1.00 0.00 H new ATOM 136 N GLU A 13 -4.248 -3.216 -21.450 1.00 0.00 N ATOM 137 CA GLU A 13 -4.438 -4.025 -20.258 1.00 0.00 C ATOM 138 C GLU A 13 -5.446 -3.359 -19.319 1.00 0.00 C ATOM 139 O GLU A 13 -5.144 -2.338 -18.703 1.00 0.00 O ATOM 140 CB GLU A 13 -3.107 -4.275 -19.546 1.00 0.00 C ATOM 141 CG GLU A 13 -2.711 -5.751 -19.627 1.00 0.00 C ATOM 142 CD GLU A 13 -1.252 -5.950 -19.209 1.00 0.00 C ATOM 143 OE1 GLU A 13 -0.379 -5.405 -19.919 1.00 0.00 O ATOM 144 OE2 GLU A 13 -1.043 -6.643 -18.190 1.00 0.00 O ATOM 0 H GLU A 13 -4.741 -2.323 -21.442 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.837 -4.993 -20.560 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -2.328 -3.660 -19.997 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -3.187 -3.973 -18.502 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -3.362 -6.342 -18.982 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -2.855 -6.115 -20.644 1.00 0.00 H new ATOM 151 N ASN A 14 -6.622 -3.964 -19.239 1.00 0.00 N ATOM 152 CA ASN A 14 -7.675 -3.442 -18.385 1.00 0.00 C ATOM 153 C ASN A 14 -7.330 -3.729 -16.923 1.00 0.00 C ATOM 154 O ASN A 14 -7.292 -2.816 -16.100 1.00 0.00 O ATOM 155 CB ASN A 14 -9.016 -4.111 -18.694 1.00 0.00 C ATOM 156 CG ASN A 14 -9.403 -3.913 -20.161 1.00 0.00 C ATOM 157 OD1 ASN A 14 -9.662 -2.812 -20.618 1.00 0.00 O ATOM 158 ND2 ASN A 14 -9.427 -5.038 -20.871 1.00 0.00 N ATOM 0 H ASN A 14 -6.869 -4.811 -19.752 1.00 0.00 H new ATOM 0 HA ASN A 14 -7.756 -2.370 -18.566 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -8.955 -5.176 -18.471 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -9.791 -3.695 -18.050 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -9.673 -5.011 -21.860 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -9.199 -5.927 -20.426 1.00 0.00 H new ATOM 165 N LYS A 15 -7.086 -5.001 -16.644 1.00 0.00 N ATOM 166 CA LYS A 15 -6.745 -5.420 -15.295 1.00 0.00 C ATOM 167 C LYS A 15 -5.304 -5.007 -14.987 1.00 0.00 C ATOM 168 O LYS A 15 -4.574 -4.575 -15.878 1.00 0.00 O ATOM 169 CB LYS A 15 -7.008 -6.916 -15.115 1.00 0.00 C ATOM 170 CG LYS A 15 -5.963 -7.749 -15.861 1.00 0.00 C ATOM 171 CD LYS A 15 -6.590 -8.474 -17.054 1.00 0.00 C ATOM 172 CE LYS A 15 -5.529 -8.833 -18.097 1.00 0.00 C ATOM 173 NZ LYS A 15 -5.107 -10.243 -17.942 1.00 0.00 N ATOM 0 H LYS A 15 -7.118 -5.756 -17.330 1.00 0.00 H new ATOM 0 HA LYS A 15 -7.384 -4.919 -14.568 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -6.989 -7.167 -14.055 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -8.004 -7.161 -15.483 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -5.156 -7.102 -16.207 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -5.519 -8.476 -15.181 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -7.090 -9.380 -16.712 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -7.353 -7.842 -17.509 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -5.927 -8.674 -19.099 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -4.667 -8.175 -17.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -4.387 -10.470 -18.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -4.708 -10.383 -16.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -5.929 -10.867 -18.068 1.00 0.00 H new ATOM 187 N GLU A 16 -4.938 -5.154 -13.722 1.00 0.00 N ATOM 188 CA GLU A 16 -3.598 -4.802 -13.285 1.00 0.00 C ATOM 189 C GLU A 16 -3.267 -3.365 -13.693 1.00 0.00 C ATOM 190 O GLU A 16 -2.826 -3.120 -14.816 1.00 0.00 O ATOM 191 CB GLU A 16 -2.564 -5.782 -13.843 1.00 0.00 C ATOM 192 CG GLU A 16 -2.403 -6.993 -12.921 1.00 0.00 C ATOM 193 CD GLU A 16 -1.569 -8.085 -13.592 1.00 0.00 C ATOM 194 OE1 GLU A 16 -2.097 -8.698 -14.545 1.00 0.00 O ATOM 195 OE2 GLU A 16 -0.422 -8.283 -13.136 1.00 0.00 O ATOM 0 H GLU A 16 -5.546 -5.512 -12.986 1.00 0.00 H new ATOM 0 HA GLU A 16 -3.563 -4.868 -12.198 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -2.870 -6.114 -14.835 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -1.605 -5.278 -13.958 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -1.925 -6.685 -11.991 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -3.384 -7.389 -12.660 1.00 0.00 H new ATOM 202 N LYS A 17 -3.492 -2.451 -12.760 1.00 0.00 N ATOM 203 CA LYS A 17 -3.223 -1.045 -13.009 1.00 0.00 C ATOM 204 C LYS A 17 -2.118 -0.567 -12.065 1.00 0.00 C ATOM 205 O LYS A 17 -2.039 -1.012 -10.921 1.00 0.00 O ATOM 206 CB LYS A 17 -4.512 -0.228 -12.911 1.00 0.00 C ATOM 207 CG LYS A 17 -4.962 -0.086 -11.455 1.00 0.00 C ATOM 208 CD LYS A 17 -5.479 1.327 -11.176 1.00 0.00 C ATOM 209 CE LYS A 17 -6.940 1.297 -10.723 1.00 0.00 C ATOM 210 NZ LYS A 17 -7.818 0.865 -11.833 1.00 0.00 N ATOM 0 H LYS A 17 -3.858 -2.657 -11.830 1.00 0.00 H new ATOM 0 HA LYS A 17 -2.858 -0.901 -14.026 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -4.355 0.760 -13.345 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -5.298 -0.710 -13.493 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -5.746 -0.813 -11.240 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -4.128 -0.310 -10.789 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -4.866 1.797 -10.407 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -5.386 1.936 -12.075 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -7.051 0.617 -9.878 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -7.240 2.286 -10.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -8.598 1.544 -11.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -7.268 0.824 -12.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -8.205 -0.077 -11.623 1.00 0.00 H new ATOM 224 N LYS A 18 -1.293 0.333 -12.579 1.00 0.00 N ATOM 225 CA LYS A 18 -0.196 0.877 -11.796 1.00 0.00 C ATOM 226 C LYS A 18 -0.657 2.161 -11.105 1.00 0.00 C ATOM 227 O LYS A 18 -1.302 3.007 -11.723 1.00 0.00 O ATOM 228 CB LYS A 18 1.046 1.060 -12.670 1.00 0.00 C ATOM 229 CG LYS A 18 2.304 1.205 -11.810 1.00 0.00 C ATOM 230 CD LYS A 18 3.164 2.376 -12.290 1.00 0.00 C ATOM 231 CE LYS A 18 2.522 3.715 -11.918 1.00 0.00 C ATOM 232 NZ LYS A 18 2.714 4.701 -13.005 1.00 0.00 N ATOM 0 H LYS A 18 -1.362 0.699 -13.528 1.00 0.00 H new ATOM 0 HA LYS A 18 0.095 0.179 -11.011 1.00 0.00 H new ATOM 0 HB2 LYS A 18 1.154 0.206 -13.338 1.00 0.00 H new ATOM 0 HB3 LYS A 18 0.927 1.943 -13.298 1.00 0.00 H new ATOM 0 HG2 LYS A 18 2.021 1.360 -10.769 1.00 0.00 H new ATOM 0 HG3 LYS A 18 2.884 0.283 -11.849 1.00 0.00 H new ATOM 0 HD2 LYS A 18 4.157 2.309 -11.846 1.00 0.00 H new ATOM 0 HD3 LYS A 18 3.293 2.318 -13.371 1.00 0.00 H new ATOM 0 HE2 LYS A 18 1.458 3.575 -11.730 1.00 0.00 H new ATOM 0 HE3 LYS A 18 2.962 4.092 -10.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 2.273 5.604 -12.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 3.731 4.847 -13.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 2.273 4.346 -13.878 1.00 0.00 H new ATOM 246 N VAL A 19 -0.307 2.268 -9.831 1.00 0.00 N ATOM 247 CA VAL A 19 -0.677 3.436 -9.049 1.00 0.00 C ATOM 248 C VAL A 19 0.530 3.899 -8.231 1.00 0.00 C ATOM 249 O VAL A 19 1.017 3.170 -7.368 1.00 0.00 O ATOM 250 CB VAL A 19 -1.899 3.121 -8.184 1.00 0.00 C ATOM 251 CG1 VAL A 19 -3.196 3.416 -8.941 1.00 0.00 C ATOM 252 CG2 VAL A 19 -1.867 1.671 -7.696 1.00 0.00 C ATOM 0 H VAL A 19 0.229 1.565 -9.321 1.00 0.00 H new ATOM 0 HA VAL A 19 -0.962 4.259 -9.704 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.866 3.769 -7.308 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -4.050 3.184 -8.304 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -3.225 4.470 -9.216 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -3.238 2.804 -9.842 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -2.747 1.474 -7.084 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -1.864 0.998 -8.554 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -0.968 1.507 -7.103 1.00 0.00 H new ATOM 262 N PHE A 20 0.979 5.109 -8.531 1.00 0.00 N ATOM 263 CA PHE A 20 2.120 5.678 -7.834 1.00 0.00 C ATOM 264 C PHE A 20 1.667 6.561 -6.670 1.00 0.00 C ATOM 265 O PHE A 20 1.105 7.634 -6.883 1.00 0.00 O ATOM 266 CB PHE A 20 2.879 6.538 -8.847 1.00 0.00 C ATOM 267 CG PHE A 20 4.399 6.505 -8.677 1.00 0.00 C ATOM 268 CD1 PHE A 20 4.968 7.005 -7.547 1.00 0.00 C ATOM 269 CD2 PHE A 20 5.181 5.974 -9.655 1.00 0.00 C ATOM 270 CE1 PHE A 20 6.379 6.974 -7.389 1.00 0.00 C ATOM 271 CE2 PHE A 20 6.592 5.943 -9.497 1.00 0.00 C ATOM 272 CZ PHE A 20 7.161 6.443 -8.368 1.00 0.00 C ATOM 0 H PHE A 20 0.573 5.711 -9.247 1.00 0.00 H new ATOM 0 HA PHE A 20 2.744 4.881 -7.428 1.00 0.00 H new ATOM 0 HB2 PHE A 20 2.629 6.202 -9.853 1.00 0.00 H new ATOM 0 HB3 PHE A 20 2.537 7.569 -8.761 1.00 0.00 H new ATOM 0 HD1 PHE A 20 4.347 7.426 -6.770 1.00 0.00 H new ATOM 0 HD2 PHE A 20 4.729 5.576 -10.552 1.00 0.00 H new ATOM 0 HE1 PHE A 20 6.831 7.372 -6.492 1.00 0.00 H new ATOM 0 HE2 PHE A 20 7.213 5.522 -10.274 1.00 0.00 H new ATOM 0 HZ PHE A 20 8.234 6.419 -8.248 1.00 0.00 H new ATOM 282 N ILE A 21 1.928 6.076 -5.465 1.00 0.00 N ATOM 283 CA ILE A 21 1.554 6.808 -4.267 1.00 0.00 C ATOM 284 C ILE A 21 2.807 7.423 -3.638 1.00 0.00 C ATOM 285 O ILE A 21 3.649 6.708 -3.098 1.00 0.00 O ATOM 286 CB ILE A 21 0.766 5.908 -3.313 1.00 0.00 C ATOM 287 CG1 ILE A 21 -0.504 5.380 -3.982 1.00 0.00 C ATOM 288 CG2 ILE A 21 0.464 6.632 -2.000 1.00 0.00 C ATOM 289 CD1 ILE A 21 -1.518 6.505 -4.200 1.00 0.00 C ATOM 0 H ILE A 21 2.394 5.185 -5.293 1.00 0.00 H new ATOM 0 HA ILE A 21 0.885 7.631 -4.517 1.00 0.00 H new ATOM 0 HB ILE A 21 1.384 5.044 -3.069 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -0.252 4.923 -4.939 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -0.948 4.600 -3.363 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -0.097 5.970 -1.340 1.00 0.00 H new ATOM 0 HG22 ILE A 21 1.399 6.917 -1.518 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -0.126 7.525 -2.204 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -2.411 6.102 -4.677 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -1.786 6.944 -3.239 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -1.079 7.271 -4.839 1.00 0.00 H new ATOM 301 N SER A 22 2.889 8.743 -3.729 1.00 0.00 N ATOM 302 CA SER A 22 4.024 9.462 -3.176 1.00 0.00 C ATOM 303 C SER A 22 3.572 10.324 -1.996 1.00 0.00 C ATOM 304 O SER A 22 2.553 11.009 -2.077 1.00 0.00 O ATOM 305 CB SER A 22 4.697 10.330 -4.241 1.00 0.00 C ATOM 306 OG SER A 22 3.919 11.479 -4.563 1.00 0.00 O ATOM 0 H SER A 22 2.188 9.333 -4.177 1.00 0.00 H new ATOM 0 HA SER A 22 4.754 8.733 -2.826 1.00 0.00 H new ATOM 0 HB2 SER A 22 5.678 10.645 -3.885 1.00 0.00 H new ATOM 0 HB3 SER A 22 4.859 9.738 -5.142 1.00 0.00 H new ATOM 0 HG SER A 22 4.383 12.008 -5.245 1.00 0.00 H new ATOM 312 N LEU A 23 4.352 10.263 -0.927 1.00 0.00 N ATOM 313 CA LEU A 23 4.045 11.030 0.268 1.00 0.00 C ATOM 314 C LEU A 23 4.303 12.514 -0.003 1.00 0.00 C ATOM 315 O LEU A 23 5.191 13.113 0.602 1.00 0.00 O ATOM 316 CB LEU A 23 4.817 10.481 1.470 1.00 0.00 C ATOM 317 CG LEU A 23 4.109 9.395 2.282 1.00 0.00 C ATOM 318 CD1 LEU A 23 3.030 9.999 3.183 1.00 0.00 C ATOM 319 CD2 LEU A 23 3.548 8.304 1.368 1.00 0.00 C ATOM 0 H LEU A 23 5.196 9.694 -0.864 1.00 0.00 H new ATOM 0 HA LEU A 23 2.990 10.931 0.524 1.00 0.00 H new ATOM 0 HB2 LEU A 23 5.766 10.080 1.115 