USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 990 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 33 THR OG1 : rot 152:sc= 0 USER MOD Set 1.2: A 73 TYR OH : rot 30:sc= -0.0289 USER MOD Set 2.1: A 11 ASN : amide:sc= 0.537 K(o=3.4,f=1.5) USER MOD Set 2.2: A 12 SER OG : rot 180:sc= 1.17 USER MOD Set 2.3: A 40 SER OG : rot 171:sc= 1.65 USER MOD Set 3.1: A 5 MET CE :methyl -177:sc= -0.738 (180deg=-0.757) USER MOD Set 3.2: A 35 SER OG : rot -159:sc= 1.42 USER MOD Single : A 1 MET CE :methyl -163:sc= 0 (180deg=-0.00254) USER MOD Single : A 1 MET N :NH3+ -102:sc= 0.0588 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -170:sc= 1.29 (180deg=1.14) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 160:sc= 0 USER MOD Single : A 16 GLN : amide:sc= 1.23 K(o=1.2,f=-5.7!) USER MOD Single : A 17 MET CE :methyl -172:sc= -1.36 (180deg=-1.69) USER MOD Single : A 23 LYS NZ :NH3+ 167:sc= 2.03 (180deg=2) USER MOD Single : A 24 THR OG1 : rot 98:sc= 0.0125 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot -160:sc= 0.344 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HE2:sc=-0.00581 K(o=-0.0058,f=-0.71) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -114:sc= -0.304 (180deg=-1.93) USER MOD Single : A 58 SER OG : rot 180:sc= 0.123 USER MOD Single : A 60 GLN : amide:sc= -1.19! C(o=-1.2!,f=-1.7!) USER MOD Single : A 61 THR OG1 : rot 37:sc= 0.652 USER MOD Single : A 62 SER OG : rot -171:sc= 0.0146 USER MOD Single : A 67 ASN : amide:sc= 1.09 K(o=1.1,f=-1.1) USER MOD Single : A 69 ASN : amide:sc= 0.0769 K(o=0.077,f=-7.2!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.0156 X(o=-0.016,f=-0.01) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.216 USER MOD Single : A 93 GLN : amide:sc= 0.16 K(o=0.16,f=-0.64) USER MOD Single : A 100 GLN : amide:sc= 0.362 K(o=0.36,f=-6!) USER MOD Single : A 107 GLN : amide:sc= 1.17 K(o=1.2,f=-0.62) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 85:sc= 0.569 USER MOD Single : A 118 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 LYS NZ :NH3+ -174:sc= 1.33 (180deg=1.19) USER MOD Single : A 125 ASN : amide:sc= -0.571 K(o=-0.57,f=-1.5!) USER MOD Single : A 129 LYS NZ :NH3+ -179:sc= 1.26 (180deg=1.24) USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.513 -0.788 0.774 1.00 0.00 N ATOM 2 CA MET A 1 1.906 -0.479 -0.637 1.00 0.00 C ATOM 3 C MET A 1 2.511 -1.725 -1.322 1.00 0.00 C ATOM 4 O MET A 1 3.055 -2.596 -0.646 1.00 0.00 O ATOM 5 CB MET A 1 2.792 0.798 -0.724 1.00 0.00 C ATOM 6 CG MET A 1 4.306 0.606 -0.535 1.00 0.00 C ATOM 7 SD MET A 1 5.245 2.124 -0.187 1.00 0.00 S ATOM 8 CE MET A 1 5.084 3.024 -1.754 1.00 0.00 C ATOM 0 H1 MET A 1 0.484 -0.927 0.825 1.00 0.00 H new ATOM 0 H2 MET A 1 1.995 -1.655 1.087 1.00 0.00 H new ATOM 0 H3 MET A 1 1.787 0.003 1.392 1.00 0.00 H new ATOM 0 HA MET A 1 1.010 -0.232 -1.206 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.627 1.260 -1.697 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.443 1.506 0.028 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.467 -0.097 0.283 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.712 0.146 -1.436 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.838 3.809 -1.802 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.225 2.334 -2.586 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.091 3.470 -1.817 1.00 0.00 H new ATOM 18 N LYS A 2 2.414 -1.848 -2.656 1.00 0.00 N ATOM 19 CA LYS A 2 2.774 -3.096 -3.366 1.00 0.00 C ATOM 20 C LYS A 2 4.292 -3.186 -3.429 1.00 0.00 C ATOM 21 O LYS A 2 4.905 -2.291 -4.001 1.00 0.00 O ATOM 22 CB LYS A 2 2.108 -3.181 -4.766 1.00 0.00 C ATOM 23 CG LYS A 2 0.653 -2.668 -4.779 1.00 0.00 C ATOM 24 CD LYS A 2 0.040 -2.658 -6.188 1.00 0.00 C ATOM 25 CE LYS A 2 -1.137 -1.666 -6.285 1.00 0.00 C ATOM 26 NZ LYS A 2 -2.384 -2.162 -5.633 1.00 0.00 N ATOM 0 H LYS A 2 2.089 -1.100 -3.269 1.00 0.00 H new ATOM 0 HA LYS A 2 2.390 -3.957 -2.819 1.00 0.00 H new ATOM 0 HB2 LYS A 2 2.697 -2.602 -5.477 1.00 0.00 H new ATOM 0 HB3 LYS A 2 2.125 -4.216 -5.107 1.00 0.00 H new ATOM 0 HG2 LYS A 2 0.045 -3.296 -4.127 1.00 0.00 H new ATOM 0 HG3 LYS A 2 0.624 -1.659 -4.368 1.00 0.00 H new ATOM 0 HD2 LYS A 2 0.805 -2.389 -6.917 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -0.305 -3.660 -6.443 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -0.846 -0.722 -5.825 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -1.342 -1.459 -7.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -3.135 -1.450 -5.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -2.684 -3.048 -6.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -2.203 -2.334 -4.623 1.00 0.00 H new ATOM 40 N LYS A 3 4.916 -4.210 -2.845 1.00 0.00 N ATOM 41 CA LYS A 3 6.371 -4.358 -2.939 1.00 0.00 C ATOM 42 C LYS A 3 6.682 -5.101 -4.220 1.00 0.00 C ATOM 43 O LYS A 3 6.018 -6.097 -4.514 1.00 0.00 O ATOM 44 CB LYS A 3 6.990 -5.033 -1.716 1.00 0.00 C ATOM 45 CG LYS A 3 6.602 -4.327 -0.417 1.00 0.00 C ATOM 46 CD LYS A 3 7.353 -4.927 0.773 1.00 0.00 C ATOM 47 CE LYS A 3 6.888 -4.179 2.024 1.00 0.00 C ATOM 48 NZ LYS A 3 7.567 -4.683 3.246 1.00 0.00 N ATOM 0 H LYS A 3 4.446 -4.940 -2.309 1.00 0.00 H new ATOM 0 HA LYS A 3 6.826 -3.368 -2.960 1.00 0.00 H new ATOM 0 HB2 LYS A 3 6.668 -6.073 -1.674 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.075 -5.039 -1.815 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.826 -3.263 -0.495 1.00 0.00 H new ATOM 0 HG3 LYS A 3 5.527 -4.416 -0.257 1.00 0.00 H new ATOM 0 HD2 LYS A 3 7.144 -5.993 0.862 1.00 0.00 H new ATOM 0 HD3 LYS A 3 8.430 -4.823 0.640 1.00 0.00 H new ATOM 0 HE2 LYS A 3 7.089 -3.114 1.908 1.00 0.00 H new ATOM 0 HE3 LYS A 3 5.809 -4.289 2.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 7.111 -4.278 4.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 7.497 -5.720 3.