USER MOD reduce.3.24.130724 H: found=0, std=0, add=1090, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1086 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 19 MET CE :methyl -129:sc= -0.467 (180deg=-0.418) USER MOD Set 1.2: A 115 MET CE :methyl -136:sc= -2.65! (180deg=-2.98!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 13:sc= 0.909 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= -0.0391 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= -0.316 X(o=-0.32,f=-0.4) USER MOD Single : A 10 GLN : amide:sc= -1.68 K(o=-1.7,f=-0.66) USER MOD Single : A 13 LYS NZ :NH3+ -157:sc= -0.129 (180deg=-0.606) USER MOD Single : A 24 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0223) USER MOD Single : A 31 GLN : amide:sc= -2.02 K(o=-2,f=-5.6!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 56:sc= -0.0942 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= 0.0881 K(o=0.088,f=-6.3!) USER MOD Single : A 55 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.266) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=-0.075) USER MOD Single : A 80 SER OG : rot 176:sc= 0 USER MOD Single : A 83 ASN : amide:sc= -0.775 K(o=-0.78,f=-0.11) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00223) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot 130:sc= -0.668 USER MOD Single : A 93 THR OG1 : rot 88:sc= 1.27 USER MOD Single : A 94 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 95 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -129:sc= 0.0758 USER MOD Single : A 108 GLN : amide:sc= -4.61! C(o=-4.6!,f=-5.4!) USER MOD Single : A 110 HIS : no HD1:sc= -1.17 K(o=-1.2,f=0) USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 158:sc= 0.191 (180deg=-0.0899) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 SER OG : rot 180:sc= -0.0111 USER MOD Single : A 119 SER OG : rot -94:sc= 0.906 USER MOD Single : A 120 TYR OH : rot 170:sc= -0.537! USER MOD Single : A 126 SER OG : rot -55:sc= 1.18 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 173:sc= -0.483 USER MOD Single : A 130 GLN : amide:sc= -0.115 K(o=-0.12,f=-0.86) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot -50:sc= 0.174 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -14.935 15.491 15.083 1.00 0.00 N ATOM 2 CA GLY A 1 -16.298 15.852 15.426 1.00 0.00 C ATOM 3 C GLY A 1 -16.870 14.979 16.526 1.00 0.00 C ATOM 4 O GLY A 1 -16.778 13.753 16.465 1.00 0.00 O ATOM 0 H1 GLY A 1 -14.590 16.117 14.327 1.00 0.00 H new ATOM 0 H2 GLY A 1 -14.328 15.593 15.921 1.00 0.00 H new ATOM 0 H3 GLY A 1 -14.909 14.505 14.755 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -16.326 16.895 15.743 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -16.926 15.771 14.539 1.00 0.00 H new ATOM 8 N SER A 2 -17.459 15.612 17.535 1.00 0.00 N ATOM 9 CA SER A 2 -18.043 14.884 18.656 1.00 0.00 C ATOM 10 C SER A 2 -18.764 13.630 18.173 1.00 0.00 C ATOM 11 O SER A 2 -18.429 12.515 18.573 1.00 0.00 O ATOM 12 CB SER A 2 -19.017 15.782 19.422 1.00 0.00 C ATOM 13 OG SER A 2 -19.634 15.076 20.484 1.00 0.00 O ATOM 0 H SER A 2 -17.545 16.626 17.600 1.00 0.00 H new ATOM 0 HA SER A 2 -17.235 14.583 19.323 1.00 0.00 H new ATOM 0 HB2 SER A 2 -18.485 16.647 19.817 1.00 0.00 H new ATOM 0 HB3 SER A 2 -19.780 16.161 18.741 1.00 0.00 H new ATOM 0 HG SER A 2 -20.250 15.672 20.959 1.00 0.00 H new ATOM 19 N SER A 3 -19.757 13.820 17.310 1.00 0.00 N ATOM 20 CA SER A 3 -20.529 12.705 16.775 1.00 0.00 C ATOM 21 C SER A 3 -21.218 13.098 15.471 1.00 0.00 C ATOM 22 O SER A 3 -21.473 14.275 15.220 1.00 0.00 O ATOM 23 CB SER A 3 -21.571 12.242 17.795 1.00 0.00 C ATOM 24 OG SER A 3 -20.964 11.512 18.847 1.00 0.00 O ATOM 0 H SER A 3 -20.046 14.736 16.966 1.00 0.00 H new ATOM 0 HA SER A 3 -19.841 11.884 16.570 1.00 0.00 H new ATOM 0 HB2 SER A 3 -22.095 13.107 18.203 1.00 0.00 H new ATOM 0 HB3 SER A 3 -22.318 11.621 17.301 1.00 0.00 H new ATOM 0 HG SER A 3 -19.992 11.636 18.813 1.00 0.00 H new ATOM 30 N GLY A 4 -21.516 12.101 14.643 1.00 0.00 N ATOM 31 CA GLY A 4 -22.172 12.361 13.375 1.00 0.00 C ATOM 32 C GLY A 4 -21.222 12.257 12.199 1.00 0.00 C ATOM 33 O GLY A 4 -20.011 12.414 12.354 1.00 0.00 O ATOM 0 H GLY A 4 -21.315 11.118 14.828 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -22.990 11.653 13.241 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -22.613 13.358 13.395 1.00 0.00 H new ATOM 37 N SER A 5 -21.771 11.990 11.018 1.00 0.00 N ATOM 38 CA SER A 5 -20.963 11.860 9.811 1.00 0.00 C ATOM 39 C SER A 5 -21.516 12.735 8.690 1.00 0.00 C ATOM 40 O SER A 5 -22.729 12.895 8.554 1.00 0.00 O ATOM 41 CB SER A 5 -20.917 10.400 9.358 1.00 0.00 C ATOM 42 OG SER A 5 -20.150 9.612 10.252 1.00 0.00 O ATOM 0 H SER A 5 -22.772 11.860 10.871 1.00 0.00 H new ATOM 0 HA SER A 5 -19.951 12.193 10.043 1.00 0.00 H new ATOM 0 HB2 SER A 5 -21.930 10.003 9.296 1.00 0.00 H new ATOM 0 HB3 SER A 5 -20.490 10.340 8.357 1.00 0.00 H new ATOM 0 HG SER A 5 -20.138 8.683 9.941 1.00 0.00 H new ATOM 48 N SER A 6 -20.618 13.298 7.889 1.00 0.00 N ATOM 49 CA SER A 6 -21.014 14.160 6.782 1.00 0.00 C ATOM 50 C SER A 6 -21.153 13.358 5.492 1.00 0.00 C ATOM 51 O SER A 6 -22.150 13.472 4.780 1.00 0.00 O ATOM 52 CB SER A 6 -19.992 15.282 6.590 1.00 0.00 C ATOM 53 OG SER A 6 -18.696 14.758 6.357 1.00 0.00 O ATOM 0 H SER A 6 -19.610 13.173 7.986 1.00 0.00 H new ATOM 0 HA SER A 6 -21.982 14.598 7.024 1.00 0.00 H new ATOM 0 HB2 SER A 6 -20.290 15.910 5.750 1.00 0.00 H new ATOM 0 HB3 SER A 6 -19.976 15.919 7.474 1.00 0.00 H new ATOM 0 HG SER A 6 -18.062 15.495 6.236 1.00 0.00 H new ATOM 59 N GLY A 7 -20.143 12.544 5.196 1.00 0.00 N ATOM 60 CA GLY A 7 -20.171 11.734 3.992 1.00 0.00 C ATOM 61 C GLY A 7 -18.809 11.167 3.644 1.00 0.00 C ATOM 62 O GLY A 7 -17.868 11.913 3.377 1.00 0.00 O ATOM 0 H GLY A 7 -19.306 12.432 5.769 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -20.879 10.916 4.124 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -20.533 12.338 3.160 1.00 0.00 H new ATOM 66 N SER A 8 -18.703 9.842 3.648 1.00 0.00 N ATOM 67 CA SER A 8 -17.445 9.174 3.336 1.00 0.00 C ATOM 68 C SER A 8 -17.448 8.653 1.902 1.00 0.00 C ATOM 69 O SER A 8 -16.431 8.702 1.211 1.00 0.00 O ATOM 70 CB SER A 8 -17.200 8.020 4.310 1.00 0.00 C ATOM 71 OG SER A 8 -16.183 7.156 3.831 1.00 0.00 O ATOM 0 H SER A 8 -19.474 9.210 3.864 1.00 0.00 H new ATOM 0 HA SER A 8 -16.640 9.902 3.438 1.00 0.00 H new ATOM 0 HB2 SER A 8 -16.916 8.417 5.285 1.00 0.00 H new ATOM 0 HB3 SER A 8 -18.123 7.457 4.452 1.00 0.00 H new ATOM 0 HG SER A 8 -16.044 6.428 4.472 1.00 0.00 H new ATOM 77 N GLN A 9 -18.599 8.153 1.463 1.00 0.00 N ATOM 78 CA GLN A 9 -18.735 7.621 0.112 1.00 0.00 C ATOM 79 C GLN A 9 -18.027 8.517 -0.899 1.00 0.00 C ATOM 80 O GLN A 9 -17.347 8.031 -1.802 1.00 0.00 O ATOM 81 CB GLN A 9 -20.213 7.484 -0.258 1.00 0.00 C ATOM 82 CG GLN A 9 -20.441 6.985 -1.675 1.00 0.00 C ATOM 83 CD GLN A 9 -21.909 6.776 -1.991 1.00 0.00 C ATOM 84 OE1 GLN A 9 -22.631 6.121 -1.239 1.00 0.00 O ATOM 85 NE2 GLN A 9 -22.360 7.333 -3.109 1.00 0.00 N ATOM 0 H GLN A 9 -19.450 8.105 2.023 1.00 0.00 H new ATOM 0 HA GLN A 9 -18.268 6.636 0.087 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -20.692 6.799 0.441 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -20.700 8.452 -0.140 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -20.020 7.701 -2.381 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -19.906 6.046 -1.816 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -21.727 7.868 -3.704 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -23.339 7.226 -3.373 1.00 0.00 H new ATOM 94 N GLN A 10 -18.192 9.826 -0.740 1.00 0.00 N ATOM 95 CA GLN A 10 -17.569 10.789 -1.641 1.00 0.00 C ATOM 96 C GLN A 10 -16.051 10.762 -1.500 1.00 0.00 C ATOM 97 O GLN A 10 -15.325 10.770 -2.495 1.00 0.00 O ATOM 98 CB GLN A 10 -18.095 12.197 -1.359 1.00 0.00 C ATOM 99 CG GLN A 10 -19.472 12.462 -1.947 1.00 0.00 C ATOM 100 CD GLN A 10 -20.548 11.596 -1.323 1.00 0.00 C ATOM 101 OE1 GLN A 10 -21.228 12.010 -0.384 1.00 0.00 O ATOM 102 NE2 GLN A 10 -20.710 10.385 -1.845 1.00 0.00 N ATOM 0 H GLN A 10 -18.751 10.244 0.004 1.00 0.00 H new ATOM 0 HA GLN A 10 -17.826 10.512 -2.663 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -18.134 12.352 -0.281 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -17.391 12.926 -1.761 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -19.728 13.512 -1.805 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -19.445 12.283 -3.022 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -20.124 10.083 -2.623 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -21.420 9.758 -1.468 1.00 0.00 H new ATOM 111 N ARG A 11 -15.577 10.731 -0.259 1.00 0.00 N ATOM 112 CA ARG A 11 -14.145 10.705 0.012 1.00 0.00 C ATOM 113 C ARG A 11 -13.496 9.474 -0.614 1.00 0.00 C ATOM 114 O ARG A 11 -12.400 9.552 -1.171 1.00 0.00 O ATOM 115 CB ARG A 11 -13.889 10.719 1.520 1.00 0.00 C ATOM 116 CG ARG A 11 -12.471 11.120 1.894 1.00 0.00 C ATOM 117 CD ARG A 11 -12.403 11.672 3.309 1.00 0.00 C ATOM 118 NE ARG A 11 -11.056 12.113 3.660 1.00 0.00 N ATOM 119 CZ ARG A 11 -10.775 12.820 4.749 1.00 0.00 C ATOM 120 NH1 ARG A 11 -11.742 13.164 5.589 1.00 0.00 N ATOM 121 NH2 ARG A 11 -9.524 13.184 5.000 1.00 0.00 N ATOM 0 H ARG A 11 -16.164 10.723 0.575 1.00 0.00 H new ATOM 0 HA ARG A 11 -13.700 11.595 -0.433 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -14.589 11.408 1.992 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -14.096 9.728 1.924 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -11.813 10.256 1.807 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -12.107 11.870 1.192 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -13.095 12.509 3.405 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -12.729 10.906 4.013 1.00 0.00 H new ATOM 0 HE ARG A 11 -10.289 11.865 3.035 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -12.705 12.886 5.400 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -11.523 13.707 6.424 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -8.777 12.921 4.357 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -9.309 13.727 5.836 1.00 0.00 H new ATOM 135 N VAL A 12 -14.178 8.338 -0.517 1.00 0.00 N ATOM 136 CA VAL A 12 -13.669 7.090 -1.074 1.00 0.00 C ATOM 137 C VAL A 12 -13.370 7.234 -2.562 1.00 0.00 C ATOM 138 O VAL A 12 -12.247 6.995 -3.007 1.00 0.00 O ATOM 139 CB VAL A 12 -14.669 5.936 -0.872 1.00 0.00 C ATOM 140 CG1 VAL A 12 -14.188 4.682 -1.586 1.00 0.00 C ATOM 141 CG2 VAL A 12 -14.879 5.668 0.610 1.00 0.00 C ATOM 0 H VAL A 12 -15.085 8.256 -0.058 1.00 0.00 H new ATOM 0 HA VAL A 12 -12.746 6.859 -0.542 1.00 0.00 H new ATOM 0 HB VAL A 12 -15.626 6.227 -1.305 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -14.907 3.877 -1.432 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -14.093 4.885 -2.653 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -13.219 4.384 -1.185 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -15.588 4.850 0.735 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -13.928 5.397 1.069 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -15.271 6.565 1.090 1.00 0.00 H new ATOM 151 N LYS A 13 -14.381 7.627 -3.328 1.00 0.00 N ATOM 152 CA LYS A 13 -14.228 7.805 -4.767 1.00 0.00 C ATOM 153 C LYS A 13 -12.888 8.456 -5.095 1.00 0.00 C ATOM 154 O LYS A 13 -12.092 7.910 -5.858 1.00 0.00 O ATOM 155 CB LYS A 13 -15.371 8.659 -5.321 1.00 0.00 C ATOM 156 CG LYS A 13 -15.248 8.951 -6.806 1.00 0.00 C ATOM 157 CD LYS A 13 -15.540 7.716 -7.642 1.00 0.00 C ATOM 158 CE LYS A 13 -15.740 8.069 -9.108 1.00 0.00 C ATOM 159 NZ LYS A 13 -16.903 8.978 -9.305 1.00 0.00 N ATOM 0 H LYS A 13 -15.317 7.829 -2.976 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.258 6.821 -5.235 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -16.317 8.149 -5.137 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -15.406 9.602 -4.776 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -15.939 9.749 -7.080 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -14.243 9.311 -7.025 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -14.717 7.008 -7.546 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -16.433 7.220 -7.261 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -14.838 8.544 -9.494 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -15.891 7.156 -9.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -17.250 8.891 -10.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -17.662 8.718 -8.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -16.610 9.960 -9.127 1.00 0.00 H new ATOM 173 N ARG A 14 -12.645 9.626 -4.512 1.00 0.00 N ATOM 174 CA ARG A 14 -11.402 10.351 -4.742 1.00 0.00 C ATOM 175 C ARG A 14 -10.231 9.385 -4.903 1.00 0.00 C ATOM 176 O ARG A 14 -9.330 9.615 -5.709 1.00 0.00 O ATOM 177 CB ARG A 14 -11.127 11.315 -3.587 1.00 0.00 C ATOM 178 CG ARG A 14 -11.853 12.644 -3.716 1.00 0.00 C ATOM 179 CD ARG A 14 -11.038 13.649 -4.515 1.00 0.00 C ATOM 180 NE ARG A 14 -11.388 15.026 -4.180 1.00 0.00 N ATOM 181 CZ ARG A 14 -11.561 15.982 -5.087 1.00 0.00 C ATOM 182 NH1 ARG A 14 -11.417 15.710 -6.377 1.00 0.00 N ATOM 183 NH2 ARG A 14 -11.879 17.212 -4.704 1.00 0.00 N ATOM 0 H ARG A 14 -13.293 10.092 -3.877 1.00 0.00 H new ATOM 0 HA ARG A 14 -11.509 10.922 -5.664 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -11.420 10.840 -2.651 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -10.055 11.501 -3.528 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -12.817 12.488 -4.201 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -12.057 13.046 -2.724 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -9.977 13.488 -4.325 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -11.200 13.482 -5.580 1.00 0.00 H new ATOM 0 HE ARG A 14 -11.506 15.268 -3.196 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -11.173 14.765 -6.675 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -11.550 16.445 -7.071 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -11.991 17.425 -3.713 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -12.012 17.945 -5.401 1.00 0.00 H new ATOM 197 N TRP A 15 -10.252 8.305 -4.130 1.00 0.00 N ATOM 198 CA TRP A 15 -9.193 7.304 -4.186 1.00 0.00 C ATOM 199 C TRP A 15 -9.182 6.598 -5.537 1.00 0.00 C ATOM 200 O TRP A 15 -8.168 6.584 -6.233 1.00 0.00 O ATOM 201 CB TRP A 15 -9.369 6.282 -3.063 1.00 0.00 C ATOM 202 CG TRP A 15 -9.632 6.907 -1.726 1.00 0.00 C ATOM 203 CD1 TRP A 15 -9.196 8.126 -1.291 1.00 0.00 C ATOM 204 CD2 TRP A 15 -10.391 6.343 -0.651 1.00 0.00 C ATOM 205 NE1 TRP A 15 -9.638 8.353 -0.010 1.00 0.00 N ATOM 206 CE2 TRP A 15 -10.373 7.275 0.405 1.00 0.00 C ATOM 207 CE3 TRP A 15 -11.084 5.142 -0.478 1.00 0.00 C ATOM 208 CZ2 TRP A 15 -11.022 7.041 1.615 1.00 0.00 C ATOM 209 CZ3 TRP A 15 -11.727 4.911 0.724 1.00 0.00 C ATOM 210 CH2 TRP A 15 -11.693 5.857 1.757 1.00 0.00 C ATOM 0 H TRP A 15 -10.991 8.100 -3.457 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.238 7.814 -4.056 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -10.195 5.616 -3.314 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -8.472 5.666 -2.998 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -8.593 8.811 -1.869 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -9.449 9.189 0.542 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -11.117 4.407 -1.269 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -10.997 7.768 2.413 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -12.265 3.986 0.869 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -12.207 5.648 2.684 1.00 0.00 H new ATOM 221 N GLY A 16 -10.318 6.010 -5.902 1.00 0.00 N ATOM 222 CA GLY A 16 -10.417 5.309 -7.168 1.00 0.00 C ATOM 223 C GLY A 16 -9.569 5.946 -8.251 1.00 0.00 C ATOM 224 O GLY A 16 -8.884 5.251 -9.003 1.00 0.00 O ATOM 0 H GLY A 16 -11.171 6.007 -5.343 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -10.108 4.273 -7.031 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -11.458 5.291 -7.490 1.00 0.00 H new ATOM 228 N PHE A 17 -9.614 7.272 -8.333 1.00 0.00 N ATOM 229 CA PHE A 17 -8.845 8.002 -9.334 1.00 0.00 C ATOM 230 C PHE A 17 -7.421 7.464 -9.426 1.00 0.00 C ATOM 231 O PHE A 17 -6.914 7.198 -10.515 1.00 0.00 O ATOM 232 CB PHE A 17 -8.818 9.494 -8.998 1.00 0.00 C ATOM 233 CG PHE A 17 -10.090 10.212 -9.349 1.00 0.00 C ATOM 234 CD1 