1.00 0.00 H new ATOM 0 HB3 LEU A 23 5.051 11.311 2.137 1.00 0.00 H new ATOM 0 HG LEU A 23 4.844 8.922 2.933 1.00 0.00 H new ATOM 0 HD11 LEU A 23 2.542 9.205 3.749 1.00 0.00 H new ATOM 0 HD12 LEU A 23 3.487 10.708 3.873 1.00 0.00 H new ATOM 0 HD13 LEU A 23 2.291 10.514 2.570 1.00 0.00 H new ATOM 0 HD21 LEU A 23 3.050 7.545 1.971 1.00 0.00 H new ATOM 0 HD22 LEU A 23 2.832 8.744 0.674 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.362 7.845 0.807 1.00 0.00 H new ATOM 331 N VAL A 24 3.512 13.063 -0.912 1.00 0.00 N ATOM 332 CA VAL A 24 3.644 14.465 -1.271 1.00 0.00 C ATOM 333 C VAL A 24 2.252 15.068 -1.472 1.00 0.00 C ATOM 334 O VAL A 24 1.251 14.477 -1.070 1.00 0.00 O ATOM 335 CB VAL A 24 4.542 14.608 -2.501 1.00 0.00 C ATOM 336 CG1 VAL A 24 5.696 13.605 -2.457 1.00 0.00 C ATOM 337 CG2 VAL A 24 3.732 14.457 -3.791 1.00 0.00 C ATOM 0 H VAL A 24 2.777 12.562 -1.411 1.00 0.00 H new ATOM 0 HA VAL A 24 4.126 15.022 -0.468 1.00 0.00 H new ATOM 0 HB VAL A 24 4.970 15.610 -2.489 1.00 0.00 H new ATOM 0 HG11 VAL A 24 6.319 13.728 -3.343 1.00 0.00 H new ATOM 0 HG12 VAL A 24 6.296 13.780 -1.564 1.00 0.00 H new ATOM 0 HG13 VAL A 24 5.296 12.591 -2.433 1.00 0.00 H new ATOM 0 HG21 VAL A 24 4.394 14.563 -4.651 1.00 0.00 H new ATOM 0 HG22 VAL A 24 3.263 13.473 -3.813 1.00 0.00 H new ATOM 0 HG23 VAL A 24 2.962 15.227 -3.829 1.00 0.00 H new ATOM 347 N GLY A 25 2.234 16.237 -2.096 1.00 0.00 N ATOM 348 CA GLY A 25 0.981 16.926 -2.356 1.00 0.00 C ATOM 349 C GLY A 25 0.136 17.026 -1.085 1.00 0.00 C ATOM 350 O GLY A 25 -1.061 16.744 -1.107 1.00 0.00 O ATOM 0 H GLY A 25 3.066 16.724 -2.429 1.00 0.00 H new ATOM 0 HA2 GLY A 25 1.185 17.925 -2.741 1.00 0.00 H new ATOM 0 HA3 GLY A 25 0.423 16.395 -3.127 1.00 0.00 H new ATOM 354 N SER A 26 0.792 17.430 -0.006 1.00 0.00 N ATOM 355 CA SER A 26 0.116 17.570 1.272 1.00 0.00 C ATOM 356 C SER A 26 -0.848 16.402 1.486 1.00 0.00 C ATOM 357 O SER A 26 -2.061 16.563 1.366 1.00 0.00 O ATOM 358 CB SER A 26 -0.636 18.900 1.353 1.00 0.00 C ATOM 359 OG SER A 26 -1.758 18.934 0.475 1.00 0.00 O ATOM 0 H SER A 26 1.785 17.665 0.009 1.00 0.00 H new ATOM 0 HA SER A 26 0.869 17.559 2.060 1.00 0.00 H new ATOM 0 HB2 SER A 26 -0.972 19.065 2.377 1.00 0.00 H new ATOM 0 HB3 SER A 26 0.043 19.716 1.105 1.00 0.00 H new ATOM 0 HG SER A 26 -2.360 18.190 0.685 1.00 0.00 H new ATOM 365 N ARG A 27 -0.271 15.250 1.798 1.00 0.00 N ATOM 366 CA ARG A 27 -1.063 14.055 2.030 1.00 0.00 C ATOM 367 C ARG A 27 -0.205 12.966 2.678 1.00 0.00 C ATOM 368 O ARG A 27 1.022 13.017 2.611 1.00 0.00 O ATOM 369 CB ARG A 27 -1.650 13.521 0.722 1.00 0.00 C ATOM 370 CG ARG A 27 -3.180 13.544 0.757 1.00 0.00 C ATOM 371 CD ARG A 27 -3.755 13.870 -0.622 1.00 0.00 C ATOM 372 NE ARG A 27 -3.530 15.298 -0.940 1.00 0.00 N ATOM 373 CZ ARG A 27 -4.019 15.912 -2.026 1.00 0.00 C ATOM 374 NH1 ARG A 27 -4.764 15.228 -2.905 1.00 0.00 N ATOM 375 NH2 ARG A 27 -3.763 17.211 -2.234 1.00 0.00 N ATOM 0 H ARG A 27 0.736 15.120 1.895 1.00 0.00 H new ATOM 0 HA ARG A 27 -1.880 14.324 2.699 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -1.293 14.123 -0.113 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -1.302 12.502 0.552 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -3.554 12.576 1.091 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -3.520 14.285 1.481 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -3.285 13.242 -1.379 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -4.822 13.648 -0.642 1.00 0.00 H new ATOM 0 HE ARG A 27 -2.967 15.849 -0.292 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -4.959 14.239 -2.748 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -5.136 15.696 -3.731 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -3.196 17.732 -1.566 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -4.135 17.678 -3.061 1.00 0.00 H new ATOM 389 N GLY A 28 -0.885 12.007 3.289 1.00 0.00 N ATOM 390 CA GLY A 28 -0.200 10.908 3.948 1.00 0.00 C ATOM 391 C GLY A 28 -0.993 9.607 3.812 1.00 0.00 C ATOM 392 O GLY A 28 -0.926 8.741 4.682 1.00 0.00 O ATOM 0 H GLY A 28 -1.903 11.968 3.342 1.00 0.00 H new ATOM 0 HA2 GLY A 28 0.792 10.781 3.514 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -0.059 11.143 5.003 1.00 0.00 H new ATOM 396 N LEU A 29 -1.726 9.511 2.712 1.00 0.00 N ATOM 397 CA LEU A 29 -2.532 8.330 2.451 1.00 0.00 C ATOM 398 C LEU A 29 -3.745 8.329 3.383 1.00 0.00 C ATOM 399 O LEU A 29 -3.604 8.517 4.590 1.00 0.00 O ATOM 400 CB LEU A 29 -1.677 7.065 2.552 1.00 0.00 C ATOM 401 CG LEU A 29 -2.155 5.865 1.733 1.00 0.00 C ATOM 402 CD1 LEU A 29 -1.459 5.817 0.371 1.00 0.00 C ATOM 403 CD2 LEU A 29 -1.977 4.562 2.514 1.00 0.00 C ATOM 0 H LEU A 29 -1.779 10.231 1.992 1.00 0.00 H new ATOM 0 HA LEU A 29 -2.914 8.348 1.430 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -0.662 7.311 2.241 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.626 6.768 3.599 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.222 5.984 1.545 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -1.817 4.954 -0.191 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.681 6.729 -0.184 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.382 5.734 0.516 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.325 3.725 1.909 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -0.923 4.423 2.754 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -2.556 4.608 3.436 1.00 0.00 H new ATOM 415 N GLY A 30 -4.908 8.114 2.787 1.00 0.00 N ATOM 416 CA GLY A 30 -6.145 8.085 3.549 1.00 0.00 C ATOM 417 C GLY A 30 -6.933 6.805 3.268 1.00 0.00 C ATOM 418 O GLY A 30 -8.155 6.779 3.411 1.00 0.00 O ATOM 0 H GLY A 30 -5.020 7.958 1.785 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -5.922 8.152 4.614 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.753 8.953 3.295 1.00 0.00 H new ATOM 422 N CYS A 31 -6.202 5.773 2.872 1.00 0.00 N ATOM 423 CA CYS A 31 -6.818 4.492 2.569 1.00 0.00 C ATOM 424 C CYS A 31 -6.360 3.478 3.620 1.00 0.00 C ATOM 425 O CYS A 31 -5.235 3.554 4.111 1.00 0.00 O ATOM 426 CB CYS A 31 -6.490 4.029 1.148 1.00 0.00 C ATOM 427 SG CYS A 31 -4.677 3.885 0.939 1.00 0.00 S ATOM 0 H CYS A 31 -5.189 5.798 2.754 1.00 0.00 H new ATOM 0 HA CYS A 31 -7.903 4.589 2.608 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -6.964 3.068 0.951 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -6.893 4.737 0.424 1.00 0.00 H new ATOM 0 HG CYS A 31 -4.202 5.006 0.483 1.00 0.00 H new ATOM 433 N SER A 32 -7.255 2.553 3.933 1.00 0.00 N ATOM 434 CA SER A 32 -6.957 1.526 4.916 1.00 0.00 C ATOM 435 C SER A 32 -6.786 0.172 4.224 1.00 0.00 C ATOM 436 O SER A 32 -7.542 -0.163 3.313 1.00 0.00 O ATOM 437 CB SER A 32 -8.056 1.444 5.978 1.00 0.00 C ATOM 438 OG SER A 32 -7.544 1.643 7.293 1.00 0.00 O ATOM 0 H SER A 32 -8.187 2.493 3.523 1.00 0.00 H new ATOM 0 HA SER A 32 -6.025 1.792 5.416 1.00 0.00 H new ATOM 0 HB2 SER A 32 -8.819 2.194 5.769 1.00 0.00 H new ATOM 0 HB3 SER A 32 -8.542 0.470 5.922 1.00 0.00 H new ATOM 0 HG SER A 32 -8.276 1.585 7.941 1.00 0.00 H new ATOM 444 N ILE A 33 -5.788 -0.569 4.682 1.00 0.00 N ATOM 445 CA ILE A 33 -5.508 -1.878 4.117 1.00 0.00 C ATOM 446 C ILE A 33 -5.957 -2.960 5.102 1.00 0.00 C ATOM 447 O ILE A 33 -5.882 -2.769 6.315 1.00 0.00 O ATOM 448 CB ILE A 33 -4.036 -1.985 3.716 1.00 0.00 C ATOM 449 CG1 ILE A 33 -3.120 -1.671 4.900 1.00 0.00 C ATOM 450 CG2 ILE A 33 -3.732 -1.100 2.505 1.00 0.00 C ATOM 451 CD1 ILE A 33 -1.745 -2.316 4.717 1.00 0.00 C ATOM 0 H ILE A 33 -5.163 -0.288 5.438 1.00 0.00 H new ATOM 0 HA ILE A 33 -6.076 -2.026 3.199 1.00 0.00 H new ATOM 0 HB ILE A 33 -3.837 -3.015 3.420 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -3.008 -0.591 5.001 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -3.575 -2.032 5.822 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -2.679 -1.195 2.240 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -4.347 -1.413 1.662 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -3.953 -0.061 2.749 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -1.114 -2.077 5.573 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -1.858 -3.397 4.640 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -1.282 -1.934 3.807 1.00 0.00 H new ATOM 463 N SER A 34 -6.413 -4.071 4.544 1.00 0.00 N ATOM 464 CA SER A 34 -6.874 -5.183 5.358 1.00 0.00 C ATOM 465 C SER A 34 -6.187 -6.476 4.914 1.00 0.00 C ATOM 466 O SER A 34 -5.675 -6.561 3.799 1.00 0.00 O ATOM 467 CB SER A 34 -8.394 -5.334 5.275 1.00 0.00 C ATOM 468 OG SER A 34 -8.808 -5.889 4.029 1.00 0.00 O ATOM 0 H SER A 34 -6.473 -4.225 3.538 1.00 0.00 H new ATOM 0 HA SER A 34 -6.613 -4.978 6.396 1.00 0.00 H new ATOM 0 HB2 SER A 34 -8.740 -5.971 6.089 1.00 0.00 H new ATOM 0 HB3 SER A 34 -8.863 -4.360 5.412 1.00 0.00 H new ATOM 0 HG SER A 34 -9.739 -5.640 3.853 1.00 0.00 H new ATOM 474 N SER A 35 -6.198 -7.452 5.811 1.00 0.00 N ATOM 475 CA SER A 35 -5.582 -8.737 5.526 1.00 0.00 C ATOM 476 C SER A 35 -6.602 -9.672 4.872 1.00 0.00 C ATOM 477 O SER A 35 -7.795 -9.596 5.162 1.00 0.00 O ATOM 478 CB SER A 35 -5.019 -9.372 6.798 1.00 0.00 C ATOM 479 OG SER A 35 -6.033 -10.005 7.573 1.00 0.00 O ATOM 0 H SER A 35 -6.624 -7.378 6.735 1.00 0.00 H new ATOM 0 HA SER A 35 -4.753 -8.574 4.837 1.00 0.00 H new ATOM 0 HB2 SER A 35 -4.257 -10.104 6.531 1.00 0.00 H new ATOM 0 HB3 SER A 35 -4.529 -8.606 7.399 1.00 0.00 H new ATOM 0 HG SER A 35 -5.633 -10.400 8.376 1.00 0.00 H new ATOM 485 N GLY A 36 -6.094 -10.533 4.002 1.00 0.00 N ATOM 486 CA GLY A 36 -6.946 -11.482 3.305 1.00 0.00 C ATOM 487 C GLY A 36 -6.866 -12.867 3.950 1.00 0.00 C ATOM 488 O GLY A 36 -5.930 -13.157 4.693 1.00 0.00 O ATOM 0 H GLY A 36 -5.104 -10.593 3.764 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.977 -11.129 3.319 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -6.646 -11.546 2.259 1.00 0.00 H new ATOM 492 N PRO A 37 -7.887 -13.708 3.634 1.00 0.00 N ATOM 493 CA PRO A 37 -7.941 -15.056 4.174 1.00 0.00 C ATOM 494 C PRO A 37 -6.929 -15.967 3.477 1.00 0.00 C ATOM 495 O PRO A 37 -6.090 -15.497 2.711 1.00 0.00 O ATOM 496 CB PRO A 37 -9.380 -15.503 3.973 1.00 0.00 C ATOM 497 CG PRO A 37 -9.960 -14.577 2.915 1.00 0.00 C ATOM 498 CD PRO A 37 -9.013 -13.399 2.757 1.00 0.00 C ATOM 0 HA PRO A 37 -7.669 -15.098 5.229 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -9.424 -16.543 3.649 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -9.944 -15.435 4.903 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -10.075 -15.104 1.968 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -10.951 -14.233 3.211 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -8.690 -13.287 1.722 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -9.493 -12.464 3.044 1.00 0.00 H new ATOM 506 N ILE A 38 -7.042 -17.255 3.768 1.00 0.00 N ATOM 507 CA ILE A 38 -6.147 -18.236 3.178 1.00 0.00 C ATOM 508 C ILE A 38 -6.514 -18.436 1.707 1.00 0.00 C ATOM 509 O ILE A 38 -5.652 -18.738 0.883 1.00 0.00 O ATOM 510 CB ILE A 38 -6.157 -19.529 3.996 1.00 0.00 C ATOM 511 CG1 ILE A 38 -5.312 -20.611 3.320 1.00 0.00 C ATOM 512 CG2 ILE A 38 -7.589 -20.001 4.258 1.00 0.00 C ATOM 513 CD1 ILE A 38 -3.944 -20.738 3.994 1.00 0.00 C ATOM 0 H ILE A 38 -7.739 -17.642 4.404 1.00 0.00 H new ATOM 0 HA ILE A 38 -5.118 -17.877 