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 8.569 -4.404 3.227 1.00 0.00 H new ATOM 62 N VAL A 4 7.686 -4.624 -4.943 1.00 0.00 N ATOM 63 CA VAL A 4 8.019 -5.022 -6.298 1.00 0.00 C ATOM 64 C VAL A 4 9.459 -5.539 -6.338 1.00 0.00 C ATOM 65 O VAL A 4 10.320 -5.060 -5.600 1.00 0.00 O ATOM 66 CB VAL A 4 7.865 -3.822 -7.259 1.00 0.00 C ATOM 67 CG1 VAL A 4 7.586 -4.268 -8.702 1.00 0.00 C ATOM 68 CG2 VAL A 4 6.777 -2.806 -6.883 1.00 0.00 C ATOM 0 H VAL A 4 8.320 -3.913 -4.579 1.00 0.00 H new ATOM 0 HA VAL A 4 7.340 -5.814 -6.615 1.00 0.00 H new ATOM 0 HB VAL A 4 8.832 -3.326 -7.170 1.00 0.00 H new ATOM 0 HG11 VAL A 4 7.485 -3.391 -9.341 1.00 0.00 H new ATOM 0 HG12 VAL A 4 8.412 -4.884 -9.059 1.00 0.00 H new ATOM 0 HG13 VAL A 4 6.663 -4.847 -8.732 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.755 -2.006 -7.623 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.808 -3.304 -6.857 1.00 0.00 H new ATOM 0 HG23 VAL A 4 6.995 -2.386 -5.901 1.00 0.00 H new ATOM 78 N MET A 5 9.732 -6.453 -7.261 1.00 0.00 N ATOM 79 CA MET A 5 11.065 -6.916 -7.632 1.00 0.00 C ATOM 80 C MET A 5 11.117 -7.073 -9.146 1.00 0.00 C ATOM 81 O MET A 5 10.124 -7.486 -9.742 1.00 0.00 O ATOM 82 CB MET A 5 11.405 -8.273 -7.003 1.00 0.00 C ATOM 83 CG MET A 5 11.365 -8.328 -5.477 1.00 0.00 C ATOM 84 SD MET A 5 12.531 -9.550 -4.815 1.00 0.00 S ATOM 85 CE MET A 5 12.464 -9.100 -3.068 1.00 0.00 C ATOM 0 H MET A 5 8.996 -6.914 -7.797 1.00 0.00 H new ATOM 0 HA MET A 5 11.785 -6.182 -7.271 1.00 0.00 H new ATOM 0 HB2 MET A 5 10.710 -9.017 -7.393 1.00 0.00 H new ATOM 0 HB3 MET A 5 12.402 -8.565 -7.332 1.00 0.00 H new ATOM 0 HG2 MET A 5 11.601 -7.344 -5.072 1.00 0.00 H new ATOM 0 HG3 MET A 5 10.355 -8.574 -5.149 1.00 0.00 H new ATOM 0 HE1 MET A 5 13.166 -9.717 -2.506 1.00 0.00 H new ATOM 0 HE2 MET A 5 12.731 -8.050 -2.952 1.00 0.00 H new ATOM 0 HE3 MET A 5 11.455 -9.262 -2.689 1.00 0.00 H new ATOM 95 N PHE A 6 12.284 -6.832 -9.743 1.00 0.00 N ATOM 96 CA PHE A 6 12.578 -7.117 -11.140 1.00 0.00 C ATOM 97 C PHE A 6 13.946 -7.785 -11.133 1.00 0.00 C ATOM 98 O PHE A 6 14.893 -7.188 -10.629 1.00 0.00 O ATOM 99 CB PHE A 6 12.603 -5.827 -11.975 1.00 0.00 C ATOM 100 CG PHE A 6 11.345 -4.988 -11.950 1.00 0.00 C ATOM 101 CD1 PHE A 6 11.129 -4.076 -10.904 1.00 0.00 C ATOM 102 CD2 PHE A 6 10.419 -5.075 -13.007 1.00 0.00 C ATOM 103 CE1 PHE A 6 9.961 -3.298 -10.884 1.00 0.00 C ATOM 104 CE2 PHE A 6 9.271 -4.265 -13.006 1.00 0.00 C ATOM 105 CZ PHE A 6 9.033 -3.391 -11.933 1.00 0.00 C ATOM 0 H PHE A 6 13.074 -6.419 -9.248 1.00 0.00 H new ATOM 0 HA PHE A 6 11.816 -7.754 -11.590 1.00 0.00 H new ATOM 0 HB2 PHE A 6 13.432 -5.211 -11.628 1.00 0.00 H new ATOM 0 HB3 PHE A 6 12.816 -6.094 -13.010 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.861 -3.974 -10.116 1.00 0.00 H new ATOM 0 HD2 PHE A 6 10.591 -5.765 -13.820 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.776 -2.626 -10.059 1.00 0.00 H new ATOM 0 HE2 PHE A 6 8.573 -4.314 -13.829 1.00 0.00 H new ATOM 0 HZ PHE A 6 8.136 -2.790 -11.915 1.00 0.00 H new ATOM 115 N VAL A 7 14.071 -9.003 -11.655 1.00 0.00 N ATOM 116 CA VAL A 7 15.294 -9.780 -11.460 1.00 0.00 C ATOM 117 C VAL A 7 15.524 -10.760 -12.614 1.00 0.00 C ATOM 118 O VAL A 7 14.575 -11.277 -13.195 1.00 0.00 O ATOM 119 CB VAL A 7 15.201 -10.436 -10.050 1.00 0.00 C ATOM 120 CG1 VAL A 7 13.821 -11.044 -9.723 1.00 0.00 C ATOM 121 CG2 VAL A 7 16.292 -11.479 -9.774 1.00 0.00 C ATOM 0 H VAL A 7 13.352 -9.469 -12.209 1.00 0.00 H new ATOM 0 HA VAL A 7 16.183 -9.149 -11.482 1.00 0.00 H new ATOM 0 HB VAL A 7 15.361 -9.589 -9.384 1.00 0.00 H new ATOM 0 HG11 VAL A 7 13.843 -11.479 -8.724 1.00 0.00 H new ATOM 0 HG12 VAL A 7 13.061 -10.264 -9.762 1.00 0.00 H new ATOM 0 HG13 VAL A 7 13.583 -11.819 -10.451 1.00 0.00 H new ATOM 0 HG21 VAL A 7 16.158 -11.889 -8.773 1.00 0.00 H new ATOM 0 HG22 VAL A 7 16.221 -12.282 -10.508 1.00 0.00 H new ATOM 0 HG23 VAL A 7 17.272 -11.008 -9.845 1.00 0.00 H new ATOM 131 N CYS A 8 16.792 -10.998 -12.954 1.00 0.00 N ATOM 132 CA CYS A 8 17.274 -12.043 -13.859 1.00 0.00 C ATOM 133 C CYS A 8 18.463 -12.719 -13.143 1.00 0.00 C ATOM 134 O CYS A 8 18.758 -12.387 -11.994 1.00 0.00 O ATOM 135 CB CYS A 8 17.609 -11.414 -15.230 1.00 0.00 C ATOM 136 SG CYS A 8 18.148 -12.534 -16.566 1.00 0.00 S ATOM 0 H CYS A 8 17.555 -10.433 -12.583 1.00 0.00 H new ATOM 0 HA CYS A 8 16.533 -12.812 -14.078 1.00 0.00 H new ATOM 0 HB2 CYS A 8 16.726 -10.877 -15.578 1.00 0.00 H new ATOM 0 HB3 CYS A 8 18.393 -10.673 -15.077 1.00 0.00 H new ATOM 141 N LYS A 9 19.157 -13.667 -13.790 1.00 0.00 N ATOM 142 CA LYS A 9 20.181 -14.497 -13.137 1.00 0.00 C ATOM 143 C LYS A 9 21.334 -13.695 -12.511 1.00 0.00 C ATOM 144 O LYS A 9 21.957 -14.185 -11.569 1.00 0.00 O ATOM 145 CB LYS A 9 20.698 -15.582 -14.106 1.00 0.00 C ATOM 146 CG LYS A 9 21.431 -15.035 -15.348 1.00 0.00 C ATOM 147 CD LYS A 9 22.073 -16.138 -16.206 1.00 0.00 C ATOM 148 CE LYS A 9 21.043 -17.082 -16.852 1.00 0.00 C ATOM 149 NZ LYS A 9 21.691 -18.100 -17.723 1.00 0.00 N ATOM 0 H LYS A 9 19.025 -13.880 -14.779 1.00 0.00 H new ATOM 0 HA LYS A 9 19.688 -14.983 -12.295 1.00 0.00 H new ATOM 0 HB2 LYS A 9 21.373 -16.244 -13.563 1.00 0.00 H new ATOM 0 HB3 LYS A 9 19.854 -16.188 -14.436 1.00 0.00 H new ATOM 0 HG2 LYS A 9 20.726 -14.472 -15.959 1.00 0.00 H new ATOM 0 HG3 LYS A 9 22.204 -14.336 -15.028 1.00 0.00 H new ATOM 0 HD2 LYS A 9 22.674 -15.676 -16.989 1.00 0.00 H new ATOM 0 HD3 LYS A 9 22.753 -16.722 -15.586 1.00 0.00 H new ATOM 0 HE2 LYS A 9 20.471 -17.584 -16.071 1.00 0.00 H new ATOM 0 HE3 LYS A 9 20.335 -16.498 -17.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 20.963 -18.715 -18.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 22.216 -17.623 -18.