PHE A 17 -10.338 10.612 -10.651 1.00 0.00 C ATOM 235 CD2 PHE A 17 -11.038 10.486 -8.375 1.00 0.00 C ATOM 236 CE1 PHE A 17 -11.508 11.272 -10.978 1.00 0.00 C ATOM 237 CE2 PHE A 17 -12.209 11.145 -8.696 1.00 0.00 C ATOM 238 CZ PHE A 17 -12.444 11.540 -9.998 1.00 0.00 C ATOM 0 H PHE A 17 -10.175 7.862 -7.719 1.00 0.00 H new ATOM 0 HA PHE A 17 -9.329 7.863 -10.300 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -8.625 9.615 -7.932 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -7.988 9.962 -9.527 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -9.609 10.406 -11.420 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -10.859 10.181 -7.355 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -11.690 11.578 -11.998 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -12.940 11.351 -7.929 1.00 0.00 H new ATOM 0 HZ PHE A 17 -13.358 12.058 -10.250 1.00 0.00 H new ATOM 248 N GLY A 18 -6.779 7.306 -8.272 1.00 0.00 N ATOM 249 CA GLY A 18 -5.418 6.801 -8.243 1.00 0.00 C ATOM 250 C GLY A 18 -4.802 6.875 -6.860 1.00 0.00 C ATOM 251 O GLY A 18 -5.313 7.569 -5.982 1.00 0.00 O ATOM 0 H GLY A 18 -7.177 7.519 -7.357 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -5.410 5.766 -8.586 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -4.806 7.373 -8.941 1.00 0.00 H new ATOM 255 N MET A 19 -3.701 6.157 -6.666 1.00 0.00 N ATOM 256 CA MET A 19 -3.014 6.145 -5.379 1.00 0.00 C ATOM 257 C MET A 19 -2.820 7.563 -4.853 1.00 0.00 C ATOM 258 O MET A 19 -3.180 7.868 -3.716 1.00 0.00 O ATOM 259 CB MET A 19 -1.659 5.446 -5.507 1.00 0.00 C ATOM 260 CG MET A 19 -0.938 5.271 -4.180 1.00 0.00 C ATOM 261 SD MET A 19 0.124 3.814 -4.153 1.00 0.00 S ATOM 262 CE MET A 19 1.378 4.287 -5.341 1.00 0.00 C ATOM 0 H MET A 19 -3.265 5.576 -7.382 1.00 0.00 H new ATOM 0 HA MET A 19 -3.633 5.595 -4.670 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.806 4.467 -5.963 1.00 0.00 H new ATOM 0 HB3 MET A 19 -1.025 6.021 -6.183 1.00 0.00 H new ATOM 0 HG2 MET A 19 -0.337 6.158 -3.978 1.00 0.00 H new ATOM 0 HG3 MET A 19 -1.673 5.195 -3.379 1.00 0.00 H new ATOM 0 HE1 MET A 19 1.501 3.492 -6.077 1.00 0.00 H new ATOM 0 HE2 MET A 19 1.074 5.204 -5.845 1.00 0.00 H new ATOM 0 HE3 MET A 19 2.324 4.453 -4.825 1.00 0.00 H new ATOM 272 N ASP A 20 -2.249 8.426 -5.687 1.00 0.00 N ATOM 273 CA ASP A 20 -2.008 9.812 -5.306 1.00 0.00 C ATOM 274 C ASP A 20 -3.086 10.307 -4.346 1.00 0.00 C ATOM 275 O ASP A 20 -2.790 10.720 -3.226 1.00 0.00 O ATOM 276 CB ASP A 20 -1.964 10.705 -6.547 1.00 0.00 C ATOM 277 CG ASP A 20 -1.403 12.082 -6.251 1.00 0.00 C ATOM 278 OD1 ASP A 20 -0.566 12.196 -5.331 1.00 0.00 O ATOM 279 OD2 ASP A 20 -1.802 13.046 -6.938 1.00 0.00 O ATOM 0 H ASP A 20 -1.945 8.189 -6.631 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.044 9.861 -4.799 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -1.356 10.226 -7.314 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.970 10.806 -6.954 1.00 0.00 H new ATOM 284 N GLU A 21 -4.336 10.264 -4.796 1.00 0.00 N ATOM 285 CA GLU A 21 -5.457 10.710 -3.977 1.00 0.00 C ATOM 286 C GLU A 21 -5.503 9.948 -2.656 1.00 0.00 C ATOM 287 O GLU A 21 -5.380 10.537 -1.583 1.00 0.00 O ATOM 288 CB GLU A 21 -6.775 10.523 -4.732 1.00 0.00 C ATOM 289 CG GLU A 21 -6.883 11.373 -5.987 1.00 0.00 C ATOM 290 CD GLU A 21 -5.958 10.901 -7.092 1.00 0.00 C ATOM 291 OE1 GLU A 21 -5.983 9.695 -7.413 1.00 0.00 O ATOM 292 OE2 GLU A 21 -5.209 11.740 -7.636 1.00 0.00 O ATOM 0 H GLU A 21 -4.598 9.925 -5.722 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.317 11.769 -3.761 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -6.882 9.473 -5.004 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.603 10.766 -4.066 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -7.912 11.354 -6.347 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -6.650 12.409 -5.741 1.00 0.00 H new ATOM 299 N ALA A 22 -5.683 8.634 -2.743 1.00 0.00 N ATOM 300 CA ALA A 22 -5.744 7.791 -1.556 1.00 0.00 C ATOM 301 C ALA A 22 -4.678 8.192 -0.541 1.00 0.00 C ATOM 302 O ALA A 22 -4.976 8.413 0.633 1.00 0.00 O ATOM 303 CB ALA A 22 -5.585 6.327 -1.939 1.00 0.00 C ATOM 0 H ALA A 22 -5.789 8.131 -3.624 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.721 7.931 -1.093 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.633 5.709 -1.042 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.386 6.040 -2.620 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.622 6.182 -2.429 1.00 0.00 H new ATOM 309 N LEU A 23 -3.436 8.285 -1.002 1.00 0.00 N ATOM 310 CA LEU A 23 -2.325 8.660 -0.134 1.00 0.00 C ATOM 311 C LEU A 23 -2.686 9.871 0.721 1.00 0.00 C ATOM 312 O LEU A 23 -2.607 9.823 1.949 1.00 0.00 O ATOM 313 CB LEU A 23 -1.080 8.964 -0.969 1.00 0.00 C ATOM 314 CG LEU A 23 -0.576 7.829 -1.861 1.00 0.00 C ATOM 315 CD1 LEU A 23 0.636 8.278 -2.664 1.00 0.00 C ATOM 316 CD2 LEU A 23 -0.239 6.603 -1.025 1.00 0.00 C ATOM 0 H LEU A 23 -3.173 8.106 -1.971 1.00 0.00 H new ATOM 0 HA LEU A 23 -2.115 7.820 0.529 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -1.292 9.828 -1.599 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.275 9.252 -0.293 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.370 7.562 -2.559 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.980 7.457 -3.293 1.00 0.00 H new ATOM 0 HD12 LEU A 23 0.363 9.126 -3.292 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.434 8.573 -1.983 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.118 5.805 -1.676 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.537 6.857 -0.303 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -1.131 6.267 -0.496 1.00 0.00 H new ATOM 328 N LYS A 24 -3.083 10.955 0.064 1.00 0.00 N ATOM 329 CA LYS A 24 -3.460 12.178 0.763 1.00 0.00 C ATOM 330 C LYS A 24 -4.231 11.859 2.040 1.00 0.00 C ATOM 331 O LYS A 24 -3.876 12.323 3.123 1.00 0.00 O ATOM 332 CB LYS A 24 -4.307 13.070 -0.148 1.00 0.00 C ATOM 333 CG LYS A 24 -3.494 14.083 -0.935 1.00 0.00 C ATOM 334 CD LYS A 24 -2.592 13.405 -1.952 1.00 0.00 C ATOM 335 CE LYS A 24 -1.900 14.420 -2.849 1.00 0.00 C ATOM 336 NZ LYS A 24 -0.945 15.272 -2.088 1.00 0.00 N ATOM 0 H LYS A 24 -3.152 11.012 -0.952 1.00 0.00 H new ATOM 0 HA LYS A 24 -2.547 12.709 1.034 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -4.861 12.441 -0.845 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.043 13.599 0.458 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -4.166 14.772 -1.446 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -2.889 14.677 -0.250 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -1.843 12.806 -1.433 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -3.181 12.720 -2.562 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -1.367 13.898 -3.644 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -2.648 15.052 -3.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -0.445 15.904 -2.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -1.467 15.840 -1.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -0.256 14.668 -1.597 1.00 0.00 H new ATOM 350 N ASP A 25 -5.287 11.065 1.905 1.00 0.00 N ATOM 351 CA ASP A 25 -6.107 10.682 3.049 1.00 0.00 C ATOM 352 C ASP A 25 -5.453 9.547 3.830 1.00 0.00 C ATOM 353 O ASP A 25 -4.851 8.635 3.262 1.00 0.00 O ATOM 354 CB ASP A 25 -7.502 10.261 2.585 1.00 0.00 C ATOM 355 CG ASP A 25 -8.408 9.885 3.741 1.00 0.00 C ATOM 356 OD1 ASP A 25 -9.087 10.785 4.280 1.00 0.00 O ATOM 357 OD2 ASP A 25 -8.438 8.692 4.108 1.00 0.00 O ATOM 0 H ASP A 25 -5.596 10.674 1.015 1.00 0.00 H new ATOM 0 HA ASP A 25 -6.197 11.547 3.706 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.956 11.077 2.022 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.415 9.414 1.905 1.00 0.00 H new ATOM 362 N PRO A 26 -5.572 9.601 5.165 1.00 0.00 N ATOM 363 CA PRO A 26 -4.999 8.586 6.053 1.00 0.00 C ATOM 364 C PRO A 26 -5.721 7.247 5.946 1.00 0.00 C ATOM 365 O PRO A 26 -5.089 6.197 5.836 1.00 0.00 O ATOM 366 CB PRO A 26 -5.190 9.186 7.448 1.00 0.00 C ATOM 367 CG PRO A 26 -6.351 10.109 7.308 1.00 0.00 C ATOM 368 CD PRO A 26 -6.277 10.659 5.910 1.00 0.00 C ATOM 0 HA PRO A 26 -3.960 8.369 5.806 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -5.388 8.411 8.189 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -4.297 9.719 7.775 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -7.291 9.581 7.470 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -6.304 10.910 8.046 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.269 10.847 5.499 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -5.734 11.604 5.878 1.00 0.00 H new ATOM 376 N VAL A 27 -7.049 7.292 5.978 1.00 0.00 N ATOM 377 CA VAL A 27 -7.858 6.083 5.882 1.00 0.00 C ATOM 378 C VAL A 27 -7.649 5.387 4.542 1.00 0.00 C ATOM 379 O VAL A 27 -7.191 4.246 4.487 1.00 0.00 O ATOM 380 CB VAL A 27 -9.356 6.393 6.059 1.00 0.00 C ATOM 381 CG1 VAL A 27 -10.189 5.135 5.866 1.00 0.00 C ATOM 382 CG2 VAL A 27 -9.614 7.008 7.427 1.00 0.00 C ATOM 0 H VAL A 27 -7.588 8.153 6.070 1.00 0.00 H new ATOM 0 HA VAL A 27 -7.535 5.422 6.686 1.00 0.00 H new ATOM 0 HB VAL A 27 -9.652 7.116 5.298 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -11.245 5.374 5.995 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -10.026 4.741 4.863 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -9.894 4.387 6.602 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -10.677 7.221 7.535 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -9.302 6.310 8.204 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -9.047 7.934 7.522 1.00 0.00 H new ATOM 392 N GLY A 28 -7.988 6.083 3.461 1.00 0.00 N ATOM 393 CA GLY A 28 -7.831 5.516 2.134 1.00 0.00 C ATOM 394 C GLY A 28 -6.506 4.800 1.963 1.00 0.00 C ATOM 395 O GLY A 28 -6.397 3.862 1.173 1.00 0.00 O ATOM 0 H GLY A 28 -8.368 7.029 3.480 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -8.645 4.817 1.942 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.910 6.310 1.391 1.00 0.00 H new ATOM 399 N ARG A 29 -5.495 5.244 2.703 1.00 0.00 N ATOM 400 CA ARG A 29 -4.170 4.641 2.627 1.00 0.00 C ATOM 401 C ARG A 29 -4.182 3.228 3.203 1.00 0.00 C ATOM 402 O ARG A 29 -3.617 2.305 2.617 1.00 0.00 O ATOM 403 CB ARG A 29 -3.152 5.501 3.379 1.00 0.00 C ATOM 404 CG ARG A 29 -2.455 6.527 2.501 1.00 0.00 C ATOM 405 CD ARG A 29 -1.342 7.240 3.253 1.00 0.00 C ATOM 406 NE ARG A 29 -1.853 8.322 4.090 1.00 0.00 N ATOM 407 CZ ARG A 29 -1.116 9.354 4.487 1.00 0.00 C ATOM 408 NH1 ARG A 29 0.156 9.443 4.125 1.00 0.00 N ATOM 409 NH2 ARG A 29 -1.653 10.300 5.247 1.00 0.00 N ATOM 0 H ARG A 29 -5.568 6.019 3.362 1.00 0.00 H new ATOM 0 HA ARG A 29 -3.883 4.584 1.577 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -3.658 6.017 4.195 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -2.402 4.851 3.829 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -2.043 6.034 1.621 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -3.182 7.258 2.146 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -0.807 6.522 3.875 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -0.622 7.642 2.540 1.00 0.00 H new ATOM 0 HE ARG A 29 -2.828 8.284 4.386 1.00 0.00 H new ATOM 0 HH11 ARG A 29 0.572 8.718 3.540 1.00 0.00 H new ATOM 0 HH12 ARG A 29 0.719 10.236 4.431 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -2.632 10.235 5.527 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -1.087 11.092 5.552 1.00 0.00 H new ATOM 423 N GLU A 30 -4.830 3.068 4.353 1.00 0.00 N ATOM 424 CA GLU A 30 -4.913 1.767 5.007 1.00 0.00 C ATOM 425 C GLU A 30 -5.848 0.833 4.243 1.00 0.00 C ATOM 426 O GLU A 30 -5.587 -0.364 4.130 1.00 0.00 O ATOM 427 CB GLU A 30 -5.400 1.927 6.448 1.00 0.00 C ATOM 428 CG GLU A 30 -6.913 1.900 6.586 1.00 0.00 C ATOM 429 CD GLU A 30 -7.371 2.051 8.024 1.00 0.00 C ATOM 430 OE1 GLU A 30 -7.063 1.159 8.842 1.00 0.00 O ATOM 431 OE2 GLU A 30 -8.037 3.062 8.331 1.00 0.00 O ATOM 0 H GLU A 30 -5.304 3.822 4.850 1.00 0.00 H new ATOM 0 HA GLU A 30 -3.915 1.328 5.015 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -4.974 1.130 7.057 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -5.024 2.869 6.847 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -7.343 2.702 5.986 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -7.294 0.961 6.184 1.00 0.00 H new ATOM 438 N GLN A 31 -6.936 1.391 3.723 1.00 0.00 N ATOM 439 CA GLN A 31 -7.910 0.608 2.971 1.00 0.00 C ATOM 440 C GLN A 31 -7.246 -0.108 1.800 1.00 0.00 C ATOM 441 O GLN A 31 -7.265 -1.336 1.717 1.00 0.00 O ATOM 442 CB GLN A 31 -9.036 1.508 2.462 1.00 0.00 C ATOM 443 CG GLN A 31 -9.743 2.281 3.564 1.00 0.00 C ATOM 444 CD GLN A 31 -9.973 1.446 4.808 1.00 0.00 C ATOM 445 OE1 GLN A 31 -9.547 1.812 5.904 1.00 0.00 O ATOM 446 NE2 GLN A 31 -10.650 0.315 4.645 1.00 0.00 N ATOM 0 H GLN A 31 -7.165 2.381 3.808 1.00 0.00 H new ATOM 0 HA GLN A 31 -8.330 -0.143 3.641 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -8.627 2.214 1.739 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -9.767 0.897 1.932 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -9.151 3.158 3.824 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -10.701 2.642 3.191 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -10.985 0.050 3.719 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -10.835 -0.289 5.446 1.00 0.00 H new ATOM 455 N PHE A 32 -6.659 0.669 0.895 1.00 0.00 N ATOM 456 CA PHE A 32 -5.990 0.109 -0.274 1.00 0.00 C ATOM 457 C PHE A 32 -4.966 -0.945 0.138 1.00 0.00 C ATOM 458 O PHE A 32 -4.788 -1.954 -0.546 1.00 0.00 O ATOM 459 CB PHE A 32 -5.303 1.218 -1.074 1.00 0.00 C ATOM 460 CG PHE A 32 -4.226 0.716 -1.992 1.00 0.00 C ATOM 461 CD1 PHE A 32 -4.507 -0.244 -2.951 1.00 0.00 C ATOM 462 CD2 PHE A 32 -2.932 1.203 -1.897 1.00 0.00 C ATOM 463 CE1 PHE A 32 -3.517 -0.709 -3.797 1.00 0.00 C ATOM 464 CE2 PHE A 32 -1.939 0.742 -2.740 1.00 0.00 C ATOM 465 CZ PHE A 32 -2.232 -0.214 -3.692 1.00 0.00 C ATOM 0 H PHE A 32 -6.633 1.687 0.949 1.00 0.00 H new ATOM 0 HA PHE A 32 -6.744 -0.368 -0.900 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -6.052 1.748 -1.662 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -4.871 1.940 -0.381 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -5.511 -0.633 -3.039 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -2.697 1.952 -1.155 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -3.748 -1.459 -4.539 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -0.934 1.129 -2.654 1.00 0.00 H new ATOM 0 HZ PHE A 32 -1.458 -0.574 -4.353 1.00 0.00 H new ATOM 475 N LEU A 33 -4.297 -0.704 1.260 1.00 0.00 N ATOM 476 CA LEU A 33 -3.290 -1.631 1.764 1.00 0.00 C ATOM 477 C LEU A 33 -3.915 -2.981 2.103 1.00 0.00 C ATOM 478 O LEU A 33 -3.474 -4.022 1.614 1.00 0.00 O ATOM 479 CB LEU A 33 -2.606 -1.048 3.002 1.00 0.00 C ATOM 480 CG LEU A 33 -1.888 -2.051 3.906 1.00 0.00 C ATOM 481 CD1 LEU A 33 -0.450 -2.247 3.450 1.00 0.00 C ATOM 482 CD2 LEU A 33 -1.931 -1.588 5.355 1.00 0.00 C ATOM 0 H LEU A 33 -4.434 0.125 1.838 1.00 0.00 H new ATOM 0 HA LEU A 33 -2.546 -1.781 0.982 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -1.883 -0.301 2.675 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -3.357 -0.526 3.596 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.404 -3.009 3.835 1.00 0.00 H new ATOM 0 HD11 LEU A 33 0.045 -2.964 4.105 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -0.441 -2.624 2.427 1.00 0.00 H new ATOM 0 HD13 LEU A 33 0.078 -1.294 3.491 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -1.415 -2.314 5.984 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -1.440 -0.619 5.442 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.968 -1.500 5.678 1.00 0.00 H new ATOM 494 N LYS A 34 -4.945 -2.957 2.942 1.00 0.00 N ATOM 495 CA LYS A 34 -5.634 -4.178 3.344 1.00 0.00 C ATOM 496 C LYS A 34 -5.679 -5.181 2.195 1.00 0.00 C ATOM 497 O LYS A 34 -5.174 -6.297 2.313 1.00 0.00 O ATOM 498 CB LYS A 34 -7.055 -3.856 3.810 1.00 0.00 C ATOM 499 CG LYS A 34 -7.108 -2.891 4.982 1.00 0.00 C ATOM 500 CD LYS A 34 -8.324 -3.143 5.857 1.00 0.00 C ATOM 501 CE LYS A 34 -8.416 -2.130 6.988 1.00 0.00 C ATOM 502 NZ LYS A 34 -7.425 -2.410 8.065 1.00 0.00 N ATOM 0 H LYS A 34 -5.321 -2.105 3.357 1.00 0.00 H new ATOM 0 HA LYS A 34 -5.080 -4.623 4.170 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -7.614 -3.432 2.976 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -7.555 -4.783 4.091 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -6.202 -2.992 5.579 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -7.132 -1.867 4.610 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -9.227 -3.094 5.249 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -8.273 -4.150 6.272 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -8.249 -1.128 6.593 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -9.422 -2.144 7.