3.203 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.703 -19.324 4.966 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -5.834 -21.567 3.365 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -5.181 -20.369 2.265 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -7.568 -20.922 4.841 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -8.130 -19.233 4.812 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -8.091 -20.185 3.308 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -3.363 -21.514 3.495 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -3.415 -19.787 3.925 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -4.078 -21.004 5.043 1.00 0.00 H new ATOM 525 N GLN A 39 -7.796 -18.259 1.420 1.00 0.00 N ATOM 526 CA GLN A 39 -8.287 -18.416 0.062 1.00 0.00 C ATOM 527 C GLN A 39 -7.952 -17.176 -0.771 1.00 0.00 C ATOM 528 O GLN A 39 -7.765 -17.271 -1.983 1.00 0.00 O ATOM 529 CB GLN A 39 -9.792 -18.692 0.052 1.00 0.00 C ATOM 530 CG GLN A 39 -10.575 -17.480 0.562 1.00 0.00 C ATOM 531 CD GLN A 39 -11.980 -17.885 1.012 1.00 0.00 C ATOM 532 OE1 GLN A 39 -12.980 -17.536 0.406 1.00 0.00 O ATOM 533 NE2 GLN A 39 -12.001 -18.640 2.107 1.00 0.00 N ATOM 0 H GLN A 39 -8.509 -18.008 2.105 1.00 0.00 H new ATOM 0 HA GLN A 39 -7.789 -19.276 -0.386 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -10.114 -18.938 -0.960 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -10.011 -19.559 0.675 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -10.041 -17.021 1.394 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -10.644 -16.729 -0.225 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -11.127 -18.897 2.566 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -12.891 -18.962 2.487 1.00 0.00 H new ATOM 542 N LYS A 40 -7.886 -16.043 -0.087 1.00 0.00 N ATOM 543 CA LYS A 40 -7.576 -14.787 -0.748 1.00 0.00 C ATOM 544 C LYS A 40 -6.586 -13.995 0.109 1.00 0.00 C ATOM 545 O LYS A 40 -6.895 -12.896 0.564 1.00 0.00 O ATOM 546 CB LYS A 40 -8.860 -14.021 -1.071 1.00 0.00 C ATOM 547 CG LYS A 40 -8.600 -12.926 -2.108 1.00 0.00 C ATOM 548 CD LYS A 40 -9.045 -13.374 -3.501 1.00 0.00 C ATOM 549 CE LYS A 40 -9.682 -12.216 -4.272 1.00 0.00 C ATOM 550 NZ LYS A 40 -10.864 -12.684 -5.028 1.00 0.00 N ATOM 0 H LYS A 40 -8.042 -15.969 0.918 1.00 0.00 H new ATOM 0 HA LYS A 40 -7.092 -14.970 -1.707 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -9.615 -14.712 -1.448 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.261 -13.576 -0.160 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -9.134 -12.019 -1.826 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -7.538 -12.679 -2.123 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -8.188 -13.756 -4.055 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -9.759 -14.193 -3.413 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -9.975 -11.428 -3.579 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -8.953 -11.783 -4.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -11.284 -11.885 -5.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -10.575 -13.420 -5.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -11.566 -13.076 -4.368 1.00 0.00 H new ATOM 564 N PRO A 41 -5.385 -14.601 0.307 1.00 0.00 N ATOM 565 CA PRO A 41 -4.348 -13.965 1.101 1.00 0.00 C ATOM 566 C PRO A 41 -3.684 -12.826 0.324 1.00 0.00 C ATOM 567 O PRO A 41 -3.552 -12.896 -0.897 1.00 0.00 O ATOM 568 CB PRO A 41 -3.382 -15.083 1.455 1.00 0.00 C ATOM 569 CG PRO A 41 -3.660 -16.204 0.467 1.00 0.00 C ATOM 570 CD PRO A 41 -4.984 -15.903 -0.218 1.00 0.00 C ATOM 0 HA PRO A 41 -4.739 -13.494 2.003 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -2.349 -14.744 1.380 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -3.534 -15.420 2.480 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -2.857 -16.274 -0.267 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -3.706 -17.164 0.981 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -4.872 -15.876 -1.302 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -5.729 -16.667 0.006 1.00 0.00 H new ATOM 578 N GLY A 42 -3.284 -11.802 1.064 1.00 0.00 N ATOM 579 CA GLY A 42 -2.637 -10.650 0.460 1.00 0.00 C ATOM 580 C GLY A 42 -3.088 -9.352 1.134 1.00 0.00 C ATOM 581 O GLY A 42 -3.592 -9.374 2.256 1.00 0.00 O ATOM 0 H GLY A 42 -3.396 -11.746 2.076 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -1.555 -10.751 0.544 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -2.872 -10.612 -0.604 1.00 0.00 H new ATOM 585 N ILE A 43 -2.891 -8.253 0.420 1.00 0.00 N ATOM 586 CA ILE A 43 -3.272 -6.949 0.935 1.00 0.00 C ATOM 587 C ILE A 43 -4.385 -6.366 0.063 1.00 0.00 C ATOM 588 O ILE A 43 -4.229 -6.249 -1.152 1.00 0.00 O ATOM 589 CB ILE A 43 -2.045 -6.042 1.056 1.00 0.00 C ATOM 590 CG1 ILE A 43 -0.981 -6.675 1.954 1.00 0.00 C ATOM 591 CG2 ILE A 43 -2.442 -4.644 1.534 1.00 0.00 C ATOM 592 CD1 ILE A 43 -1.356 -6.533 3.431 1.00 0.00 C ATOM 0 H ILE A 43 -2.473 -8.239 -0.510 1.00 0.00 H new ATOM 0 HA ILE A 43 -3.673 -7.040 1.944 1.00 0.00 H new ATOM 0 HB ILE A 43 -1.604 -5.930 0.066 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -0.869 -7.730 1.703 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -0.017 -6.200 1.772 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -1.552 -4.020 1.612 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -3.136 -4.199 0.821 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -2.921 -4.716 2.510 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -0.583 -6.991 4.048 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -1.444 -5.476 3.684 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -2.309 -7.030 3.614 1.00 0.00 H new ATOM 604 N PHE A 44 -5.483 -6.015 0.716 1.00 0.00 N ATOM 605 CA PHE A 44 -6.621 -5.446 0.014 1.00 0.00 C ATOM 606 C PHE A 44 -7.140 -4.198 0.731 1.00 0.00 C ATOM 607 O PHE A 44 -7.250 -4.182 1.956 1.00 0.00 O ATOM 608 CB PHE A 44 -7.721 -6.511 0.009 1.00 0.00 C ATOM 609 CG PHE A 44 -7.240 -7.899 -0.418 1.00 0.00 C ATOM 610 CD1 PHE A 44 -6.408 -8.609 0.391 1.00 0.00 C ATOM 611 CD2 PHE A 44 -7.646 -8.424 -1.605 1.00 0.00 C ATOM 612 CE1 PHE A 44 -5.963 -9.898 -0.006 1.00 0.00 C ATOM 613 CE2 PHE A 44 -7.200 -9.712 -2.002 1.00 0.00 C ATOM 614 CZ PHE A 44 -6.368 -10.422 -1.193 1.00 0.00 C ATOM 0 H PHE A 44 -5.609 -6.114 1.723 1.00 0.00 H new ATOM 0 HA PHE A 44 -6.329 -5.157 -0.996 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -8.152 -6.578 1.008 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -8.519 -6.192 -0.662 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -6.086 -8.193 1.334 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -8.308 -7.861 -2.246 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -5.302 -10.462 0.636 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -7.521 -10.128 -2.946 1.00 0.00 H new ATOM 0 HZ PHE A 44 -6.029 -11.402 -1.494 1.00 0.00 H new ATOM 624 N ILE A 45 -7.444 -3.182 -0.063 1.00 0.00 N ATOM 625 CA ILE A 45 -7.948 -1.932 0.481 1.00 0.00 C ATOM 626 C ILE A 45 -9.290 -2.186 1.172 1.00 0.00 C ATOM 627 O ILE A 45 -10.087 -2.999 0.707 1.00 0.00 O ATOM 628 CB ILE A 45 -8.011 -0.861 -0.610 1.00 0.00 C ATOM 629 CG1 ILE A 45 -6.614 -0.334 -0.942 1.00 0.00 C ATOM 630 CG2 ILE A 45 -8.969 0.265 -0.216 1.00 0.00 C ATOM 631 CD1 ILE A 45 -6.693 0.906 -1.835 1.00 0.00 C ATOM 0 H ILE A 45 -7.351 -3.199 -1.079 1.00 0.00 H new ATOM 0 HA ILE A 45 -7.267 -1.544 1.239 1.00 0.00 H new ATOM 0 HB ILE A 45 -8.406 -1.319 -1.517 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -6.085 -0.090 -0.021 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -6.038 -1.112 -1.444 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -8.996 1.014 -1.008 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -9.969 -0.143 -0.068 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -8.626 0.728 0.709 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -5.686 1.260 -2.056 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -7.201 0.652 -2.766 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -7.249 1.690 -1.321 1.00 0.00 H new ATOM 643 N SER A 46 -9.497 -1.475 2.270 1.00 0.00 N ATOM 644 CA SER A 46 -10.728 -1.613 3.030 1.00 0.00 C ATOM 645 C SER A 46 -11.555 -0.330 2.924 1.00 0.00 C ATOM 646 O SER A 46 -12.782 -0.382 2.870 1.00 0.00 O ATOM 647 CB SER A 46 -10.436 -1.936 4.497 1.00 0.00 C ATOM 648 OG SER A 46 -10.235 -0.759 5.273 1.00 0.00 O ATOM 0 H SER A 46 -8.833 -0.801 2.652 1.00 0.00 H new ATOM 0 HA SER A 46 -11.298 -2.441 2.610 1.00 0.00 H new ATOM 0 HB2 SER A 46 -11.265 -2.508 4.914 1.00 0.00 H new ATOM 0 HB3 SER A 46 -9.550 -2.567 4.560 1.00 0.00 H new ATOM 0 HG SER A 46 -10.053 -1.008 6.203 1.00 0.00 H new ATOM 654 N HIS A 47 -10.849 0.791 2.896 1.00 0.00 N ATOM 655 CA HIS A 47 -11.502 2.085 2.797 1.00 0.00 C ATOM 656 C HIS A 47 -10.523 3.112 2.226 1.00 0.00 C ATOM 657 O HIS A 47 -9.316 3.011 2.440 1.00 0.00 O ATOM 658 CB HIS A 47 -12.081 2.506 4.150 1.00 0.00 C ATOM 659 CG HIS A 47 -13.019 3.686 4.075 1.00 0.00 C ATOM 660 ND1 HIS A 47 -12.584 4.975 3.818 1.00 0.00 N ATOM 661 CD2 HIS A 47 -14.373 3.760 4.225 1.00 0.00 C ATOM 662 CE1 HIS A 47 -13.637 5.780 3.817 1.00 0.00 C ATOM 663 NE2 HIS A 47 -14.745 5.025 4.070 1.00 0.00 N ATOM 0 H HIS A 47 -9.831 0.830 2.940 1.00 0.00 H new ATOM 0 HA HIS A 47 -12.346 2.019 2.110 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -12.612 1.660 4.586 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -11.261 2.749 4.825 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -15.031 2.930 4.434 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -13.621 6.846 3.646 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -15.701 5.375 4.130 1.00 0.00 H new ATOM 671 N VAL A 48 -11.080 4.077 1.509 1.00 0.00 N ATOM 672 CA VAL A 48 -10.271 5.122 0.905 1.00 0.00 C ATOM 673 C VAL A 48 -11.097 6.406 0.801 1.00 0.00 C ATOM 674 O VAL A 48 -12.133 6.429 0.139 1.00 0.00 O ATOM 675 CB VAL A 48 -9.729 4.650 -0.446 1.00 0.00 C ATOM 676 CG1 VAL A 48 -10.750 3.768 -1.168 1.00 0.00 C ATOM 677 CG2 VAL A 48 -9.317 5.837 -1.317 1.00 0.00 C ATOM 0 H VAL A 48 -12.081 4.157 1.333 1.00 0.00 H new ATOM 0 HA VAL A 48 -9.405 5.342 1.529 1.00 0.00 H new ATOM 0 HB VAL A 48 -8.840 4.049 -0.258 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -10.340 3.446 -2.125 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -10.973 2.894 -0.556 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -11.665 4.335 -1.338 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -8.936 5.473 -2.271 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -10.182 6.477 -1.492 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -8.540 6.408 -0.810 1.00 0.00 H new ATOM 687 N LYS A 49 -10.608 7.442 1.467 1.00 0.00 N ATOM 688 CA LYS A 49 -11.289 8.726 1.458 1.00 0.00 C ATOM 689 C LYS A 49 -11.208 9.331 0.055 1.00 0.00 C ATOM 690 O LYS A 49 -10.268 9.058 -0.689 1.00 0.00 O ATOM 691 CB LYS A 49 -10.730 9.636 2.554 1.00 0.00 C ATOM 692 CG LYS A 49 -11.493 9.446 3.866 1.00 0.00 C ATOM 693 CD LYS A 49 -10.573 9.654 5.071 1.00 0.00 C ATOM 694 CE LYS A 49 -10.251 11.138 5.265 1.00 0.00 C ATOM 695 NZ LYS A 49 -10.441 11.528 6.679 1.00 0.00 N ATOM 0 H LYS A 49 -9.749 7.419 2.016 1.00 0.00 H new ATOM 0 HA LYS A 49 -12.346 8.599 1.690 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -9.673 9.418 2.709 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -10.798 10.677 2.237 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -12.324 10.150 3.913 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -11.921 8.444 3.900 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -11.050 9.261 5.969 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -9.649 9.093 4.929 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -9.223 11.336 4.962 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -10.894 11.743 4.