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 22.348 -18.674 -17.157 1.00 0.00 H new ATOM 163 N ARG A 10 21.621 -12.483 -13.004 1.00 0.00 N ATOM 164 CA ARG A 10 22.643 -11.587 -12.451 1.00 0.00 C ATOM 165 C ARG A 10 22.119 -10.147 -12.488 1.00 0.00 C ATOM 166 O ARG A 10 21.196 -9.841 -13.241 1.00 0.00 O ATOM 167 CB ARG A 10 23.961 -11.815 -13.230 1.00 0.00 C ATOM 168 CG ARG A 10 25.204 -11.193 -12.567 1.00 0.00 C ATOM 169 CD ARG A 10 26.491 -11.684 -13.238 1.00 0.00 C ATOM 170 NE ARG A 10 27.673 -10.971 -12.716 1.00 0.00 N ATOM 171 CZ ARG A 10 28.432 -11.320 -11.666 1.00 0.00 C ATOM 172 NH1 ARG A 10 28.172 -12.411 -10.951 1.00 0.00 N ATOM 173 NH2 ARG A 10 29.466 -10.554 -11.328 1.00 0.00 N ATOM 0 H ARG A 10 21.140 -12.091 -13.814 1.00 0.00 H new ATOM 0 HA ARG A 10 22.859 -11.797 -11.404 1.00 0.00 H new ATOM 0 HB2 ARG A 10 24.122 -12.887 -13.343 1.00 0.00 H new ATOM 0 HB3 ARG A 10 23.853 -11.401 -14.233 1.00 0.00 H new ATOM 0 HG2 ARG A 10 25.149 -10.106 -12.631 1.00 0.00 H new ATOM 0 HG3 ARG A 10 25.222 -11.450 -11.508 1.00 0.00 H new ATOM 0 HD2 ARG A 10 26.606 -12.755 -13.070 1.00 0.00 H new ATOM 0 HD3 ARG A 10 26.421 -11.536 -14.316 1.00 0.00 H new ATOM 0 HE ARG A 10 27.943 -10.119 -13.208 1.00 0.00 H new ATOM 0 HH11 ARG A 10 27.380 -13.005 -11.196 1.00 0.00 H new ATOM 0 HH12 ARG A 10 28.765 -12.654 -10.157 1.00 0.00 H new ATOM 0 HH21 ARG A 10 29.674 -9.712 -11.865 1.00 0.00 H new ATOM 0 HH22 ARG A 10 30.051 -10.809 -10.532 1.00 0.00 H new ATOM 187 N ASN A 11 22.700 -9.271 -11.665 1.00 0.00 N ATOM 188 CA ASN A 11 22.270 -7.874 -11.524 1.00 0.00 C ATOM 189 C ASN A 11 22.628 -7.012 -12.741 1.00 0.00 C ATOM 190 O ASN A 11 21.877 -6.096 -13.073 1.00 0.00 O ATOM 191 CB ASN A 11 22.920 -7.288 -10.256 1.00 0.00 C ATOM 192 CG ASN A 11 22.795 -5.767 -10.182 1.00 0.00 C ATOM 193 OD1 ASN A 11 21.779 -5.233 -9.760 1.00 0.00 O ATOM 194 ND2 ASN A 11 23.825 -5.043 -10.596 1.00 0.00 N ATOM 0 H ASN A 11 23.492 -9.513 -11.070 1.00 0.00 H new ATOM 0 HA ASN A 11 21.183 -7.864 -11.448 1.00 0.00 H new ATOM 0 HB2 ASN A 11 22.454 -7.731 -9.376 1.00 0.00 H new ATOM 0 HB3 ASN A 11 23.974 -7.564 -10.232 1.00 0.00 H new ATOM 0 HD21 ASN A 11 23.778 -4.025 -10.565 1.00 0.00 H new ATOM 0 HD22 ASN A 11 24.665 -5.504 -10.945 1.00 0.00 H new ATOM 201 N SER A 12 23.771 -7.273 -13.385 1.00 0.00 N ATOM 202 CA SER A 12 24.335 -6.390 -14.404 1.00 0.00 C ATOM 203 C SER A 12 23.421 -6.305 -15.632 1.00 0.00 C ATOM 204 O SER A 12 22.967 -5.217 -15.999 1.00 0.00 O ATOM 205 CB SER A 12 25.753 -6.860 -14.777 1.00 0.00 C ATOM 206 OG SER A 12 26.299 -7.744 -13.802 1.00 0.00 O ATOM 0 H SER A 12 24.331 -8.107 -13.211 1.00 0.00 H new ATOM 0 HA SER A 12 24.407 -5.382 -13.996 1.00 0.00 H new ATOM 0 HB2 SER A 12 25.725 -7.361 -15.745 1.00 0.00 H new ATOM 0 HB3 SER A 12 26.405 -5.993 -14.885 1.00 0.00 H new ATOM 0 HG SER A 12 27.198 -8.020 -14.077 1.00 0.00 H new ATOM 212 N SER A 13 23.106 -7.460 -16.223 1.00 0.00 N ATOM 213 CA SER A 13 22.309 -7.551 -17.437 1.00 0.00 C ATOM 214 C SER A 13 20.826 -7.630 -17.073 1.00 0.00 C ATOM 215 O SER A 13 20.470 -8.264 -16.082 1.00 0.00 O ATOM 216 CB SER A 13 22.750 -8.774 -18.257 1.00 0.00 C ATOM 217 OG SER A 13 24.166 -8.808 -18.407 1.00 0.00 O ATOM 0 H SER A 13 23.404 -8.367 -15.863 1.00 0.00 H new ATOM 0 HA SER A 13 22.462 -6.661 -18.048 1.00 0.00 H new ATOM 0 HB2 SER A 13 22.411 -9.686 -17.766 1.00 0.00 H new ATOM 0 HB3 SER A 13 22.278 -8.747 -19.239 1.00 0.00 H new ATOM 0 HG SER A 13 24.421 -9.596 -18.931 1.00 0.00 H new ATOM 223 N ARG A 14 19.956 -7.054 -17.912 1.00 0.00 N ATOM 224 CA ARG A 14 18.485 -7.049 -17.813 1.00 0.00 C ATOM 225 C ARG A 14 18.005 -6.214 -16.619 1.00 0.00 C ATOM 226 O ARG A 14 17.271 -5.247 -16.804 1.00 0.00 O ATOM 227 CB ARG A 14 17.897 -8.487 -17.833 1.00 0.00 C ATOM 228 CG ARG A 14 18.422 -9.441 -18.935 1.00 0.00 C ATOM 229 CD ARG A 14 17.745 -9.307 -20.306 1.00 0.00 C ATOM 230 NE ARG A 14 16.467 -10.059 -20.360 1.00 0.00 N ATOM 231 CZ ARG A 14 15.997 -10.798 -21.379 1.00 0.00 C ATOM 232 NH1 ARG A 14 16.712 -11.010 -22.481 1.00 0.00 N ATOM 233 NH2 ARG A 14 14.782 -11.331 -21.274 1.00 0.00 N ATOM 0 H ARG A 14 20.279 -6.544 -18.734 1.00 0.00 H new ATOM 0 HA ARG A 14 18.094 -6.558 -18.704 1.00 0.00 H new ATOM 0 HB2 ARG A 14 18.092 -8.947 -16.864 1.00 0.00 H new ATOM 0 HB3 ARG A 14 16.815 -8.410 -17.938 1.00 0.00 H new ATOM 0 HG2 ARG A 14 19.491 -9.270 -19.060 1.00 0.00 H new ATOM 0 HG3 ARG A 14 18.302 -10.468 -18.589 1.00 0.00 H new ATOM 0 HD2 ARG A 14 17.558 -8.254 -20.519 1.00 0.00 H new ATOM 0 HD3 ARG A 14 18.417 -9.674 -21.082 1.00 0.00 H new ATOM 0 HE ARG A 14 15.878 -10.009 -19.529 1.00 0.00 H new ATOM 0 HH11 ARG A 14 17.645 -10.607 -22.569 1.00 0.00 H new ATOM 0 HH12 ARG A 14 16.327 -11.576 -23.238 1.00 0.00 H new ATOM 0 HH21 ARG A 14 14.228 -11.175 -20.432 1.00 0.00 H new ATOM 0 HH22 ARG A 14 14.405 -11.896 -22.035 1.00 0.00 H new ATOM 247 N SER A 15 18.439 -6.537 -15.402 1.00 0.00 N ATOM 248 CA SER A 15 17.947 -5.945 -14.158 1.00 0.00 C ATOM 249 C SER A 15 18.352 -4.474 -13.963 1.00 0.00 C ATOM 250 O SER A 15 17.820 -3.818 -13.068 1.00 0.00 O ATOM 251 CB SER A 15 18.373 -6.842 -12.984 1.00 0.00 C ATOM 252 OG SER A 15 18.214 -8.220 -13.324 1.00 0.00 O ATOM 0 H SER A 15 19.164 -7.238 -15.249 1.00 0.00 H new ATOM 0 HA SER A 15 16.859 -5.906 -14.208 1.00 0.00 H new ATOM 0 HB2 SER A 15 19.413 -6.643 -12.725 1.00 0.00 H new ATOM 0 HB3 SER A 15 17.775 -6.607 -12.104 1.00 0.00 H new ATOM 0 HG SER A 15 18.767 -8.769 -12.730 1.00 0.00 H new ATOM 258 N GLN A 16 19.251 -3.922 -14.789 1.00 0.00 N ATOM 259 CA GLN A 16 19.745 -2.562 -14.586 1.00 0.00 C ATOM 260 C GLN A 16 18.666 -1.489 -14.743 1.00 0.00 C ATOM 261 O GLN A 16 18.634 -0.589 -13.916 1.00 0.00 O ATOM 262 CB GLN A 16 21.001 -2.275 -15.421 1.00 0.00 C ATOM 263 CG GLN A 16 20.879 -2.329 -16.953 1.00 0.00 C ATOM 264 CD GLN A 16 22.267 -2.203 -17.604 1.00 0.00 C ATOM 265 OE1 GLN A 16 23.164 -1.566 -17.052 1.00 0.00 O ATOM 266 NE2 GLN A 16 22.493 -2.789 -18.769 1.00 0.00 N ATOM 0 H GLN A 16 19.647 -4.398 -15.600 1.00 0.00 H new ATOM 0 HA GLN A 16 20.045 -2.505 -13.540 1.00 0.00 H new ATOM 0 HB2 GLN A 16 21.362 -1.283 -15.150 1.00 0.00 H new ATOM 0 HB3 GLN A 16 21.770 -2.987 -15.122 1.00 0.00 H new ATOM 0 HG2 GLN A 16 20.412 -3.267 -17.255 1.00 0.00 H new ATOM 0 HG3 GLN A 16 20.232 -1.524 -17.302 1.00 0.00 H new ATOM 0 HE21 GLN A 16 21.750 -3.317 -19.227 1.00 0.00 H new ATOM 0 HE22 GLN A 16 23.410 -2.713 -19.209 1.00 0.00 H new ATOM 275 N MET A 17 17.782 -1.569 -15.745 1.00 0.00 N ATOM 276 CA MET A 17 16.877 -0.466 -16.089 1.00 0.00 C ATOM 277 C MET A 17 15.497 -0.566 -15.441 1.00 0.00 C ATOM 278 O MET A 17 14.916 0.455 -15.089 1.00 0.00 O ATOM 279 CB MET A 17 16.786 -0.413 -17.622 1.00 0.00 C ATOM 280 CG MET A 17 15.846 0.646 -18.225 1.00 0.00 C ATOM 281 SD MET A 17 16.272 2.412 -18.189 1.00 0.00 S ATOM 282 CE MET A 17 16.053 2.987 -16.481 1.00 0.00 C ATOM 0 H MET A 17 17.674 -2.393 -16.336 1.00 0.00 H new ATOM 0 HA MET A 17 17.287 0.461 -15.687 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.788 -0.242 -18.016 1.00 0.00 H new ATOM 0 HB3 MET A 17 16.467 -1.393 -17.977 1.00 0.00 H new ATOM 0 HG2 MET A 17 15.692 0.377 -19.270 1.00 0.00 H new ATOM 0 HG3 MET A 17 14.884 0.540 -17.724 1.00 0.00 H new ATOM 0 HE1 MET A 17 16.161 4.071 -16.445 1.00 0.00 H new ATOM 0 HE2 MET A 17 15.060 2.710 -16.128 1.00 0.00 H new ATOM 0 HE3 MET A 17 16.807 2.526 -15.842 1.00 0.00 H new ATOM 292 N ALA A 18 14.955 -1.778 -15.299 1.00 0.00 N ATOM 293 CA ALA A 18 13.546 -1.970 -14.912 1.00 0.00 C ATOM 294 C ALA A 18 13.214 -1.421 -13.524 1.00 0.00 C ATOM 295 O ALA A 18 12.218 -0.719 -13.377 1.00 0.00 O ATOM 296 CB ALA A 18 13.185 -3.455 -15.061 1.00 0.00 C ATOM 0 H ALA A 18 15.469 -2.647 -15.446 1.00 0.00 H new ATOM 0 HA ALA A 18 12.925 -1.381 -15.587 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.144 -3.607 -14.777 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.326 -3.762 -16.097 1.00 0.00 H new ATOM 0 HB3 ALA A 18 13.828 -4.052 -14.415 1.00 0.00 H new ATOM 302 N GLU A 19 14.075 -1.642 -12.523 1.00 0.00 N ATOM 303 CA GLU A 19 13.854 -1.056 -11.191 1.00 0.00 C ATOM 304 C GLU A 19 13.934 0.470 -11.288 1.00 0.00 C ATOM 305 O GLU A 19 13.172 1.162 -10.612 1.00 0.00 O ATOM 306 CB GLU A 19 14.828 -1.652 -10.159 1.00 0.00 C ATOM 307 CG GLU A 19 16.225 -1.024 -10.064 1.00 0.00 C ATOM 308 CD GLU A 19 16.290 0.323 -9.330 1.00 0.00 C ATOM 309 OE1 GLU A 19 15.753 0.459 -8.208 1.00 0.00 O ATOM 310 OE2 GLU A 19 16.942 1.248 -9.864 1.00 0.00 O ATOM 0 H GLU A 19 14.917 -2.211 -12.604 1.00 0.00 H new ATOM 0 HA GLU A 19 12.855 -1.309 -10.835 1.00 0.00 H new ATOM 0 HB2 GLU A 19 14.361 -1.585 -9.177 1.00 0.00 H new ATOM 0 HB3 GLU A 19 14.949 -2.712 -10.383 1.00 0.00 H new ATOM 0 HG2 GLU A 19 16.888 -1.727 -9.559 1.00 0.00 H new ATOM 0 HG3 GLU A 19 16.614 -0.888 -11.073 1.00 0.00 H new ATOM 317 N GLY A 20 14.795 0.966 -12.190 1.00 0.00 N ATOM 318 CA GLY A 20 14.964 2.378 -12.509 1.00 0.00 C ATOM 319 C GLY A 20 13.622 3.013 -12.834 1.00 0.00 C ATOM 320 O GLY A 20 13.184 3.942 -12.159 1.00 0.00 O ATOM 0 H GLY A 20 15.413 0.365 -12.734 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.423 2.895 -11.667 1.00 0.00 H new ATOM 0 HA3 GLY A 20 15.640 2.487 -13.357 1.00 0.00 H new ATOM 324 N PHE A 21 12.917 2.480 -13.830 1.00 0.00 N ATOM 325 CA PHE A 21 11.632 3.058 -14.198 1.00 0.00 C ATOM 326 C PHE A 21 10.565 2.808 -13.166 1.00 0.00 C ATOM 327 O PHE A 21 9.687 3.652 -13.006 1.00 0.00 O ATOM 328 CB PHE A 21 11.152 2.556 -15.553 1.00 0.00 C ATOM 329 CG PHE A 21 11.715 3.395 -16.659 1.00 0.00 C ATOM 330 CD1 PHE A 21 11.424 4.773 -16.712 1.00 0.00 C ATOM 331 CD2 PHE A 21 12.566 2.801 -17.596 1.00 0.00 C ATOM 332 CE1 PHE A 21 11.979 5.551 -17.741 1.00 0.00 C ATOM 333 CE2 PHE A 21 13.121 3.577 -18.615 1.00 0.00 C ATOM 334 CZ PHE A 21 12.819 4.951 -18.698 1.00 0.00 C ATOM 0 H PHE A 21 13.205 1.672 -14.381 1.00 0.00 H new ATOM 0 HA PHE A 21 11.803 4.133 -14.256 1.00 0.00 H new ATOM 0 HB2 PHE A 21 11.453 1.517 -15.689 1.00 0.00 H new ATOM 0 HB3 PHE A 21 10.063 2.580 -15.590 1.00 0.00 H new ATOM 0 HD1 PHE A 21 10.782 5.225 -15.970 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.793 1.747 -17.532 1.00 0.00 H new ATOM 0 HE1 PHE A 21 11.762 6.607 -17.798 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.782 3.124 -19.340 1.00 0.00 H new ATOM 0 HZ PHE A 21 13.233 5.546 -19.499 1.00 0.00 H new ATOM 344 N ALA A 22 10.604 1.688 -12.455 1.00 0.00 N ATOM 345 CA ALA A 22 9.519 1.389 -11.543 1.00 0.00 C ATOM 346 C ALA A 22 9.515 2.351 -10.357 1.00 0.00 C ATOM 347 O ALA A 22 8.440 2.776 -9.944 1.00 0.00 O ATOM 348 CB ALA A 22 9.614 -0.073 -11.133 1.00 0.00 C ATOM 0 H ALA A 22 11.351 0.995 -12.492 1.00 0.00 H new ATOM 0 HA ALA A 22 8.559 1.537 -12.037 1.00 0.00 H new ATOM 0 HB1 ALA A 22 8.802 -0.312 -10.446 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.538 -0.705 -12.018 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.570 -0.252 -10.641 1.00 0.00 H new ATOM 354 N LYS A 23 10.683 2.799 -9.878 1.00 0.00 N ATOM 355 CA LYS A 23 10.726 3.842 -8.841 1.00 0.00 C ATOM 356 C LYS A 23 10.176 5.179 -9.357 1.00 0.00 C ATOM 357 O LYS A 23 9.706 5.991 -8.570 1.00 0.00 O ATOM 358 CB LYS A 23 12.159 3.962 -8.269 1.00 0.00 C ATOM 359 CG LYS A 23 13.119 4.883 -9.059 1.00 0.00 C ATOM 360 CD LYS A 23 14.486 4.275 -9.393 1.00 0.00 C ATOM 361 CE LYS A 23 15.294 3.941 -8.134 1.00 0.00 C ATOM 362 NZ LYS A 23 16.698 3.572 -8.444 1.00 0.00 N ATOM 0 H LYS A 23 11.596 2.464 -10.184 1.00 0.00 H new ATOM 0 HA LYS A 23 10.069 3.550 -8.022 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.093 4.329 -7.245 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.597 2.965 -8.222 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.632 5.174 -9.990 1.00 0.00 H new ATOM 0 HG3 LYS A 23 13.277 5.795 -8.483 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.345 3.369 -9.983 1.00 0.00 H new ATOM 0 HD3 LYS A 23 15.051 4.973 -10.011 1.00 0.00 H new ATOM 0 HE2 LYS A 23 15.287 4.800 -7.462 1.00 0.00 H new ATOM 0 HE3 LYS A 23 14.813 3.118 -7.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 17.258 3.570 -7.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 16.721 2.624 -8.