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -7.519 -1.698 8.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -7.600 -3.356 8.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -6.463 -2.372 7.671 1.00 0.00 H new ATOM 516 N PHE A 35 -6.284 -4.774 1.084 1.00 0.00 N ATOM 517 CA PHE A 35 -6.394 -5.638 -0.086 1.00 0.00 C ATOM 518 C PHE A 35 -5.044 -6.259 -0.432 1.00 0.00 C ATOM 519 O PHE A 35 -4.935 -7.473 -0.612 1.00 0.00 O ATOM 520 CB PHE A 35 -6.925 -4.845 -1.282 1.00 0.00 C ATOM 521 CG PHE A 35 -6.842 -5.595 -2.581 1.00 0.00 C ATOM 522 CD1 PHE A 35 -7.826 -6.504 -2.936 1.00 0.00 C ATOM 523 CD2 PHE A 35 -5.781 -5.390 -3.448 1.00 0.00 C ATOM 524 CE1 PHE A 35 -7.753 -7.195 -4.131 1.00 0.00 C ATOM 525 CE2 PHE A 35 -5.703 -6.077 -4.644 1.00 0.00 C ATOM 526 CZ PHE A 35 -6.689 -6.981 -4.986 1.00 0.00 C ATOM 0 H PHE A 35 -6.705 -3.852 0.969 1.00 0.00 H new ATOM 0 HA PHE A 35 -7.093 -6.440 0.149 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -7.963 -4.572 -1.095 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -6.362 -3.916 -1.371 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -8.660 -6.675 -2.271 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -5.006 -4.685 -3.186 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -8.526 -7.901 -4.396 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -4.871 -5.907 -5.311 1.00 0.00 H new ATOM 0 HZ PHE A 35 -6.629 -7.520 -5.920 1.00 0.00 H new ATOM 536 N LEU A 36 -4.019 -5.420 -0.523 1.00 0.00 N ATOM 537 CA LEU A 36 -2.675 -5.885 -0.848 1.00 0.00 C ATOM 538 C LEU A 36 -2.305 -7.107 -0.013 1.00 0.00 C ATOM 539 O LEU A 36 -2.005 -8.171 -0.552 1.00 0.00 O ATOM 540 CB LEU A 36 -1.657 -4.767 -0.617 1.00 0.00 C ATOM 541 CG LEU A 36 -1.975 -3.423 -1.273 1.00 0.00 C ATOM 542 CD1 LEU A 36 -0.950 -2.376 -0.867 1.00 0.00 C ATOM 543 CD2 LEU A 36 -2.024 -3.567 -2.787 1.00 0.00 C ATOM 0 H LEU A 36 -4.092 -4.413 -0.376 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.660 -6.169 -1.900 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.558 -4.610 0.457 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.687 -5.106 -0.981 1.00 0.00 H new ATOM 0 HG LEU A 36 -2.955 -3.094 -0.928 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -1.192 -1.426 -1.343 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -0.965 -2.253 0.216 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.043 -2.697 -1.182 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.252 -2.601 -3.237 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -1.058 -3.918 -3.151 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -2.797 -4.285 -3.059 1.00 0.00 H new ATOM 555 N GLU A 37 -2.332 -6.945 1.307 1.00 0.00 N ATOM 556 CA GLU A 37 -2.001 -8.036 2.216 1.00 0.00 C ATOM 557 C GLU A 37 -2.488 -9.372 1.663 1.00 0.00 C ATOM 558 O GLU A 37 -1.757 -10.362 1.670 1.00 0.00 O ATOM 559 CB GLU A 37 -2.618 -7.786 3.594 1.00 0.00 C ATOM 560 CG GLU A 37 -2.127 -6.510 4.258 1.00 0.00 C ATOM 561 CD GLU A 37 -2.769 -6.273 5.611 1.00 0.00 C ATOM 562 OE1 GLU A 37 -2.308 -6.878 6.602 1.00 0.00 O ATOM 563 OE2 GLU A 37 -3.733 -5.482 5.679 1.00 0.00 O ATOM 0 H GLU A 37 -2.579 -6.070 1.769 1.00 0.00 H new ATOM 0 HA GLU A 37 -0.916 -8.077 2.314 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -3.702 -7.740 3.494 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -2.393 -8.633 4.243 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -1.045 -6.560 4.377 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -2.337 -5.662 3.607 1.00 0.00 H new ATOM 570 N SER A 38 -3.728 -9.391 1.186 1.00 0.00 N ATOM 571 CA SER A 38 -4.316 -10.606 0.633 1.00 0.00 C ATOM 572 C SER A 38 -3.443 -11.173 -0.482 1.00 0.00 C ATOM 573 O SER A 38 -3.065 -12.344 -0.454 1.00 0.00 O ATOM 574 CB SER A 38 -5.722 -10.322 0.101 1.00 0.00 C ATOM 575 OG SER A 38 -6.585 -9.899 1.142 1.00 0.00 O ATOM 0 H SER A 38 -4.345 -8.579 1.171 1.00 0.00 H new ATOM 0 HA SER A 38 -4.380 -11.345 1.432 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.674 -9.554 -0.671 1.00 0.00 H new ATOM 0 HB3 SER A 38 -6.125 -11.220 -0.368 1.00 0.00 H new ATOM 0 HG SER A 38 -7.477 -9.722 0.776 1.00 0.00 H new ATOM 581 N GLU A 39 -3.127 -10.333 -1.463 1.00 0.00 N ATOM 582 CA GLU A 39 -2.300 -10.751 -2.589 1.00 0.00 C ATOM 583 C GLU A 39 -0.825 -10.785 -2.197 1.00 0.00 C ATOM 584 O GLU A 39 0.050 -10.960 -3.045 1.00 0.00 O ATOM 585 CB GLU A 39 -2.501 -9.807 -3.776 1.00 0.00 C ATOM 586 CG GLU A 39 -2.125 -8.365 -3.479 1.00 0.00 C ATOM 587 CD GLU A 39 -1.709 -7.603 -4.722 1.00 0.00 C ATOM 588 OE1 GLU A 39 -1.327 -8.254 -5.717 1.00 0.00 O ATOM 589 OE2 GLU A 39 -1.764 -6.355 -4.699 1.00 0.00 O ATOM 0 H GLU A 39 -3.431 -9.360 -1.501 1.00 0.00 H new ATOM 0 HA GLU A 39 -2.605 -11.757 -2.878 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -1.906 -10.163 -4.617 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.545 -9.845 -4.086 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -2.973 -7.861 -3.015 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -1.309 -8.348 -2.757 1.00 0.00 H new ATOM 596 N PHE A 40 -0.558 -10.616 -0.906 1.00 0.00 N ATOM 597 CA PHE A 40 0.810 -10.626 -0.401 1.00 0.00 C ATOM 598 C PHE A 40 1.681 -9.638 -1.171 1.00 0.00 C ATOM 599 O PHE A 40 2.858 -9.897 -1.423 1.00 0.00 O ATOM 600 CB PHE A 40 1.403 -12.033 -0.502 1.00 0.00 C ATOM 601 CG PHE A 40 0.441 -13.118 -0.112 1.00 0.00 C ATOM 602 CD1 PHE A 40 -0.486 -13.600 -1.022 1.00 0.00 C ATOM 603 CD2 PHE A 40 0.464 -13.657 1.164 1.00 0.00 C ATOM 604 CE1 PHE A 40 -1.372 -14.599 -0.666 1.00 0.00 C ATOM 605 CE2 PHE A 40 -0.420 -14.656 1.526 1.00 0.00 C ATOM 606 CZ PHE A 40 -1.339 -15.128 0.610 1.00 0.00 C ATOM 0 H PHE A 40 -1.271 -10.471 -0.191 1.00 0.00 H new ATOM 0 HA PHE A 40 0.787 -10.323 0.646 1.00 0.00 H new ATOM 0 HB2 PHE A 40 1.737 -12.205 -1.525 1.00 0.00 H new ATOM 0 HB3 PHE A 40 2.285 -12.094 0.136 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -0.516 -13.190 -2.021 1.00 0.00 H new ATOM 0 HD2 PHE A 40 1.181 -13.292 1.884 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -2.090 -14.966 -1.385 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -0.392 -15.067 2.524 1.00 0.00 H new ATOM 0 HZ PHE A 40 -2.030 -15.909 0.890 1.00 0.00 H new ATOM 616 N SER A 41 1.094 -8.505 -1.542 1.00 0.00 N ATOM 617 CA SER A 41 1.814 -7.479 -2.287 1.00 0.00 C ATOM 618 C SER A 41 1.887 -6.179 -1.491 1.00 0.00 C ATOM 619 O SER A 41 2.154 -5.113 -2.045 1.00 0.00 O ATOM 620 CB SER A 41 1.136 -7.227 -3.635 1.00 0.00 C ATOM 621 OG SER A 41 1.070 -8.416 -4.403 1.00 0.00 O ATOM 0 H SER A 41 0.121 -8.274 -1.339 1.00 0.00 H new ATOM 0 HA SER A 41 2.829 -7.836 -2.460 1.00 0.00 H new ATOM 0 HB2 SER A 41 0.130 -6.839 -3.473 1.00 0.00 H new ATOM 0 HB3 SER A 41 1.687 -6.465 -4.186 1.00 0.00 H new ATOM 0 HG SER A 41 0.613 -9.113 -3.888 1.00 0.00 H new ATOM 627 N SER A 42 1.648 -6.278 -0.187 1.00 0.00 N ATOM 628 CA SER A 42 1.682 -5.110 0.686 1.00 0.00 C ATOM 629 C SER A 42 3.094 -4.540 0.775 1.00 0.00 C ATOM 630 O SER A 42 3.279 -3.330 0.903 1.00 0.00 O ATOM 631 CB SER A 42 1.179 -5.478 2.084 1.00 0.00 C ATOM 632 OG SER A 42 2.025 -6.437 2.694 1.00 0.00 O ATOM 0 H SER A 42 1.429 -7.154 0.288 1.00 0.00 H new ATOM 0 HA SER A 42 1.028 -4.349 0.261 1.00 0.00 H new ATOM 0 HB2 SER A 42 1.132 -4.583 2.704 1.00 0.00 H new ATOM 0 HB3 SER A 42 0.165 -5.873 2.017 1.00 0.00 H new ATOM 0 HG SER A 42 1.683 -6.654 3.586 1.00 0.00 H new ATOM 638 N GLU A 43 4.087 -5.421 0.707 1.00 0.00 N ATOM 639 CA GLU A 43 5.483 -5.005 0.780 1.00 0.00 C ATOM 640 C GLU A 43 5.720 -3.746 -0.048 1.00 0.00 C ATOM 641 O GLU A 43 6.237 -2.749 0.453 1.00 0.00 O ATOM 642 CB GLU A 43 6.399 -6.129 0.293 1.00 0.00 C ATOM 643 CG GLU A 43 6.115 -7.472 0.945 1.00 0.00 C ATOM 644 CD GLU A 43 6.965 -8.590 0.373 1.00 0.00 C ATOM 645 OE1 GLU A 43 7.333 -8.505 -0.817 1.00 0.00 O ATOM 646 OE2 GLU A 43 7.263 -9.549 1.116 1.00 0.00 O ATOM 0 H GLU A 43 3.951 -6.426 0.602 1.00 0.00 H new ATOM 0 HA GLU A 43 5.715 -4.782 1.822 1.00 0.00 H new ATOM 0 HB2 GLU A 43 6.294 -6.230 -0.787 1.00 0.00 H new ATOM 0 HB3 GLU A 43 7.435 -5.852 0.488 1.00 0.00 H new ATOM 0 HG2 GLU A 43 6.295 -7.396 2.017 1.00 0.00 H new ATOM 0 HG3 GLU A 43 5.061 -7.719 0.815 1.00 0.00 H new ATOM 653 N ASN A 44 5.338 -3.801 -1.320 1.00 0.00 N ATOM 654 CA ASN A 44 5.510 -2.666 -2.219 1.00 0.00 C ATOM 655 C ASN A 44 5.179 -1.355 -1.511 1.00 0.00 C ATOM 656 O ASN A 44 6.021 -0.462 -1.410 1.00 0.00 O ATOM 657 CB ASN A 44 4.622 -2.828 -3.455 1.00 0.00 C ATOM 658 CG ASN A 44 4.842 -4.156 -4.154 1.00 0.00 C ATOM 659 OD1 ASN A 44 5.362 -5.102 -3.563 1.00 0.00 O ATOM 660 ND2 ASN A 44 4.446 -4.230 -5.419 1.00 0.00 N ATOM 0 H ASN A 44 4.908 -4.619 -1.751 1.00 0.00 H new ATOM 0 HA ASN A 44 6.554 -2.637 -2.530 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.576 -2.744 -3.161 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.823 -2.015 -4.153 1.00 0.00 H new ATOM 0 HD21 ASN A 44 4.568 -5.097 -5.942 1.00 0.00 H new ATOM 0 HD22 ASN A 44 4.020 -3.420 -5.868 1.00 0.00 H new ATOM 667 N LEU A 45 3.949 -1.248 -1.021 1.00 0.00 N ATOM 668 CA LEU A 45 3.507 -0.047 -0.321 1.00 0.00 C ATOM 669 C LEU A 45 4.224 0.098 1.018 1.00 0.00 C ATOM 670 O LEU A 45 4.879 1.108 1.276 1.00 0.00 O ATOM 671 CB LEU A 45 1.994 -0.091 -0.099 1.00 0.00 C ATOM 672 CG LEU A 45 1.398 1.070 0.699 1.00 0.00 C ATOM 673 CD1 LEU A 45 1.532 2.373 -0.074 1.00 0.00 C ATOM 674 CD2 LEU A 45 -0.060 0.794 1.034 1.00 0.00 C ATOM 0 H LEU A 45 3.240 -1.978 -1.095 1.00 0.00 H new ATOM 0 HA LEU A 45 3.753 0.816 -0.940 1.00 0.00 H new ATOM 0 HB2 LEU A 45 1.505 -0.125 -1.073 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.749 -1.021 0.413 1.00 0.00 H new ATOM 0 HG LEU A 45 1.952 1.167 1.633 1.00 0.00 H new ATOM 0 HD11 LEU A 45 1.103 3.188 0.509 1.00 0.00 H new ATOM 0 HD12 LEU A 45 2.586 2.578 -0.262 1.00 0.00 H new ATOM 0 HD13 LEU A 45 1.004 2.289 -1.024 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.468 1.630 1.602 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -0.628 0.670 0.112 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -0.131 -0.117 1.629 1.00 0.00 H new ATOM 686 N ARG A 46 4.097 -0.918 1.865 1.00 0.00 N ATOM 687 CA ARG A 46 4.734 -0.904 3.176 1.00 0.00 C ATOM 688 C ARG A 46 6.083 -0.192 3.118 1.00 0.00 C ATOM 689 O ARG A 46 6.420 0.594 4.003 1.00 0.00 O ATOM 690 CB ARG A 46 4.922 -2.332 3.691 1.00 0.00 C ATOM 691 CG ARG A 46 3.690 -2.898 4.379 1.00 0.00 C ATOM 692 CD ARG A 46 4.042 -4.078 5.271 1.00 0.00 C ATOM 693 NE ARG A 46 4.859 -3.676 6.413 1.00 0.00 N ATOM 694 CZ ARG A 46 4.744 -4.212 7.623 1.00 0.00 C ATOM 695 NH1 ARG A 46 3.851 -5.167 7.847 1.00 0.00 N ATOM 696 NH2 ARG A 46 5.523 -3.793 8.612 1.00 0.00 N ATOM 0 H ARG A 46 3.559 -1.761 1.667 1.00 0.00 H new ATOM 0 HA ARG A 46 4.084 -0.360 3.861 1.00 0.00 H new ATOM 0 HB2 ARG A 46 5.190 -2.978 2.855 1.00 0.00 H new ATOM 0 HB3 ARG A 46 5.759 -2.350 4.390 1.00 0.00 H new ATOM 0 HG2 ARG A 46 3.215 -2.119 4.975 1.00 0.00 H new ATOM 0 HG3 ARG A 46 2.965 -3.212 3.628 1.00 0.00 H new ATOM 0 HD2 ARG A 46 3.126 -4.548 5.628 1.00 0.00 H new ATOM 0 HD3 ARG A 46 4.578 -4.826 4.687 1.00 0.00 H new ATOM 0 HE ARG A 46 5.556 -2.944 6.274 1.00 0.00 H new ATOM 0 HH11 ARG A 46 3.250 -5.492 7.089 1.00 0.00 H new ATOM 0 HH12 ARG A 46 3.765 -5.577 8.777 1.00 0.00 H new ATOM 0 HH21 ARG A 46 6.211 -3.059 8.443 1.00 0.00 H new ATOM 0 HH22 ARG A 46 5.434 -4.205 9.541 1.00 0.00 H new ATOM 710 N PHE A 47 6.850 -0.474 2.070 1.00 0.00 N ATOM 711 CA PHE A 47 8.162 0.138 1.896 1.00 0.00 C ATOM 712 C PHE A 47 8.030 1.617 1.545 1.00 0.00 C ATOM 713 O PHE A 47 8.718 2.465 2.114 1.00 0.00 O ATOM 714 CB PHE A 47 8.947 -0.589 0.803 1.00 0.00 C ATOM 715 CG PHE A 47 9.947 0.285 0.101 1.00 0.00 C ATOM 716 CD1 PHE A 47 10.996 0.859 0.800 1.00 0.00 C ATOM 717 CD2 PHE A 47 9.838 0.531 -1.258 1.00 0.00 C ATOM 718 CE1 PHE A 47 11.917 1.664 0.156 1.00 0.00 C ATOM 719 CE2 PHE A 47 10.756 1.335 -1.908 1.00 0.00 C ATOM 720 CZ PHE A 47 11.798 1.901 -1.199 1.00 0.00 C ATOM 0 H PHE A 47 6.586 -1.122 1.328 1.00 0.00 H new ATOM 0 HA PHE A 47 8.702 0.053 2.839 1.00 0.00 H new ATOM 0 HB2 PHE A 47 9.466 -1.440 1.244 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.247 -0.989 0.069 1.00 0.00 H new ATOM 0 HD1 PHE A 47 11.095 0.676 1.860 1.00 0.00 H new ATOM 0 HD2 PHE A 47 9.026 0.089 -1.817 1.00 0.00 H new ATOM 0 HE1 PHE A 47 12.729 2.107 0.713 1.00 0.00 H new ATOM 0 HE2 PHE A 47 10.659 1.520 -2.968 1.00 0.00 H new ATOM 0 HZ PHE A 47 12.518 2.528 -1.704 1.00 0.00 H new ATOM 730 N TRP A 48 7.143 1.919 0.604 1.00 0.00 N ATOM 731 CA TRP A 48 6.921 3.295 0.176 1.00 0.00 C ATOM 732 C TRP A 48 6.742 4.217 1.377 1.00 0.00 C ATOM 733 O TRP A 48 7.523 5.149 1.578 1.00 0.00 O ATOM 734 CB TRP A 48 5.692 3.377 -0.732 1.00 0.00 C ATOM 735 CG TRP A 48 5.619 4.650 -1.519 1.00 0.00 C ATOM 736 CD1 TRP A 48 6.291 4.940 -2.672 1.00 0.00 C ATOM 737 CD2 TRP A 48 4.831 5.805 -1.210 1.00 0.00 C ATOM 738 NE1 TRP A 48 5.968 6.206 -3.099 1.00 0.00 N ATOM 739 CE2 TRP A 48 5.074 6.757 -2.220 1.00 0.00 C ATOM 740 CE3 TRP A 48 3.942 6.126 -0.181 1.00 0.00 C ATOM 741 CZ2 TRP A 48 4.461 8.007 -2.226 1.00 0.00 C ATOM 742 CZ3 TRP A 48 3.335 7.367 -0.189 1.00 0.00 C ATOM 743 CH2 TRP A 48 3.595 8.295 -1.206 1.00 0.00 C ATOM 0 H TRP A 48 6.566 1.229 0.123 1.00 0.00 H new ATOM 0 HA TRP A 48 7.799 3.621 -0.382 1.00 0.00 H new ATOM 0 HB2 TRP A 48 5.701 2.532 -1.421 1.00 0.00 H new ATOM 0 HB3 TRP A 48 4.793 3.282 -0.124 1.00 0.00 H new ATOM 0 HD1 TRP A 48 6.976 4.273 -3.174 1.00 0.00 H new ATOM 0 HE1 TRP A 48 6.335 6.661 -3.935 1.00 0.00 H new ATOM 0 HE3 TRP A 48 3.733 5.417 0.606 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 4.662 8.724 -3.008 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 2.648 7.626 0.603 1.00 0.00 H new ATOM 0 HH2 TRP A 48 3.103 9.256 -1.185 1.00 0.00 H new ATOM 754 N LEU A 49 5.712 3.952 2.173 1.00 0.00 N ATOM 755 CA LEU A 49 5.432 4.759 3.356 1.00 0.00 C ATOM 756 C LEU A 49 6.662 4.854 4.253 1.00 0.00 C ATOM 757 O LEU A 49 7.017 5.935 4.723 1.00 0.00 O ATOM 758 CB LEU A 49 4.261 4.162 4.138 1.00 0.00 C ATOM 759 CG LEU A 49 2.899 4.204 3.444 1.00 0.00 C ATOM 760 CD1 LEU A 49 1.942 3.211 4.085 1.00 0.00 C ATOM 761 CD2 LEU A 49 2.320 5.611 3.490 1.00 0.00 C ATOM 0 H LEU A 49 5.057 3.185 2.021 1.00 0.00 H new ATOM 0 HA LEU A 49 5.167 5.764 3.027 1.00 0.00 H new ATOM 0 HB2 LEU A 49 4.497 3.123 4.369 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.178 4.689 5.088 1.00 0.00 H new ATOM 0 HG LEU A 49 3.036 3.923 2.400 1.00 0.00 H new ATOM 0 HD11 LEU A 49 0.978 3.255 3.578 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.351 2.204 4.000 1.00 0.00 H new ATOM 0 HD13 LEU A 49 1.810 3.461 5.138 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.351 5.622 2.991 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.198 5.920 4.528 1.00 0.00 H new ATOM 0 HD23 LEU A 49 2.996 6.300 2.983 1.00 0.00 H new ATOM 773 N ALA A 50 7.308 3.717 4.486 1.00 0.00 N ATOM 774 CA ALA A 50 8.501 3.673 5.323 1.00 0.00 C ATOM 775 C ALA A 50 9.507 4.739 4.902 1.00 0.00 C ATOM 776 O ALA A 50 10.099 5.415 5.743 1.00 0.00 O ATOM 777 CB ALA A 50 9.136 2.292 5.265 1.00 0.00 C ATOM 0 H ALA A 50 7.025 2.813 4.107 1.00 0.00 H new ATOM 0 HA ALA A 50 8.202 3.880 6.350 1.00 0.00 H new ATOM 0 HB1 ALA A 50 10.026 2.274 5.895 1.00 0.00 H new ATOM 0 HB2 ALA A 50 8.423 1.549 5.622 1.00 0.00 H new ATOM 0 HB3 ALA A 50 9.415 2.063 4.236 1.00 0.00 H new ATOM 783 N VAL A 51 9.696 4.883 3.594 1.00 0.00 N ATOM 784 CA VAL A 51 10.630 5.867 3.061 1.00 0.00 C ATOM 785 C VAL A 51 10.161 7.288 3.358 1.00 0.00 C ATOM 786 O VAL A 51 10.855 8.053 4.026 1.00 0.00 O ATOM 787 CB VAL A 51 10.810 5.705 1.540 1.00 0.00 C ATOM 788 CG1 VAL A 51 11.775 6.750 1.001 1.00 0.00 C ATOM 789 CG2 VAL A 51 11.292 4.301 1.208 1.00 0.00 C ATOM 0 H VAL A 51 9.215 4.331 