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -10.218 12.537 6.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -11.429 11.358 6.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -9.810 10.964 7.283 1.00 0.00 H new ATOM 709 N PRO A 50 -12.233 10.163 -0.271 1.00 0.00 N ATOM 710 CA PRO A 50 -12.287 10.810 -1.571 1.00 0.00 C ATOM 711 C PRO A 50 -11.281 11.960 -1.654 1.00 0.00 C ATOM 712 O PRO A 50 -11.180 12.768 -0.733 1.00 0.00 O ATOM 713 CB PRO A 50 -13.728 11.269 -1.723 1.00 0.00 C ATOM 714 CG PRO A 50 -14.312 11.278 -0.319 1.00 0.00 C ATOM 715 CD PRO A 50 -13.363 10.510 0.586 1.00 0.00 C ATOM 0 HA PRO A 50 -12.008 10.141 -2.385 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -13.777 12.261 -2.173 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -14.286 10.596 -2.374 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -14.435 12.301 0.037 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -15.300 10.818 -0.314 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -13.045 11.118 1.433 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -13.839 9.618 0.994 1.00 0.00 H new ATOM 723 N GLY A 51 -10.563 11.996 -2.767 1.00 0.00 N ATOM 724 CA GLY A 51 -9.568 13.033 -2.982 1.00 0.00 C ATOM 725 C GLY A 51 -8.262 12.699 -2.259 1.00 0.00 C ATOM 726 O GLY A 51 -7.262 13.396 -2.423 1.00 0.00 O ATOM 0 H GLY A 51 -10.650 11.324 -3.529 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -9.378 13.144 -4.050 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -9.951 13.989 -2.625 1.00 0.00 H new ATOM 730 N SER A 52 -8.313 11.631 -1.475 1.00 0.00 N ATOM 731 CA SER A 52 -7.146 11.196 -0.727 1.00 0.00 C ATOM 732 C SER A 52 -5.971 10.963 -1.679 1.00 0.00 C ATOM 733 O SER A 52 -6.038 11.322 -2.854 1.00 0.00 O ATOM 734 CB SER A 52 -7.445 9.924 0.069 1.00 0.00 C ATOM 735 OG SER A 52 -7.545 8.779 -0.773 1.00 0.00 O ATOM 0 H SER A 52 -9.144 11.055 -1.342 1.00 0.00 H new ATOM 0 HA SER A 52 -6.881 11.981 -0.019 1.00 0.00 H new ATOM 0 HB2 SER A 52 -6.658 9.764 0.806 1.00 0.00 H new ATOM 0 HB3 SER A 52 -8.377 10.052 0.620 1.00 0.00 H new ATOM 0 HG SER A 52 -8.489 8.587 -0.953 1.00 0.00 H new ATOM 741 N LEU A 53 -4.921 10.363 -1.137 1.00 0.00 N ATOM 742 CA LEU A 53 -3.733 10.078 -1.923 1.00 0.00 C ATOM 743 C LEU A 53 -3.998 8.864 -2.817 1.00 0.00 C ATOM 744 O LEU A 53 -3.289 8.645 -3.798 1.00 0.00 O ATOM 745 CB LEU A 53 -2.514 9.917 -1.013 1.00 0.00 C ATOM 746 CG LEU A 53 -1.150 9.966 -1.704 1.00 0.00 C ATOM 747 CD1 LEU A 53 -1.067 11.150 -2.669 1.00 0.00 C ATOM 748 CD2 LEU A 53 -0.015 9.984 -0.677 1.00 0.00 C ATOM 0 H LEU A 53 -4.869 10.066 -0.162 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.502 10.915 -2.581 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -2.544 10.701 -0.256 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -2.600 8.965 -0.489 1.00 0.00 H new ATOM 0 HG LEU A 53 -1.035 9.058 -2.296 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -0.087 11.162 -3.147 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.841 11.054 -3.430 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -1.213 12.079 -2.118 1.00 0.00 H new ATOM 0 HD21 LEU A 53 0.944 10.019 -1.195 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.115 10.862 -0.039 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.064 9.084 -0.065 1.00 0.00 H new ATOM 760 N SER A 54 -5.020 8.108 -2.445 1.00 0.00 N ATOM 761 CA SER A 54 -5.387 6.922 -3.201 1.00 0.00 C ATOM 762 C SER A 54 -6.502 7.258 -4.193 1.00 0.00 C ATOM 763 O SER A 54 -6.437 6.873 -5.359 1.00 0.00 O ATOM 764 CB SER A 54 -5.827 5.790 -2.271 1.00 0.00 C ATOM 765 OG SER A 54 -5.101 5.794 -1.044 1.00 0.00 O ATOM 0 H SER A 54 -5.605 8.293 -1.631 1.00 0.00 H new ATOM 0 HA SER A 54 -4.510 6.583 -3.752 1.00 0.00 H new ATOM 0 HB2 SER A 54 -6.892 5.886 -2.062 1.00 0.00 H new ATOM 0 HB3 SER A 54 -5.685 4.833 -2.773 1.00 0.00 H new ATOM 0 HG SER A 54 -5.067 4.884 -0.681 1.00 0.00 H new ATOM 771 N ALA A 55 -7.499 7.973 -3.693 1.00 0.00 N ATOM 772 CA ALA A 55 -8.627 8.365 -4.521 1.00 0.00 C ATOM 773 C ALA A 55 -8.122 9.191 -5.705 1.00 0.00 C ATOM 774 O ALA A 55 -8.661 9.098 -6.807 1.00 0.00 O ATOM 775 CB ALA A 55 -9.645 9.128 -3.670 1.00 0.00 C ATOM 0 H ALA A 55 -7.549 8.291 -2.725 1.00 0.00 H new ATOM 0 HA ALA A 55 -9.131 7.486 -4.923 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -10.491 9.422 -4.291 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -9.995 8.488 -2.860 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -9.175 10.018 -3.252 1.00 0.00 H new ATOM 781 N GLU A 56 -7.093 9.982 -5.438 1.00 0.00 N ATOM 782 CA GLU A 56 -6.509 10.824 -6.469 1.00 0.00 C ATOM 783 C GLU A 56 -5.991 9.966 -7.624 1.00 0.00 C ATOM 784 O GLU A 56 -5.973 10.409 -8.772 1.00 0.00 O ATOM 785 CB GLU A 56 -5.395 11.701 -5.894 1.00 0.00 C ATOM 786 CG GLU A 56 -4.256 10.845 -5.337 1.00 0.00 C ATOM 787 CD GLU A 56 -2.905 11.538 -5.530 1.00 0.00 C ATOM 788 OE1 GLU A 56 -2.846 12.754 -5.249 1.00 0.00 O ATOM 789 OE2 GLU A 56 -1.963 10.835 -5.955 1.00 0.00 O ATOM 0 H GLU A 56 -6.649 10.058 -4.523 1.00 0.00 H new ATOM 0 HA GLU A 56 -7.285 11.486 -6.854 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -5.011 12.363 -6.670 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -5.798 12.335 -5.104 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -4.424 10.656 -4.277 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -4.247 9.876 -5.836 1.00 0.00 H new ATOM 796 N VAL A 57 -5.581 8.754 -7.282 1.00 0.00 N ATOM 797 CA VAL A 57 -5.063 7.830 -8.277 1.00 0.00 C ATOM 798 C VAL A 57 -6.212 6.982 -8.826 1.00 0.00 C ATOM 799 O VAL A 57 -6.069 6.332 -9.861 1.00 0.00 O ATOM 800 CB VAL A 57 -3.936 6.989 -7.674 1.00 0.00 C ATOM 801 CG1 VAL A 57 -2.936 7.871 -6.923 1.00 0.00 C ATOM 802 CG2 VAL A 57 -4.495 5.896 -6.762 1.00 0.00 C ATOM 0 H VAL A 57 -5.597 8.390 -6.329 1.00 0.00 H new ATOM 0 HA VAL A 57 -4.631 8.376 -9.116 1.00 0.00 H new ATOM 0 HB VAL A 57 -3.406 6.503 -8.493 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -2.145 7.249 -6.504 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -2.501 8.596 -7.611 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -3.448 8.398 -6.118 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -3.673 5.313 -6.347 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -5.062 6.353 -5.951 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -5.149 5.241 -7.338 1.00 0.00 H new ATOM 812 N GLY A 58 -7.326 7.017 -8.109 1.00 0.00 N ATOM 813 CA GLY A 58 -8.499 6.260 -8.512 1.00 0.00 C ATOM 814 C GLY A 58 -8.566 4.920 -7.777 1.00 0.00 C ATOM 815 O GLY A 58 -9.134 3.956 -8.287 1.00 0.00 O ATOM 0 H GLY A 58 -7.441 7.558 -7.252 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -9.399 6.839 -8.303 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -8.473 6.088 -9.588 1.00 0.00 H new ATOM 819 N LEU A 59 -7.979 4.903 -6.589 1.00 0.00 N ATOM 820 CA LEU A 59 -7.965 3.698 -5.778 1.00 0.00 C ATOM 821 C LEU A 59 -9.348 3.490 -5.157 1.00 0.00 C ATOM 822 O LEU A 59 -10.003 4.451 -4.756 1.00 0.00 O ATOM 823 CB LEU A 59 -6.832 3.756 -4.751 1.00 0.00 C ATOM 824 CG LEU A 59 -5.505 3.128 -5.181 1.00 0.00 C ATOM 825 CD1 LEU A 59 -4.452 3.266 -4.079 1.00 0.00 C ATOM 826 CD2 LEU A 59 -5.699 1.673 -5.610 1.00 0.00 C ATOM 0 H LEU A 59 -7.510 5.705 -6.169 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.758 2.825 -6.397 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.652 4.801 -4.497 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -7.168 3.260 -3.840 1.00 0.00 H new ATOM 0 HG LEU A 59 -5.135 3.672 -6.050 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.518 2.812 -4.409 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.286 4.322 -3.864 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.801 2.763 -3.177 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -4.740 1.251 -5.911 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -6.103 1.099 -4.776 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -6.393 1.631 -6.449 1.00 0.00 H new ATOM 838 N GLU A 60 -9.751 2.229 -5.098 1.00 0.00 N ATOM 839 CA GLU A 60 -11.044 1.883 -4.533 1.00 0.00 C ATOM 840 C GLU A 60 -10.936 0.602 -3.704 1.00 0.00 C ATOM 841 O GLU A 60 -9.899 -0.060 -3.711 1.00 0.00 O ATOM 842 CB GLU A 60 -12.101 1.739 -5.630 1.00 0.00 C ATOM 843 CG GLU A 60 -12.106 2.960 -6.551 1.00 0.00 C ATOM 844 CD GLU A 60 -13.213 2.851 -7.601 1.00 0.00 C ATOM 845 OE1 GLU A 60 -14.389 2.998 -7.203 1.00 0.00 O ATOM 846 OE2 GLU A 60 -12.859 2.622 -8.778 1.00 0.00 O ATOM 0 H GLU A 60 -9.205 1.435 -5.432 1.00 0.00 H new ATOM 0 HA GLU A 60 -11.359 2.693 -3.875 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -11.904 0.840 -6.214 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -13.085 1.616 -5.178 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -12.248 3.865 -5.960 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -11.139 3.051 -7.045 1.00 0.00 H new ATOM 853 N ILE A 61 -12.020 0.291 -3.009 1.00 0.00 N ATOM 854 CA ILE A 61 -12.060 -0.900 -2.177 1.00 0.00 C ATOM 855 C ILE A 61 -12.006 -2.142 -3.068 1.00 0.00 C ATOM 856 O ILE A 61 -12.735 -2.234 -4.055 1.00 0.00 O ATOM 857 CB ILE A 61 -13.273 -0.863 -1.246 1.00 0.00 C ATOM 858 CG1 ILE A 61 -13.163 0.291 -0.247 1.00 0.00 C ATOM 859 CG2 ILE A 61 -13.469 -2.209 -0.547 1.00 0.00 C ATOM 860 CD1 ILE A 61 -14.547 0.754 0.211 1.00 0.00 C ATOM 0 H ILE A 61 -12.878 0.843 -3.005 1.00 0.00 H new ATOM 0 HA ILE A 61 -11.188 -0.938 -1.524 1.00 0.00 H new ATOM 0 HB ILE A 61 -14.162 -0.682 -1.851 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -12.577 -0.025 0.616 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -12.630 1.124 -0.706 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -14.338 -2.155 0.109 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -13.626 -2.987 -1.294 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -12.583 -2.445 0.043 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -14.440 1.575 0.920 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -15.121 1.092 -0.651 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -15.068 -0.075 0.691 1.00 0.00 H new ATOM 872 N GLY A 62 -11.137 -3.067 -2.689 1.00 0.00 N ATOM 873 CA GLY A 62 -10.979 -4.300 -3.441 1.00 0.00 C ATOM 874 C GLY A 62 -9.593 -4.375 -4.085 1.00 0.00 C ATOM 875 O GLY A 62 -9.030 -5.459 -4.230 1.00 0.00 O ATOM 0 H GLY A 62 -10.534 -2.987 -1.870 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -11.124 -5.155 -2.780 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -11.746 -4.361 -4.213 1.00 0.00 H new ATOM 879 N ASP A 63 -9.083 -3.210 -4.455 1.00 