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 17.100 4.263 -9.110 1.00 0.00 H new ATOM 376 N THR A 24 10.245 5.405 -10.672 1.00 0.00 N ATOM 377 CA THR A 24 9.895 6.646 -11.323 1.00 0.00 C ATOM 378 C THR A 24 8.383 6.695 -11.552 1.00 0.00 C ATOM 379 O THR A 24 7.689 7.588 -11.072 1.00 0.00 O ATOM 380 CB THR A 24 10.767 6.735 -12.584 1.00 0.00 C ATOM 381 OG1 THR A 24 12.088 7.038 -12.188 1.00 0.00 O ATOM 382 CG2 THR A 24 10.268 7.747 -13.598 1.00 0.00 C ATOM 0 H THR A 24 10.561 4.691 -11.329 1.00 0.00 H new ATOM 0 HA THR A 24 10.100 7.533 -10.723 1.00 0.00 H new ATOM 0 HB THR A 24 10.722 5.771 -13.091 1.00 0.00 H new ATOM 0 HG1 THR A 24 12.615 6.213 -12.147 1.00 0.00 H new ATOM 0 HG21 THR A 24 10.933 7.755 -14.462 1.00 0.00 H new ATOM 0 HG22 THR A 24 9.262 7.476 -13.917 1.00 0.00 H new ATOM 0 HG23 THR A 24 10.250 8.738 -13.145 1.00 0.00 H new ATOM 390 N LEU A 25 7.874 5.689 -12.260 1.00 0.00 N ATOM 391 CA LEU A 25 6.482 5.591 -12.683 1.00 0.00 C ATOM 392 C LEU A 25 5.595 5.213 -11.497 1.00 0.00 C ATOM 393 O LEU A 25 4.463 5.680 -11.388 1.00 0.00 O ATOM 394 CB LEU A 25 6.387 4.505 -13.771 1.00 0.00 C ATOM 395 CG LEU A 25 7.175 4.792 -15.060 1.00 0.00 C ATOM 396 CD1 LEU A 25 7.276 3.490 -15.860 1.00 0.00 C ATOM 397 CD2 LEU A 25 6.538 5.905 -15.896 1.00 0.00 C ATOM 0 H LEU A 25 8.438 4.895 -12.564 1.00 0.00 H new ATOM 0 HA LEU A 25 6.143 6.551 -13.073 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.740 3.563 -13.352 1.00 0.00 H new ATOM 0 HB3 LEU A 25 5.338 4.365 -14.030 1.00 0.00 H new ATOM 0 HG LEU A 25 8.170 5.149 -14.794 1.00 0.00 H new ATOM 0 HD11 LEU A 25 7.832 3.670 -16.780 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.793 2.737 -15.265 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.275 3.135 -16.105 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.132 6.070 -16.795 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.526 5.615 -16.178 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.502 6.824 -15.311 1.00 0.00 H new ATOM 409 N GLY A 26 6.119 4.359 -10.610 1.00 0.00 N ATOM 410 CA GLY A 26 5.413 3.813 -9.458 1.00 0.00 C ATOM 411 C GLY A 26 5.628 4.624 -8.187 1.00 0.00 C ATOM 412 O GLY A 26 5.257 4.146 -7.116 1.00 0.00 O ATOM 0 H GLY A 26 7.079 4.021 -10.682 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.347 3.771 -9.679 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.744 2.788 -9.289 1.00 0.00 H new ATOM 416 N ALA A 27 6.246 5.809 -8.278 1.00 0.00 N ATOM 417 CA ALA A 27 6.609 6.649 -7.142 1.00 0.00 C ATOM 418 C ALA A 27 5.402 6.856 -6.219 1.00 0.00 C ATOM 419 O ALA A 27 4.354 7.334 -6.654 1.00 0.00 O ATOM 420 CB ALA A 27 7.130 8.001 -7.652 1.00 0.00 C ATOM 0 H ALA A 27 6.513 6.217 -9.174 1.00 0.00 H new ATOM 0 HA ALA A 27 7.393 6.154 -6.569 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.402 8.630 -6.804 1.00 0.00 H new ATOM 0 HB2 ALA A 27 8.006 7.840 -8.280 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.352 8.494 -8.235 1.00 0.00 H new ATOM 426 N GLY A 28 5.557 6.481 -4.945 1.00 0.00 N ATOM 427 CA GLY A 28 4.525 6.606 -3.916 1.00 0.00 C ATOM 428 C GLY A 28 3.416 5.549 -3.998 1.00 0.00 C ATOM 429 O GLY A 28 2.614 5.452 -3.068 1.00 0.00 O ATOM 0 H GLY A 28 6.424 6.073 -4.595 1.00 0.00 H new ATOM 0 HA2 GLY A 28 4.997 6.544 -2.936 1.00 0.00 H new ATOM 0 HA3 GLY A 28 4.073 7.595 -3.990 1.00 0.00 H new ATOM 433 N LYS A 29 3.366 4.735 -5.062 1.00 0.00 N ATOM 434 CA LYS A 29 2.364 3.680 -5.241 1.00 0.00 C ATOM 435 C LYS A 29 2.936 2.331 -4.834 1.00 0.00 C ATOM 436 O LYS A 29 2.269 1.575 -4.133 1.00 0.00 O ATOM 437 CB LYS A 29 1.847 3.637 -6.695 1.00 0.00 C ATOM 438 CG LYS A 29 1.329 4.992 -7.198 1.00 0.00 C ATOM 439 CD LYS A 29 0.715 4.867 -8.600 1.00 0.00 C ATOM 440 CE LYS A 29 0.352 6.239 -9.194 1.00 0.00 C ATOM 441 NZ LYS A 29 -0.817 6.887 -8.535 1.00 0.00 N ATOM 0 H LYS A 29 4.031 4.794 -5.833 1.00 0.00 H new ATOM 0 HA LYS A 29 1.516 3.908 -4.595 1.00 0.00 H new ATOM 0 HB2 LYS A 29 2.651 3.298 -7.349 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.046 2.901 -6.767 1.00 0.00 H new ATOM 0 HG2 LYS A 29 0.582 5.379 -6.504 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.147 5.712 -7.219 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.419 4.361 -9.260 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -0.179 4.245 -8.550 1.00 0.00 H new ATOM 0 HE2 LYS A 29 1.215 6.900 -9.114 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.139 6.120 -10.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -1.004 7.806 -8.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -1.653 6.277 -8.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -0.611 7.032 -7.526 1.00 0.00 H new ATOM 455 N ILE A 30 4.153 2.015 -5.290 1.00 0.00 N ATOM 456 CA ILE A 30 4.743 0.682 -5.168 1.00 0.00 C ATOM 457 C ILE A 30 6.233 0.814 -4.801 1.00 0.00 C ATOM 458 O ILE A 30 6.869 1.806 -5.150 1.00 0.00 O ATOM 459 CB ILE A 30 4.447 -0.138 -6.451 1.00 0.00 C ATOM 460 CG1 ILE A 30 5.130 0.432 -7.714 1.00 0.00 C ATOM 461 CG2 ILE A 30 2.926 -0.236 -6.689 1.00 0.00 C ATOM 462 CD1 ILE A 30 4.832 -0.355 -9.000 1.00 0.00 C ATOM 0 H ILE A 30 4.761 2.687 -5.759 1.00 0.00 H new ATOM 0 HA ILE A 30 4.291 0.115 -4.354 1.00 0.00 H new ATOM 0 HB ILE A 30 4.867 -1.129 -6.279 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.811 1.465 -7.851 1.00 0.00 H new ATOM 0 HG13 ILE A 30 6.208 0.450 -7.554 1.00 0.00 H new ATOM 0 HG21 ILE A 30 2.736 -0.814 -7.593 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.455 -0.728 -5.838 1.00 0.00 H new ATOM 0 HG23 ILE A 30 2.511 0.765 -6.805 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.349 0.110 -9.839 1.00 0.00 H new ATOM 0 HD12 ILE A 30 5.177 -1.383 -8.886 1.00 0.00 H new ATOM 0 HD13 ILE A 30 3.758 -0.352 -9.188 1.00 0.00 H new ATOM 474 N ALA A 31 6.771 -0.161 -4.060 1.00 0.00 N ATOM 475 CA ALA A 31 8.095 -0.114 -3.440 1.00 0.00 C ATOM 476 C ALA A 31 8.998 -1.150 -4.102 1.00 0.00 C ATOM 477 O ALA A 31 8.810 -2.339 -3.870 1.00 0.00 O ATOM 478 CB ALA A 31 7.962 -0.416 -1.938 1.00 0.00 C ATOM 0 H ALA A 31 6.278 -1.033 -3.870 1.00 0.00 H new ATOM 0 HA