2.884 1.00 0.00 H new ATOM 0 HA VAL A 51 11.587 5.693 3.553 1.00 0.00 H new ATOM 0 HB VAL A 51 9.844 5.857 1.059 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.889 6.619 -0.075 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.384 7.747 1.206 1.00 0.00 H new ATOM 0 HG13 VAL A 51 12.745 6.634 1.485 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.414 4.204 0.129 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.248 4.119 1.699 1.00 0.00 H new ATOM 0 HG23 VAL A 51 10.560 3.573 1.557 1.00 0.00 H new ATOM 799 N GLU A 52 8.980 7.632 2.855 1.00 0.00 N ATOM 800 CA GLU A 52 8.418 8.961 3.066 1.00 0.00 C ATOM 801 C GLU A 52 8.752 9.477 4.463 1.00 0.00 C ATOM 802 O GLU A 52 9.065 10.654 4.643 1.00 0.00 O ATOM 803 CB GLU A 52 6.901 8.935 2.869 1.00 0.00 C ATOM 804 CG GLU A 52 6.469 9.185 1.434 1.00 0.00 C ATOM 805 CD GLU A 52 5.099 9.826 1.341 1.00 0.00 C ATOM 806 OE1 GLU A 52 4.105 9.160 1.697 1.00 0.00 O ATOM 807 OE2 GLU A 52 5.020 10.997 0.911 1.00 0.00 O ATOM 0 H GLU A 52 8.394 7.009 2.299 1.00 0.00 H new ATOM 0 HA GLU A 52 8.860 9.635 2.333 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.518 7.967 3.191 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.447 9.688 3.513 1.00 0.00 H new ATOM 0 HG2 GLU A 52 7.201 9.828 0.945 1.00 0.00 H new ATOM 0 HG3 GLU A 52 6.462 8.240 0.891 1.00 0.00 H new ATOM 814 N ASP A 53 8.683 8.588 5.448 1.00 0.00 N ATOM 815 CA ASP A 53 8.978 8.952 6.829 1.00 0.00 C ATOM 816 C ASP A 53 10.480 9.107 7.041 1.00 0.00 C ATOM 817 O ASP A 53 10.930 10.027 7.725 1.00 0.00 O ATOM 818 CB ASP A 53 8.421 7.898 7.787 1.00 0.00 C ATOM 819 CG ASP A 53 6.941 8.086 8.058 1.00 0.00 C ATOM 820 OD1 ASP A 53 6.473 9.243 8.021 1.00 0.00 O ATOM 821 OD2 ASP A 53 6.251 7.075 8.307 1.00 0.00 O ATOM 0 H ASP A 53 8.425 7.610 5.316 1.00 0.00 H new ATOM 0 HA ASP A 53 8.499 9.909 7.037 1.00 0.00 H new ATOM 0 HB2 ASP A 53 8.587 6.906 7.367 1.00 0.00 H new ATOM 0 HB3 ASP A 53 8.968 7.942 8.729 1.00 0.00 H new ATOM 826 N LEU A 54 11.252 8.201 6.451 1.00 0.00 N ATOM 827 CA LEU A 54 12.705 8.235 6.575 1.00 0.00 C ATOM 828 C LEU A 54 13.209 9.672 6.672 1.00 0.00 C ATOM 829 O LEU A 54 13.747 10.085 7.699 1.00 0.00 O ATOM 830 CB LEU A 54 13.356 7.533 5.382 1.00 0.00 C ATOM 831 CG LEU A 54 14.885 7.529 5.358 1.00 0.00 C ATOM 832 CD1 LEU A 54 15.436 6.776 6.559 1.00 0.00 C ATOM 833 CD2 LEU A 54 15.396 6.917 4.062 1.00 0.00 C ATOM 0 H LEU A 54 10.896 7.433 5.882 1.00 0.00 H new ATOM 0 HA LEU A 54 12.979 7.710 7.490 1.00 0.00 H new ATOM 0 HB2 LEU A 54 13.010 6.500 5.361 1.00 0.00 H new ATOM 0 HB3 LEU A 54 12.999 8.008 4.468 1.00 0.00 H new ATOM 0 HG LEU A 54 15.233 8.561 5.411 1.00 0.00 H new ATOM 0 HD11 LEU A 54 16.525 6.784 6.525 1.00 0.00 H new ATOM 0 HD12 LEU A 54 15.098 7.258 7.477 1.00 0.00 H new ATOM 0 HD13 LEU A 54 15.080 5.746 6.538 1.00 0.00 H new ATOM 0 HD21 LEU A 54 16.486 6.922 4.062 1.00 0.00 H new ATOM 0 HD22 LEU A 54 15.038 5.891 3.978 1.00 0.00 H new ATOM 0 HD23 LEU A 54 15.030 7.499 3.216 1.00 0.00 H new ATOM 845 N LYS A 55 13.030 10.430 5.595 1.00 0.00 N ATOM 846 CA LYS A 55 13.463 11.821 5.557 1.00 0.00 C ATOM 847 C LYS A 55 12.935 12.588 6.766 1.00 0.00 C ATOM 848 O LYS A 55 13.682 13.301 7.436 1.00 0.00 O ATOM 849 CB LYS A 55 12.985 12.491 4.267 1.00 0.00 C ATOM 850 CG LYS A 55 11.480 12.434 4.074 1.00 0.00 C ATOM 851 CD LYS A 55 11.099 12.589 2.611 1.00 0.00 C ATOM 852 CE LYS A 55 10.952 11.239 1.927 1.00 0.00 C ATOM 853 NZ LYS A 55 12.218 10.809 1.270 1.00 0.00 N ATOM 0 H LYS A 55 12.587 10.103 4.736 1.00 0.00 H new ATOM 0 HA LYS A 55 14.553 11.837 5.585 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.303 13.533 4.269 1.00 0.00 H new ATOM 0 HB3 LYS A 55 13.470 12.011 3.417 1.00 0.00 H new ATOM 0 HG2 LYS A 55 11.100 11.485 4.451 1.00 0.00 H new ATOM 0 HG3 LYS A 55 11.007 13.222 4.660 1.00 0.00 H new ATOM 0 HD2 LYS A 55 10.162 13.141 2.535 1.00 0.00 H new ATOM 0 HD3 LYS A 55 11.858 13.178 2.097 1.00 0.00 H new ATOM 0 HE2 LYS A 55 10.651 10.491 2.661 1.00 0.00 H new ATOM 0 HE3 LYS A 55 10.157 11.293 1.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 12.020 10.029 0.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 12.626 11.609 0.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 12.893 10.488 1.993 1.00 0.00 H new ATOM 867 N LYS A 56 11.644 12.435 7.040 1.00 0.00 N ATOM 868 CA LYS A 56 11.016 13.111 8.169 1.00 0.00 C ATOM 869 C LYS A 56 11.802 12.867 9.454 1.00 0.00 C ATOM 870 O LYS A 56 11.964 13.771 10.274 1.00 0.00 O ATOM 871 CB LYS A 56 9.574 12.627 8.342 1.00 0.00 C ATOM 872 CG LYS A 56 8.691 12.908 7.138 1.00 0.00 C ATOM 873 CD LYS A 56 8.346 14.384 7.032 1.00 0.00 C ATOM 874 CE LYS A 56 9.297 15.113 6.095 1.00 0.00 C ATOM 875 NZ LYS A 56 8.676 16.337 5.516 1.00 0.00 N ATOM 0 H LYS A 56 11.012 11.848 6.495 1.00 0.00 H new ATOM 0 HA LYS A 56 11.012 14.181 7.963 1.00 0.00 H new ATOM 0 HB2 LYS A 56 9.580 11.554 8.535 1.00 0.00 H new ATOM 0 HB3 LYS A 56 9.141 13.107 9.220 1.00 0.00 H new ATOM 0 HG2 LYS A 56 9.200 12.586 6.229 1.00 0.00 H new ATOM 0 HG3 LYS A 56 7.774 12.324 7.214 1.00 0.00 H new ATOM 0 HD2 LYS A 56 7.323 14.495 6.672 1.00 0.00 H new ATOM 0 HD3 LYS A 56 8.387 14.840 8.021 1.00 0.00 H new ATOM 0 HE2 LYS A 56 10.202 15.387 6.637 1.00 0.00 H new ATOM 0 HE3 LYS A 56 9.598 14.443 5.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 9.356 16.805 4.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 7.826 16.074 4.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 8.412 16.988 6.283 1.00 0.00 H new ATOM 889 N ARG A 57 12.288 11.642 9.622 1.00 0.00 N ATOM 890 CA ARG A 57 13.057 11.280 10.807 1.00 0.00 C ATOM 891 C ARG A 57 14.257 12.207 10.979 1.00 0.00 C ATOM 892 O ARG A 57 14.788 12.761 10.016 1.00 0.00 O ATOM 893 CB ARG A 57 13.529 9.828 10.711 1.00 0.00 C ATOM 894 CG ARG A 57 12.392 8.821 10.653 1.00 0.00 C ATOM 895 CD ARG A 57 11.729 8.650 12.011 1.00 0.00 C ATOM 896 NE ARG A 57 10.498 7.869 11.925 1.00 0.00 N ATOM 897 CZ ARG A 57 9.478 8.009 12.764 1.00 0.00 C ATOM 898 NH1 ARG A 57 9.542 8.896 13.748 1.00 0.00 N ATOM 899 NH2 ARG A 57 8.392 7.261 12.621 1.00 0.00 N ATOM 0 H ARG A 57 12.163 10.883 8.952 1.00 0.00 H new ATOM 0 HA ARG A 57 12.409 11.387 11.677 1.00 0.00 H new ATOM 0 HB2 ARG A 57 14.149 9.714 9.822 1.00 0.00 H new ATOM 0 HB3 ARG A 57 14.160 9.602 11.571 1.00 0.00 H new ATOM 0 HG2 ARG A 57 11.651 9.149 9.924 1.00 0.00 H new ATOM 0 HG3 ARG A 57 12.773 7.859 10.309 1.00 0.00 H new ATOM 0 HD2 ARG A 57 12.423 8.159 12.694 1.00 0.00 H new ATOM 0 HD3 ARG A 57 11.507 9.631 12.432 1.00 0.00 H new ATOM 0 HE ARG A 57 10.417 7.178 11.179 1.00 0.00 H new ATOM 0 HH11 ARG A 57 10.376 9.472 13.862 1.00 0.00 H new ATOM 0 HH12 ARG A 57 8.757 9.002 14.391 1.00 0.00 H new ATOM 0 HH21 ARG A 57 8.340 6.577 11.866 1.00 0.00 H new ATOM 0 HH22 ARG A 57 7.609 7.370 13.266 1.00 0.00 H new ATOM 913 N PRO A 58 14.696 12.379 12.235 1.00 0.00 N ATOM 914 CA PRO A 58 15.839 13.237 12.563 1.00 0.00 C ATOM 915 C PRO A 58 17.161 12.654 12.076 1.00 0.00 C ATOM 916 O PRO A 58 17.247 11.467 11.760 1.00 0.00 O ATOM 917 CB PRO A 58 15.810 13.295 14.092 1.00 0.00 C ATOM 918 CG PRO A 58 15.121 12.041 14.507 1.00 0.00 C ATOM 919 CD PRO A 58 14.112 11.749 13.430 1.00 0.00 C ATOM 0 HA PRO A 58 15.767 14.213 12.084 1.00 0.00 H new ATOM 0 HB2 PRO A 58 16.817 13.348 14.505 1.00 0.00 H new ATOM 0 HB3 PRO A 58 15.274 14.176 14.444 1.00 0.00 H new ATOM 0 HG2 PRO A 58 15.831 11.221 14.609 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.635 12.164 15.475 1.00 0.00 H new ATOM 0 HD2 PRO A 58 13.972 10.677 13.291 1.00 0.00 H new ATOM 0 HD3 PRO A 58 13.136 12.170 13.670 1.00 0.00 H new ATOM 927 N ILE A 59 18.188 13.495 12.019 1.00 0.00 N ATOM 928 CA ILE A 59 19.506 13.061 11.573 1.00 0.00 C ATOM 929 C ILE A 59 20.000 11.873 12.390 1.00 0.00 C ATOM 930 O ILE A 59 20.737 11.023 11.890 1.00 0.00 O ATOM 931 CB ILE A 59 20.537 14.201 11.670 1.00 0.00 C ATOM 932 CG1 ILE A 59 21.757 13.890 10.802 1.00 0.00 C ATOM 933 CG2 ILE A 59 20.951 14.418 13.118 1.00 0.00 C ATOM 934 CD1 ILE A 59 22.722 12.916 11.442 1.00 0.00 C ATOM 0 H ILE A 59 18.133 14.481 12.276 1.00 0.00 H new ATOM 0 HA ILE A 59 19.403 12.763 10.530 1.00 0.00 H new ATOM 0 HB ILE A 59 20.078 15.119 11.302 1.00 0.00 H new ATOM 0 HG12 ILE A 59 21.420 13.482 9.849 1.00 0.00 H new ATOM 0 HG13 ILE A 59 22.283 14.819 10.583 1.00 0.00 H new ATOM 0 HG21 ILE A 59 21.680 15.227 13.171 1.00 0.00 H new ATOM 0 HG22 ILE A 59 20.075 14.680 13.712 1.00 0.00 H new ATOM 0 HG23 ILE A 59 21.395 13.503 13.510 1.00 0.00 H new ATOM 0 HD11 ILE A 59 23.563 12.742 10.770 1.00 0.00 H new ATOM 0 HD12 ILE A 59 23.088 13.331 12.381 1.00 0.00 H new ATOM 0 HD13 ILE A 59 22.212 11.973 11.636 1.00 0.00 H new ATOM 946 N LYS A 60 19.587 11.817 13.652 1.00 0.00 N ATOM 947 CA LYS A 60 19.984 10.731 14.540 1.00 0.00 C ATOM 948 C LYS A 60 19.304 9.425 14.141 1.00 0.00 C ATOM 949 O LYS A 60 19.865 8.344 14.318 1.00 0.00 O ATOM 950 CB LYS A 60 19.635 11.077 15.990 1.00 0.00 C ATOM 951 CG LYS A 60 18.148 11.273 16.228 1.00 0.00 C ATOM 952 CD LYS A 60 17.888 12.321 17.296 1.00 0.00 C ATOM 953 CE LYS A 60 18.771 12.106 18.515 1.00 0.00 C ATOM 954 NZ LYS A 60 18.399 10.871 19.259 1.00 0.00 N ATOM 0 H LYS A 60 18.977 12.512 14.083 1.00 0.00 H new ATOM 0 HA LYS A 60 21.063 10.600 14.453 1.00 0.00 H new ATOM 0 HB2 LYS A 60 19.997 10.282 16.642 1.00 0.00 H new ATOM 0 HB3 LYS A 60 20.163 11.987 16.275 1.00 0.00 H new ATOM 0 HG2 LYS A 60 17.666 11.573 15.298 1.00 0.00 H new ATOM 0 HG3 LYS A 60 17.699 10.326 16.529 1.00 0.00 H new ATOM 0 HD2 LYS A 60 18.070 13.314 16.885 1.00 0.00 H new ATOM 0 HD3 LYS A 60 16.840 12.286 17.594 1.00 0.00 H new ATOM 0 HE2 LYS A 60 19.813 12.041 18.202 1.00 0.00 H new ATOM 0 HE3 LYS A 60 18.691 12.967 19.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 19.024 10.760 20.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 17.413 10.943 19.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 18.500 10.046 18.634 1.00 0.00 H new ATOM 968 N GLU A 61 18.095 9.534 13.600 1.00 0.00 N ATOM 969 CA GLU A 61 17.340 8.361 13.175 1.00 0.00 C ATOM 970 C GLU A 61 17.296 8.264 11.653 1.00 0.00 C ATOM 971 O GLU A 61 16.543 7.468 11.092 1.00 0.00 O ATOM 972 CB GLU A 61 15.917 8.411 13.735 1.00 0.00 C ATOM 973 CG GLU A 61 15.838 8.114 15.223 1.00 0.00 C ATOM 974 CD GLU A 61 14.472 7.610 15.645 1.00 0.00 C ATOM 975 OE1 GLU A 61 14.011 6.597 15.078 1.00 0.00 O ATOM 976 OE2 GLU A 61 13.863 8.228 16.544 1.00 0.00 O ATOM 0 H GLU A 61 17.617 10.422 13.446 1.00 0.00 H new ATOM 0 HA GLU A 61 17.844 7.477 13.564 1.00 0.00 H new ATOM 0 HB2 GLU A 61 15.496 9.399 13.547 1.00 0.00 H new ATOM 0 HB3 GLU A 61 15.298 7.693 13.196 1.00 0.00 H new ATOM 0 HG2 GLU A 61 16.592 7.370 15.482 1.00 0.00 H new ATOM 0 HG3 GLU A 61 16.077 9.018 15.783 1.00 0.00 H new ATOM 983 N VAL A 62 18.109 9.081 10.990 1.00 0.00 N ATOM 984 CA VAL A 62 18.164 9.089 9.533 1.00 0.00 C ATOM 985 C VAL A 62 18.908 7.867 9.005 1.00 0.00 C ATOM 986 O VAL A 62 18.371 7.065 8.242 1.00 0.00 O ATOM 987 CB VAL A 62 18.849 10.362 9.004 1.00 0.00 C ATOM 988 CG1 VAL A 62 19.588 10.072 7.706 1.00 0.00 C ATOM 989 CG2 VAL A 62 17.829 11.474 8.809 1.00 0.00 C ATOM 0 H VAL A 62 18.739 9.746 11.439 1.00 0.00 H new ATOM 0 HA VAL A 62 17.134 9.066 9.177 1.00 0.00 H new ATOM 0 HB VAL A 62 19.578 10.694 9.743 1.00 0.00 H new ATOM 0 HG11 VAL A 62 20.066 10.984 7.348 1.00 0.00 H new ATOM 0 HG12 VAL A 62 20.347 9.310 7.882 1.00 0.00 H new ATOM 0 HG13 VAL A 62 18.881 9.714 6.957 1.00 0.00 H new ATOM 0 HG21 VAL A 62 18.331 12.366 8.435 1.00 0.00 H new ATOM 0 HG22 VAL A 62 17.074 11.154 8.091 1.00 0.00 H new ATOM 0 HG23 VAL A 62 17.350 11.700 9.762 1.00 0.00 H new ATOM 999 N PRO A 63 20.175 7.721 9.421 1.00 0.00 N ATOM 1000 CA PRO A 63 21.020 6.599 9.003 1.00 0.00 C ATOM 1001 C PRO A 63 20.566 5.274 9.607 1.00 0.00 C ATOM 1002 O PRO A 63 20.406 4.280 8.898 1.00 0.00 O ATOM 1003 CB PRO A 63 22.404 6.981 9.534 1.00 0.00 C ATOM 1004 CG PRO A 63 22.132 7.887 10.685 1.00 0.00 C ATOM 1005 CD PRO A 63 20.879 8.639 10.332 1.00 0.00 C ATOM 0 HA PRO A 63 20.989 6.445 7.924 1.00 0.00 H new ATOM 0 HB2 PRO A 63 22.965 6.100 9.847 1.00 0.00 H new ATOM 0 HB3 PRO A 63 22.998 7.481 8.768 1.00 0.00 H new ATOM 0 HG2 PRO A 63 22.000 7.319 11.606 1.00 0.00 H new ATOM 0 HG3 PRO A 63 22.965 8.571 10.849 1.00 0.00 H new ATOM 0 HD2 PRO A 63 20.282 8.863 11.216 1.00 0.00 H new ATOM 0 HD3 PRO A 63 21.104 9.590 9.849 1.00 0.00 H new ATOM 1013 N SER A 64 20.358 5.268 10.920 1.00 0.00 N ATOM 1014 CA SER A 64 19.925 4.064 11.619 1.00 0.00 C ATOM 1015 C SER A 64 18.763 3.399 10.887 1.00 0.00 C ATOM 1016 O SER A 64 18.671 2.172 10.831 1.00 0.00 O ATOM 1017 CB SER A 64 19.513 4.402 13.053 1.00 0.00 C ATOM 1018 OG SER A 64 20.646 4.677 13.858 1.00 0.00 O ATOM 0 H SER A 64 20.482 6.083 11.521 1.00 0.00 H new ATOM 0 HA SER A 64 20.762 3.367 11.644 1.00 0.00 H new ATOM 0 HB2 SER A 64 18.847 5.265 13.050 1.00 0.00 H new ATOM 0 HB3 SER A 64 18.953 3.570 13.480 1.00 0.00 H new ATOM 0 HG SER A 64 20.356 4.892 14.769 1.00 0.00 H new ATOM 1024 N ARG A 65 17.878 4.218 10.329 1.00 0.00 N ATOM 1025 CA ARG A 65 16.721 3.710 9.601 1.00 0.00 C ATOM 1026 C ARG A 65 17.108 3.295 8.185 1.00 0.00 C ATOM 1027 O ARG A 65 16.700 2.238 7.703 1.00 0.00 O ATOM 1028 CB ARG A 65 15.619 4.770 9.550 1.00 0.00 C ATOM 1029 CG ARG A 65 14.701 4.753 10.762 1.00 0.00 C ATOM 1030 CD ARG A 65 13.803 3.526 10.763 1.00 0.00 C ATOM 1031 NE ARG A 65 12.651 3.689 9.881 1.00 0.00 N ATOM 1032 CZ ARG A 65 11.504 4.239 10.264 1.00 0.00 C ATOM 1033 NH1 ARG A 65 11.357 4.675 11.507 1.00 0.00 N ATOM 1034 NH2 ARG A 65 10.501 4.353 9.402 1.00 0.00 N ATOM 0 H ARG A 65 17.940 5.235 10.367 1.00 0.00 H new ATOM 0 HA ARG A 65 16.348 2.832 10.129 1.00 0.00 H new ATOM 0 HB2 ARG A 65 16.078 5.755 9.466 1.00 0.00 H new ATOM 0 HB3 ARG A 65 15.022 4.619 8.651 1.00 0.00 H new ATOM 0 HG2 ARG A 65 15.299 4.768 11.673 1.00 0.00 H new ATOM 0 HG3 ARG A 65 14.088 5.654 10.768 1.00 0.00 H new ATOM 0 HD2 ARG A 65 14.379 2.655 10.449 1.00 0.00 H new ATOM 0 HD3 ARG A 65 13.457 3.331 11.778 1.00 0.00 H new ATOM 0 HE ARG A 65 12.731 3.363 8.918 1.00 0.00 H new ATOM 0 HH11 ARG A 65 12.126 4.589 12.172 1.00 0.00 H new ATOM 0 HH12 ARG A 65 10.475 5.097 11.799 1.00 0.00 H new ATOM 0 HH21 ARG A 65 10.611 4.018 8.445 1.00 0.00 H new ATOM 0 HH22 ARG A 65 9.621 4.775 9.697 1.00 0.00 H new ATOM 1048 N VAL A 66 17.897 4.136 7.522 1.00 0.00 N ATOM 1049 CA VAL A 66 18.340 3.856 6.162 1.00 0.00 C ATOM 1050 C VAL A 66 18.531 2.360 5.942 1.00 0.00 C ATOM 1051 O VAL A 66 17.842 1.750 5.125 1.00 0.00 O ATOM 1052 CB VAL A 66 19.659 4.584 5.840 1.00 0.00 C ATOM 1053 CG1 VAL A 66 20.346 3.940 4.646 1.00 0.00 C ATOM 1054 CG2 VAL A 66 19.403 6.062 5.586 1.00 0.00 C ATOM 0 H VAL A 66 18.242 5.016 7.905 1.00 0.00 H new ATOM 0 HA VAL A 66 17.560 4.221 5.494 1.00 0.00 H new ATOM 0 HB VAL A 66 20.322 4.497 6.701 1.00 0.00 H new ATOM 0 HG11 VAL A 66 21.276 4.467 4.433 1.00 0.00 H new ATOM 0 HG12 VAL A 66 20.564 2.896 4.871 1.00 0.00 H new ATOM 0 HG13 VAL A 66 19.691 3.994 3.776 1.00 0.00 H new ATOM 0 HG21 VAL A 66 20.345 6.561 5.360 1.00 0.00 H new ATOM 0 HG22 VAL A 66 18.722 6.174 4.742 1.00 0.00 H new ATOM 0 HG23 VAL A 66 18.958 6.512 6.473 1.00 0.00 H new ATOM 1064 N GLN A 67 19.471 1.775 6.678 1.00 0.00 N ATOM 1065 CA GLN A 67 19.752 0.349 6.563 1.00 0.00 C ATOM 1066 C GLN A 67 18.509 -0.479 6.872 1.00 0.00 C ATOM 1067 O GLN A 67 18.126 -1.354 6.097 1.00 0.00 O ATOM 1068 CB GLN A 67 20.890 -0.046 7.507 1.00 0.00 C ATOM 1069 CG GLN A 67 20.484 -0.068 8.972 1.00 0.00 C ATOM 1070 CD GLN A 67 21.655 -0.336 9.898 1.00 0.00 C ATOM 1071 OE1 GLN A 67 22.425 -1.273 9.687 1.00 0.00 O ATOM 1072 NE2 GLN A 67 21.794 0.488 10.930 1.00 0.00 N ATOM 0 H GLN A 67 20.050 2.266 7.359 1.00 0.00 H new ATOM 0 HA GLN A 67 20.054 0.146 5.535 1.00 0.00 H new ATOM 0 HB2 GLN A 67 21.259 -1.032 7.226 1.00 0.00 H new ATOM 0 HB3 GLN A 67 21.717 0.652 7.378 1.00 0.00 H new ATOM 0 HG2 GLN A 67 20.030 0.888 9.234 1.00 0.00 H new ATOM 0 HG3 GLN A 67 19.723 -0.834 9.123 1.00 0.00 H new ATOM 0 HE21 GLN A 67 21.132 1.252 11.066 1.00 0.00 H new ATOM 0 HE22 GLN A 67 22.563 0.357 11.587 1.00 0.00 H new ATOM 1081 N GLU A 68 17.883 -0.195 8.011 1.00 0.00 N ATOM 1082 CA GLU A 68 16.684 -0.915 8.422 1.00 0.00 C ATOM 1083 C GLU A 68 15.712 -1.064 7.255 1.00 0.00 C ATOM 1084 O GLU A 68 15.451 -2.174 6.789 1.00 0.00 O ATOM 1085 CB GLU A 68 15.998 -0.188 9.581 1.00 0.00 C ATOM 1086 CG GLU A 68 16.710 -0.358 10.913 1.00 0.00 C ATOM 1087 CD GLU A 68 16.642 -1.781 11.432 1.00 0.00 C ATOM 1088 OE1 GLU A 68 17.316 -2.658 10.853 1.00 0.00 O ATOM 1089 OE2 GLU A 68 15.913 -2.017 12.419 1.00 0.00 O ATOM 0 H GLU A 68 18.186 0.528 8.664 1.00 0.00 H new ATOM 0 HA GLU A 68 16.984 -1.910 8.752 1.00 0.00 H new ATOM 0 HB2 GLU A 68 15.934 0.874 9.346 1.00 0.00 H new ATOM 0 HB3 GLU A 68 14.976 -0.555 9.675 1.00 0.00 H new ATOM 0 HG2 GLU A 68 17.754 -0.065 10.803 1.00 0.00 H new ATOM 0 HG3 GLU A 68 16.266 0.314 11.647 1.00 0.00 H new ATOM 1096 N ILE A 69 15.179 0.060 6.789 1.00 0.00 N ATOM 1097 CA ILE A 69 14.237 0.055 5.677 1.00 0.00 C ATOM 1098 C ILE A 69 14.747 -0.808 4.528 1.00 0.00 C ATOM 1099 O ILE A 69 13.996 -1.587 3.942 1.00 0.00 O ATOM 1100 CB ILE A 69 13.973 1.480 5.156 1.00 0.00 C ATOM 1101 CG1 ILE A 69 13.283 2.320 6.232 1.00 0.00 C ATOM 1102 CG2 ILE A 69 13.129 1.433 3.891 1.00 0.00 C ATOM 1103 CD1 ILE A 69 13.546 3.804 6.101 1.00 0.00 C ATOM 0 H ILE A 69 15.384 0.986 7.164 1.00 0.00 H new ATOM 0 HA ILE A 69 13.304 -0.363 6.056 1.00 0.00 H new ATOM 0 HB ILE A 69 14.928 1.946 4.915 1.00 0.00 H new ATOM 0 HG12 ILE A 69 12.208 2.144 6.185 1.00 0.00 H new ATOM 0 HG13 ILE A 69 13.618 1.985 7.214 1.00 0.00 H new ATOM 0 HG21 ILE A 69 12.951 2.448 3.535 1.00 0.00 H new ATOM 0 HG22 ILE A 69 13.655 0.866 3.123 1.00 0.00 H new ATOM 0 HG23 ILE A 69 12.175 0.952 4.108 1.00 0.00 H new ATOM 0 HD11 ILE A 69 13.026 4.337 6.897 1.00 0.00 H new ATOM 0 HD12 ILE A 69 14.617 3.992 6.178 1.00 0.00 H new ATOM 0 HD13 ILE A 69 13.185 4.153 5.134 1.00 0.00 H new ATOM 1115 N TRP A 70 16.030 -0.665 4.213 1.00 0.00 N ATOM 1116 CA TRP A 70 16.642 -1.433 3.135 1.00 0.00 C ATOM 1117 C TRP A 70 16.783 -2.901 3.524 1.00 0.00 C ATOM 1118 O TRP A 70 16.832 -3.778 2.662 1.00 0.00 O ATOM 1119 CB TRP A 70 18.012 -0.853 2.781 1.00 0.00 C ATOM 1120 CG TRP A 70 19.021 -1.896 2.408 1.00 0.00 C ATOM 1121 CD1 TRP A 70 19.724 -2.698 3.260 1.00 0.00 C ATOM 1122 CD2 TRP A 70 19.440 -2.249 1.085 1.00 0.00 C ATOM 1123 NE1 TRP A 70 20.556 -3.528 2.547 1.00 0.00 N ATOM 1124 CE2 TRP A 70 20.399 -3.272 1.210 1.00 0.00 C ATOM 1125 CE3 TRP A 70 19.096 -1.800 -0.194 1.00 0.00 C ATOM 1126 CZ2 TRP A 70 21.017 -3.852 0.105 1.00 0.00 C ATOM 1127 CZ3 TRP A 70 19.711 -2.377 -1.289 1.00 0.00 C ATOM 1128 CH2 TRP A 70 20.662 -3.394 -1.134 1.00 0.00 C ATOM 0 H TRP A 70 16.666 -0.025 4.689 1.00 0.00 H new ATOM 0 HA TRP A 70 15.992 -1.368 2.263 1.00 0.00 H new ATOM 0 HB2 TRP A 70 17.899 -0.154 1.952 1.00 0.00 H new ATOM 0 HB3 TRP A 70 18.387 -0.282 3.630 1.00 0.00 H new ATOM 0 HD1 TRP A 70 19.639 -2.683 4.337 1.00 0.00 H new ATOM 0 HE1 TRP A 70 21.187 -4.222 2.948 1.00 0.00 H new ATOM 0 HE3 TRP A 70 18.363 -1.017 -0.324 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 21.751 -4.636 0.222 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 19.454 -2.038 -2.282 1.00 0.00 H new ATOM 0 HH2 TRP A 70 21.124 -3.825 -2.010 1.00 0.00 H new ATOM 1139 N GLN A 71 16.847 -3.160 4.826 1.00 0.00 N ATOM 1140 CA GLN A 71 16.982 -4.522 5.328 1.00 0.00 C ATOM 1141 C GLN A 71 15.615 -5.169 5.524 1.00 0.00 C ATOM 1142 O GLN A 71 15.519 -6.338 5.893 1.00 0.00 O ATOM 1143 CB GLN A 71 17.756 -4.527 6.647 1.00 0.00 C ATOM 1144 CG GLN A 71 19.233 -4.204 6.487 1.00 0.00 C ATOM 1145 CD GLN A 71 20.087 -4.823 7.577 1.00 0.00 C ATOM 1146 OE1 GLN A 71 19.696 -4.856 8.744 1.00 0.00 O ATOM 1147 NE2 GLN A 71 21.260 -5.317 7.201 1.00 0.00 N ATOM 0 H GLN A 71 16.808 -2.445 5.552 1.00 0.00 H new ATOM 0 HA GLN A 71 17.534 -5.102 4.588 1.00 0.00 H new ATOM 0 HB2 GLN A 71 17.306 -3.803 7.326 1.00 0.00 H new ATOM 0 HB3 GLN A 71 17.655 -5.507 7.114 1.00 0.00 H new ATOM 0 HG2 GLN A 71 19.576 -4.560 5.516 1.00 0.00 H new ATOM 0 HG3 GLN A 71 19.368 -3.122 6.495 1.00 0.00 H new ATOM 0 HE21 GLN A 71 21.544 -5.268 6.223 1.00 0.00 H new ATOM 0 HE22 GLN A 71 21.878 -5.746 7.890 1.00 0.00 H new ATOM 1156 N GLU A 72 14.560 -4.399 5.274 1.00 0.00 N ATOM 1157 CA GLU A 72 13.199 -4.898 5.425 1.00 0.00 C ATOM 1158 C GLU A 72 12.648 -5.389 4.089 1.00 0.00 C ATOM 1159 O GLU A 72 12.085 -6.480 4.000 1.00 0.00 O ATOM 1160 CB GLU A 72 12.291 -3.804 5.992 1.00 0.00 C ATOM 1161 CG GLU A 72 10.827 -4.206 6.066 1.00 0.00 C ATOM 1162 CD GLU A 72 10.065 -3.437 7.127 1.00 0.00 C ATOM 1163 OE1 GLU A 72 10.131 -2.190 7.120 1.00 0.00 O ATOM 1164 OE2 GLU A 72 9.401 -4.083 7.965 1.00 0.00 O ATOM 0 H GLU A 72 14.622 -3.428 4.966 1.00 0.00 H new ATOM 0 HA GLU A 72 13.222 -5.738 6.120 1.00 0.00 H new ATOM 0 HB2 GLU A 72 12.637 -3.538 6.991 1.00 0.00 H new ATOM 0 HB3 GLU A 72 12.383 -2.911 5.374 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.359 -4.040 5.096 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.757 -5.273 6.275 1.00 0.00 H new ATOM 1171 N PHE A 73 12.815 -4.574 3.052 1.00 0.00 N ATOM 1172 CA PHE A 73 12.333 -4.924 1.721 1.00 0.00 C ATOM 1173 C PHE A 73 13.492 -5.024 0.732 1.00 0.00 C ATOM 1174 O PHE A 73 13.502 -5.889 -0.144 1.00 0.00 O ATOM 1175 CB PHE A 73 11.320 -3.886 1.233 1.00 0.00 C ATOM 1176 CG PHE A 73 10.508 -3.276 2.339 1.00 0.00 C ATOM 1177 CD1 PHE A 73 11.046 -2.287 3.147 1.00 0.00 C ATOM 1178 CD2 PHE A 73 9.206 -3.690 2.569 1.00 0.00 C ATOM 1179 CE1 PHE A 73 10.300 -1.724 4.166 1.00 0.00 C ATOM 1180 CE2 PHE A 73 8.455 -3.130 3.587 1.00 0.00 C ATOM 1181 CZ PHE A 73 9.003 -2.146 4.385 1.00 0.00 C ATOM 0 H PHE A 73 13.280 -3.668 3.108 1.00 0.00 H new ATOM 0 HA PHE A 73 11.845 -5.897 1.782 1.00 0.00 H new ATOM 0 HB2 PHE A 73 11.849 -3.095 0.703 1.00 0.00 H new ATOM 0 HB3 PHE A 73 10.647 -4.356 0.515 1.00 0.00 H new ATOM 0 HD1 PHE A 73 12.059 -1.952 2.979 1.00 0.00 H new ATOM 0 HD2 PHE A 73 8.772 -4.459 1.946 1.00 0.00 H new ATOM 0 HE1 PHE A 73 10.731 -0.955 4.790 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.442 -3.462 3.757 1.00 0.00 H new ATOM 0 HZ PHE A 73 8.418 -1.707 5.180 1.00 0.00 H new ATOM 1191 N LEU A 74 14.465 -4.132 0.879 1.00 0.00 N ATOM 1192 CA LEU A 74 15.629 -4.118 0.000 1.00 0.00 C ATOM 1193 C LEU A 74 16.672 -5.131 0.462 1.00 0.00 C ATOM 1194 O LEU A 74 17.838 -5.057 0.074 1.00 0.00 O ATOM 1195 CB LEU A 74 16.245 -2.718 -0.042 1.00 0.00 C ATOM 1196 CG LEU A 74 15.282 -1.571 -0.346 1.00 0.00 C ATOM 1197 CD1 LEU A 74 16.036 -0.254 -0.449 1.00 0.00 C ATOM 1198 CD2 LEU A 74 14.510 -1.847 -1.628 1.00 0.00 C ATOM 0 H LEU A 74 14.471 -3.409 1.598 1.00 0.00 H new ATOM 0 HA LEU A 74 15.300 -4.393 -1.002 1.00 0.00 H new ATOM 0 HB2 LEU A 74 16.719 -2.522 0.920 1.00 0.00 H new ATOM 0 HB3 LEU A 74 17.034 -2.712 -0.794 1.00 0.00 H new ATOM 0 HG LEU A 74 14.568 -1.495 0.474 1.00 0.00 H new ATOM 0 HD11 LEU A 74 15.334 0.551 -0.666 1.00 0.00 H new ATOM 0 HD12 LEU A 74 16.542 -0.050 0.494 1.00 0.00 H new ATOM 0 HD13 LEU A 74 16.773 -0.318 -1.250 1.00 0.00 H new ATOM 0 HD21 LEU A 74 13.829 -1.019 -1.828 1.00 0.00 H new ATOM 0 HD22 LEU A 74 15.209 -1.951 -2.458 1.00 0.00 H new ATOM 0 HD23 LEU A 74 13.938 -2.768 -1.517 1.00 0.00 H new ATOM 1210 N ALA A 75 16.244 -6.078 1.290 1.00 0.00 N ATOM 1211 CA ALA A 75 17.140 -7.108 1.801 1.00 0.00 C ATOM 1212 C ALA A 75 16.711 -8.493 1.327 1.00 0.00 C ATOM 1213 O ALA A 75 15.529 -8.764 1.116 1.00 0.00 O ATOM 1214 CB ALA A 75 17.187 -7.060 3.321 1.00 0.00 C ATOM 0 H ALA A 75 15.282 -6.153 1.621 1.00 0.00 H new ATOM 0 HA ALA A 75 18.139 -6.912 1.411 1.00 0.00 H new ATOM 0 HB1 ALA A 75 17.860 -7.835 3.689 1.00 0.00 H new ATOM 0 HB2 ALA A 75 17.548 -6.083 3.643 1.00 0.00 H new ATOM 0 HB3 ALA A 75 16.187 -7.228 3.721 1.00 0.00 H new ATOM 1220 N PRO A 76 17.693 -9.390 1.153 1.00 0.00 N ATOM 1221 CA PRO A 76 17.441 -10.761 0.701 1.00 0.00 C ATOM 1222 C PRO A 76 16.729 -11.599 1.758 1.00 0.00 C ATOM 1223 O PRO A 76 15.698 -12.213 1.487 1.00 0.00 O ATOM 1224 CB PRO A 76 18.845 -11.312 0.439 1.00 0.00 C ATOM 1225 CG PRO A 76 19.738 -10.506 1.317 1.00 0.00 C ATOM 1226 CD PRO A 76 19.124 -9.135 1.385 1.00 0.00 C ATOM 0 HA PRO A 76 16.787 -10.789 -0.171 1.00 0.00 H new ATOM 0 HB2 PRO A 76 18.905 -12.373 0.680 1.00 0.00 H new ATOM 0 HB3 PRO A 76 19.122 -11.208 -0.610 1.00 0.00 H new ATOM 0 HG2 PRO A 76 19.813 -10.950 2.310 1.00 0.00 H new ATOM 0 HG3 PRO A 76 20.748 -10.461 0.910 1.00 0.00 H new ATOM 0 HD2 PRO A 76 19.297 -8.665 2.353 1.00 0.00 H new ATOM 0 HD3 PRO A 76 19.541 -8.470 0.629 1.00 0.00 H new ATOM 1234 N GLY A 77 17.286 -11.618 2.966 1.00 0.00 N ATOM 1235 CA GLY A 77 16.691 -12.383 4.045 1.00 0.00 C ATOM 1236 C GLY A 77 15.673 -11.580 4.831 1.00 0.00 C ATOM 1237 O GLY A 77 15.605 -11.681 6.056 1.00 0.00 O ATOM 0 H GLY A 77 18.139 -11.117 3.216 1.00 0.00 H new ATOM 0 HA2 GLY A 77 16.210 -13.271 3.635 1.00 0.00 H new ATOM 0 HA3 GLY A 77 17.476 -12.727 4.718 1.00 0.00 H new ATOM 1241 N ALA A 78 14.880 -10.781 4.126 1.00 0.00 N ATOM 1242 CA ALA A 78 13.860 -9.958 4.765 1.00 0.00 C ATOM 1243 C ALA A 78 12.460 -10.472 4.445 1.00 0.00 C ATOM 1244 O ALA A 78 12.229 -11.119 3.423 1.00 0.00 O ATOM 1245 CB ALA A 78 14.004 -8.507 4.331 1.00 0.00 C ATOM 0 H ALA A 78 14.924 -10.686 3.111 1.00 0.00 H new ATOM 0 HA ALA A 78 14.003 -10.019 5.844 1.00 0.00 H new ATOM 0 HB1 ALA A 78 13.236 -7.904 4.816 1.00 0.00 H new ATOM 0 HB2 ALA A 78 14.989 -8.138 4.617 1.00 0.00 H new ATOM 0 HB3 ALA A 78 13.890 -8.438 3.249 1.00 0.00 H new ATOM 1251 N PRO A 79 11.503 -10.179 5.338 1.00 0.00 N ATOM 1252 CA PRO A 79 10.110 -10.602 5.172 1.00 0.00 C ATOM 1253 C PRO A 79 9.411 -9.864 4.035 1.00 0.00 C ATOM 1254 O PRO A 79 8.806 -10.483 3.159 1.00 0.00 O ATOM 1255 CB PRO A 79 9.468 -10.245 6.515 1.00 0.00 C ATOM 1256 CG PRO A 79 10.308 -9.138 7.053 1.00 0.00 C ATOM 1257 CD PRO A 79 11.708 -9.412 6.578 1.00 0.00 C ATOM 0 HA PRO A 79 10.033 -11.658 4.915 1.00 0.00 H new ATOM 0 HB2 PRO A 79 8.432 -9.930 6.388 1.00 0.00 H new ATOM 0 HB3 PRO A 79 9.460 -11.101 7.190 1.00 0.00 H new ATOM 0 HG2 PRO A 79 9.956 -8.171 6.693 1.00 0.00 H new ATOM 0 HG3 PRO A 79 10.264 -9.108 8.142 1.00 0.00 H new ATOM 0 HD2 PRO A 79 12.258 -8.489 6.393 1.00 0.00 H new ATOM 0 HD3 PRO A 79 12.278 -9.981 7.313 1.00 0.00 H new ATOM 1265 N SER A 80 9.500 -8.538 4.053 1.00 0.00 N ATOM 1266 CA SER A 80 8.873 -7.716 3.025 1.00 0.00 C ATOM 1267 C SER A 80 9.806 -7.534 1.832 1.00 0.00 C ATOM 1268 O SER A 80 9.621 -6.630 1.018 1.00 0.00 O ATOM 1269 CB SER A 80 8.488 -6.350 3.599 1.00 0.00 C ATOM 1270 OG SER A 80 7.907 -6.483 4.884 1.00 0.00 O ATOM 0 H SER A 80 10.000 -8.010 4.768 1.00 0.00 H new ATOM 0 HA SER A 80 7.972 -8.227 2.685 1.00 0.00 H new ATOM 0 HB2 SER A 80 9.372 -5.715 3.660 1.00 0.00 H new ATOM 0 HB3 SER A 80 7.786 -5.855 2.928 1.00 0.00 H new ATOM 0 HG SER A 80 7.730 -5.594 5.256 1.00 0.00 H new ATOM 1276 N ALA A 81 10.809 -8.400 1.736 1.00 0.00 N ATOM 1277 CA ALA A 81 11.770 -8.337 0.642 1.00 0.00 C ATOM 1278 C ALA A 81 11.068 -8.127 -0.695 1.00 0.00 C ATOM 1279 O ALA A 81 10.509 -9.063 -1.268 1.00 0.00 O ATOM 1280 CB ALA A 81 12.611 -9.605 0.604 1.00 0.00 C ATOM 0 H ALA A 81 10.977 -9.154 2.403 1.00 0.00 H new ATOM 0 HA ALA A 81 12.425 -7.484 0.817 1.00 0.00 H new ATOM 0 HB1 ALA A 81 13.324 -9.544 -0.218 1.00 0.00 H new ATOM 0 HB2 ALA A 81 13.150 -9.712 1.545 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.962 -10.468 0.457 1.00 0.00 H new ATOM 1286 N ILE A 82 11.099 -6.893 -1.187 1.00 0.00 N ATOM 1287 CA ILE A 82 10.465 -6.561 -2.457 1.00 0.00 C ATOM 1288 C ILE A 82 11.394 -6.856 -3.629 1.00 0.00 C ATOM 1289 O ILE A 82 12.507 -7.348 -3.444 1.00 0.00 O ATOM 1290 CB ILE A 82 10.048 -5.079 -2.507 1.00 0.00 C ATOM 1291 CG1 ILE A 82 11.268 -4.176 -2.316 1.00 0.00 C ATOM 1292 CG2 ILE A 82 8.996 -4.789 -1.447 1.00 0.00 C ATOM 1293 CD1 ILE A 82 11.141 -2.835 -3.004 1.00 0.00 C ATOM 0 H ILE A 82 11.556 -6.107 -0.725 1.00 0.00 H new ATOM 0 HA ILE A 82 9.574 -7.184 -2.537 1.00 0.00 H new ATOM 0 HB ILE A 82 9.616 -4.871 -3.486 1.00 0.00 H new ATOM 0 HG12 ILE A 82 11.427 -4.015 -1.250 1.00 0.00 H new ATOM 0 HG13 ILE A 82 12.152 -4.688 -2.696 1.00 0.00 H new ATOM 0 HG21 ILE A 82 8.711 -3.738 -1.495 1.00 0.00 H new ATOM 0 HG22 ILE A 82 8.119 -5.411 -1.625 1.00 0.00 H new ATOM 0 HG23 ILE A 82 9.403 -5.010 -0.460 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.042 -2.248 -2.826 1.00 0.00 H new ATOM 0 HD12 ILE A 82 11.013 -2.987 -4.076 1.00 0.00 H new ATOM 0 HD13 ILE A 82 10.277 -2.303 -2.607 1.00 0.00 H new ATOM 1305 N ASN A 83 10.931 -6.549 -4.836 1.00 0.00 N ATOM 1306 CA ASN A 83 11.722 -6.780 -6.040 1.00 0.00 C ATOM 1307 C ASN A 83 11.866 -5.496 -6.850 1.00 0.00 C ATOM 1308 O ASN A 83 10.901 -4.755 -7.038 1.00 0.00 O ATOM 1309 CB ASN A 83 11.075 -7.868 -6.899 1.00 0.00 C ATOM 1310 CG ASN A 83 11.946 -8.273 -8.072 1.00 0.00 C ATOM 1311 OD1 ASN A 83 12.593 -9.320 -8.047 1.00 0.00 O ATOM 1312 ND2 ASN A 83 11.967 -7.442 -9.108 1.00 0.00 N ATOM 0 H ASN A 83 10.012 -6.140 -5.007 1.00 0.00 H new ATOM 0 HA ASN A 83 12.715 -7.110 -5.735 1.00 0.00 H new ATOM 0 HB2 ASN A 83 10.873 -8.743 -6.281 1.00 0.00 H new ATOM 0 HB3 ASN A 83 10.114 -7.511 -7.270 1.00 0.00 H new ATOM 0 HD21 ASN A 83 12.535 -7.661 -9.926 1.00 0.00 H new ATOM 0 HD22 ASN A 83 11.415 -6.585 -9.085 1.00 0.00 H new ATOM 1319 N LEU A 84 13.079 -5.238 -7.328 1.00 0.00 N ATOM 1320 CA LEU A 84 13.351 -4.043 -8.120 1.00 0.00 C ATOM 1321 C LEU A 84 14.000 -4.408 -9.451 1.00 0.00 C ATOM 1322 O LEU A 84 14.377 -5.559 -9.675 1.00 0.00 O ATOM 1323 CB LEU A 84 14.258 -3.088 -7.342 1.00 0.00 C ATOM 1324 CG LEU A 84 13.594 -2.306 -6.208 1.00 0.00 C ATOM 1325 CD1 LEU A 84 14.636 -1.543 -5.404 1.00 0.00 C ATOM 1326 CD2 LEU A 84 12.543 -1.354 -6.761 1.00 0.00 C ATOM 0 H LEU A 84 13.889 -5.840 -7.181 1.00 0.00 H new ATOM 0 HA LEU A 84 12.402 -3.548 -8.324 1.00 0.00 H new ATOM 0 HB2 LEU A 84 15.084 -3.663 -6.925 1.00 0.00 H new ATOM 0 HB3 LEU A 84 14.689 -2.375 -8.045 1.00 0.00 H new ATOM 0 HG LEU A 84 13.100 -3.015 -5.544 1.00 0.00 H new ATOM 0 HD11 LEU A 84 14.145 -0.993 -4.602 1.00 0.00 H new ATOM 0 HD12 LEU A 84 15.352 -2.245 -4.977 1.00 0.00 H new ATOM 0 HD13 LEU A 84 15.159 -0.844 -6.057 1.00 0.00 H new ATOM 0 HD21 LEU A 84 12.081 -0.806 -5.940 1.00 0.00 H new ATOM 0 HD22 LEU A 84 13.014 -0.650 -7.447 1.00 0.00 H new ATOM 0 HD23 LEU A 84 11.780 -1.923 -7.292 1.00 0.00 H new ATOM 1338 N ASP A 85 14.129 -3.421 -10.330 1.00 0.00 N ATOM 1339 CA ASP A 85 14.736 -3.637 -11.639 1.00 0.00 C ATOM 1340 C ASP A 85 16.251 -3.772 -11.519 1.00 0.00 C ATOM 1341 O ASP A 85 16.880 -3.113 -10.691 1.00 0.00 O ATOM 1342 CB ASP A 85 14.387 -2.486 -12.583 1.00 0.00 C ATOM 1343 CG ASP A 85 14.692 -2.812 -14.032 1.00 0.00 C ATOM 1344 OD1 ASP A 85 13.827 -3.416 -14.699 1.00 0.00 O ATOM 1345 OD2 ASP A 85 15.797 -2.463 -14.498 1.00 0.00 O ATOM 0 H ASP A 85 13.822 -2.463 -10.161 1.00 0.00 H new ATOM 0 HA ASP A 85 14.338 -4.565 -12.049 1.00 0.00 H new ATOM 0 HB2 ASP A 85 13.328 -2.246 -12.483 1.00 0.00 H new ATOM 0 HB3 ASP A 85 14.945 -1.597 -12.289 1.00 0.00 H new ATOM 1350 N SER A 86 16.831 -4.630 -12.352 1.00 0.00 N ATOM 1351 CA SER A 86 18.272 -4.855 -12.337 1.00 0.00 C ATOM 1352 C SER A 86 19.028 -3.531 -12.265 1.00 0.00 C ATOM 1353 O SER A 86 20.028 -3.411 -11.557 1.00 0.00 O ATOM 1354 CB SER A 86 18.701 -5.633 -13.582 1.00 0.00 C ATOM 1355 OG SER A 86 18.345 -4.940 -14.765 1.00 0.00 O ATOM 0 H SER A 86 16.325 -5.181 -13.046 1.00 0.00 H new ATOM 0 HA SER A 86 18.514 -5.441 -11.450 1.00 0.00 H new ATOM 0 HB2 SER A 86 19.779 -5.793 -13.561 1.00 0.00 H new ATOM 0 HB3 SER A 86 18.233 -6.617 -13.579 1.00 0.00 H new ATOM 0 HG SER A 86 18.632 -5.458 -15.546 1.00 0.00 H new ATOM 1361 N LYS A 87 18.542 -2.539 -13.004 1.00 0.00 N ATOM 1362 CA LYS A 87 19.169 -1.223 -13.024 1.00 0.00 C ATOM 1363 C LYS A 87 18.921 -0.482 -11.715 1.00 0.00 C ATOM 1364 O LYS A 87 19.861 -0.138 -10.998 1.00 0.00 O ATOM 1365 CB LYS A 87 18.633 -0.399 -14.198 1.00 0.00 C ATOM 1366 CG LYS A 87 18.879 1.093 -14.056 1.00 0.00 C ATOM 1367 CD LYS A 87 18.836 1.796 -15.402 1.00 0.00 C ATOM 1368 CE LYS A 87 19.024 3.298 -15.253 1.00 0.00 C ATOM 1369 NZ LYS A 87 20.428 3.649 -14.905 1.00 0.00 N ATOM 0 H LYS A 87 17.716 -2.622 -13.597 1.00 0.00 H new ATOM 0 HA LYS A 87 20.243 -1.361 -13.144 1.00 0.00 H new ATOM 0 HB2 LYS A 87 19.098 -0.749 -15.119 1.00 0.00 H new ATOM 0 HB3 LYS A 87 17.562 -0.575 -14.295 1.00 0.00 H new ATOM 0 HG2 LYS A 87 18.128 1.525 -13.395 1.00 0.00 H new ATOM 0 HG3 LYS A 87 19.849 1.260 -13.588 1.00 0.00 H new ATOM 0 HD2 LYS A 87 19.615 1.393 -16.049 1.00 0.00 H new ATOM 0 HD3 LYS A 87 17.882 1.594 -15.889 1.00 0.00 H new ATOM 0 HE2 LYS A 87 18.746 3.793 -16.183 1.00 0.00 H new ATOM 0 HE3 LYS A 87 18.354 3.673 -14.