0.00 N ATOM 880 CA ASP A 63 -7.774 -3.130 -5.080 1.00 0.00 C ATOM 881 C ASP A 63 -6.751 -3.859 -4.207 1.00 0.00 C ATOM 882 O ASP A 63 -6.261 -3.305 -3.224 1.00 0.00 O ATOM 883 CB ASP A 63 -7.320 -1.676 -5.225 1.00 0.00 C ATOM 884 CG ASP A 63 -8.233 -0.796 -6.081 1.00 0.00 C ATOM 885 OD1 ASP A 63 -9.193 -1.359 -6.650 1.00 0.00 O ATOM 886 OD2 ASP A 63 -7.951 0.420 -6.147 1.00 0.00 O ATOM 0 H ASP A 63 -9.553 -2.313 -4.334 1.00 0.00 H new ATOM 0 HA ASP A 63 -7.844 -3.586 -6.067 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -7.242 -1.235 -4.231 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -6.320 -1.665 -5.658 1.00 0.00 H new ATOM 891 N GLN A 64 -6.460 -5.092 -4.597 1.00 0.00 N ATOM 892 CA GLN A 64 -5.504 -5.903 -3.862 1.00 0.00 C ATOM 893 C GLN A 64 -4.076 -5.556 -4.287 1.00 0.00 C ATOM 894 O GLN A 64 -3.735 -5.651 -5.465 1.00 0.00 O ATOM 895 CB GLN A 64 -5.787 -7.394 -4.055 1.00 0.00 C ATOM 896 CG GLN A 64 -4.690 -8.248 -3.416 1.00 0.00 C ATOM 897 CD GLN A 64 -4.796 -9.705 -3.869 1.00 0.00 C ATOM 898 OE1 GLN A 64 -5.581 -10.058 -4.734 1.00 0.00 O ATOM 899 NE2 GLN A 64 -3.963 -10.529 -3.239 1.00 0.00 N ATOM 0 H GLN A 64 -6.869 -5.549 -5.412 1.00 0.00 H new ATOM 0 HA GLN A 64 -5.610 -5.682 -2.800 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -6.751 -7.645 -3.613 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -5.855 -7.620 -5.119 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -3.711 -7.850 -3.685 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -4.769 -8.194 -2.330 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -3.331 -10.167 -2.524 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -3.956 -11.522 -3.471 1.00 0.00 H new ATOM 908 N ILE A 65 -3.279 -5.162 -3.304 1.00 0.00 N ATOM 909 CA ILE A 65 -1.896 -4.800 -3.562 1.00 0.00 C ATOM 910 C ILE A 65 -1.082 -6.070 -3.824 1.00 0.00 C ATOM 911 O ILE A 65 -0.820 -6.844 -2.906 1.00 0.00 O ATOM 912 CB ILE A 65 -1.345 -3.942 -2.421 1.00 0.00 C ATOM 913 CG1 ILE A 65 -2.123 -2.630 -2.298 1.00 0.00 C ATOM 914 CG2 ILE A 65 0.157 -3.704 -2.590 1.00 0.00 C ATOM 915 CD1 ILE A 65 -1.780 -1.911 -0.991 1.00 0.00 C ATOM 0 H ILE A 65 -3.565 -5.086 -2.328 1.00 0.00 H new ATOM 0 HA ILE A 65 -1.824 -4.183 -4.458 1.00 0.00 H new ATOM 0 HB ILE A 65 -1.481 -4.487 -1.487 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -1.890 -1.984 -3.145 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -3.193 -2.832 -2.336 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.523 -3.092 -1.766 1.00 0.00 H new ATOM 0 HG22 ILE A 65 0.679 -4.661 -2.591 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.340 -3.190 -3.533 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.346 -0.982 -0.928 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -2.036 -2.550 -0.146 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -0.713 -1.689 -0.967 1.00 0.00 H new ATOM 927 N VAL A 66 -0.706 -6.243 -5.083 1.00 0.00 N ATOM 928 CA VAL A 66 0.072 -7.405 -5.478 1.00 0.00 C ATOM 929 C VAL A 66 1.556 -7.032 -5.511 1.00 0.00 C ATOM 930 O VAL A 66 2.420 -7.900 -5.395 1.00 0.00 O ATOM 931 CB VAL A 66 -0.438 -7.946 -6.815 1.00 0.00 C ATOM 932 CG1 VAL A 66 -1.946 -8.198 -6.765 1.00 0.00 C ATOM 933 CG2 VAL A 66 -0.077 -7.001 -7.963 1.00 0.00 C ATOM 0 H VAL A 66 -0.926 -5.598 -5.842 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.046 -8.209 -4.751 1.00 0.00 H new ATOM 0 HB VAL A 66 0.055 -8.900 -7.000 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.283 -8.582 -7.728 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.167 -8.927 -5.986 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.464 -7.264 -6.546 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.451 -7.409 -8.902 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.529 -6.025 -7.786 1.00 0.00 H new ATOM 0 HG23 VAL A 66 1.006 -6.895 -8.020 1.00 0.00 H new ATOM 943 N GLU A 67 1.806 -5.741 -5.669 1.00 0.00 N ATOM 944 CA GLU A 67 3.170 -5.243 -5.718 1.00 0.00 C ATOM 945 C GLU A 67 3.224 -3.794 -5.229 1.00 0.00 C ATOM 946 O GLU A 67 2.233 -3.070 -5.309 1.00 0.00 O ATOM 947 CB GLU A 67 3.748 -5.367 -7.129 1.00 0.00 C ATOM 948 CG GLU A 67 5.100 -4.658 -7.232 1.00 0.00 C ATOM 949 CD GLU A 67 5.662 -4.751 -8.652 1.00 0.00 C ATOM 950 OE1 GLU A 67 5.044 -4.137 -9.548 1.00 0.00 O ATOM 951 OE2 GLU A 67 6.696 -5.435 -8.809 1.00 0.00 O ATOM 0 H GLU A 67 1.087 -5.024 -5.765 1.00 0.00 H new ATOM 0 HA GLU A 67 3.783 -5.853 -5.054 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.865 -6.420 -7.387 1.00 0.00 H new ATOM 0 HB3 GLU A 67 3.052 -4.938 -7.850 1.00 0.00 H new ATOM 0 HG2 GLU A 67 4.988 -3.611 -6.949 1.00 0.00 H new ATOM 0 HG3 GLU A 67 5.803 -5.105 -6.529 1.00 0.00 H new ATOM 958 N VAL A 68 4.393 -3.414 -4.732 1.00 0.00 N ATOM 959 CA VAL A 68 4.589 -2.065 -4.230 1.00 0.00 C ATOM 960 C VAL A 68 6.064 -1.682 -4.372 1.00 0.00 C ATOM 961 O VAL A 68 6.927 -2.275 -3.727 1.00 0.00 O ATOM 962 CB VAL A 68 4.081 -1.964 -2.790 1.00 0.00 C ATOM 963 CG1 VAL A 68 4.295 -0.555 -2.232 1.00 0.00 C ATOM 964 CG2 VAL A 68 2.610 -2.373 -2.697 1.00 0.00 C ATOM 0 H VAL A 68 5.213 -4.017 -4.667 1.00 0.00 H new ATOM 0 HA VAL A 68 4.010 -1.351 -4.816 1.00 0.00 H new ATOM 0 HB VAL A 68 4.660 -2.658 -2.181 1.00 0.00 H new ATOM 0 HG11 VAL A 68 3.926 -0.509 -1.207 1.00 0.00 H new ATOM 0 HG12 VAL A 68 5.358 -0.316 -2.245 1.00 0.00 H new ATOM 0 HG13 VAL A 68 3.754 0.165 -2.845 1.00 0.00 H new ATOM 0 HG21 VAL A 68 2.275 -2.292 -1.663 1.00 0.00 H new ATOM 0 HG22 VAL A 68 2.009 -1.716 -3.326 1.00 0.00 H new ATOM 0 HG23 VAL A 68 2.497 -3.403 -3.036 1.00 0.00 H new ATOM 974 N ASN A 69 6.306 -0.694 -5.221 1.00 0.00 N ATOM 975 CA ASN A 69 7.661 -0.226 -5.456 1.00 0.00 C ATOM 976 C ASN A 69 8.516 -1.386 -5.969 1.00 0.00 C ATOM 977 O ASN A 69 9.744 -1.318 -5.939 1.00 0.00 O ATOM 978 CB ASN A 69 8.296 0.295 -4.165 1.00 0.00 C ATOM 979 CG ASN A 69 8.899 1.686 -4.372 1.00 0.00 C ATOM 980 OD1 ASN A 69 8.992 2.192 -5.478 1.00 0.00 O ATOM 981 ND2 ASN A 69 9.302 2.273 -3.249 1.00 0.00 N ATOM 0 H ASN A 69 5.587 -0.205 -5.754 1.00 0.00 H new ATOM 0 HA ASN A 69 7.616 0.581 -6.187 1.00 0.00 H new ATOM 0 HB2 ASN A 69 7.545 0.334 -3.376 1.00 0.00 H new ATOM 0 HB3 ASN A 69 9.071 -0.395 -3.833 1.00 0.00 H new ATOM 0 HD21 ASN A 69 9.719 3.204 -3.281 1.00 0.00 H new ATOM 0 HD22 ASN A 69 9.195 1.793 -2.356 1.00 0.00 H new ATOM 988 N GLY A 70 7.833 -2.425 -6.426 1.00 0.00 N ATOM 989 CA GLY A 70 8.514 -3.599 -6.945 1.00 0.00 C ATOM 990 C GLY A 70 8.551 -4.717 -5.901 1.00 0.00 C ATOM 991 O GLY A 70 9.070 -5.801 -6.165 1.00 0.00 O ATOM 0 H GLY A 70 6.815 -2.478 -6.448 1.00 0.00 H new ATOM 0 HA2 GLY A 70 8.006 -3.951 -7.843 1.00 0.00 H new ATOM 0 HA3 GLY A 70 9.531 -3.335 -7.237 1.00 0.00 H new ATOM 995 N VAL A 71 7.995 -4.415 -4.737 1.00 0.00 N ATOM 996 CA VAL A 71 7.958 -5.381 -3.652 1.00 0.00 C ATOM 997 C VAL A 71 6.880 -6.427 -3.943 1.00 0.00 C ATOM 998 O VAL A 71 5.840 -6.109 -4.519 1.00 0.00 O ATOM 999 CB VAL A 71 7.748 -4.662 -2.318 1.00 0.00 C ATOM 1000 CG1 VAL A 71 7.715 -5.658 -1.157 1.00 0.00 C ATOM 1001 CG2 VAL A 71 8.822 -3.595 -2.095 1.00 0.00 C ATOM 0 H VAL A 71 7.566 -3.515 -4.521 1.00 0.00 H new ATOM 0 HA VAL A 71 8.910 -5.907 -3.576 1.00 0.00 H new ATOM 0 HB VAL A 71 6.781 -4.161 -2.357 1.00 0.00 H new ATOM 0 HG11 VAL A 71 7.565 -5.121 -0.221 1.00 0.00 H new ATOM 0 HG12 VAL A 71 6.897 -6.363 -1.306 1.00 0.00 H new ATOM 0 HG13 VAL A 71 8.659 -6.201 -1.116 1.00 0.00 H new ATOM 0 HG21 VAL A 71 8.649 -3.099 -1.140 1.00 0.00 H new ATOM 0 HG22 VAL A 71 9.806 -4.065 -2.088 1.00 0.00 H new ATOM 0 HG23 VAL A 71 8.777 -2.860 -2.899 1.00 0.00 H new ATOM 1011 N ASP A 72 7.165 -7.654 -3.532 1.00 0.00 N ATOM 1012 CA ASP A 72 6.233 -8.749 -3.742 1.00 0.00 C ATOM 1013 C ASP A 72 5.199 -8.757 -2.614 1.00 0.00 C ATOM 1014 O ASP A 72 5.412 -9.383 -1.576 1.00 0.00 O ATOM 1015 CB ASP A 72 6.956 -10.098 -3.730 1.00 0.00 C ATOM 1016 CG ASP A 72 6.378 -11.149 -4.679 1.00 0.00 C ATOM 1017 OD1 ASP A 72 5.149 -11.365 -4.607 1.00 0.00 O ATOM 1018 OD2 ASP A 72 7.179 -11.714 -5.456 1.00 0.00 O ATOM 0 H ASP A 72 8.028 -7.914 -3.055 1.00 0.00 H new ATOM 0 HA ASP A 72 5.756 -8.604 -4.711 1.00 0.00 H new ATOM 0 HB2 ASP A 72 8.003 -9.935 -3.987 1.00 0.00 H new ATOM 0 HB3 ASP A 72 6.935 -10.496 -2.715 1.00 0.00 H new ATOM 1023 N PHE A 73 4.103 -8.054 -2.855 1.00 0.00 N ATOM 1024 CA PHE A 73 3.036 -7.971 -1.872 1.00 0.00 C ATOM 1025 C PHE A 73 2.042 -9.122 -2.043 1.00 0.00 C ATOM 1026 O PHE A 73 0.842 -8.946 -1.841 1.00 0.00 O ATOM 1027 CB PHE A 73 2.309 -6.646 -2.110 1.00 0.00 C ATOM 1028 CG PHE A 73 2.810 -5.496 -1.234 1.00 0.00 C ATOM 1029 CD1 PHE A 73 4.138 -5.206 -1.186 1.00 0.00 C ATOM 1030 CD2 PHE A 73 1.928 -4.763 -0.503 1.00 0.00 C ATOM 1031 CE1 PHE A 73 4.603 -4.138 -0.374 1.00 0.00 C ATOM 1032 CE2 PHE A 73 2.392 -3.695 0.309 1.00 0.00 C ATOM 1033 CZ PHE A 73 3.720 -3.405 0.357 1.00 0.00 C ATOM 0 H PHE A 73 3.930 -7.536 -3.717 1.00 0.00 H new ATOM 0 HA PHE A 73 3.452 -8.032 -0.866 1.00 0.00 H new ATOM 0 HB2 PHE A 73 2.419 -6.366 -3.158 1.00 0.00 H new ATOM 0 HB3 PHE A 73 1.244 -6.790 -1.929 1.00 0.00 H new ATOM 0 HD1 PHE A 73 4.839 -5.788 -1.766 1.00 0.00 H new ATOM 0 HD2 PHE A 73 0.874 -4.994 -0.540 1.00 0.00 H new ATOM 0 HE1 PHE A 73 5.657 -3.908 -0.337 1.00 0.00 H new ATOM 0 HE2 PHE A 73 1.691 -3.113 0.888 1.00 0.00 H new ATOM 0 HZ PHE A 73 4.074 -2.593 0.975 1.00 0.00 H new ATOM 1043 N SER A 74 2.579 -10.274 -2.415 1.00 0.00 N ATOM 1044 CA SER A 74 1.754 -11.454 -2.617 1.00 0.00 C ATOM 1045 C SER A 74 1.233 -11.964 -1.272 1.00 0.00 C ATOM 1046 O SER A 74 0.030 -11.937 -1.018 1.00 0.00 O ATOM 1047 CB SER A 74 2.535 -12.556 -3.336 1.00 0.00 C ATOM 1048 OG SER A 74 1.986 -13.847 -3.089 1.00 0.00 O ATOM 0 H SER A 74 3.575 -10.416 -2.582 1.00 0.00 H new ATOM 0 HA SER A 74 0.908 -11.176 -3.246 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.534 -12.361 -4.408 1.00 0.00 H new ATOM 0 HB3 SER A 74 3.575 -12.536 -3.009 1.00 0.00 H new ATOM 0 HG SER A 74 2.511 -14.523 -3.566 1.00 0.00 H new ATOM 1054 N ASN A 75 2.165 -12.416 -0.445 1.00 0.00 N ATOM 1055 CA ASN A 75 1.814 -12.932 0.867 1.00 0.00 C ATOM 1056 C ASN A 75 2.499 -12.085 1.942 1.00 0.00 C ATOM 1057 O ASN A 75 3.215 -12.614 2.792 1.00 0.00 O ATOM 1058 CB ASN A 75 2.283 -14.378 1.034 1.00 0.00 C ATOM 1059 CG ASN A 75 1.181 -15.362 0.636 1.00 0.00 C ATOM 1060 OD1 ASN A 75 0.591 -16.039 1.461 1.00 0.00 O ATOM 1061 ND2 ASN A 75 0.938 -15.401 -0.671 1.00 0.00 N ATOM 0 H ASN A 75 3.162 -12.435 -0.658 1.00 0.00 H new ATOM 0 HA ASN A 75 0.729 -12.892 0.967 1.00 0.00 H new ATOM 0 HB2 ASN A 75 3.168 -14.550 0.421 1.00 0.00 H new ATOM 0 HB3 ASN A 75 2.574 -14.552 2.070 1.00 0.00 H new ATOM 0 HD21 ASN A 75 0.220 -16.025 -1.038 1.00 0.00 H new ATOM 0 HD22 ASN A 75 1.470 -14.806 -1.307 1.00 0.00 H new ATOM 1068 N LEU A 76 2.257 -10.785 1.870 1.00 0.00 N ATOM 1069 CA LEU A 76 2.841 -9.860 2.826 1.00 0.00 C ATOM 1070 C LEU A 76 2.008 -9.866 4.110 1.00 0.00 C ATOM 1071 O LEU A 76 1.176 -10.749 4.309 1.00 0.00 O ATOM 1072 CB LEU A 76 2.999 -8.472 2.202 1.00 0.00 C ATOM 1073 CG LEU A 76 4.398 -8.122 1.689 1.00 0.00 C ATOM 1074 CD1 LEU A 76 4.466 -6.662 1.237 1.00 0.00 C ATOM 1075 CD2 LEU A 76 5.463 -8.449 2.737 1.00 0.00 C ATOM 0 H LEU A 76 