ALA A 31 8.531 0.876 -3.570 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.947 -0.382 -1.471 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.314 0.328 -1.473 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.531 -1.408 -1.803 1.00 0.00 H new ATOM 484 N VAL A 32 9.952 -0.745 -4.934 1.00 0.00 N ATOM 485 CA VAL A 32 10.844 -1.683 -5.611 1.00 0.00 C ATOM 486 C VAL A 32 12.019 -2.034 -4.693 1.00 0.00 C ATOM 487 O VAL A 32 12.631 -1.138 -4.104 1.00 0.00 O ATOM 488 CB VAL A 32 11.349 -1.090 -6.937 1.00 0.00 C ATOM 489 CG1 VAL A 32 11.838 -2.223 -7.848 1.00 0.00 C ATOM 490 CG2 VAL A 32 10.289 -0.270 -7.695 1.00 0.00 C ATOM 0 H VAL A 32 10.129 0.234 -5.158 1.00 0.00 H new ATOM 0 HA VAL A 32 10.291 -2.594 -5.840 1.00 0.00 H new ATOM 0 HB VAL A 32 12.157 -0.405 -6.678 1.00 0.00 H new ATOM 0 HG11 VAL A 32 12.196 -1.805 -8.789 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.650 -2.760 -7.357 1.00 0.00 H new ATOM 0 HG13 VAL A 32 11.016 -2.911 -8.047 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.720 0.115 -8.619 1.00 0.00 H new ATOM 0 HG22 VAL A 32 9.436 -0.907 -7.930 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.960 0.563 -7.073 1.00 0.00 H new ATOM 500 N THR A 33 12.384 -3.315 -4.661 1.00 0.00 N ATOM 501 CA THR A 33 13.575 -3.834 -4.027 1.00 0.00 C ATOM 502 C THR A 33 14.042 -4.998 -4.896 1.00 0.00 C ATOM 503 O THR A 33 13.586 -6.128 -4.735 1.00 0.00 O ATOM 504 CB THR A 33 13.245 -4.322 -2.611 1.00 0.00 C ATOM 505 OG1 THR A 33 12.486 -3.376 -1.861 1.00 0.00 O ATOM 506 CG2 THR A 33 14.542 -4.632 -1.850 1.00 0.00 C ATOM 0 H THR A 33 11.825 -4.046 -5.100 1.00 0.00 H new ATOM 0 HA THR A 33 14.349 -3.072 -3.937 1.00 0.00 H new ATOM 0 HB THR A 33 12.637 -5.220 -2.724 1.00 0.00 H new ATOM 0 HG1 THR A 33 11.933 -3.848 -1.203 1.00 0.00 H new ATOM 0 HG21 THR A 33 14.300 -4.978 -0.845 1.00 0.00 H new ATOM 0 HG22 THR A 33 15.097 -5.408 -2.377 1.00 0.00 H new ATOM 0 HG23 THR A 33 15.151 -3.730 -1.787 1.00 0.00 H new ATOM 514 N SER A 34 14.918 -4.738 -5.862 1.00 0.00 N ATOM 515 CA SER A 34 15.264 -5.754 -6.843 1.00 0.00 C ATOM 516 C SER A 34 16.447 -6.601 -6.363 1.00 0.00 C ATOM 517 O SER A 34 17.559 -6.520 -6.890 1.00 0.00 O ATOM 518 CB SER A 34 15.422 -5.114 -8.212 1.00 0.00 C ATOM 519 OG SER A 34 14.120 -4.738 -8.648 1.00 0.00 O ATOM 0 H SER A 34 15.394 -3.844 -5.984 1.00 0.00 H new ATOM 0 HA SER A 34 14.453 -6.474 -6.953 1.00 0.00 H new ATOM 0 HB2 SER A 34 16.077 -4.244 -8.158 1.00 0.00 H new ATOM 0 HB3 SER A 34 15.877 -5.813 -8.914 1.00 0.00 H new ATOM 0 HG SER A 34 14.122 -4.621 -9.621 1.00 0.00 H new ATOM 525 N SER A 35 16.189 -7.399 -5.329 1.00 0.00 N ATOM 526 CA SER A 35 17.069 -8.442 -4.813 1.00 0.00 C ATOM 527 C SER A 35 17.318 -9.523 -5.882 1.00 0.00 C ATOM 528 O SER A 35 16.605 -9.589 -6.889 1.00 0.00 O ATOM 529 CB SER A 35 16.423 -9.004 -3.542 1.00 0.00 C ATOM 530 OG SER A 35 16.050 -7.923 -2.698 1.00 0.00 O ATOM 0 H SER A 35 15.317 -7.331 -4.803 1.00 0.00 H new ATOM 0 HA SER A 35 18.051 -8.040 -4.565 1.00 0.00 H new ATOM 0 HB2 SER A 35 15.548 -9.602 -3.797 1.00 0.00 H new ATOM 0 HB3 SER A 35 17.120 -9.663 -3.025 1.00 0.00 H new ATOM 0 HG SER A 35 15.946 -8.247 -1.779 1.00 0.00 H new ATOM 536 N GLY A 36 18.332 -10.374 -5.691 1.00 0.00 N ATOM 537 CA GLY A 36 18.821 -11.306 -6.692 1.00 0.00 C ATOM 538 C GLY A 36 19.563 -12.412 -5.970 1.00 0.00 C ATOM 539 O GLY A 36 19.450 -12.541 -4.753 1.00 0.00 O ATOM 0 H GLY A 36 18.843 -10.429 -4.810 1.00 0.00 H new ATOM 0 HA2 GLY A 36 17.993 -11.716 -7.270 1.00 0.00 H new ATOM 0 HA3 GLY A 36 19.481 -10.799 -7.396 1.00 0.00 H new ATOM 543 N LEU A 37 20.303 -13.233 -6.705 1.00 0.00 N ATOM 544 CA LEU A 37 21.066 -14.352 -6.164 1.00 0.00 C ATOM 545 C LEU A 37 22.547 -14.257 -6.538 1.00 0.00 C ATOM 546 O LEU A 37 23.366 -15.052 -6.077 1.00 0.00 O ATOM 547 CB LEU A 37 20.389 -15.645 -6.625 1.00 0.00 C ATOM 548 CG LEU A 37 19.104 -15.906 -5.818 1.00 0.00 C ATOM 549 CD1 LEU A 37 18.131 -16.784 -6.609 1.00 0.00 C ATOM 550 CD2 LEU A 37 19.420 -16.571 -4.472 1.00 0.00 C ATOM 0 H LEU A 37 20.392 -13.137 -7.717 1.00 0.00 H new ATOM 0 HA LEU A 37 21.063 -14.334 -5.074 1.00 0.00 H new ATOM 0 HB2 LEU A 37 20.150 -15.577 -7.686 1.00 0.00 H new ATOM 0 HB3 LEU A 37 21.076 -16.483 -6.506 1.00 0.00 H new ATOM 0 HG LEU A 37 18.637 -14.940 -5.629 1.00 0.00 H new ATOM 0 HD11 LEU A 37 17.231 -16.954 -6.018 1.00 0.00 H new ATOM 0 HD12 LEU A 37 17.864 -16.284 -7.540 1.00 0.00 H new ATOM 0 HD13 LEU A 37 18.604 -17.740 -6.833 1.00 0.00 H new ATOM 0 HD21 LEU A 37 18.493 -16.743 -3.925 1.00 0.00 H new ATOM 0 HD22 LEU A 37 19.921 -17.523 -4.645 1.00 0.00 H new ATOM 0 HD23 LEU A 37 20.071 -15.920 -3.888 1.00 0.00 H new ATOM 562 N GLU A 38 22.876 -13.245 -7.337 1.00 0.00 N ATOM 563 CA GLU A 38 24.205 -12.775 -7.685 1.00 0.00 C ATOM 564 C GLU A 38 24.121 -11.265 -7.762 1.00 0.00 C ATOM 565 O GLU A 38 23.050 -10.723 -8.067 1.00 0.00 O ATOM 566 CB GLU A 38 24.661 -13.289 -9.052 1.00 0.00 C ATOM 567 CG GLU A 38 25.212 -14.704 -8.940 1.00 0.00 C ATOM 568 CD GLU A 38 25.725 -15.253 -10.287 1.00 0.00 C ATOM 569 OE1 GLU A 38 26.371 -14.496 -11.055 1.00 0.00 O ATOM 570 OE2 GLU A 38 25.519 -16.461 -10.568 1.00 0.00 O ATOM 0 H GLU A 38 22.154 -12.688 -7.794 1.00 0.00 H new ATOM 0 HA GLU A 38 24.916 -13.132 -6.940 1.00 0.00 H new ATOM 0 HB2 GLU A 38 23.823 -13.274 -9.749 1.00 0.00 H new ATOM 0 HB3 GLU A 38 25.426 -12.627 -9.458 1.00 0.00 H new ATOM 0 HG2 GLU A 38 26.025 -14.716 -8.214 1.00 0.00 H new ATOM 0 HG3 GLU A 38 24.433 -15.363 -8.557 1.00 0.00 H new ATOM 577 N SER A 39 25.242 -10.584 -7.542 1.00 0.00 N ATOM 578 CA SER A 39 25.252 -9.139 -7.589 1.00 0.00 C ATOM 579 C SER A 39 26.565 -8.552 -8.065 1.00 0.00 C ATOM 580 O SER A 39 27.608 -9.213 -8.120 1.00 0.00 O ATOM 581 CB SER A 39 24.771 -8.591 -6.248 1.00 0.00 C ATOM 582 OG SER A 39 25.550 -9.080 -5.161 1.00 0.00 O ATOM 0 H SER A 39 26.144 -11.012 -7.332 1.00 0.00 H new ATOM 0 HA SER A 39 24.551 -8.813 -8.357 1.00 0.00 H new