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 20.519 4.682 -14.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 20.680 3.211 -13.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 21.067 3.299 -15.647 1.00 0.00 H new ATOM 1383 N SER A 88 17.651 -0.240 -11.408 1.00 0.00 N ATOM 1384 CA SER A 88 17.281 0.463 -10.184 1.00 0.00 C ATOM 1385 C SER A 88 17.970 -0.156 -8.972 1.00 0.00 C ATOM 1386 O SER A 88 18.727 0.511 -8.267 1.00 0.00 O ATOM 1387 CB SER A 88 15.763 0.432 -9.993 1.00 0.00 C ATOM 1388 OG SER A 88 15.113 1.263 -10.939 1.00 0.00 O ATOM 0 H SER A 88 16.861 -0.520 -11.989 1.00 0.00 H new ATOM 0 HA SER A 88 17.608 1.499 -10.276 1.00 0.00 H new ATOM 0 HB2 SER A 88 15.401 -0.591 -10.094 1.00 0.00 H new ATOM 0 HB3 SER A 88 15.513 0.760 -8.984 1.00 0.00 H new ATOM 0 HG SER A 88 14.144 1.225 -10.797 1.00 0.00 H new ATOM 1394 N TYR A 89 17.702 -1.436 -8.737 1.00 0.00 N ATOM 1395 CA TYR A 89 18.294 -2.145 -7.609 1.00 0.00 C ATOM 1396 C TYR A 89 19.786 -1.846 -7.499 1.00 0.00 C ATOM 1397 O TYR A 89 20.282 -1.494 -6.429 1.00 0.00 O ATOM 1398 CB TYR A 89 18.075 -3.652 -7.756 1.00 0.00 C ATOM 1399 CG TYR A 89 18.378 -4.434 -6.498 1.00 0.00 C ATOM 1400 CD1 TYR A 89 17.456 -4.503 -5.460 1.00 0.00 C ATOM 1401 CD2 TYR A 89 19.587 -5.102 -6.346 1.00 0.00 C ATOM 1402 CE1 TYR A 89 17.729 -5.215 -4.308 1.00 0.00 C ATOM 1403 CE2 TYR A 89 19.867 -5.818 -5.198 1.00 0.00 C ATOM 1404 CZ TYR A 89 18.936 -5.871 -4.182 1.00 0.00 C ATOM 1405 OH TYR A 89 19.213 -6.582 -3.037 1.00 0.00 O ATOM 0 H TYR A 89 17.079 -2.003 -9.312 1.00 0.00 H new ATOM 0 HA TYR A 89 17.805 -1.799 -6.698 1.00 0.00 H new ATOM 0 HB2 TYR A 89 17.040 -3.834 -8.046 1.00 0.00 H new ATOM 0 HB3 TYR A 89 18.703 -4.025 -8.565 1.00 0.00 H new ATOM 0 HD1 TYR A 89 16.510 -3.991 -5.556 1.00 0.00 H new ATOM 0 HD2 TYR A 89 20.320 -5.061 -7.138 1.00 0.00 H new ATOM 0 HE1 TYR A 89 17.002 -5.258 -3.511 1.00 0.00 H new ATOM 0 HE2 TYR A 89 20.810 -6.334 -5.097 1.00 0.00 H new ATOM 0 HH TYR A 89 20.104 -6.984 -3.109 1.00 0.00 H new ATOM 1415 N ASP A 90 20.495 -1.987 -8.614 1.00 0.00 N ATOM 1416 CA ASP A 90 21.930 -1.730 -8.645 1.00 0.00 C ATOM 1417 C ASP A 90 22.252 -0.373 -8.027 1.00 0.00 C ATOM 1418 O ASP A 90 23.033 -0.279 -7.080 1.00 0.00 O ATOM 1419 CB ASP A 90 22.448 -1.786 -10.083 1.00 0.00 C ATOM 1420 CG ASP A 90 23.908 -2.189 -10.156 1.00 0.00 C ATOM 1421 OD1 ASP A 90 24.294 -3.148 -9.456 1.00 0.00 O ATOM 1422 OD2 ASP A 90 24.664 -1.546 -10.914 1.00 0.00 O ATOM 0 H ASP A 90 20.099 -2.278 -9.508 1.00 0.00 H new ATOM 0 HA ASP A 90 22.426 -2.503 -8.058 1.00 0.00 H new ATOM 0 HB2 ASP A 90 21.849 -2.495 -10.655 1.00 0.00 H new ATOM 0 HB3 ASP A 90 22.319 -0.810 -10.551 1.00 0.00 H new ATOM 1427 N LYS A 91 21.647 0.678 -8.571 1.00 0.00 N ATOM 1428 CA LYS A 91 21.869 2.031 -8.074 1.00 0.00 C ATOM 1429 C LYS A 91 21.581 2.115 -6.578 1.00 0.00 C ATOM 1430 O LYS A 91 22.454 2.474 -5.786 1.00 0.00 O ATOM 1431 CB LYS A 91 20.986 3.025 -8.831 1.00 0.00 C ATOM 1432 CG LYS A 91 21.225 4.473 -8.438 1.00 0.00 C ATOM 1433 CD LYS A 91 22.594 4.954 -8.892 1.00 0.00 C ATOM 1434 CE LYS A 91 22.601 6.454 -9.145 1.00 0.00 C ATOM 1435 NZ LYS A 91 23.826 6.887 -9.872 1.00 0.00 N ATOM 0 H LYS A 91 20.999 0.619 -9.356 1.00 0.00 H new ATOM 0 HA LYS A 91 22.916 2.285 -8.239 1.00 0.00 H new ATOM 0 HB2 LYS A 91 21.163 2.914 -9.901 1.00 0.00 H new ATOM 0 HB3 LYS A 91 19.940 2.777 -8.653 1.00 0.00 H new ATOM 0 HG2 LYS A 91 20.452 5.103 -8.878 1.00 0.00 H new ATOM 0 HG3 LYS A 91 21.142 4.576 -7.356 1.00 0.00 H new ATOM 0 HD2 LYS A 91 23.337 4.708 -8.134 1.00 0.00 H new ATOM 0 HD3 LYS A 91 22.882 4.429 -9.803 1.00 0.00 H new ATOM 0 HE2 LYS A 91 21.719 6.729 -9.723 1.00 0.00 H new ATOM 0 HE3 LYS A 91 22.537 6.983 -8.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 23.793 7.915 -10.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 24.667 6.647 -9.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 23.875 6.401 -10.790 1.00 0.00 H new ATOM 1449 N THR A 92 20.352 1.781 -6.197 1.00 0.00 N ATOM 1450 CA THR A 92 19.950 1.819 -4.796 1.00 0.00 C ATOM 1451 C THR A 92 20.966 1.106 -3.913 1.00 0.00 C ATOM 1452 O THR A 92 21.545 1.704 -3.005 1.00 0.00 O ATOM 1453 CB THR A 92 18.566 1.173 -4.592 1.00 0.00 C ATOM 1454 OG1 THR A 92 17.611 1.771 -5.476 1.00 0.00 O ATOM 1455 CG2 THR A 92 18.102 1.334 -3.152 1.00 0.00 C ATOM 0 H THR A 92 19.618 1.481 -6.839 1.00 0.00 H new ATOM 0 HA THR A 92 19.899 2.870 -4.510 1.00 0.00 H new ATOM 0 HB THR A 92 18.649 0.109 -4.814 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.124 1.068 -5.955 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.123 0.871 -3.031 1.00 0.00 H new ATOM 0 HG22 THR A 92 18.816 0.853 -2.484 1.00 0.00 H new ATOM 0 HG23 THR A 92 18.034 2.394 -2.908 1.00 0.00 H new ATOM 1463 N THR A 93 21.181 -0.178 -4.184 1.00 0.00 N ATOM 1464 CA THR A 93 22.128 -0.974 -3.413 1.00 0.00 C ATOM 1465 C THR A 93 23.348 -0.148 -3.020 1.00 0.00 C ATOM 1466 O THR A 93 23.715 -0.083 -1.846 1.00 0.00 O ATOM 1467 CB THR A 93 22.593 -2.213 -4.200 1.00 0.00 C ATOM 1468 OG1 THR A 93 21.458 -2.962 -4.649 1.00 0.00 O ATOM 1469 CG2 THR A 93 23.484 -3.098 -3.341 1.00 0.00 C ATOM 0 H THR A 93 20.712 -0.689 -4.932 1.00 0.00 H new ATOM 0 HA THR A 93 21.607 -1.300 -2.513 1.00 0.00 H new ATOM 0 HB THR A 93 23.168 -1.874 -5.061 1.00 0.00 H new ATOM 0 HG1 THR A 93 21.164 -2.620 -5.519 1.00 0.00 H new ATOM 0 HG21 THR A 93 23.800 -3.967 -3.919 1.00 0.00 H new ATOM 0 HG22 THR A 93 24.362 -2.534 -3.025 1.00 0.00 H new ATOM 0 HG23 THR A 93 22.930 -3.429 -2.462 1.00 0.00 H new ATOM 1477 N HIS A 94 23.974 0.482 -4.009 1.00 0.00 N ATOM 1478 CA HIS A 94 25.153 1.305 -3.766 1.00 0.00 C ATOM 1479 C HIS A 94 24.795 2.536 -2.938 1.00 0.00 C ATOM 1480 O HIS A 94 25.388 2.783 -1.889 1.00 0.00 O ATOM 1481 CB HIS A 94 25.784 1.733 -5.091 1.00 0.00 C ATOM 1482 CG HIS A 94 26.705 2.908 -4.964 1.00 0.00 C ATOM 1483 ND1 HIS A 94 27.955 2.826 -4.387 1.00 0.00 N ATOM 1484 CD2 HIS A 94 26.552 4.198 -5.346 1.00 0.00 C ATOM 1485 CE1 HIS A 94 28.530 4.015 -4.418 1.00 0.00 C ATOM 1486 NE2 HIS A 94 27.700 4.865 -4.995 1.00 0.00 N ATOM 0 H HIS A 94 23.684 0.438 -4.986 1.00 0.00 H new ATOM 0 HA HIS A 94 25.873 0.709 -3.205 1.00 0.00 H new ATOM 0 HB2 HIS A 94 26.337 0.892 -5.509 1.00 0.00 H new ATOM 0 HB3 HIS A 94 24.992 1.977 -5.799 1.00 0.00 H new ATOM 0 HD2 HIS A 94 25.688 4.623 -5.835 1.00 0.00 H new ATOM 0 HE1 HIS A 94 29.512 4.252 -4.036 1.00 0.00 H new ATOM 0 HE2 HIS A 94 27.882 5.856 -5.154 1.00 0.00 H new ATOM 1494 N ASN A 95 23.823 3.304 -3.418 1.00 0.00 N ATOM 1495 CA ASN A 95 23.387 4.509 -2.723 1.00 0.00 C ATOM 1496 C ASN A 95 23.235 4.250 -1.227 1.00 0.00 C ATOM 1497 O ASN A 95 23.683 5.044 -0.400 1.00 0.00 O ATOM 1498 CB ASN A 95 22.062 5.007 -3.303 1.00 0.00 C ATOM 1499 CG ASN A 95 22.244 5.736 -4.620 1.00 0.00 C ATOM 1500 OD1 ASN A 95 22.931 5.253 -5.520 1.00 0.00 O ATOM 1501 ND2 ASN A 95 21.629 6.907 -4.738 1.00 0.00 N ATOM 0 H ASN A 95 23.322 3.113 -4.286 1.00 0.00 H new ATOM 0 HA ASN A 95 24.149 5.275 -2.865 1.00 0.00 H new ATOM 0 HB2 ASN A 95 21.392 4.160 -3.450 1.00 0.00 H new ATOM 0 HB3 ASN A 95 21.582 5.673 -2.586 1.00 0.00 H new ATOM 0 HD21 ASN A 95 21.716 7.444 -5.601 1.00 0.00 H new ATOM 0 HD22 ASN A 95 21.069 7.269 -3.966 1.00 0.00 H new ATOM 1508 N VAL A 96 22.601 3.132 -0.888 1.00 0.00 N ATOM 1509 CA VAL A 96 22.391 2.767 0.508 1.00 0.00 C ATOM 1510 C VAL A 96 23.651 3.002 1.333 1.00 0.00 C ATOM 1511 O VAL A 96 23.595 3.569 2.425 1.00 0.00 O ATOM 1512 CB VAL A 96 21.969 1.292 0.644 1.00 0.00 C ATOM 1513 CG1 VAL A 96 21.797 0.918 2.109 1.00 0.00 C ATOM 1514 CG2 VAL A 96 20.689 1.030 -0.135 1.00 0.00 C ATOM 0 H VAL A 96 22.224 2.464 -1.560 1.00 0.00 H new ATOM 0 HA VAL A 96 21.590 3.403 0.885 1.00 0.00 H new ATOM 0 HB VAL A 96 22.757 0.667 0.224 1.00 0.00 H new ATOM 0 HG11 VAL A 96 21.499 -0.128 2.185 1.00 0.00 H new ATOM 0 HG12 VAL A 96 22.740 1.066 2.635 1.00 0.00 H new ATOM 0 HG13 VAL A 96 21.029 1.548 2.558 1.00 0.00 H new ATOM 0 HG21 VAL A 96 20.406 -0.017 -0.028 1.00 0.00 H new ATOM 0 HG22 VAL A 96 19.891 1.663 0.253 1.00 0.00 H new ATOM 0 HG23 VAL A 96 20.852 1.256 -1.189 1.00 0.00 H new ATOM 1524 N LYS A 97 24.788 2.562 0.805 1.00 0.00 N ATOM 1525 CA LYS A 97 26.065 2.726 1.490 1.00 0.00 C ATOM 1526 C LYS A 97 26.100 4.037 2.268 1.00 0.00 C ATOM 1527 O LYS A 97 26.501 4.068 3.431 1.00 0.00 O ATOM 1528 CB LYS A 97 27.216 2.686 0.483 1.00 0.00 C ATOM 1529 CG LYS A 97 27.282 1.396 -0.316 1.00 0.00 C ATOM 1530 CD LYS A 97 28.012 0.304 0.447 1.00 0.00 C ATOM 1531 CE LYS A 97 27.717 -1.072 -0.129 1.00 0.00 C ATOM 1532 NZ LYS A 97 26.427 -1.619 0.375 1.00 0.00 N ATOM 0 H LYS A 97 24.851 2.089 -0.096 1.00 0.00 H new ATOM 0 HA LYS A 97 26.180 1.903 2.195 1.00 0.00 H new ATOM 0 HB2 LYS A 97 27.114 3.525 -0.205 1.00 0.00 H new ATOM 0 HB3 LYS A 97 28.158 2.822 1.015 1.00 0.00 H new ATOM 0 HG2 LYS A 97 26.272 1.062 -0.554 1.00 0.00 H new ATOM 0 HG3 LYS A 97 27.788 1.580 -1.264 1.00 0.00 H new ATOM 0 HD2 LYS A 97 29.085 0.491 0.414 1.00 0.00 H new ATOM 0 HD3 LYS A 97 27.716 0.332 1.496 1.00 0.00 H new ATOM 0 HE2 LYS A 97 27.685 -1.011 -1.217 1.00 0.00 H new ATOM 0 HE3 LYS A 97 28.527 -1.755 0.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 26.262 -2.558 -0.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 26.466 -1.701 1.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 25.651 -0.981 0.107 1.00 0.00 H new ATOM 1546 N GLU A 98 25.677 5.117 1.619 1.00 0.00 N ATOM 1547 CA GLU A 98 25.661 6.431 2.252 1.00 0.00 C ATOM 1548 C GLU A 98 24.261 6.777 2.752 1.00 0.00 C ATOM 1549 O GLU A 98 23.311 6.901 1.978 1.00 0.00 O ATOM 1550 CB GLU A 98 26.142 7.501 1.269 1.00 0.00 C ATOM 1551 CG GLU A 98 25.401 7.487 -0.057 1.00 0.00 C ATOM 1552 CD GLU A 98 25.879 8.571 -1.004 1.00 0.00 C ATOM 1553 OE1 GLU A 98 25.392 9.715 -0.891 1.00 0.00 O ATOM 1554 OE2 GLU A 98 26.741 8.274 -1.858 1.00 0.00 O ATOM 0 H GLU A 98 25.341 5.108 0.656 1.00 0.00 H new ATOM 0 HA GLU A 98 26.337 6.403 3.107 1.00 0.00 H new ATOM 0 HB2 GLU A 98 26.028 8.483 1.729 1.00 0.00 H new ATOM 0 HB3 GLU A 98 27.206 7.359 1.082 1.00 0.00 H new ATOM 0 HG2 GLU A 98 25.529 6.514 -0.530 1.00 0.00 H new ATOM 0 HG3 GLU A 98 24.334 7.614 0.126 1.00 0.00 H new ATOM 1561 N PRO A 99 24.129 6.935 4.077 1.00 0.00 N ATOM 1562 CA PRO A 99 22.850 7.268 4.711 1.00 0.00 C ATOM 1563 C PRO A 99 22.401 8.691 4.398 1.00 0.00 C ATOM 1564 O PRO A 99 23.189 9.633 4.478 1.00 0.00 O ATOM 1565 CB PRO A 99 23.145 7.117 6.205 1.00 0.00 C ATOM 1566 CG PRO A 99 24.613 7.338 6.326 1.00 0.00 C ATOM 1567 CD PRO A 99 25.218 6.801 5.059 1.00 0.00 C ATOM 0 HA PRO A 99 22.041 6.630 4.356 1.00 0.00 H new ATOM 0 HB2 PRO A 99 22.586 7.843 6.794 1.00 0.00 H new ATOM 0 HB3 PRO A 99 22.863 6.128 6.566 1.00 0.00 H new ATOM 0 HG2 PRO A 99 24.839 8.397 6.448 1.00 0.00 H new ATOM 0 HG3 PRO A 99 25.015 6.823 7.199 1.00 0.00 H new ATOM 0 HD2 PRO A 99 26.099 7.370 4.762 1.00 0.00 H new ATOM 0 HD3 PRO A 99 25.532 5.763 5.172 1.00 0.00 H new ATOM 1575 N GLY A 100 21.129 8.841 4.040 1.00 0.00 N ATOM 1576 CA GLY A 100 20.598 10.153 3.720 1.00 0.00 C ATOM 1577 C GLY A 100 19.085 10.203 3.807 1.00 0.00 C ATOM 1578 O GLY A 100 18.467 9.368 4.468 1.00 0.00 O ATOM 0 H GLY A 100 20.457 8.077 3.966 1.00 0.00 H new ATOM 0 HA2 GLY A 100 21.023 10.890 4.402 1.00 0.00 H new ATOM 0 HA3 GLY A 100 20.910 10.433 2.714 1.00 0.00 H new ATOM 1582 N ARG A 101 18.488 11.185 3.140 1.00 0.00 N ATOM 1583 CA ARG A 101 17.038 11.342 3.148 1.00 0.00 C ATOM 1584 C ARG A 101 16.438 10.915 1.811 1.00 0.00 C ATOM 1585 O ARG A 101 15.363 10.318 1.765 1.00 0.00 O ATOM 1586 CB ARG A 101 16.663 12.795 3.447 1.00 0.00 C ATOM 1587 CG ARG A 101 16.955 13.217 4.878 1.00 0.00 C ATOM 1588 CD ARG A 101 16.526 14.653 5.133 1.00 0.00 C ATOM 1589 NE ARG A 101 16.349 14.926 6.557 1.00 0.00 N ATOM 1590 CZ ARG A 101 15.915 16.088 7.034 1.00 0.00 C ATOM 1591 NH1 ARG A 101 15.615 17.078 6.205 1.00 0.00 N ATOM 1592 NH2 ARG A 101 15.780 16.260 8.343 1.00 0.00 N ATOM 0 H ARG A 101 18.985 11.884 2.588 1.00 0.00 H new ATOM 0 HA ARG A 101 16.632 10.701 3.930 1.00 0.00 H new ATOM 0 HB2 ARG A 101 17.207 13.449 2.766 1.00 0.00 H new ATOM 0 HB3 ARG A 101 15.601 12.936 3.245 1.00 0.00 H new ATOM 0 HG2 ARG A 101 16.435 12.553 5.568 1.00 0.00 H new ATOM 0 HG3 ARG A 101 18.021 13.113 5.079 1.00 0.00 H new ATOM 0 HD2 ARG A 101 17.273 15.333 4.724 1.00 0.00 H new ATOM 0 HD3 ARG A 101 15.592 14.851 4.607 1.00 0.00 H new ATOM 0 HE ARG A 101 16.571 14.184 7.221 1.00 0.00 H new ATOM 0 HH11 ARG A 101 15.717 16.949 5.198 1.00 0.00 H new ATOM 0 HH12 ARG A 101 15.282 17.969 6.574 1.00 0.00 H new ATOM 0 HH21 ARG A 101 16.009 15.500 8.984 1.00 0.00 H new ATOM 0 HH22 ARG A 101 15.447 17.152 8.708 1.00 0.00 H new ATOM 1606 N TYR A 102 17.140 11.226 0.728 1.00 0.00 N ATOM 1607 CA TYR A 102 16.676 10.878 -0.610 1.00 0.00 C ATOM 1608 C TYR A 102 17.464 9.698 -1.170 1.00 0.00 C ATOM 1609 O TYR A 102 17.466 9.453 -2.377 1.00 0.00 O ATOM 1610 CB TYR A 102 16.802 12.081 -1.546 1.00 0.00 C ATOM 1611 CG TYR A 102 16.016 13.289 -1.089 1.00 0.00 C ATOM 1612 CD1 TYR A 102 14.629 13.251 -1.012 1.00 0.00 C ATOM 1613 CD2 TYR A 102 16.659 14.468 -0.735 1.00 0.00 C ATOM 1614 CE1 TYR A 102 13.906 14.352 -0.596 1.00 0.00 C ATOM 1615 CE2 TYR A 102 15.945 15.574 -0.316 1.00 0.00 C ATOM 1616 CZ TYR A 102 14.569 15.511 -0.249 1.00 0.00 C ATOM 1617 OH TYR A 102 13.852 16.610 0.167 1.00 0.00 O ATOM 0 H TYR A 102 18.033 11.719 0.750 1.00 0.00 H new ATOM 0 HA TYR A 102 15.627 10.590 -0.540 1.00 0.00 H new ATOM 0 HB2 TYR A 102 17.854 12.354 -1.633 1.00 0.00 H new ATOM 0 HB3 TYR A 102 16.464 11.793 -2.541 1.00 0.00 H new ATOM 0 HD1 TYR A 102 14.107 12.345 -1.282 1.00 0.00 H new ATOM 0 HD2 TYR A 102 17.736 14.521 -0.788 1.00 0.00 H new ATOM 0 HE1 TYR A 102 12.828 14.306 -0.543 1.00 0.00 H new ATOM 0 HE2 TYR A 102 16.461 16.482 -0.043 1.00 0.00 H new ATOM 0 HH TYR A 102 14.468 17.343 0.375 1.00 0.00 H new ATOM 1627 N THR A 103 18.134 8.968 -0.284 1.00 0.00 N ATOM 1628 CA THR A 103 18.927 7.814 -0.688 1.00 0.00 C ATOM 1629 C THR A 103 18.093 6.831 -1.501 1.00 0.00 C ATOM 1630 O THR A 103 18.517 6.369 -2.561 1.00 0.00 O ATOM 1631 CB THR A 103 19.517 7.082 0.533 1.00 0.00 C ATOM 1632 OG1 THR A 103 20.350 7.973 1.283 1.00 0.00 O ATOM 1633 CG2 THR A 103 20.325 5.869 0.098 1.00 0.00 C ATOM 0 H THR A 103 18.143 9.156 0.719 1.00 0.00 H new ATOM 0 HA THR A 103 19.742 8.192 -1.305 1.00 0.00 H new ATOM 0 HB THR A 103 18.692 6.743 1.160 1.00 0.00 H new ATOM 0 HG1 THR A 103 21.221 7.552 1.440 1.00 0.00 H new ATOM 0 HG21 THR A 103 20.732 5.368 0.977 1.00 0.00 H new ATOM 0 HG22 THR A 103 19.681 5.179 -0.447 1.00 0.00 H new ATOM 0 HG23 THR A 103 21.143 6.189 -0.548 1.00 0.00 H new ATOM 1641 N PHE A 104 16.903 6.515 -1.000 1.00 0.00 N ATOM 1642 CA PHE A 104 16.009 5.586 -1.680 1.00 0.00 C ATOM 1643 C PHE A 104 14.973 6.338 -2.511 1.00 0.00 C ATOM 1644 O PHE A 104 13.946 5.779 -2.893 1.00 0.00 O ATOM 1645 CB PHE A 104 15.306 4.684 -0.664 1.00 0.00 C ATOM 1646 CG PHE A 104 16.244 4.052 0.325 1.00 0.00 C ATOM 1647 CD1 PHE A 104 16.892 2.865 0.024 1.00 0.00 C ATOM 1648 CD2 PHE A 104 16.476 4.644 1.556 1.00 0.00 C ATOM 1649 CE1 PHE A 104 17.756 2.281 0.932 1.00 0.00 C ATOM 1650 CE2 PHE A 104 17.338 4.065 2.468 1.00 0.00 C ATOM 1651 CZ PHE A 104 17.978 2.881 2.155 1.00 0.00 C ATOM 0 H PHE A 104 16.536 6.889 -0.125 1.00 0.00 H new ATOM 0 HA PHE A 104 16.608 4.969 -2.349 1.00 0.00 H new ATOM 0 HB2 PHE A 104 14.562 5.269 -0.124 1.00 0.00 H new ATOM 0 HB3 PHE A 104 14.769 3.899 -1.197 1.00 0.00 H new ATOM 0 HD1 PHE A 104 16.720 2.390 -0.931 1.00 0.00 H new ATOM 0 HD2 PHE A 104 15.977 5.569 1.806 1.00 0.00 H new ATOM 0 HE1 PHE A 104 18.256 1.357 0.685 1.00 0.00 H new ATOM 0 HE2 PHE A 104 17.511 4.537 3.424 1.00 0.00 H new ATOM 0 HZ PHE A 104 18.651 2.426 2.866 1.00 0.00 H new ATOM 1661 N GLU A 105 15.253 7.608 -2.786 1.00 0.00 N ATOM 1662 CA GLU A 105 14.344 8.437 -3.569 1.00 0.00 C ATOM 1663 C GLU A 105 13.941 7.731 -4.861 1.00 