1.664 -10.350 1.164 1.00 0.00 H new ATOM 0 HA LEU A 76 3.848 -10.178 3.097 1.00 0.00 H new ATOM 0 HB2 LEU A 76 2.297 -8.387 1.372 1.00 0.00 H new ATOM 0 HB3 LEU A 76 2.708 -7.727 2.943 1.00 0.00 H new ATOM 0 HG LEU A 76 4.607 -8.739 0.815 1.00 0.00 H new ATOM 0 HD11 LEU A 76 5.470 -6.439 0.877 1.00 0.00 H new ATOM 0 HD12 LEU A 76 3.748 -6.496 0.434 1.00 0.00 H new ATOM 0 HD13 LEU A 76 4.228 -6.010 2.077 1.00 0.00 H new ATOM 0 HD21 LEU A 76 6.448 -8.191 2.348 1.00 0.00 H new ATOM 0 HD22 LEU A 76 5.270 -7.876 3.644 1.00 0.00 H new ATOM 0 HD23 LEU A 76 5.432 -9.514 2.968 1.00 0.00 H new ATOM 1087 N ASP A 77 2.262 -8.871 4.947 1.00 0.00 N ATOM 1088 CA ASP A 77 1.546 -8.750 6.205 1.00 0.00 C ATOM 1089 C ASP A 77 1.130 -7.293 6.413 1.00 0.00 C ATOM 1090 O ASP A 77 1.573 -6.407 5.683 1.00 0.00 O ATOM 1091 CB ASP A 77 2.430 -9.162 7.384 1.00 0.00 C ATOM 1092 CG ASP A 77 1.754 -9.095 8.754 1.00 0.00 C ATOM 1093 OD1 ASP A 77 0.649 -9.669 8.871 1.00 0.00 O ATOM 1094 OD2 ASP A 77 2.357 -8.472 9.655 1.00 0.00 O ATOM 0 H ASP A 77 2.954 -8.141 4.778 1.00 0.00 H new ATOM 0 HA ASP A 77 0.675 -9.404 6.161 1.00 0.00 H new ATOM 0 HB2 ASP A 77 2.780 -10.181 7.218 1.00 0.00 H new ATOM 0 HB3 ASP A 77 3.311 -8.521 7.399 1.00 0.00 H new ATOM 1099 N HIS A 78 0.285 -7.088 7.413 1.00 0.00 N ATOM 1100 CA HIS A 78 -0.195 -5.753 7.726 1.00 0.00 C ATOM 1101 C HIS A 78 0.944 -4.926 8.325 1.00 0.00 C ATOM 1102 O HIS A 78 0.795 -3.724 8.543 1.00 0.00 O ATOM 1103 CB HIS A 78 -1.424 -5.817 8.635 1.00 0.00 C ATOM 1104 CG HIS A 78 -2.060 -4.474 8.903 1.00 0.00 C ATOM 1105 ND1 HIS A 78 -1.526 -3.556 9.790 1.00 0.00 N ATOM 1106 CD2 HIS A 78 -3.189 -3.904 8.392 1.00 0.00 C ATOM 1107 CE1 HIS A 78 -2.307 -2.486 9.805 1.00 0.00 C ATOM 1108 NE2 HIS A 78 -3.337 -2.704 8.938 1.00 0.00 N ATOM 0 H HIS A 78 -0.080 -7.825 8.017 1.00 0.00 H new ATOM 0 HA HIS A 78 -0.517 -5.254 6.812 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -2.165 -6.474 8.181 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -1.137 -6.268 9.585 1.00 0.00 H new ATOM 0 HD1 HIS A 78 -0.676 -3.682 10.339 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -3.850 -4.353 7.666 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -2.155 -1.597 10.399 1.00 0.00 H new ATOM 1116 N LYS A 79 2.055 -5.602 8.575 1.00 0.00 N ATOM 1117 CA LYS A 79 3.219 -4.944 9.145 1.00 0.00 C ATOM 1118 C LYS A 79 4.306 -4.822 8.075 1.00 0.00 C ATOM 1119 O LYS A 79 5.019 -3.821 8.022 1.00 0.00 O ATOM 1120 CB LYS A 79 3.680 -5.672 10.409 1.00 0.00 C ATOM 1121 CG LYS A 79 2.600 -5.628 11.492 1.00 0.00 C ATOM 1122 CD LYS A 79 3.198 -5.250 12.849 1.00 0.00 C ATOM 1123 CE LYS A 79 2.645 -3.910 13.338 1.00 0.00 C ATOM 1124 NZ LYS A 79 3.315 -3.500 14.592 1.00 0.00 N ATOM 0 H LYS A 79 2.174 -6.599 8.394 1.00 0.00 H new ATOM 0 HA LYS A 79 2.967 -3.932 9.461 1.00 0.00 H new ATOM 0 HB2 LYS A 79 3.918 -6.708 10.170 1.00 0.00 H new ATOM 0 HB3 LYS A 79 4.595 -5.213 10.784 1.00 0.00 H new ATOM 0 HG2 LYS A 79 1.832 -4.906 11.215 1.00 0.00 H new ATOM 0 HG3 LYS A 79 2.112 -6.600 11.564 1.00 0.00 H new ATOM 0 HD2 LYS A 79 2.974 -6.028 13.579 1.00 0.00 H new ATOM 0 HD3 LYS A 79 4.283 -5.192 12.769 1.00 0.00 H new ATOM 0 HE2 LYS A 79 2.794 -3.148 12.573 1.00 0.00 H new ATOM 0 HE3 LYS A 79 1.571 -3.991 13.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 2.928 -2.589 14.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 3.152 -4.220 15.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 4.337 -3.403 14.424 1.00 0.00 H new ATOM 1138 N GLU A 80 4.397 -5.854 7.249 1.00 0.00 N ATOM 1139 CA GLU A 80 5.385 -5.874 6.184 1.00 0.00 C ATOM 1140 C GLU A 80 4.940 -4.972 5.030 1.00 0.00 C ATOM 1141 O GLU A 80 5.764 -4.305 4.407 1.00 0.00 O ATOM 1142 CB GLU A 80 5.636 -7.302 5.697 1.00 0.00 C ATOM 1143 CG GLU A 80 6.223 -8.167 6.814 1.00 0.00 C ATOM 1144 CD GLU A 80 7.460 -8.926 6.328 1.00 0.00 C ATOM 1145 OE1 GLU A 80 8.317 -8.269 5.697 1.00 0.00 O ATOM 1146 OE2 GLU A 80 7.522 -10.144 6.599 1.00 0.00 O ATOM 0 H GLU A 80 3.803 -6.682 7.296 1.00 0.00 H new ATOM 0 HA GLU A 80 6.325 -5.489 6.579 1.00 0.00 H new ATOM 0 HB2 GLU A 80 4.702 -7.740 5.346 1.00 0.00 H new ATOM 0 HB3 GLU A 80 6.319 -7.286 4.848 1.00 0.00 H new ATOM 0 HG2 GLU A 80 6.488 -7.538 7.664 1.00 0.00 H new ATOM 0 HG3 GLU A 80 5.472 -8.875 7.163 1.00 0.00 H new ATOM 1153 N ALA A 81 3.639 -4.981 4.782 1.00 0.00 N ATOM 1154 CA ALA A 81 3.075 -4.172 3.715 1.00 0.00 C ATOM 1155 C ALA A 81 3.096 -2.700 4.132 1.00 0.00 C ATOM 1156 O ALA A 81 3.398 -1.825 3.320 1.00 0.00 O ATOM 1157 CB ALA A 81 1.664 -4.665 3.391 1.00 0.00 C ATOM 0 H ALA A 81 2.959 -5.536 5.302 1.00 0.00 H new ATOM 0 HA ALA A 81 3.670 -4.267 2.807 1.00 0.00 H new ATOM 0 HB1 ALA A 81 1.241 -4.058 2.591 1.00 0.00 H new ATOM 0 HB2 ALA A 81 1.707 -5.707 3.073 1.00 0.00 H new ATOM 0 HB3 ALA A 81 1.037 -4.582 4.279 1.00 0.00 H new ATOM 1163 N VAL A 82 2.772 -2.471 5.396 1.00 0.00 N ATOM 1164 CA VAL A 82 2.751 -1.119 5.930 1.00 0.00 C ATOM 1165 C VAL A 82 4.172 -0.554 5.932 1.00 0.00 C ATOM 1166 O VAL A 82 4.411 0.537 5.415 1.00 0.00 O ATOM 1167 CB VAL A 82 2.103 -1.115 7.316 1.00 0.00 C ATOM 1168 CG1 VAL A 82 2.537 0.112 8.120 1.00 0.00 C ATOM 1169 CG2 VAL A 82 0.578 -1.189 7.209 1.00 0.00 C ATOM 0 H VAL A 82 2.522 -3.198 6.066 1.00 0.00 H new ATOM 0 HA VAL A 82 2.144 -0.468 5.300 1.00 0.00 H new ATOM 0 HB VAL A 82 2.445 -2.003 7.848 1.00 0.00 H new ATOM 0 HG11 VAL A 82 2.062 0.091 9.101 1.00 0.00 H new ATOM 0 HG12 VAL A 82 3.620 0.103 8.241 1.00 0.00 H new ATOM 0 HG13 VAL A 82 2.238 1.017 7.592 1.00 0.00 H new ATOM 0 HG21 VAL A 82 0.143 -1.185 8.208 1.00 0.00 H new ATOM 0 HG22 VAL A 82 0.210 -0.329 6.649 1.00 0.00 H new ATOM 0 HG23 VAL A 82 0.294 -2.106 6.693 1.00 0.00 H new ATOM 1179 N ASN A 83 5.079 -1.320 6.520 1.00 0.00 N ATOM 1180 CA ASN A 83 6.470 -0.909 6.597 1.00 0.00 C ATOM 1181 C ASN A 83 6.974 -0.565 5.194 1.00 0.00 C ATOM 1182 O ASN A 83 7.613 0.467 4.995 1.00 0.00 O ATOM 1183 CB ASN A 83 7.347 -2.033 7.152 1.00 0.00 C ATOM 1184 CG ASN A 83 8.770 -1.537 7.420 1.00 0.00 C ATOM 1185 OD1 ASN A 83 9.097 -1.064 8.496 1.00 0.00 O ATOM 1186 ND2 ASN A 83 9.593 -1.671 6.385 1.00 0.00 N ATOM 0 H ASN A 83 4.877 -2.224 6.948 1.00 0.00 H new ATOM 0 HA ASN A 83 6.530 -0.045 7.259 1.00 0.00 H new ATOM 0 HB2 ASN A 83 6.912 -2.417 8.075 1.00 0.00 H new ATOM 0 HB3 ASN A 83 7.374 -2.861 6.444 1.00 0.00 H new ATOM 0 HD21 ASN A 83 10.564 -1.369 6.463 1.00 0.00 H new ATOM 0 HD22 ASN A 83 9.253 -2.076 5.512 1.00 0.00 H new ATOM 1193 N VAL A 84 6.667 -1.449 4.256 1.00 0.00 N ATOM 1194 CA VAL A 84 7.081 -1.253 2.877 1.00 0.00 C ATOM 1195 C VAL A 84 6.330 -0.056 2.290 1.00 0.00 C ATOM 1196 O VAL A 84 6.780 0.547 1.317 1.00 0.00 O ATOM 1197 CB VAL A 84 6.871 -2.541 2.079 1.00 0.00 C ATOM 1198 CG1 VAL A 84 7.198 -2.329 0.600 1.00 0.00 C ATOM 1199 CG2 VAL A 84 7.695 -3.689 2.664 1.00 0.00 C ATOM 0 H VAL A 84 6.136 -2.303 4.424 1.00 0.00 H new ATOM 0 HA VAL A 84 8.146 -1.026 2.826 1.00 0.00 H new ATOM 0 HB VAL A 84 5.818 -2.813 2.153 1.00 0.00 H new ATOM 0 HG11 VAL A 84 7.040 -3.260 0.055 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.549 -1.555 0.191 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.239 -2.021 0.498 1.00 0.00 H new ATOM 0 HG21 VAL A 84 7.527 -4.593 2.078 1.00 0.00 H new ATOM 0 HG22 VAL A 84 8.753 -3.429 2.635 1.00 0.00 H new ATOM 0 HG23 VAL A 84 7.393 -3.865 3.696 1.00 0.00 H new ATOM 1209 N LEU A 85 5.197 0.252 2.906 1.00 0.00 N ATOM 1210 CA LEU A 85 4.380 1.365 2.456 1.00 0.00 C ATOM 1211 C LEU A 85 4.883 2.656 3.105 1.00 0.00 C ATOM 1212 O LEU A 85 4.790 3.730 2.512 1.00 0.00 O ATOM 1213 CB LEU A 85 2.899 1.082 2.717 1.00 0.00 C ATOM 1214 CG LEU A 85 2.192 0.202 1.684 1.00 0.00 C ATOM 1215 CD1 LEU A 85 0.814 -0.234 2.187 1.00 0.00 C ATOM 1216 CD2 LEU A 85 2.111 0.906 0.328 1.00 0.00 C ATOM 0 H LEU A 85 4.827 -0.250 3.713 1.00 0.00 H new ATOM 0 HA LEU A 85 4.471 1.493 1.377 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.807 0.607 3.694 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.372 2.034 2.775 1.00 0.00 H new ATOM 0 HG LEU A 85 2.784 -0.702 1.542 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.333 -0.858 1.434 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.927 -0.801 3.111 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.200 0.647 2.375 1.00 0.00 H new ATOM 0 HD21 LEU A 85 1.604 0.259 -0.388 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.554 1.837 0.434 1.00 0.00 H new ATOM 0 HD23 LEU A 85 3.117 1.124 -0.029 1.00 0.00 H new ATOM 1228 N LYS A 86 5.404 2.509 4.314 1.00 0.00 N ATOM 1229 CA LYS A 86 5.922 3.650 5.049 1.00 0.00 C ATOM 1230 C LYS A 86 7.438 3.728 4.861 1.00 0.00 C ATOM 1231 O LYS A 86 8.087 4.633 5.383 1.00 0.00 O ATOM 1232 CB LYS A 86 5.487 3.586 6.515 1.00 0.00 C ATOM 1233 CG LYS A 86 6.454 2.731 7.337 1.00 0.00 C ATOM 1234 CD LYS A 86 5.703 1.913 8.390 1.00 0.00 C ATOM 1235 CE LYS A 86 4.987 2.828 9.386 1.00 0.00 C ATOM 1236 NZ LYS A 86 5.712 2.856 10.676 1.00 0.00 N ATOM 0 H LYS A 86 5.479 1.617 4.803 1.00 0.00 H new ATOM 0 HA LYS A 86 5.504 4.577 4.656 1.00 0.00 H new ATOM 0 HB2 LYS A 86 5.444 4.593 6.930 1.00 0.00 H new ATOM 0 HB3 LYS A 86 4.482 3.170 6.582 1.00 0.00 H new ATOM 0 HG2 LYS A 86 7.005 2.062 6.676 1.00 0.00 H new ATOM 0 HG3 LYS A 86 7.188 3.373 7.825 1.00 0.00 H new ATOM 0 HD2 LYS A 86 4.977 1.263 7.901 1.00 0.00 H new ATOM 0 HD3 LYS A 86 6.402 1.268 8.921 1.00 0.00 H new ATOM 0 HE2 LYS A 86 4.919 3.837 8.978 1.00 0.00 H new ATOM 0 HE3 LYS A 86 3.967 2.478 9.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 5.213 3.481 11.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 5.755 1.895 11.