0.00 C ATOM 1664 O GLU A 105 12.762 7.684 -5.213 1.00 0.00 O ATOM 1665 CB GLU A 105 14.998 9.782 -3.894 1.00 0.00 C ATOM 1666 CG GLU A 105 14.129 10.691 -4.748 1.00 0.00 C ATOM 1667 CD GLU A 105 13.192 11.549 -3.920 1.00 0.00 C ATOM 1668 OE1 GLU A 105 12.097 11.063 -3.568 1.00 0.00 O ATOM 1669 OE2 GLU A 105 13.555 12.706 -3.624 1.00 0.00 O ATOM 0 H GLU A 105 16.101 8.085 -2.479 1.00 0.00 H new ATOM 0 HA GLU A 105 13.447 8.610 -2.974 1.00 0.00 H new ATOM 0 HB2 GLU A 105 15.239 10.294 -2.962 1.00 0.00 H new ATOM 0 HB3 GLU A 105 15.940 9.603 -4.412 1.00 0.00 H new ATOM 0 HG2 GLU A 105 14.768 11.336 -5.352 1.00 0.00 H new ATOM 0 HG3 GLU A 105 13.544 10.084 -5.439 1.00 0.00 H new ATOM 1676 N ASP A 106 14.928 7.183 -5.562 1.00 0.00 N ATOM 1677 CA ASP A 106 14.677 6.479 -6.814 1.00 0.00 C ATOM 1678 C ASP A 106 13.846 5.222 -6.573 1.00 0.00 C ATOM 1679 O ASP A 106 12.749 5.079 -7.112 1.00 0.00 O ATOM 1680 CB ASP A 106 15.998 6.110 -7.490 1.00 0.00 C ATOM 1681 CG ASP A 106 16.790 7.330 -7.917 1.00 0.00 C ATOM 1682 OD1 ASP A 106 17.527 7.885 -7.075 1.00 0.00 O ATOM 1683 OD2 ASP A 106 16.674 7.730 -9.094 1.00 0.00 O ATOM 0 H ASP A 106 15.909 7.213 -5.284 1.00 0.00 H new ATOM 0 HA ASP A 106 14.116 7.144 -7.470 1.00 0.00 H new ATOM 0 HB2 ASP A 106 16.599 5.512 -6.805 1.00 0.00 H new ATOM 0 HB3 ASP A 106 15.795 5.488 -8.362 1.00 0.00 H new ATOM 1688 N ALA A 107 14.378 4.314 -5.761 1.00 0.00 N ATOM 1689 CA ALA A 107 13.685 3.070 -5.449 1.00 0.00 C ATOM 1690 C ALA A 107 12.258 3.338 -4.983 1.00 0.00 C ATOM 1691 O ALA A 107 11.298 2.886 -5.605 1.00 0.00 O ATOM 1692 CB ALA A 107 14.451 2.292 -4.389 1.00 0.00 C ATOM 0 H ALA A 107 15.286 4.417 -5.308 1.00 0.00 H new ATOM 0 HA ALA A 107 13.635 2.472 -6.359 1.00 0.00 H new ATOM 0 HB1 ALA A 107 13.923 1.365 -4.165 1.00 0.00 H new ATOM 0 HB2 ALA A 107 15.450 2.060 -4.759 1.00 0.00 H new ATOM 0 HB3 ALA A 107 14.530 2.893 -3.483 1.00 0.00 H new ATOM 1698 N GLN A 108 12.128 4.076 -3.884 1.00 0.00 N ATOM 1699 CA GLN A 108 10.818 4.402 -3.335 1.00 0.00 C ATOM 1700 C GLN A 108 9.851 4.814 -4.440 1.00 0.00 C ATOM 1701 O GLN A 108 8.711 4.354 -4.483 1.00 0.00 O ATOM 1702 CB GLN A 108 10.939 5.525 -2.303 1.00 0.00 C ATOM 1703 CG GLN A 108 9.601 5.997 -1.758 1.00 0.00 C ATOM 1704 CD GLN A 108 9.694 7.346 -1.072 1.00 0.00 C ATOM 1705 OE1 GLN A 108 10.542 8.171 -1.412 1.00 0.00 O ATOM 1706 NE2 GLN A 108 8.818 7.578 -0.101 1.00 0.00 N ATOM 0 H GLN A 108 12.914 4.459 -3.358 1.00 0.00 H new ATOM 0 HA GLN A 108 10.425 3.510 -2.847 1.00 0.00 H new ATOM 0 HB2 GLN A 108 11.558 5.181 -1.475 1.00 0.00 H new ATOM 0 HB3 GLN A 108 11.456 6.371 -2.757 1.00 0.00 H new ATOM 0 HG2 GLN A 108 8.881 6.058 -2.574 1.00 0.00 H new ATOM 0 HG3 GLN A 108 9.220 5.260 -1.051 1.00 0.00 H new ATOM 0 HE21 GLN A 108 8.132 6.865 0.148 1.00 0.00 H new ATOM 0 HE22 GLN A 108 8.831 8.469 0.396 1.00 0.00 H new ATOM 1715 N GLU A 109 10.315 5.683 -5.333 1.00 0.00 N ATOM 1716 CA GLU A 109 9.490 6.157 -6.437 1.00 0.00 C ATOM 1717 C GLU A 109 9.153 5.016 -7.393 1.00 0.00 C ATOM 1718 O GLU A 109 7.985 4.769 -7.695 1.00 0.00 O ATOM 1719 CB GLU A 109 10.208 7.277 -7.195 1.00 0.00 C ATOM 1720 CG GLU A 109 9.643 7.531 -8.583 1.00 0.00 C ATOM 1721 CD GLU A 109 10.285 8.725 -9.263 1.00 0.00 C ATOM 1722 OE1 GLU A 109 11.441 9.053 -8.922 1.00 0.00 O ATOM 1723 OE2 GLU A 109 9.630 9.331 -10.138 1.00 0.00 O ATOM 0 H GLU A 109 11.257 6.073 -5.313 1.00 0.00 H new ATOM 0 HA GLU A 109 8.561 6.547 -6.022 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.146 8.196 -6.613 1.00 0.00 H new ATOM 0 HB3 GLU A 109 11.265 7.026 -7.282 1.00 0.00 H new ATOM 0 HG2 GLU A 109 9.790 6.644 -9.199 1.00 0.00 H new ATOM 0 HG3 GLU A 109 8.568 7.694 -8.510 1.00 0.00 H new ATOM 1730 N HIS A 110 10.185 4.325 -7.867 1.00 0.00 N ATOM 1731 CA HIS A 110 9.999 3.210 -8.789 1.00 0.00 C ATOM 1732 C HIS A 110 8.777 2.383 -8.402 1.00 0.00 C ATOM 1733 O HIS A 110 7.958 2.032 -9.252 1.00 0.00 O ATOM 1734 CB HIS A 110 11.244 2.323 -8.807 1.00 0.00 C ATOM 1735 CG HIS A 110 11.116 1.128 -9.701 1.00 0.00 C ATOM 1736 ND1 HIS A 110 11.100 1.217 -11.078 1.00 0.00 N ATOM 1737 CD2 HIS A 110 10.998 -0.188 -9.409 1.00 0.00 C ATOM 1738 CE1 HIS A 110 10.977 0.006 -11.593 1.00 0.00 C ATOM 1739 NE2 HIS A 110 10.913 -0.864 -10.601 1.00 0.00 N ATOM 0 H HIS A 110 11.158 4.517 -7.628 1.00 0.00 H new ATOM 0 HA HIS A 110 9.838 3.619 -9.787 1.00 0.00 H new ATOM 0 HB2 HIS A 110 12.099 2.918 -9.129 1.00 0.00 H new ATOM 0 HB3 HIS A 110 11.455 1.986 -7.792 1.00 0.00 H new ATOM 0 HD2 HIS A 110 10.975 -0.625 -8.422 1.00 0.00 H new ATOM 0 HE1 HIS A 110 10.936 -0.232 -12.646 1.00 0.00 H new ATOM 0 HE2 HIS A 110 10.816 -1.874 -10.704 1.00 0.00 H new ATOM 1747 N ILE A 111 8.661 2.074 -7.115 1.00 0.00 N ATOM 1748 CA ILE A 111 7.538 1.289 -6.616 1.00 0.00 C ATOM 1749 C ILE A 111 6.220 2.031 -6.808 1.00 0.00 C ATOM 1750 O ILE A 111 5.194 1.426 -7.118 1.00 0.00 O ATOM 1751 CB ILE A 111 7.709 0.946 -5.124 1.00 0.00 C ATOM 1752 CG1 ILE A 111 8.978 0.118 -4.911 1.00 0.00 C ATOM 1753 CG2 ILE A 111 6.489 0.198 -4.609 1.00 0.00 C ATOM 1754 CD1 ILE A 111 9.037 -1.128 -5.766 1.00 0.00 C ATOM 0 H ILE A 111 9.331 2.355 -6.399 1.00 0.00 H new ATOM 0 HA ILE A 111 7.519 0.364 -7.193 1.00 0.00 H new ATOM 0 HB ILE A 111 7.805 1.875 -4.562 1.00 0.00 H new ATOM 0 HG12 ILE A 111 9.848 0.739 -5.127 1.00 0.00 H new ATOM 0 HG13 ILE A 111 9.044 -0.168 -3.861 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.625 -0.037 -3.553 1.00 0.00 H new ATOM 0 HG22 ILE A 111 5.602 0.820 -4.731 1.00 0.00 H new ATOM 0 HG23 ILE A 111 6.364 -0.726 -5.173 1.00 0.00 H new ATOM 0 HD11 ILE A 111 9.963 -1.665 -5.563 1.00 0.00 H new ATOM 0 HD12 ILE A 111 8.187 -1.769 -5.534 1.00 0.00 H new ATOM 0 HD13 ILE A 111 9.003 -0.849 -6.819 1.00 0.00 H new ATOM 1766 N TYR A 112 6.256 3.346 -6.623 1.00 0.00 N ATOM 1767 CA TYR A 112 5.063 4.172 -6.774 1.00 0.00 C ATOM 1768 C TYR A 112 4.489 4.046 -8.182 1.00 0.00 C ATOM 1769 O TYR A 112 3.323 3.694 -8.361 1.00 0.00 O ATOM 1770 CB TYR A 112 5.390 5.636 -6.474 1.00 0.00 C ATOM 1771 CG TYR A 112 4.272 6.590 -6.828 1.00 0.00 C ATOM 1772 CD1 TYR A 112 3.961 6.867 -8.154 1.00 0.00 C ATOM 1773 CD2 TYR A 112 3.526 7.215 -5.837 1.00 0.00 C ATOM 1774 CE1 TYR A 112 2.941 7.739 -8.482 1.00 0.00 C ATOM 1775 CE2 TYR A 112 2.503 8.088 -6.155 1.00 0.00 C ATOM 1776 CZ TYR A 112 2.215 8.346 -7.479 1.00 0.00 C ATOM 1777 OH TYR A 112 1.197 9.215 -7.801 1.00 0.00 O ATOM 0 H TYR A 112 7.098 3.863 -6.368 1.00 0.00 H new ATOM 0 HA TYR A 112 4.315 3.820 -6.063 1.00 0.00 H new ATOM 0 HB2 TYR A 112 5.622 5.738 -5.414 1.00 0.00 H new ATOM 0 HB3 TYR A 112 6.287 5.920 -7.025 1.00 0.00 H new ATOM 0 HD1 TYR A 112 4.527 6.392 -8.942 1.00 0.00 H new ATOM 0 HD2 TYR A 112 3.749 7.015 -4.799 1.00 0.00 H new ATOM 0 HE1 TYR A 112 2.714 7.944 -9.518 1.00 0.00 H new ATOM 0 HE2 TYR A 112 1.933 8.565 -5.372 1.00 0.00 H new ATOM 0 HH TYR A 112 0.785 9.555 -6.979 1.00 0.00 H new ATOM 1787 N LYS A 113 5.317 4.335 -9.180 1.00 0.00 N ATOM 1788 CA LYS A 113 4.895 4.253 -10.573 1.00 0.00 C ATOM 1789 C LYS A 113 4.426 2.842 -10.918 1.00 0.00 C ATOM 1790 O LYS A 113 3.838 2.614 -11.976 1.00 0.00 O ATOM 1791 CB LYS A 113 6.042 4.661 -11.500 1.00 0.00 C ATOM 1792 CG LYS A 113 6.446 6.118 -11.363 1.00 0.00 C ATOM 1793 CD LYS A 113 7.737 6.268 -10.576 1.00 0.00 C ATOM 1794 CE LYS A 113 8.936 5.780 -11.374 1.00 0.00 C ATOM 1795 NZ LYS A 113 9.563 6.878 -12.161 1.00 0.00 N ATOM 0 H LYS A 113 6.285 4.628 -9.050 1.00 0.00 H new ATOM 0 HA LYS A 113 4.060 4.939 -10.714 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.907 4.032 -11.292 1.00 0.00 H new ATOM 0 HB3 LYS A 113 5.749 4.469 -12.532 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.570 6.557 -12.353 1.00 0.00 H new ATOM 0 HG3 LYS A 113 5.650 6.672 -10.866 1.00 0.00 H new ATOM 0 HD2 LYS A 113 7.880 7.314 -10.306 1.00 0.00 H new ATOM 0 HD3 LYS A 113 7.665 5.705 -9.645 1.00 0.00 H new ATOM 0 HE2 LYS A 113 9.674 5.352 -10.695 1.00 0.00 H new ATOM 0 HE3 LYS A 113 8.623 4.983 -12.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 10.548 6.628 -12.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 9.034 7.017 -13.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 9.545 7.757 -11.606 1.00 0.00 H new ATOM 1809 N LEU A 114 4.689 1.901 -10.018 1.00 0.00 N ATOM 1810 CA LEU A 114 4.292 0.512 -10.226 1.00 0.00 C ATOM 1811 C LEU A 114 2.929 0.236 -9.599 1.00 0.00 C ATOM 1812 O LEU A 114 1.935 0.062 -10.303 1.00 0.00 O ATOM 1813 CB LEU A 114 5.340 -0.432 -9.634 1.00 0.00 C ATOM 1814 CG LEU A 114 4.894 -1.879 -9.419 1.00 0.00 C ATOM 1815 CD1 LEU A 114 5.360 -2.757 -10.570 1.00 0.00 C ATOM 1816 CD2 LEU A 114 5.422 -2.408 -8.094 1.00 0.00 C ATOM 0 H LEU A 114 5.175 2.074 -9.138 1.00 0.00 H new ATOM 0 HA LEU A 114 4.219 0.337 -11.299 1.00 0.00 H new ATOM 0 HB2 LEU A 114 6.210 -0.435 -10.291 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.665 -0.027 -8.676 1.00 0.00 H new ATOM 0 HG LEU A 114 3.805 -1.903 -9.389 1.00 0.00 H new ATOM 0 HD11 LEU A 114 5.034 -3.783 -10.400 1.00 0.00 H new ATOM 0 HD12 LEU A 114 4.933 -2.390 -11.503 1.00 0.00 H new ATOM 0 HD13 LEU A 114 6.448 -2.728 -10.633 1.00 0.00 H new ATOM 0 HD21 LEU A 114 5.095 -3.439 -7.958 1.00 0.00 H new ATOM 0 HD22 LEU A 114 6.511 -2.370 -8.095 1.00 0.00 H new ATOM 0 HD23 LEU A 114 5.038 -1.795 -7.279 1.00 0.00 H new ATOM 1828 N MET A 115 2.892 0.197 -8.271 1.00 0.00 N ATOM 1829 CA MET A 115 1.650 -0.055 -7.549 1.00 0.00 C ATOM 1830 C MET A 115 0.501 0.754 -8.144 1.00 0.00 C ATOM 1831 O MET A 115 -0.624 0.265 -8.255 1.00 0.00 O ATOM 1832 CB MET A 115 1.817 0.289 -6.068 1.00 0.00 C ATOM 1833 CG MET A 115 2.994 -0.413 -5.410 1.00 0.00 C ATOM 1834 SD MET A 115 3.281 0.147 -3.721 1.00 0.00 S ATOM 1835 CE MET A 115 3.218 1.924 -3.937 1.00 0.00 C ATOM 0 H MET A 115 3.707 0.337 -7.673 1.00 0.00 H new ATOM 0 HA MET A 115 1.413 -1.115 -7.644 1.00 0.00 H new ATOM 0 HB2 MET A 115 1.944 1.367 -5.966 1.00 0.00 H new ATOM 0 HB3 MET A 115 0.903 0.024 -5.537 1.00 0.00 H new ATOM 0 HG2 MET A 115 2.815 -1.488 -5.407 1.00 0.00 H new ATOM 0 HG3 MET A 115 3.892 -0.241 -6.003 1.00 0.00 H new ATOM 0 HE1 MET A 115 4.033 2.387 -3.381 1.00 0.00 H new ATOM 0 HE2 MET A 115 3.317 2.166 -4.995 1.00 0.00 H new ATOM 0 HE3 MET A 115 2.265 2.302 -3.566 1.00 0.00 H new ATOM 1845 N LYS A 116 0.791 1.993 -8.527 1.00 0.00 N ATOM 1846 CA LYS A 116 -0.216 2.869 -9.112 1.00 0.00 C ATOM 1847 C LYS A 116 -1.047 2.125 -10.152 1.00 0.00 C ATOM 1848 O LYS A 116 -2.276 2.195 -10.146 1.00 0.00 O ATOM 1849 CB LYS A 116 0.449 4.089 -9.752 1.00 0.00 C ATOM 1850 CG LYS A 116 1.305 3.751 -10.960 1.00 0.00 C ATOM 1851 CD LYS A 116 1.861 5.003 -11.618 1.00 0.00 C ATOM 1852 CE LYS A 116 0.852 5.627 -12.570 1.00 0.00 C ATOM 1853 NZ LYS A 116 0.973 5.073 -13.947 1.00 0.00 N ATOM 0 H LYS A 116 1.717 2.413 -8.442 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.879 3.202 -8.314 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.323 4.798 -10.051 1.00 0.00 H new ATOM 0 HB3 LYS A 116 1.068 4.588 -9.006 1.00 0.00 H new ATOM 0 HG2 LYS A 116 2.127 3.104 -10.655 1.00 0.00 H new ATOM 0 HG3 LYS A 116 0.711 3.192 -11.683 1.00 0.00 H new ATOM 0 HD2 LYS A 116 2.135 5.727 -10.851 1.00 0.00 H new ATOM 0 HD3 LYS A 116 2.772 4.755 -12.163 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -0.157 5.453 -12.196 1.00 0.00 H new ATOM 0 HE3 LYS A 116 0.999 6.707 -12.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 0.269 5.523 -14.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 1.927 5.262 -14.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 0.808 4.047 -13.924 1.00 0.00 H new ATOM 1867 N SER A 117 -0.367 1.411 -11.045 1.00 0.00 N ATOM 1868 CA SER A 117 -1.043 0.656 -12.093 1.00 0.00 C ATOM 1869 C SER A 117 -0.782 -0.839 -11.940 1.00 0.00 C ATOM 1870 O SER A 117 -1.057 -1.625 -12.846 1.00 0.00 O ATOM 1871 CB SER A 117 -0.576 1.127 -13.472 1.00 0.00 C ATOM 1872 OG SER A 117 0.489 0.325 -13.952 1.00 0.00 O ATOM 0 H SER A 117 0.650 1.340 -11.063 1.00 0.00 H new ATOM 0 HA SER A 117 -2.115 0.832 -12.000 1.00 0.00 H new ATOM 0 HB2 SER A 117 -1.409 1.089 -14.174 1.00 0.00 H new ATOM 0 HB3 SER A 117 -0.255 2.167 -13.415 1.00 0.00 H new ATOM 0 HG SER A 117 0.768 0.646 -14.835 1.00 0.00 H new ATOM 1878 N ASP A 118 -0.249 -1.225 -10.785 1.00 0.00 N ATOM 1879 CA ASP A 118 0.048 -2.626 -10.510 1.00 0.00 C ATOM 1880 C ASP A 118 -0.982 -3.223 -9.557 1.00 0.00 C ATOM 1881 O ASP A 118 -1.722 -4.137 -9.921 1.00 0.00 O ATOM 1882 CB ASP A 118 1.451 -2.764 -9.917 1.00 0.00 C ATOM 1883 CG ASP A 118 2.506 -3.016 -10.976 1.00 0.00 C ATOM 1884 OD1 ASP A 118 2.679 -2.148 -11.858 1.00 0.00 O ATOM 1885 OD2 ASP A 118 3.157 -4.080 -10.925 1.00 0.00 O ATOM 0 H ASP A 118 -0.014 -0.587 -10.025 1.00 0.00 H new ATOM 0 HA ASP A 118 0.004 -3.173 -11.452 1.00 0.00 H new ATOM 0 HB2 ASP A 118 1.701 -1.856 -9.368 1.00 0.00 H new ATOM 0 HB3 ASP A 118 1.459 -3.583 -9.198 1.00 0.00 H new ATOM 1890 N SER A 119 -1.023 -2.701 -8.335 1.00 0.00 N ATOM 1891 CA SER A 119 -1.959 -3.187 -7.328 1.00 0.00 C ATOM 1892 C SER A 119 -3.234 -2.349 -7.323 1.00 0.00 C ATOM 1893 O SER A 119 -4.340 -2.881 -7.424 1.00 0.00 O ATOM 1894 CB SER A 119 -1.310 -3.157 -5.942 1.00 0.00 C ATOM 1895 OG SER A 119 -0.325 -4.168 -5.819 1.00 0.00 O ATOM 0 H SER A 119 -0.419 -1.942 -8.019 1.00 0.00 H new ATOM 0 HA SER A 119 -2.221 -4.215 -7.577 1.00 0.00 H new ATOM 0 HB2 SER A 119 -0.857 -2.181 -5.770 1.00 0.00 H new ATOM 0 HB3 SER A 119 -2.074 -3.294 -5.176 1.00 0.00 H new ATOM 0 HG SER A 119 -0.726 -4.968 -5.420 1.00 0.00 H new ATOM 1901 N TYR A 120 -3.071 -1.036 -7.204 1.00 0.00 N ATOM 1902 CA TYR A 120 -4.208 -0.124 -7.183 1.00 0.00 C ATOM 1903 C TYR A 120 -5.319 -0.617 -8.105 1.00 0.00 C ATOM 1904 O TYR A 120 -6.483 -0.720 -7.718 1.00 0.00 O ATOM 1905 CB TYR A 120 -3.770 1.281 -7.599 1.00 0.00 C ATOM 1906 CG TYR A 120 -4.444 2.383 -6.814 1.00 0.00 C ATOM 1907 CD1 TYR A 120 -4.186 2.557 -5.460 1.00 0.00 C ATOM 1908 CD2 TYR A 120 -5.339 3.252 -7.427 1.00 0.00 C ATOM 1909 CE1 TYR A 120 -4.800 3.563 -4.740 1.00 0.00 C ATOM 1910 CE2 TYR A 120 -5.957 4.261 -6.715 1.00 0.00 C ATOM 1911 CZ TYR A 120 -5.685 4.412 -5.371 1.00 0.00 C ATOM 1912 OH TYR A 120 -6.298 5.416 -4.657 1.00 0.00 O ATOM 0 H TYR A 120 -2.163 -0.580 -7.121 1.00 0.00 H new ATOM 0 HA TYR A 120 -4.595 -0.090 -6.164 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -2.690 1.367 -7.476 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -3.982 1.420 -8.659 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -3.494 1.894 -4.962 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -5.555 3.136 -8.479 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -4.588 3.684 -3.688 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -6.649 4.928 -7.207 1.00 0.00 H new ATOM 0 HH TYR A 120 -6.762 6.019 -5.274 1.00 0.00 H new ATOM 1922 N PRO A 121 -4.952 -0.929 -9.357 1.00 0.00 N ATOM 1923 CA PRO A 121 -5.901 -1.418 -10.362 1.00 0.00 C ATOM 1924 C PRO A 121 -6.788 -2.537 -9.826 1.00 0.00 C ATOM 1925 O PRO A 121 -8.014 -2.456 -9.893 1.00 0.00 O ATOM 1926 CB PRO A 121 -4.996 -1.941 -11.480 1.00 0.00 C ATOM 1927 CG PRO A 121 -3.733 -1.164 -11.340 1.00 0.00 C ATOM 1928 CD PRO A 121 -3.582 -0.831 -9.887 1.00 0.00 C ATOM 0 HA PRO A 121 -6.591 -0.638 -10.684 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -4.816 -3.011 -11.376 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -5.448 -1.788 -12.460 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -2.881 -1.746 -11.693 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -3.770 -0.256 -11.942 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -2.909 -1.527 -9.386 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -3.170 0.168 -9.747 1.00 0.00 H new ATOM 1936 N ARG A 122 -6.159 -3.581 -9.295 1.00 0.00 N ATOM 1937 CA ARG A 122 -6.892 -4.717 -8.749 1.00 0.00 C ATOM 1938 C ARG A 122 -7.877 -4.263 -7.676 1.00 0.00 C ATOM 1939 O ARG A 122 -8.961 -4.829 -7.534 1.00 0.00 O ATOM 1940 CB ARG A 122 -5.920 -5.743 -8.163 1.00 0.00 C ATOM 1941 CG ARG A 122 -4.957 -6.323 -9.186 1.00 0.00 C ATOM 1942 CD ARG A 122 -4.241 -7.550 -8.643 1.00 0.00 C ATOM 1943 NE ARG A 122 -5.155 -8.668 -8.428 1.00 0.00 N ATOM 1944 CZ ARG A 122 -5.001 -9.569 -7.464 1.00 0.00 C ATOM 1945 NH1 ARG A 122 -3.973 -9.484 -6.631 1.00 0.00 N ATOM 1946 NH2 ARG A 122 -5.876 -10.558 -7.332 1.00 0.00 N ATOM 0 H ARG A 122 -5.144 -3.663 -9.231 1.00 0.00 H new ATOM 0 HA ARG A 122 -7.453 -5.180 -9.561 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -5.348 -5.273 -7.363 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -6.490 -6.555 -7.712 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -5.503 -6.590 -10.091 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -4.224 -5.567 -9.467 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -3.459 -7.851 -9.340 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -3.751 -7.297 -7.703 1.00 0.00 H new ATOM 0 HE ARG A 122 -5.956 -8.763 -9.052 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -3.298 -8.726 -6.729 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -3.857 -10.177 -5.892 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -6.668 -10.627 -7.971 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -5.757 -11.249 -6.591 1.00 0.00 H new ATOM 1960 N PHE A 123 -7.493 -3.237 -6.923 1.00 0.00 N ATOM 1961 CA PHE A 123 -8.342 -2.708 -5.861 1.00 0.00 C ATOM 1962 C PHE A 123 -9.729 -2.365 -6.395 1.00 0.00 C ATOM 1963 O PHE A 123 -10.743 -2.752 -5.814 1.00 0.00 O ATOM 1964 CB PHE A 123 -7.701 -1.466 -5.238 1.00 0.00 C ATOM 1965 CG PHE A 123 -8.354 -1.034 -3.957 1.00 0.00 C ATOM 1966 CD1 PHE A 123 -8.627 -1.955 -2.958 1.00 0.00 C ATOM 1967 CD2 PHE A 123 -8.696 0.293 -3.751 1.00 0.00 C ATOM 1968 CE1 PHE A 123 -9.227 -1.560 -1.777 1.00 0.00 C ATOM 1969 CE2 PHE A 123 -9.296 0.694 -2.572 1.00 0.00 C ATOM 1970 CZ PHE A 123 -9.563 -0.234 -1.585 1.00 0.00 C ATOM 0 H PHE A 123 -6.600 -2.756 -7.028 1.00 0.00 H new ATOM 0 HA PHE A 123 -8.446 -3.477 -5.096 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -6.646 -1.667 -5.049 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -7.746 -0.646 -5.954 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -8.368 -2.993 -3.104 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -8.491 1.022 -4.521 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -9.433 -2.287 -1.005 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -9.556 1.732 -2.423 1.00 0.00 H new ATOM 0 HZ PHE A 123 -10.034 0.077 -0.664 1.00 0.00 H new ATOM 1980 N ILE A 124 -9.766 -1.634 -7.505 1.00 0.00 N ATOM 1981 CA ILE A 124 -11.028 -1.239 -8.117 1.00 0.00 C ATOM 1982 C ILE A 124 -11.835 -2.458 -8.551 1.00 0.00 C ATOM 1983 O ILE A 124 -13.000 -2.606 -8.184 1.00 0.00 O ATOM 1984 CB ILE A 124 -10.800 -0.327 -9.338 1.00 0.00 C ATOM 1985 CG1 ILE A 124 -10.149 0.988 -8.905 1.00 0.00 C ATOM 1986 CG2 ILE A 124 -12.116 -0.063 -10.054 1.00 0.00 C ATOM 1987 CD1 ILE A 124 -8.637 0.939 -8.895 1.00 0.00 C ATOM 0 H ILE A 124 -8.936 -1.304 -7.998 1.00 0.00 H new ATOM 0 HA ILE A 124 -11.586 -0.688 -7.360 1.00 0.00 H new ATOM 0 HB ILE A 124 -10.127 -0.832 -10.031 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -10.474 1.783 -9.576 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -10.503 1.248 -7.907 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -11.939 0.583 -10.914 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -12.543 -1.008 -10.391 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -12.810 0.426 -9.371 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -8.244 1.905 -8.578 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -8.303 0.166 -8.203 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -8.274 0.710 -9.897 1.00 0.00 H new ATOM 1999 N ARG A 125 -11.205 -3.330 -9.332 1.00 0.00 N ATOM 2000 CA ARG A 125 -11.864 -4.537 -9.815 1.00 0.00 C ATOM 2001 C ARG A 125 -12.489 -5.314 -8.660 1.00 0.00 C ATOM 2002 O ARG A 125 -13.638 -5.750 -8.742 1.00 0.00 O ATOM 2003 CB ARG A 125 -10.866 -5.425 -10.560 1.00 0.00 C ATOM 2004 CG ARG A 125 -9.786 -4.645 -11.293 1.00 0.00 C ATOM 2005 CD ARG A 125 -9.305 -5.389 -12.529 1.00 0.00 C ATOM 2006 NE ARG A 125 -7.883 -5.167 -12.782 1.00 0.00 N ATOM 2007 CZ ARG A 125 -7.229 -5.695 -13.810 1.00 0.00 C ATOM 2008 NH1 ARG A 125 -7.864 -6.471 -14.677 1.00 0.00 N ATOM 2009 NH2 ARG A 125 -5.935 -5.447 -13.973 1.00 0.00 N ATOM 0 H ARG A 125 -10.240 -3.223 -9.643 1.00 0.00 H new ATOM 0 HA ARG A 125 -12.657 -4.239 -10.501 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -10.394 -6.102 -9.849 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -11.407 -6.042 -11.277 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -10.174 -3.668 -11.583 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -8.945 -4.468 -10.623 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -9.489 -6.456 -12.404 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -9.882 -5.065 -13.395 1.00 0.00 H new ATOM 0 HE ARG A 125 -7.365 -4.574 -12.134 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -8.858 -6.664 -14.556 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -7.358 -6.875 -15.465 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -5.442 -4.850 -13.308 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -5.433 -5.853 -14.763 1.00 0.00 H new ATOM 2023 N SER A 126 -11.725 -5.485 -7.586 1.00 0.00 N ATOM 2024 CA SER A 126 -12.202 -6.214 -6.417 1.00 0.00 C ATOM 2025 C SER A 126 -13.441 -5.545 -5.828 1.00 0.00 C ATOM 2026 O SER A 126 -13.641 -4.340 -5.982 1.00 0.00 O ATOM 2027 CB SER A 126 -11.101 -6.297 -5.358 1.00 0.00 C ATOM 2028 OG SER A 126 -11.018 -5.095 -4.613 1.00 0.00 O ATOM 0 H SER A 126 -10.773 -5.129 -7.501 1.00 0.00 H new ATOM 0 HA SER A 126 -12.470 -7.222 -6.732 1.00 0.00 H new ATOM 0 HB2 SER A 126 -11.301 -7.132 -4.686 1.00 0.00 H new ATOM 0 HB3 SER A 126 -10.144 -6.497 -5.839 1.00 0.00 H new ATOM 0 HG SER A 126 -10.902 -4.338 -5.225 1.00 0.00 H new ATOM 2034 N SER A 127 -14.268 -6.336 -5.152 1.00 0.00 N ATOM 2035 CA SER A 127 -15.489 -5.822 -4.543 1.00 0.00 C ATOM 2036 C SER A 127 -15.171 -5.000 -3.297 1.00 0.00 C ATOM 2037 O SER A 127 -15.759 -3.944 -3.071 1.00 0.00 O ATOM 2038 CB SER A 127 -16.427 -6.975 -4.181 1.00 0.00 C ATOM 2039 OG SER A 127 -17.249 -7.328 -5.280 1.00 0.00 O ATOM 0 H SER A 127 -14.115 -7.335 -5.012 1.00 0.00 H new ATOM 0 HA SER A 127 -15.983 -5.174 -5.268 1.00 0.00 H new ATOM 0 HB2 SER A 127 -15.842 -7.840 -3.868 1.00 0.00 H new ATOM 0 HB3 SER A 127 -17.050 -6.689 -3.334 1.00 0.00 H new ATOM 0 HG SER A 127 -17.838 -8.068 -5.024 1.00 0.00 H new ATOM 2045 N ALA A 128 -14.235 -5.495 -2.493 1.00 0.00 N ATOM 2046 CA ALA A 128 -13.836 -4.807 -1.272 1.00 0.00 C ATOM 2047 C ALA A 128 -13.837 -3.294 -1.468 1.00 0.00 C ATOM 2048 O ALA A 128 -14.261 -2.544 -0.589 1.00 0.00 O ATOM 2049 CB ALA A 128 -12.462 -5.282 -0.823 1.00 0.00 C ATOM 0 H ALA A 128 -13.739 -6.370 -2.666 1.00 0.00 H new ATOM 0 HA ALA A 128 -14.563 -5.047 -0.496 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -12.177 -4.760 0.090 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -12.492 -6.355 -0.633 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -11.731 -5.072 -1.604 1.00 0.00 H new ATOM 2055 N TYR A 129 -13.358 -2.853 -2.626 1.00 0.00 N ATOM 2056 CA TYR A 129 -13.301 -1.429 -2.937 1.00 0.00 C ATOM 2057 C TYR A 129 -14.701 -0.861 -3.150 1.00 0.00 C ATOM 2058 O TYR A 129 -15.093 0.110 -2.503 1.00 0.00 O ATOM 2059 CB TYR A 129 -12.447 -1.192 -4.183 1.00 0.00 C ATOM 2060 CG TYR A 129 -12.638 0.177 -4.796 1.00 0.00 C ATOM 2061 CD1 TYR A 129 -12.056 1.302 -4.225 1.00 0.00 C ATOM 2062 CD2 TYR A 129 -13.398 0.346 -5.946 1.00 0.00 C ATOM 2063 CE1 TYR A 129 -12.228 2.555 -4.781 1.00 0.00 C ATOM 2064 CE2 TYR A 129 -13.575 1.594 -6.510 1.00 0.00 C ATOM 2065 CZ TYR A 129 -12.988 2.696 -5.923 1.00 0.00 C ATOM 2066 OH TYR A 129 -13.160 3.942 -6.481 1.00 0.00 O ATOM 0 H TYR A 129 -13.004 -3.461 -3.365 1.00 0.00 H new ATOM 0 HA TYR A 129 -12.846 -0.916 -2.090 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -11.396 -1.321 -3.923 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -12.687 -1.951 -4.928 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -11.459 1.195 -3.331 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -13.859 -0.515 -6.408 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -11.770 3.419 -4.324 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -14.169 1.707 -7.405 1.00 0.00 H new ATOM 0 HH TYR A 129 -13.625 3.855 -7.339 1.00 0.00 H new ATOM 2076 N GLN A 130 -15.449 -1.475 -4.060 1.00 0.00 N ATOM 2077 CA GLN A 130 -16.806 -1.032 -4.359 1.00 0.00 C ATOM 2078 C GLN A 130 -17.648 -0.961 -3.089 1.00 0.00 C ATOM 2079 O GLN A 130 -18.357 0.017 -2.858 1.00 0.00 O ATOM 2080 CB GLN A 130 -17.463 -1.974 -5.369 1.00 0.00 C ATOM 2081 CG GLN A 130 -16.679 -2.121 -6.663 1.00 0.00 C ATOM 2082 CD GLN A 130 -17.071 -1.090 -7.703 1.00 0.00 C ATOM 2083 OE1 GLN A 130 -18.247 -0.754 -7.849 1.00 0.00 O ATOM 2084 NE2 GLN A 130 -16.086 -0.580 -8.433 1.00 0.00 N ATOM 0 H GLN A 130 -15.139 -2.281 -4.603 1.00 0.00 H new ATOM 0 HA GLN A 130 -16.747 -0.033 -4.791 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -17.582 -2.957 -4.913 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -18.463 -1.606 -5.599 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -15.614 -2.030 -6.450 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -16.839 -3.120 -7.069 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -15.125 -0.887 -8.279 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -16.290 0.119 -9.148 1.00 0.00 H new ATOM 2093 N GLU A 131 -17.563 -2.005 -2.270 1.00 0.00 N ATOM 2094 CA GLU A 131 -18.319 -2.061 -1.025 1.00 0.00 C ATOM 2095 C GLU A 131 -18.421 -0.677 -0.388 1.00 0.00 C ATOM 2096 O GLU A 131 -19.492 -0.266 0.061 1.00 0.00 O ATOM 2097 CB GLU A 131 -17.661 -3.037 -0.047 1.00 0.00 C ATOM 2098 CG GLU A 131 -17.577 -4.460 -0.572 1.00 0.00 C ATOM 2099 CD GLU A 131 -18.871 -5.228 -0.385 1.00 0.00 C ATOM 2100 OE1 GLU A 131 -19.085 -5.772 0.719 1.00 0.00 O ATOM 2101 OE2 GLU A 131 -19.670 -5.286 -1.343 1.00 0.00 O ATOM 0 H GLU A 131 -16.979 -2.822 -2.446 1.00 0.00 H new ATOM 0 HA GLU A 131 -19.325 -2.411 -1.256 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -16.656 -2.684 0.184 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -18.222 -3.036 0.887 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -17.322 -4.438 -1.631 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -16.770 -4.985 -0.061 1.00 0.00 H new ATOM 2108 N LEU A 132 -17.301 0.035 -0.353 1.00 0.00 N ATOM 2109 CA LEU A 132 -17.263 1.373 0.229 1.00 0.00 C ATOM 2110 C LEU A 132 -18.093 2.350 -0.598 1.00 0.00 C ATOM 2111 O LEU A 132 -18.968 3.038 -0.071 1.00 0.00 O ATOM 2112 CB LEU A 132 -15.819 1.867 0.326 1.00 0.00 C ATOM 2113 CG LEU A 132 -14.811 0.883 0.921 1.00 0.00 C ATOM 2114 CD1 LEU A 132 -13.415 1.487 0.927 1.00 0.00 C ATOM 2115 CD2 LEU A 132 -15.227 0.481 2.328 1.00 0.00 C ATOM 0 H LEU A 132 -16.407 -0.291 -0.720 1.00 0.00 H new ATOM 0 HA LEU A 132 -17.690 1.320 1.230 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -15.482 2.141 -0.674 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -15.807 2.776 0.927 1.00 0.00 H new ATOM 0 HG LEU A 132 -14.794 -0.012 0.299 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -12.711 0.772 1.354 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -13.117 1.724 -0.094 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -13.415 2.398 1.526 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -14.499 -0.220 2.737 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -15.273 1.367 2.961 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -16.208 0.007 2.296 1.00 0.00 H new ATOM 2127 N LEU A 133 -17.814 2.404 -1.896 1.00 0.00 N ATOM 2128 CA LEU A 133 -18.536 3.295 -2.797 1.00 0.00 C ATOM 2129 C LEU A 133 -20.044 3.137 -2.627 1.00 0.00 C ATOM 2130 O LEU A 133 -20.765 4.119 -2.448 1.00 0.00 O ATOM 2131 CB LEU A 133 -18.143 3.013 -4.248 1.00 0.00 C ATOM 2132 CG LEU A 133 -16.903 3.745 -4.762 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -16.439 3.148 -6.081 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -17.187 5.232 -4.918 1.00 0.00 C ATOM 0 H LEU A 133 -17.093 1.841 -2.348 1.00 0.00 H new ATOM 0 HA LEU A 133 -18.266 4.321 -2.547 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -17.979 1.941 -4.357 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -18.986 3.273 -4.889 1.00 0.00 H new ATOM 0 HG LEU A 133 -16.104 3.623 -4.031 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -15.556 3.682 -6.431 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -16.194 2.096 -5.938 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -17.234 3.238 -6.821 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -16.293 5.737 -5.285 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -18.001 5.374 -5.628 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -17.470 5.652 -3.953 1.00 0.00 H new ATOM 2146 N SER A 134 -20.513 1.895 -2.682 1.00 0.00 N ATOM 2147 CA SER A 134 -21.935 1.608 -2.535 1.00 0.00 C ATOM 2148 C SER A 134 -22.394 1.851 -1.100 1.00 0.00 C ATOM 2149 O SER A 134 -23.323 2.619 -0.855 1.00 0.00 O ATOM 2150 CB SER A 134 -22.230 0.162 -2.939 1.00 0.00 C ATOM 2151 OG SER A 134 -23.595 -0.158 -2.731 1.00 0.00 O ATOM 0 H SER A 134 -19.929 1.071 -2.827 1.00 0.00 H new ATOM 0 HA SER A 134 -22.485 2.281 -3.193 1.00 0.00 H new ATOM 0 HB2 SER A 134 -21.975 0.015 -3.988 1.00 0.00 H new ATOM 0 HB3 SER A 134 -21.602 -0.516 -2.360 1.00 0.00 H new ATOM 0 HG SER A 134 -23.758 -1.087 -2.998 1.00 0.00 H new ATOM 2157 N GLY A 135 -21.733 1.189 -0.155 1.00 0.00 N ATOM 2158 CA GLY A 135 -22.086 1.345 1.244 1.00 0.00 C ATOM 2159 C GLY A 135 -23.580 1.249 1.480 1.00 0.00 C ATOM 2160 O GLY A 135 -24.310 2.236 1.387 1.00 0.00 O ATOM 0 H GLY A 135 -20.960 0.548 -0.333 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -21.579 0.579 1.831 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -21.726 2.310 1.601 1.00 0.00 H new ATOM 2164 N PRO A 136 -24.057 0.035 1.791 1.00 0.00 N ATOM 2165 CA PRO A 136 -25.479 -0.216 2.046 1.00 0.00 C ATOM 2166 C PRO A 136 -25.954 0.413 3.351 1.00 0.00 C ATOM 2167 O PRO A 136 -27.033 1.002 3.410 1.00 0.00 O ATOM 2168 CB PRO A 136 -25.561 -1.742 2.127 1.00 0.00 C ATOM 2169 CG PRO A 136 -24.195 -2.174 2.539 1.00 0.00 C ATOM 2170 CD PRO A 136 -23.245 -1.187 1.920 1.00 0.00 C ATOM 0 HA PRO A 136 -26.114 0.218 1.274 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -26.312 -2.060 2.850 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -25.840 -2.175 1.166 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -24.099 -2.180 3.625 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -23.985 -3.187 2.194 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -22.370 -1.023 2.549 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -22.882 -1.532 0.952 1.00 0.00 H new ATOM 2178 N SER A 137 -25.141 0.285 4.395 1.00 0.00 N ATOM 2179 CA SER A 137 -25.480 0.838 5.701 1.00 0.00 C ATOM 2180 C SER A 137 -25.659 2.351 5.620 1.00 0.00 C ATOM 2181 O SER A 137 -24.931 3.035 4.900 1.00 0.00 O ATOM 2182 CB SER A 137 -24.394 0.495 6.721 1.00 0.00 C ATOM 2183 OG SER A 137 -24.128 -0.897 6.735 1.00 0.00 O ATOM 0 H SER A 137 -24.243 -0.197 4.362 1.00 0.00 H new ATOM 0 HA SER A 137 -26.423 0.395 6.022 1.00 0.00 H new ATOM 0 HB2 SER A 137 -23.481 1.040 6.482 1.00 0.00 H new ATOM 0 HB3 SER A 137 -24.708 0.818 7.713 1.00 0.00 H new ATOM 0 HG SER A 137 -23.429 -1.090 7.394 1.00 0.00 H new ATOM 2189 N SER A 138 -26.632 2.866 6.363 1.00 0.00 N ATOM 2190 CA SER A 138 -26.910 4.298 6.374 1.00 0.00 C ATOM 2191 C SER A 138 -26.672 4.887 7.761 1.00 0.00 C ATOM 2192 O SER A 138 -27.148 5.978 8.074 1.00 0.00 O ATOM 2193 CB SER A 138 -28.352 4.562 5.936 1.00 0.00 C ATOM 2194 OG SER A 138 -28.527 5.913 5.545 1.00 0.00 O ATOM 0 H SER A 138 -27.242 2.314 6.966 1.00 0.00 H new ATOM 0 HA SER A 138 -26.230 4.781 5.672 1.00 0.00 H new ATOM 0 HB2 SER A 138 -28.610 3.904 5.106 1.00 0.00 H new ATOM 0 HB3 SER A 138 -29.033 4.326 6.754 1.00 0.00 H new ATOM 0 HG SER A 138 -28.170 6.504 6.241 1.00 0.00 H new ATOM 2200 N GLY A 139 -25.931 4.157 8.588 1.00 0.00 N ATOM 2201 CA GLY A 139 -25.642 4.622 9.932 1.00 0.00 C ATOM 2202 C GLY A 139 -26.884 4.702 10.798 1.00 0.00 C ATOM 2203 O GLY A 139 -26.801 4.618 12.023 1.00 0.00 O ATOM 0 H GLY A 139 -25.525 3.252 8.351 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -24.921 3.951 10.398 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -25.175 5.606 9.880 1.00 0.00 H new TER 2207 GLY A 139