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 6.677 3.212 10.524 1.00 0.00 H new ATOM 1250 N SER A 87 7.959 2.766 4.113 1.00 0.00 N ATOM 1251 CA SER A 87 9.387 2.714 3.850 1.00 0.00 C ATOM 1252 C SER A 87 9.866 4.055 3.290 1.00 0.00 C ATOM 1253 O SER A 87 10.575 4.797 3.967 1.00 0.00 O ATOM 1254 CB SER A 87 9.727 1.582 2.878 1.00 0.00 C ATOM 1255 OG SER A 87 11.124 1.300 2.854 1.00 0.00 O ATOM 0 H SER A 87 7.418 2.017 3.681 1.00 0.00 H new ATOM 0 HA SER A 87 9.901 2.516 4.791 1.00 0.00 H new ATOM 0 HB2 SER A 87 9.181 0.683 3.163 1.00 0.00 H new ATOM 0 HB3 SER A 87 9.395 1.853 1.876 1.00 0.00 H new ATOM 0 HG SER A 87 11.300 0.571 2.223 1.00 0.00 H new ATOM 1261 N SER A 88 9.458 4.325 2.058 1.00 0.00 N ATOM 1262 CA SER A 88 9.836 5.564 1.400 1.00 0.00 C ATOM 1263 C SER A 88 8.590 6.404 1.110 1.00 0.00 C ATOM 1264 O SER A 88 7.477 6.007 1.450 1.00 0.00 O ATOM 1265 CB SER A 88 10.602 5.288 0.105 1.00 0.00 C ATOM 1266 OG SER A 88 11.604 6.270 -0.142 1.00 0.00 O ATOM 0 H SER A 88 8.870 3.707 1.499 1.00 0.00 H new ATOM 0 HA SER A 88 10.494 6.119 2.069 1.00 0.00 H new ATOM 0 HB2 SER A 88 11.066 4.303 0.161 1.00 0.00 H new ATOM 0 HB3 SER A 88 9.903 5.264 -0.731 1.00 0.00 H new ATOM 0 HG SER A 88 12.072 6.057 -0.977 1.00 0.00 H new ATOM 1272 N ARG A 89 8.820 7.549 0.484 1.00 0.00 N ATOM 1273 CA ARG A 89 7.730 8.448 0.145 1.00 0.00 C ATOM 1274 C ARG A 89 7.083 8.023 -1.175 1.00 0.00 C ATOM 1275 O ARG A 89 5.879 7.774 -1.229 1.00 0.00 O ATOM 1276 CB ARG A 89 8.224 9.890 0.021 1.00 0.00 C ATOM 1277 CG ARG A 89 9.183 10.241 1.161 1.00 0.00 C ATOM 1278 CD ARG A 89 8.464 10.215 2.511 1.00 0.00 C ATOM 1279 NE ARG A 89 9.430 9.925 3.594 1.00 0.00 N ATOM 1280 CZ ARG A 89 10.339 10.801 4.043 1.00 0.00 C ATOM 1281 NH1 ARG A 89 10.412 12.026 3.506 1.00 0.00 N ATOM 1282 NH2 ARG A 89 11.175 10.451 5.030 1.00 0.00 N ATOM 0 H ARG A 89 9.745 7.875 0.203 1.00 0.00 H new ATOM 0 HA ARG A 89 6.995 8.395 0.948 1.00 0.00 H new ATOM 0 HB2 ARG A 89 8.727 10.025 -0.937 1.00 0.00 H new ATOM 0 HB3 ARG A 89 7.374 10.572 0.033 1.00 0.00 H new ATOM 0 HG2 ARG A 89 10.013 9.534 1.173 1.00 0.00 H new ATOM 0 HG3 ARG A 89 9.609 11.230 0.991 1.00 0.00 H new ATOM 0 HD2 ARG A 89 7.979 11.174 2.692 1.00 0.00 H new ATOM 0 HD3 ARG A 89 7.680 9.458 2.500 1.00 0.00 H new ATOM 0 HE ARG A 89 9.402 9.001 4.025 1.00 0.00 H new ATOM 0 HH11 ARG A 89 9.775 12.292 2.755 1.00 0.00 H new ATOM 0 HH12 ARG A 89 11.104 12.692 3.848 1.00 0.00 H new ATOM 0 HH21 ARG A 89 11.119 9.518 5.439 1.00 0.00 H new ATOM 0 HH22 ARG A 89 11.867 11.117 5.372 1.00 0.00 H new ATOM 1296 N SER A 90 7.910 7.953 -2.207 1.00 0.00 N ATOM 1297 CA SER A 90 7.434 7.562 -3.523 1.00 0.00 C ATOM 1298 C SER A 90 7.435 6.038 -3.649 1.00 0.00 C ATOM 1299 O SER A 90 8.487 5.405 -3.567 1.00 0.00 O ATOM 1300 CB SER A 90 8.290 8.187 -4.627 1.00 0.00 C ATOM 1301 OG SER A 90 9.512 8.717 -4.119 1.00 0.00 O ATOM 0 H SER A 90 8.907 8.161 -2.159 1.00 0.00 H new ATOM 0 HA SER A 90 6.414 7.929 -3.640 1.00 0.00 H new ATOM 0 HB2 SER A 90 8.508 7.436 -5.386 1.00 0.00 H new ATOM 0 HB3 SER A 90 7.726 8.981 -5.117 1.00 0.00 H new ATOM 0 HG SER A 90 10.031 9.105 -4.854 1.00 0.00 H new ATOM 1307 N LEU A 91 6.244 5.491 -3.846 1.00 0.00 N ATOM 1308 CA LEU A 91 6.095 4.052 -3.985 1.00 0.00 C ATOM 1309 C LEU A 91 5.151 3.752 -5.150 1.00 0.00 C ATOM 1310 O LEU A 91 4.223 4.514 -5.415 1.00 0.00 O ATOM 1311 CB LEU A 91 5.652 3.430 -2.659 1.00 0.00 C ATOM 1312 CG LEU A 91 6.508 3.774 -1.438 1.00 0.00 C ATOM 1313 CD1 LEU A 91 5.635 4.234 -0.269 1.00 0.00 C ATOM 1314 CD2 LEU A 91 7.410 2.600 -1.052 1.00 0.00 C ATOM 0 H LEU A 91 5.373 6.018 -3.913 1.00 0.00 H new ATOM 0 HA LEU A 91 7.053 3.590 -4.224 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.627 3.742 -2.459 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.639 2.346 -2.775 1.00 0.00 H new ATOM 0 HG LEU A 91 7.159 4.607 -1.701 1.00 0.00 H new ATOM 0 HD11 LEU A 91 6.268 4.472 0.586 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.072 5.120 -0.562 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.942 3.438 0.003 1.00 0.00 H new ATOM 0 HD21 LEU A 91 8.008 2.871 -0.182 1.00 0.00 H new ATOM 0 HD22 LEU A 91 6.795 1.732 -0.814 1.00 0.00 H new ATOM 0 HD23 LEU A 91 8.071 2.360 -1.885 1.00 0.00 H new ATOM 1326 N THR A 92 5.420 2.638 -5.816 1.00 0.00 N ATOM 1327 CA THR A 92 4.607 2.227 -6.948 1.00 0.00 C ATOM 1328 C THR A 92 3.783 0.989 -6.590 1.00 0.00 C ATOM 1329 O THR A 92 4.301 -0.127 -6.589 1.00 0.00 O ATOM 1330 CB THR A 92 5.535 2.014 -8.145 1.00 0.00 C ATOM 1331 OG1 THR A 92 6.153 3.284 -8.336 1.00 0.00 O ATOM 1332 CG2 THR A 92 4.767 1.775 -9.446 1.00 0.00 C ATOM 0 H THR A 92 6.190 2.007 -5.593 1.00 0.00 H new ATOM 0 HA THR A 92 3.882 2.996 -7.214 1.00 0.00 H new ATOM 0 HB THR A 92 6.190 1.165 -7.949 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.561 3.860 -8.864 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.473 1.630 -10.264 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.144 0.887 -9.343 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.136 2.638 -9.660 1.00 0.00 H new ATOM 1340 N ILE A 93 2.513 1.227 -6.295 1.00 0.00 N ATOM 1341 CA ILE A 93 1.612 0.145 -5.936 1.00 0.00 C ATOM 1342 C ILE A 93 0.962 -0.413 -7.204 1.00 0.00 C ATOM 1343 O ILE A 93 0.536 0.346 -8.073 1.00 0.00 O ATOM 1344 CB ILE A 93 0.605 0.612 -4.884 1.00 0.00 C ATOM 1345 CG1 ILE A 93 1.319 1.201 -3.665 1.00 0.00 C ATOM 1346 CG2 ILE A 93 -0.350 -0.519 -4.498 1.00 0.00 C ATOM 1347 CD1 ILE A 93 0.483 2.310 -3.023 1.00 0.00 C ATOM 0 H ILE A 93 2.087 2.154 -6.297 1.00 0.00 H new ATOM 0 HA ILE A 93 2.165 -0.673 -5.473 1.00 0.00 H new ATOM 0 HB ILE A 93 0.001 1.408 -5.319 1.00 0.00 H new ATOM 0 HG12 ILE A 93 1.508 0.414 -2.935 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.289 1.599 -3.964 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -1.055 -0.160 -3.749 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.896 -0.851 -5.381 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.220 -1.353 -4.089 1.00 0.00 H new ATOM 0 HD11 ILE A 93 1.013 2.711 -2.159 1.00 0.00 H new ATOM 0 HD12 ILE A 93 0.316 3.106 -3.749 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -0.476 1.904 -2.703 1.00 0.00 H new ATOM 1359 N SER A 94 0.907 -1.736 -7.270 1.00 0.00 N ATOM 1360 CA SER A 94 0.317 -2.404 -8.416 1.00 0.00 C ATOM 1361 C SER A 94 -0.885 -3.240 -7.973 1.00 0.00 C ATOM 1362 O SER A 94 -0.720 -4.315 -7.399 1.00 0.00 O ATOM 1363 CB SER A 94 1.344 -3.287 -9.129 1.00 0.00 C ATOM 1364 OG SER A 94 1.567 -2.868 -10.472 1.00 0.00 O ATOM 0 H SER A 94 1.262 -2.362 -6.547 1.00 0.00 H new ATOM 0 HA SER A 94 -0.018 -1.642 -9.120 1.00 0.00 H new ATOM 0 HB2 SER A 94 2.286 -3.263 -8.581 1.00 0.00 H new ATOM 0 HB3 SER A 94 0.999 -4.321 -9.124 1.00 0.00 H new ATOM 0 HG SER A 94 2.230 -3.455 -10.892 1.00 0.00 H new ATOM 1370 N ILE A 95 -2.068 -2.715 -8.256 1.00 0.00 N ATOM 1371 CA ILE A 95 -3.297 -3.400 -7.894 1.00 0.00 C ATOM 1372 C ILE A 95 -3.863 -4.110 -9.125 1.00 0.00 C ATOM 1373 O ILE A 95 -3.336 -3.963 -10.227 1.00 0.00 O ATOM 1374 CB ILE A 95 -4.280 -2.426 -7.240 1.00 0.00 C ATOM 1375 CG1 ILE A 95 -4.501 -1.195 -8.122 1.00 0.00 C ATOM 1376 CG2 ILE A 95 -3.821 -2.048 -5.831 1.00 0.00 C ATOM 1377 CD1 ILE A 95 -5.993 -0.919 -8.314 1.00 0.00 C ATOM 0 H ILE A 95 -2.201 -1.823 -8.732 1.00 0.00 H new ATOM 0 HA ILE A 95 -3.099 -4.168 -7.146 1.00 0.00 H new ATOM 0 HB ILE A 95 -5.243 -2.927 -7.141 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -4.023 -0.327 -7.668 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -4.028 -1.349 -9.092 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -4.537 -1.355 -5.389 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -3.757 -2.946 -5.216 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -2.841 -1.573 -5.883 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -6.122 -0.039 -8.944 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -6.464 -1.779 -8.790 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -6.458 -0.742 -7.344 1.00 0.00 H new ATOM 1389 N VAL A 96 -4.927 -4.866 -8.897 1.00 0.00 N ATOM 1390 CA VAL A 96 -5.569 -5.599 -9.974 1.00 0.00 C ATOM 1391 C VAL A 96 -6.975 -5.038 -10.200 1.00 0.00 C ATOM 1392 O VAL A 96 -7.885 -5.771 -10.584 1.00 0.00 O ATOM 1393 CB VAL A 96 -5.566 -7.097 -9.662 1.00 0.00 C ATOM 1394 CG1 VAL A 96 -6.376 -7.875 -10.701 1.00 0.00 C ATOM 1395 CG2 VAL A 96 -4.137 -7.634 -9.565 1.00 0.00 C ATOM 0 H VAL A 96 -5.360 -4.987 -7.982 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.015 -5.473 -10.905 1.00 0.00 H new ATOM 0 HB VAL A 96 -6.043 -7.238 -8.692 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -6.358 -8.937 -10.456 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -7.407 -7.520 -10.699 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.942 -7.723 -11.689 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -4.163 -8.701 -9.343 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -3.623 -7.474 -10.513 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -3.605 -7.111 -8.771 1.00 0.00 H new ATOM 1405 N ALA A 97 -7.107 -3.744 -9.952 1.00 0.00 N ATOM 1406 CA ALA A 97 -8.387 -3.076 -10.124 1.00 0.00 C ATOM 1407 C ALA A 97 -9.492 -3.934 -9.504 1.00 0.00 C ATOM 1408 O ALA A 97 -9.999 -4.855 -10.143 1.00 0.00 O ATOM 1409 CB ALA A 97 -8.625 -2.803 -11.610 1.00 0.00 C ATOM 0 H ALA A 97 -6.350 -3.140 -9.633 1.00 0.00 H new ATOM 0 HA ALA A 97 -8.390 -2.114 -9.612 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -9.585 -2.302 -11.739 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -7.829 -2.166 -11.995 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -8.632 -3.746 -12.157 1.00 0.00 H new ATOM 1415 N ALA A 98 -9.832 -3.601 -8.268 1.00 0.00 N ATOM 1416 CA ALA A 98 -10.868 -4.329 -7.555 1.00 0.00 C ATOM 1417 C ALA A 98 -10.627 -5.832 -7.710 1.00 0.00 C ATOM 1418 O ALA A 98 -11.483 -6.552 -8.222 1.00 0.00 O ATOM 1419 CB ALA A 98 -12.242 -3.903 -8.075 1.00 0.00 C ATOM 0 H ALA A 98 -9.409 -2.837 -7.742 1.00 0.00 H new ATOM 0 HA ALA A 98 -10.836 -4.097 -6.490 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -13.019 -4.449 -7.540 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -12.376 -2.833 -7.916 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -12.312 -4.123 -9.140 1.00 0.00 H new ATOM 1425 N ALA A 99 -9.458 -6.261 -7.257 1.00 0.00 N ATOM 1426 CA ALA A 99 -9.093 -7.665 -7.339 1.00 0.00 C ATOM 1427 C ALA A 99 -10.018 -8.481 -6.434 1.00 0.00 C ATOM 1428 O ALA A 99 -10.862 -9.234 -6.918 1.00 0.00 O ATOM 1429 CB ALA A 99 -7.618 -7.832 -6.968 1.00 0.00 C ATOM 0 H ALA A 99 -8.751 -5.661 -6.832 1.00 0.00 H new ATOM 0 HA ALA A 99 -9.217 -8.035 -8.357 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -7.344 -8.885 -7.030 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -7.002 -7.256 -7.658 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -7.456 -7.474 -5.951 1.00 0.00 H new ATOM 1435 N GLY A 100 -9.828 -8.305 -5.134 1.00 0.00 N ATOM 1436 CA GLY A 100 -10.635 -9.015 -4.157 1.00 0.00 C ATOM 1437 C GLY A 100 -11.661 -8.082 -3.511 1.00 0.00 C ATOM 1438 O GLY A 100 -11.647 -7.883 -2.297 1.00 0.00 O ATOM 0 H GLY A 100 -9.127 -7.681 -4.735 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -11.148 -9.847 -4.639 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.990 -9.441 -3.388 1.00 0.00 H new ATOM 1442 N ARG A 101 -12.527 -7.535 -4.351 1.00 0.00 N ATOM 1443 CA ARG A 101 -13.558 -6.628 -3.877 1.00 0.00 C ATOM 1444 C ARG A 101 -14.634 -7.401 -3.111 1.00 0.00 C ATOM 1445 O ARG A 101 -15.240 -6.871 -2.180 1.00 0.00 O ATOM 1446 CB ARG A 101 -14.210 -5.878 -5.041 1.00 0.00 C ATOM 1447 CG ARG A 101 -14.181 -4.367 -4.805 1.00 0.00 C ATOM 1448 CD ARG A 101 -15.482 -3.713 -5.276 1.00 0.00 C ATOM 1449 NE ARG A 101 -16.121 -2.991 -4.154 1.00 0.00 N ATOM 1450 CZ ARG A 101 -17.038 -2.025 -4.307 1.00 0.00 C ATOM 1451 NH1 ARG A 101 -17.427 -1.660 -5.535 1.00 0.00 N ATOM 1452 NH2 ARG A 101 -17.564 -1.425 -3.231 1.00 0.00 N ATOM 0 H ARG A 101 -12.536 -7.703 -5.357 1.00 0.00 H new ATOM 0 HA ARG A 101 -13.084 -5.905 -3.214 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -13.689 -6.115 -5.968 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -15.241 -6.211 -5.161 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -14.031 -4.164 -3.745 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -13.336 -3.929 -5.336 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -15.276 -3.022 -6.093 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -16.161 -4.473 -5.664 1.00 0.00 H new ATOM 0 HE ARG A 101 -15.847 -3.244 -3.205 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -17.026 -2.117 -6.354 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -18.125 -0.925 -5.652 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -17.267 -1.703 -2.296 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -18.262 -0.690 -3.347 1.00 0.00 H new ATOM 1466 N GLU A 102 -14.838 -8.641 -3.530 1.00 0.00 N ATOM 1467 CA GLU A 102 -15.830 -9.492 -2.895 1.00 0.00 C ATOM 1468 C GLU A 102 -15.477 -9.710 -1.422 1.00 0.00 C ATOM 1469 O GLU A 102 -16.355 -9.978 -0.603 1.00 0.00 O ATOM 1470 CB GLU A 102 -15.960 -10.827 -3.632 1.00 0.00 C ATOM 1471 CG GLU A 102 -14.660 -11.629 -3.545 1.00 0.00 C ATOM 1472 CD GLU A 102 -14.829 -13.016 -4.167 1.00 0.00 C ATOM 1473 OE1 GLU A 102 -15.205 -13.062 -5.358 1.00 0.00 O ATOM 1474 OE2 GLU A 102 -14.579 -14.000 -3.437 1.00 0.00 O ATOM 0 H GLU A 102 -14.333 -9.077 -4.302 1.00 0.00 H new ATOM 0 HA GLU A 102 -16.797 -8.991 -2.946 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -16.778 -11.406 -3.203 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -16.211 -10.647 -4.677 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -13.862 -11.092 -4.057 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -14.359 -11.728 -2.502 1.00 0.00 H new ATOM 1481 N LEU A 103 -14.191 -9.587 -1.130 1.00 0.00 N ATOM 1482 CA LEU A 103 -13.712 -9.767 0.229 1.00 0.00 C ATOM 1483 C LEU A 103 -14.490 -8.843 1.167 1.00 0.00 C ATOM 1484 O LEU A 103 -14.607 -9.118 2.360 1.00 0.00 O ATOM 1485 CB LEU A 103 -12.195 -9.572 0.293 1.00 0.00 C ATOM 1486 CG LEU A 103 -11.362 -10.503 -0.590 1.00 0.00 C ATOM 1487 CD1 LEU A 103 -9.870 -10.190 -0.462 1.00 0.00 C ATOM 1488 CD2 LEU A 103 -11.668 -11.970 -0.282 1.00 0.00 C ATOM 0 H LEU A 103 -13.466 -9.365 -1.812 1.00 0.00 H new ATOM 0 HA LEU A 103 -13.894 -10.788 0.564 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -11.969 -8.542 0.016 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -11.875 -9.702 1.327 1.00 0.00 H new ATOM 0 HG LEU A 103 -11.640 -10.327 -1.629 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -9.300 -10.866 -1.100 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.687 -9.160 -0.769 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -9.559 -10.320 0.574 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -11.063 -12.610 -0.923 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -11.436 -12.179 0.762 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -12.724 -12.168 -0.465 1.00 0.00 H new ATOM 1500 N PHE A 104 -15.003 -7.765 0.592 1.00 0.00 N ATOM 1501 CA PHE A 104 -15.767 -6.798 1.361 1.00 0.00 C ATOM 1502 C PHE A 104 -17.231 -6.777 0.917 1.00 0.00 C ATOM 1503 O PHE A 104 -17.742 -5.739 0.499 1.00 0.00 O ATOM 1504 CB PHE A 104 -15.147 -5.424 1.097 1.00 0.00 C ATOM 1505 CG PHE A 104 -13.658 -5.338 1.438 1.00 0.00 C ATOM 1506 CD1 PHE A 104 -13.265 -5.148 2.726 1.00 0.00 C ATOM 1507 CD2 PHE A 104 -12.727 -5.452 0.453 1.00 0.00 C ATOM 1508 CE1 PHE A 104 -11.883 -5.068 3.042 1.00 0.00 C ATOM 1509 CE2 PHE A 104 -11.345 -5.372 0.769 1.00 0.00 C ATOM 1510 CZ PHE A 104 -10.952 -5.182 2.057 1.00 0.00 C ATOM 0 H PHE A 104 -14.904 -7.540 -0.398 1.00 0.00 H new ATOM 0 HA PHE A 104 -15.740 -7.060 2.419 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -15.284 -5.171 0.046 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -15.686 -4.676 1.678 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -14.004 -5.058 3.508 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -13.039 -5.603 -0.570 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -11.571 -4.917 4.065 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -10.606 -5.462 -0.013 1.00 0.00 H new ATOM 0 HZ PHE A 104 -9.901 -5.122 2.298 1.00 0.00 H new ATOM 1520 N MET A 105 -17.865 -7.936 1.022 1.00 0.00 N ATOM 1521 CA MET A 105 -19.259 -8.064 0.636 1.00 0.00 C ATOM 1522 C MET A 105 -20.156 -8.229 1.865 1.00 0.00 C ATOM 1523 O MET A 105 -20.501 -9.349 2.239 1.00 0.00 O ATOM 1524 CB MET A 105 -19.426 -9.275 -0.284 1.00 0.00 C ATOM 1525 CG MET A 105 -19.532 -8.841 -1.748 1.00 0.00 C ATOM 1526 SD MET A 105 -21.154 -8.168 -2.069 1.00 0.00 S ATOM 1527 CE MET A 105 -20.971 -7.724 -3.788 1.00 0.00 C ATOM 0 H MET A 105 -17.438 -8.795 1.369 1.00 0.00 H new ATOM 0 HA MET A 105 -19.556 -7.155 0.112 1.00 0.00 H new ATOM 0 HB2 MET A 105 -18.578 -9.949 -0.161 1.00 0.00 H new ATOM 0 HB3 MET A 105 -20.319 -9.831 -0.000 1.00 0.00 H new ATOM 0 HG2 MET A 105 -18.769 -8.095 -1.971 1.00 0.00 H new ATOM 0 HG3 MET A 105 -19.346 -9.692 -2.403 1.00 0.00 H new ATOM 0 HE1 MET A 105 -21.900 -7.285 -4.151 1.00 0.00 H new ATOM 0 HE2 MET A 105 -20.163 -7.000 -3.893 1.00 0.00 H new ATOM 0 HE3 MET A 105 -20.738 -8.615 -4.371 1.00 0.00 H new ATOM 1537 N THR A 106 -20.506 -7.098 2.458 1.00 0.00 N ATOM 1538 CA THR A 106 -21.356 -7.103 3.637 1.00 0.00 C ATOM 1539 C THR A 106 -22.104 -5.775 3.761 1.00 0.00 C ATOM 1540 O THR A 106 -23.315 -5.719 3.550 1.00 0.00 O ATOM 1541 CB THR A 106 -20.479 -7.422 4.850 1.00 0.00 C ATOM 1542 OG1 THR A 106 -20.247 -8.825 4.752 1.00 0.00 O ATOM 1543 CG2 THR A 106 -21.229 -7.260 6.174 1.00 0.00 C ATOM 0 H THR A 106 -20.217 -6.171 2.145 1.00 0.00 H new ATOM 0 HA THR A 106 -22.128 -7.869 3.565 1.00 0.00 H new ATOM 0 HB THR A 106 -19.605 -6.771 4.846 1.00 0.00 H new ATOM 0 HG1 THR A 106 -20.629 -9.162 3.915 1.00 0.00 H new ATOM 0 HG21 THR A 106 -20.561 -7.498 7.002 1.00 0.00 H new ATOM 0 HG22 THR A 106 -21.576 -6.231 6.272 1.00 0.00 H new ATOM 0 HG23 THR A 106 -22.085 -7.935 6.192 1.00 0.00 H new ATOM 1551 N ASP A 107 -21.353 -4.739 4.103 1.00 0.00 N ATOM 1552 CA ASP A 107 -21.931 -3.414 4.258 1.00 0.00 C ATOM 1553 C ASP A 107 -22.781 -3.379 5.530 1.00 0.00 C ATOM 1554 O ASP A 107 -23.528 -4.315 5.808 1.00 0.00 O ATOM 1555 CB ASP A 107 -22.836 -3.067 3.075 1.00 0.00 C ATOM 1556 CG ASP A 107 -22.681 -1.642 2.539 1.00 0.00 C ATOM 1557 OD1 ASP A 107 -21.650 -1.019 2.873 1.00 0.00 O ATOM 1558 OD2 ASP A 107 -23.596 -1.209 1.806 1.00 0.00 O ATOM 0 H ASP A 107 -20.349 -4.790 4.277 1.00 0.00 H new ATOM 0 HA ASP A 107 -21.115 -2.694 4.311 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -22.635 -3.768 2.265 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -23.873 -3.216 3.375 1.00 0.00 H new ATOM 1563 N ARG A 108 -22.638 -2.288 6.268 1.00 0.00 N ATOM 1564 CA ARG A 108 -23.383 -2.118 7.504 1.00 0.00 C ATOM 1565 C ARG A 108 -23.152 -0.717 8.075 1.00 0.00 C ATOM 1566 O ARG A 108 -22.065 -0.413 8.563 1.00 0.00 O ATOM 1567 CB ARG A 108 -22.968 -3.160 8.545 1.00 0.00 C ATOM 1568 CG ARG A 108 -24.194 -3.790 9.209 1.00 0.00 C ATOM 1569 CD ARG A 108 -24.811 -4.866 8.312 1.00 0.00 C ATOM 1570 NE ARG A 108 -25.823 -4.260 7.418 1.00 0.00 N ATOM 1571 CZ ARG A 108 -26.969 -3.711 7.844 1.00 0.00 C ATOM 1572 NH1 ARG A 108 -27.255 -3.688 9.153 1.00 0.00 N ATOM 1573 NH2 ARG A 108 -27.829 -3.186 6.960 1.00 0.00 N ATOM 0 H ARG A 108 -22.017 -1.513 6.034 1.00 0.00 H new ATOM 0 HA ARG A 108 -24.440 -2.251 7.275 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -22.369 -3.936 8.069 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -22.340 -2.692 9.303 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -23.909 -4.228 10.165 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -24.935 -3.019 9.420 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -24.033 -5.348 7.720 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -25.272 -5.641 8.924 1.00 0.00 H new ATOM 0 HE ARG A 108 -25.637 -4.260 6.415 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -26.600 -4.088 9.825 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -28.127 -3.270 9.477 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -27.611 -3.204 5.964 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -28.701 -2.768 7.284 1.00 0.00 H new ATOM 1587 N SER A 109 -24.193 0.099 7.994 1.00 0.00 N ATOM 1588 CA SER A 109 -24.117 1.460 8.497 1.00 0.00 C ATOM 1589 C SER A 109 -24.548 1.501 9.964 1.00 0.00 C ATOM 1590 O SER A 109 -25.152 0.553 10.464 1.00 0.00 O ATOM 1591 CB SER A 109 -24.985 2.404 7.662 1.00 0.00 C ATOM 1592 OG SER A 109 -24.229 3.480 7.113 1.00 0.00 O ATOM 0 H SER A 109 -25.093 -0.156 7.588 1.00 0.00 H new ATOM 0 HA SER A 109 -23.083 1.796 8.420 1.00 0.00 H new ATOM 0 HB2 SER A 109 -25.457 1.844 6.855 1.00 0.00 H new ATOM 0 HB3 SER A 109 -25.786 2.804 8.283 1.00 0.00 H new ATOM 0 HG SER A 109 -24.819 4.059 6.586 1.00 0.00 H new ATOM 1598 N GLY A 110 -24.222 2.609 10.613 1.00 0.00 N ATOM 1599 CA GLY A 110 -24.568 2.786 12.013 1.00 0.00 C ATOM 1600 C GLY A 110 -24.041 4.121 12.543 1.00 0.00 C ATOM 1601 O GLY A 110 -22.934 4.189 13.075 1.00 0.00 O ATOM 0 H GLY A 110 -23.722 3.393 10.195 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -25.651 2.745 12.132 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -24.152 1.968 12.601 1.00 0.00 H new ATOM 1605 N PRO A 111 -24.881 5.178 12.375 1.00 0.00 N ATOM 1606 CA PRO A 111 -24.512 6.507 12.831 1.00 0.00 C ATOM 1607 C PRO A 111 -24.624 6.616 14.353 1.00 0.00 C ATOM 1608 O PRO A 111 -23.624 6.822 15.039 1.00 0.00 O ATOM 1609 CB PRO A 111 -25.453 7.450 12.097 1.00 0.00 C ATOM 1610 CG PRO A 111 -26.613 6.592 11.618 1.00 0.00 C ATOM 1611 CD PRO A 111 -26.200 5.135 11.750 1.00 0.00 C ATOM 0 HA PRO A 111 -23.473 6.753 12.613 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -25.801 8.245 12.756 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -24.949 7.929 11.258 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -27.506 6.791 12.211 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -26.859 6.827 10.582 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -26.909 4.576 12.361 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -26.161 4.645 10.777 1.00 0.00 H new ATOM 1619 N SER A 112 -25.849 6.472 14.836 1.00 0.00 N ATOM 1620 CA SER A 112 -26.105 6.552 16.264 1.00 0.00 C ATOM 1621 C SER A 112 -25.825 5.199 16.922 1.00 0.00 C ATOM 1622 O SER A 112 -26.655 4.293 16.863 1.00 0.00 O ATOM 1623 CB SER A 112 -27.544 6.991 16.543 1.00 0.00 C ATOM 1624 OG SER A 112 -27.656 8.405 16.669 1.00 0.00 O ATOM 0 H SER A 112 -26.676 6.300 14.264 1.00 0.00 H new ATOM 0 HA SER A 112 -25.437 7.301 16.690 1.00 0.00 H new ATOM 0 HB2 SER A 112 -28.191 6.647 15.736 1.00 0.00 H new ATOM 0 HB3 SER A 112 -27.897 6.516 17.459 1.00 0.00 H new ATOM 0 HG SER A 112 -28.590 8.645 16.845 1.00 0.00 H new ATOM 1630 N SER A 113 -24.654 5.105 17.534 1.00 0.00 N ATOM 1631 CA SER A 113 -24.255 3.878 18.202 1.00 0.00 C ATOM 1632 C SER A 113 -24.651 3.933 19.678 1.00 0.00 C ATOM 1633 O SER A 113 -24.028 4.644 20.466 1.00 0.00 O ATOM 1634 CB SER A 113 -22.749 3.641 18.065 1.00 0.00 C ATOM 1635 OG SER A 113 -22.429 2.910 16.884 1.00 0.00 O ATOM 0 H SER A 113 -23.968 5.859 17.581 1.00 0.00 H new ATOM 0 HA SER A 113 -24.772 3.045 17.725 1.00 0.00 H new ATOM 0 HB2 SER A 113 -22.231 4.600 18.049 1.00 0.00 H new ATOM 0 HB3 SER A 113 -22.387 3.097 18.937 1.00 0.00 H new ATOM 0 HG SER A 113 -21.459 2.781 16.832 1.00 0.00 H new ATOM 1641 N GLY A 114 -25.685 3.174 20.009 1.00 0.00 N ATOM 1642 CA GLY A 114 -26.172 3.128 21.378 1.00 0.00 C ATOM 1643 C GLY A 114 -25.033 2.829 22.355 1.00 0.00 C ATOM 1644 O GLY A 114 -24.736 3.637 23.233 1.00 0.00 O ATOM 0 H GLY A 114 -26.199 2.586 19.353 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -26.636 4.080 21.635 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -26.943 2.363 21.468 1.00 0.00 H new TER 1648 GLY A 114