ATOM 0 HB2 SER A 39 24.815 -7.502 -6.265 1.00 0.00 H new ATOM 0 HB3 SER A 39 23.727 -8.865 -6.098 1.00 0.00 H new ATOM 0 HG SER A 39 25.212 -8.705 -4.321 1.00 0.00 H new ATOM 588 N SER A 40 26.439 -7.298 -8.487 1.00 0.00 N ATOM 589 CA SER A 40 27.433 -6.537 -9.204 1.00 0.00 C ATOM 590 C SER A 40 26.988 -5.071 -9.113 1.00 0.00 C ATOM 591 O SER A 40 26.380 -4.663 -8.121 1.00 0.00 O ATOM 592 CB SER A 40 27.385 -7.100 -10.631 1.00 0.00 C ATOM 593 OG SER A 40 26.125 -6.821 -11.230 1.00 0.00 O ATOM 0 H SER A 40 25.587 -6.762 -8.323 1.00 0.00 H new ATOM 0 HA SER A 40 28.454 -6.599 -8.827 1.00 0.00 H new ATOM 0 HB2 SER A 40 28.184 -6.662 -11.229 1.00 0.00 H new ATOM 0 HB3 SER A 40 27.555 -8.176 -10.610 1.00 0.00 H new ATOM 0 HG SER A 40 26.155 -7.057 -12.181 1.00 0.00 H new ATOM 599 N ARG A 41 27.220 -4.297 -10.174 1.00 0.00 N ATOM 600 CA ARG A 41 26.662 -2.962 -10.371 1.00 0.00 C ATOM 601 C ARG A 41 26.204 -2.899 -11.827 1.00 0.00 C ATOM 602 O ARG A 41 26.410 -3.837 -12.598 1.00 0.00 O ATOM 603 CB ARG A 41 27.703 -1.873 -10.036 1.00 0.00 C ATOM 604 CG ARG A 41 27.107 -0.756 -9.167 1.00 0.00 C ATOM 605 CD ARG A 41 28.181 0.266 -8.779 1.00 0.00 C ATOM 606 NE ARG A 41 27.599 1.377 -8.006 1.00 0.00 N ATOM 607 CZ ARG A 41 28.276 2.321 -7.336 1.00 0.00 C ATOM 608 NH1 ARG A 41 29.608 2.336 -7.328 1.00 0.00 N ATOM 609 NH2 ARG A 41 27.600 3.258 -6.676 1.00 0.00 N ATOM 0 H ARG A 41 27.821 -4.593 -10.943 1.00 0.00 H new ATOM 0 HA ARG A 41 25.821 -2.776 -9.703 1.00 0.00 H new ATOM 0 HB2 ARG A 41 28.547 -2.326 -9.516 1.00 0.00 H new ATOM 0 HB3 ARG A 41 28.091 -1.445 -10.961 1.00 0.00 H new ATOM 0 HG2 ARG A 41 26.304 -0.257 -9.709 1.00 0.00 H new ATOM 0 HG3 ARG A 41 26.666 -1.185 -8.268 1.00 0.00 H new ATOM 0 HD2 ARG A 41 28.958 -0.223 -8.191 1.00 0.00 H new ATOM 0 HD3 ARG A 41 28.659 0.655 -9.678 1.00 0.00 H new ATOM 0 HE ARG A 41 26.581 1.434 -7.978 1.00 0.00 H new ATOM 0 HH11 ARG A 41 30.129 1.622 -7.837 1.00 0.00 H new ATOM 0 HH12 ARG A 41 30.107 3.062 -6.813 1.00 0.00 H new ATOM 0 HH21 ARG A 41 26.580 3.252 -6.684 1.00 0.00 H new ATOM 0 HH22 ARG A 41 28.102 3.982 -6.162 1.00 0.00 H new ATOM 623 N VAL A 42 25.532 -1.816 -12.185 1.00 0.00 N ATOM 624 CA VAL A 42 25.009 -1.619 -13.525 1.00 0.00 C ATOM 625 C VAL A 42 26.121 -1.095 -14.454 1.00 0.00 C ATOM 626 O VAL A 42 27.229 -0.801 -13.994 1.00 0.00 O ATOM 627 CB VAL A 42 23.788 -0.704 -13.427 1.00 0.00 C ATOM 628 CG1 VAL A 42 22.786 -1.163 -12.359 1.00 0.00 C ATOM 629 CG2 VAL A 42 24.185 0.749 -13.173 1.00 0.00 C ATOM 0 H VAL A 42 25.334 -1.044 -11.548 1.00 0.00 H new ATOM 0 HA VAL A 42 24.678 -2.556 -13.973 1.00 0.00 H new ATOM 0 HB VAL A 42 23.295 -0.769 -14.397 1.00 0.00 H new ATOM 0 HG11 VAL A 42 21.940 -0.476 -12.334 1.00 0.00 H new ATOM 0 HG12 VAL A 42 22.432 -2.166 -12.599 1.00 0.00 H new ATOM 0 HG13 VAL A 42 23.273 -1.174 -11.384 1.00 0.00 H new ATOM 0 HG21 VAL A 42 23.288 1.366 -13.110 1.00 0.00 H new ATOM 0 HG22 VAL A 42 24.738 0.817 -12.236 1.00 0.00 H new ATOM 0 HG23 VAL A 42 24.812 1.103 -13.991 1.00 0.00 H new ATOM 639 N HIS A 43 25.830 -0.954 -15.751 1.00 0.00 N ATOM 640 CA HIS A 43 26.834 -0.569 -16.748 1.00 0.00 C ATOM 641 C HIS A 43 26.896 0.961 -16.933 1.00 0.00 C ATOM 642 O HIS A 43 25.875 1.629 -16.772 1.00 0.00 O ATOM 643 CB HIS A 43 26.565 -1.350 -18.044 1.00 0.00 C ATOM 644 CG HIS A 43 26.741 -2.838 -17.835 1.00 0.00 C ATOM 645 ND1 HIS A 43 27.934 -3.532 -17.857 1.00 0.00 N ATOM 646 CD2 HIS A 43 25.762 -3.749 -17.536 1.00 0.00 C ATOM 647 CE1 HIS A 43 27.669 -4.827 -17.609 1.00 0.00 C ATOM 648 NE2 HIS A 43 26.353 -5.009 -17.400 1.00 0.00 N ATOM 0 H HIS A 43 24.898 -1.102 -16.138 1.00 0.00 H new ATOM 0 HA HIS A 43 27.832 -0.838 -16.403 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.552 -1.146 -18.390 1.00 0.00 H new ATOM 0 HB3 HIS A 43 27.244 -1.007 -18.825 1.00 0.00 H new ATOM 0 HD1 HIS A 43 28.856 -3.132 -18.031 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.710 -3.530 -17.424 1.00 0.00 H new ATOM 0 HE1 HIS A 43 28.410 -5.612 -17.581 1.00 0.00 H new ATOM 656 N PRO A 44 28.053 1.555 -17.292 1.00 0.00 N ATOM 657 CA PRO A 44 28.228 3.013 -17.302 1.00 0.00 C ATOM 658 C PRO A 44 27.317 3.725 -18.303 1.00 0.00 C ATOM 659 O PRO A 44 26.662 4.709 -17.958 1.00 0.00 O ATOM 660 CB PRO A 44 29.702 3.265 -17.644 1.00 0.00 C ATOM 661 CG PRO A 44 30.186 1.951 -18.259 1.00 0.00 C ATOM 662 CD PRO A 44 29.323 0.898 -17.571 1.00 0.00 C ATOM 0 HA PRO A 44 27.953 3.419 -16.329 1.00 0.00 H new ATOM 0 HB2 PRO A 44 29.810 4.094 -18.344 1.00 0.00 H new ATOM 0 HB3 PRO A 44 30.277 3.522 -16.754 1.00 0.00 H new ATOM 0 HG2 PRO A 44 30.048 1.939 -19.340 1.00 0.00 H new ATOM 0 HG3 PRO A 44 31.247 1.786 -18.071 1.00 0.00 H new ATOM 0 HD2 PRO A 44 29.182 0.027 -18.211 1.00 0.00 H new ATOM 0 HD3 PRO A 44 29.792 0.545 -16.653 1.00 0.00 H new ATOM 670 N THR A 45 27.220 3.214 -19.533 1.00 0.00 N ATOM 671 CA THR A 45 26.403 3.845 -20.568 1.00 0.00 C ATOM 672 C THR A 45 24.908 3.713 -20.225 1.00 0.00 C ATOM 673 O THR A 45 24.114 4.560 -20.632 1.00 0.00 O ATOM 674 CB THR A 45 26.790 3.272 -21.938 1.00 0.00 C ATOM 675 OG1 THR A 45 28.205 3.182 -22.063 1.00 0.00 O ATOM 676 CG2 THR A 45 26.214 4.048 -23.130 1.00 0.00 C ATOM 0 H THR A 45 27.698 2.365 -19.835 1.00 0.00 H new ATOM 0 HA THR A 45 26.596 4.917 -20.614 1.00 0.00 H new ATOM 0 HB THR A 45 26.343 2.278 -21.972 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.433 2.813 -22.942 1.00 0.00 H new ATOM 0 HG21 THR A 45 26.535 3.578 -24.060 1.00 0.00 H new ATOM 0 HG22 THR A 45 25.125 4.041 -23.077 1.00 0.00 H new ATOM 0 HG23 THR A 45 26.572 5.077 -23.101 1.00 0.00 H new ATOM 684 N ALA A 46 24.533 2.721 -19.394 1.00 0.00 N ATOM 685 CA ALA A 46 23.192 2.636 -18.836 1.00 0.00 C ATOM 686 C ALA A 46 22.947 3.873 -18.008 1.00 0.00 C ATOM 687 O ALA A 46 22.031 4.629 -18.297 1.00 0.00 O ATOM 688 CB ALA A 46 23.002 1.369 -17.981 1.00 0.00 C ATOM 0 H ALA A 46 25.154 1.967 -19.100 1.00 0.00 H new ATOM 0 HA ALA A 46 22.472 2.573 -19.652 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.987 1.346 -17.584 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.171 0.486 -18.597 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.714 1.377 -17.156 1.00 0.00 H new ATOM 694 N ILE A 47 23.809 4.116 -17.027 1.00 0.00 N ATOM 695 CA ILE A 47 23.622 5.219 -16.097 1.00 0.00 C ATOM 696 C ILE A 47 23.523 6.512 -16.897 1.00 0.00 C ATOM 697 O ILE A 47 22.681 7.337 -16.572 1.00 0.00 O ATOM 698 CB ILE A 47 24.790 5.286 -15.083 1.00 0.00 C ATOM 699 CG1 ILE A 47 24.880 3.988 -14.252 1.00 0.00 C ATOM 700 CG2 ILE A 47 24.650 6.514 -14.167 1.00 0.00 C ATOM 701 CD1 ILE A 47 26.202 3.826 -13.491 1.00 0.00 C ATOM 0 H ILE A 47 24.647 3.560 -16.856 1.00 0.00 H new ATOM 0 HA ILE A 47 22.705 5.069 -15.526 1.00 0.00 H new ATOM 0 HB ILE A 47 25.717 5.387 -15.647 1.00 0.00 H new ATOM 0 HG12 ILE A 47 24.057 3.968 -13.538 1.00 0.00 H new ATOM 0 HG13 ILE A 47 24.747 3.134 -14.916 1.00 0.00 H new ATOM 0 HG21 ILE A 47 25.482 6.540 -13.463 1.00 0.00 H new ATOM 0 HG22 ILE A 47 24.658 7.421 -14.771 1.00 0.00 H new ATOM 0 HG23 ILE A 47 23.711 6.452 -13.617 1.00 0.00 H new ATOM 0 HD11 ILE A 47 26.188 2.890 -12.932 1.00 0.00 H new ATOM 0 HD12 ILE A 47 27.030 3.813 -14.199 1.00 0.00 H new ATOM 0 HD13 ILE A 47 26.329 4.660 -12.800 1.00 0.00 H new ATOM 713 N ALA A 48 24.309 6.672 -17.961 1.00 0.00 N ATOM 714 CA ALA A 48 24.280 7.891 -18.750 1.00 0.00 C ATOM 715 C ALA A 48 22.912 8.117 -19.398 1.00 0.00 C ATOM 716 O ALA A 48 22.343 9.192 -19.226 1.00 0.00 O ATOM 717 CB ALA A 48 25.405 7.869 -19.790 1.00 0.00 C ATOM 0 H ALA A 48 24.971 5.970 -18.292 1.00 0.00 H new ATOM 0 HA ALA A 48 24.447 8.736 -18.081 1.00 0.00 H new ATOM 0 HB1 ALA A 48 25.376 8.787 -20.377 1.00 0.00 H new ATOM 0 HB2 ALA A 48 26.367 7.793 -19.284 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.273 7.012 -20.450 1.00 0.00 H new ATOM 723 N MET A 49 22.336 7.127 -20.094 1.00 0.00 N ATOM 724 CA MET A 49 21.030 7.320 -20.745 1.00 0.00 C ATOM 725 C MET A 49 19.906 7.373 -19.705 1.00 0.00 C ATOM 726 O MET A 49 18.900 8.078 -19.847 1.00 0.00 O ATOM 727 CB MET A 49 20.768 6.195 -21.758 1.00 0.00 C ATOM 728 CG MET A 49 21.779 6.157 -22.913 1.00 0.00 C ATOM 729 SD MET A 49 21.961 7.692 -23.862 1.00 0.00 S ATOM 730 CE MET A 49 23.614 8.174 -23.292 1.00 0.00 C ATOM 0 H MET A 49 22.743 6.200 -20.220 1.00 0.00 H new ATOM 0 HA MET A 49 21.049 8.272 -21.275 1.00 0.00 H new ATOM 0 HB2 MET A 49 20.788 5.237 -21.238 1.00 0.00 H new ATOM 0 HB3 MET A 49 19.765 6.314 -22.168 1.00 0.00 H new ATOM 0 HG2 MET A 49 22.754 5.886 -22.507 1.00 0.00 H new ATOM 0 HG3 MET A 49 21.487 5.362 -23.599 1.00 0.00 H new ATOM 0 HE1 MET A 49 23.906 9.108 -23.771 1.00 0.00 H new ATOM 0 HE2 MET A 49 23.601 8.309 -22.211 1.00 0.00 H new ATOM 0 HE3 MET A 49 24.330 7.394 -23.551 1.00 0.00 H new ATOM 740 N MET A 50 20.083 6.646 -18.615 1.00 0.00 N ATOM 741 CA MET A 50 19.088 6.566 -17.573 1.00 0.00 C ATOM 742 C MET A 50 19.096 7.918 -16.845 1.00 0.00 C ATOM 743 O MET A 50 18.038 8.438 -16.510 1.00 0.00 O ATOM 744 CB MET A 50 19.360 5.334 -16.696 1.00 0.00 C ATOM 745 CG MET A 50 19.326 3.950 -17.409 1.00 0.00 C ATOM 746 SD MET A 50 19.073 3.808 -19.220 1.00 0.00 S ATOM 747 CE MET A 50 19.305 2.018 -19.537 1.00 0.00 C ATOM 0 H MET A 50 20.923 6.096 -18.433 1.00 0.00 H new ATOM 0 HA MET A 50 18.076 6.410 -17.948 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.339 5.455 -16.233 1.00 0.00 H new ATOM 0 HB3 MET A 50 18.626 5.320 -15.890 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.269 3.454 -17.182 1.00 0.00 H new ATOM 0 HG3 MET A 50 18.537 3.368 -16.933 1.00 0.00 H new ATOM 0 HE1 MET A 50 20.197 1.869 -20.146 1.00 0.00 H new ATOM 0 HE2 MET A 50 19.421 1.493 -18.589 1.00 0.00 H new ATOM 0 HE3 MET A 50 18.435 1.626 -20.065 1.00 0.00 H new ATOM 757 N GLU A 51 20.247 8.577 -16.735 1.00 0.00 N ATOM 758 CA GLU A 51 20.374 9.921 -16.218 1.00 0.00 C ATOM 759 C GLU A 51 19.878 10.943 -17.249 1.00 0.00 C ATOM 760 O GLU A 51 19.490 12.044 -16.853 1.00 0.00 O ATOM 761 CB GLU A 51 21.822 10.177 -15.771 1.00 0.00 C ATOM 762 CG GLU A 51 22.019 11.533 -15.088 1.00 0.00 C ATOM 763 CD GLU A 51 23.435 11.663 -14.493 1.00 0.00 C ATOM 764 OE1 GLU A 51 24.392 11.959 -15.251 1.00 0.00 O ATOM 765 OE2 GLU A 51 23.594 11.503 -13.258 1.00 0.00 O ATOM 0 H GLU A 51 21.140 8.170 -17.014 1.00 0.00 H new ATOM 0 HA GLU A 51 19.741 10.037 -15.338 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.128 9.386 -15.086 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.478 10.118 -16.639 1.00 0.00 H new ATOM 0 HG2 GLU A 51 21.851 12.333 -15.809 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.278 11.655 -14.298 1.00 0.00 H new ATOM 772 N GLU A 52 19.795 10.593 -18.541 1.00 0.00 N ATOM 773 CA GLU A 52 19.123 11.460 -19.505 1.00 0.00 C ATOM 774 C GLU A 52 17.634 11.569 -19.162 1.00 0.00 C ATOM 775 O GLU A 52 17.057 12.648 -19.316 1.00 0.00 O ATOM 776 CB GLU A 52 19.360 11.086 -20.982 1.00 0.00 C ATOM 777 CG GLU A 52 20.782 11.381 -21.474 1.00 0.00 C ATOM 778 CD GLU A 52 21.053 12.893 -21.608 1.00 0.00 C ATOM 779 OE1 GLU A 52 20.687 13.489 -22.652 1.00 0.00 O ATOM 780 OE2 GLU A 52 21.643 13.498 -20.679 1.00 0.00 O ATOM 0 H GLU A 52 20.178 9.732 -18.932 1.00 0.00 H new ATOM 0 HA GLU A 52 19.583 12.443 -19.410 1.00 0.00 H new ATOM 0 HB2 GLU A 52 19.152 10.025 -21.116 1.00 0.00 H new ATOM 0 HB3 GLU A 52 18.650 11.631 -21.604 1.00 0.00 H new ATOM 0 HG2 GLU A 52 21.502 10.945 -20.781 1.00 0.00 H new ATOM 0 HG3 GLU A 52 20.937 10.899 -22.439 1.00 0.00 H new ATOM 787 N VAL A 53 17.028 10.501 -18.622 1.00 0.00 N ATOM 788 CA VAL A 53 15.683 10.562 -18.046 1.00 0.00 C ATOM 789 C VAL A 53 15.707 10.884 -16.536 1.00 0.00 C ATOM 790 O VAL A 53 14.680 10.791 -15.861 1.00 0.00 O ATOM 791 CB VAL A 53 14.850 9.330 -18.434 1.00 0.00 C ATOM 792 CG1 VAL A 53 14.519 9.372 -19.933 1.00 0.00 C ATOM 793 CG2 VAL A 53 15.480 7.982 -18.065 1.00 0.00 C ATOM 0 H VAL A 53 17.457 9.577 -18.574 1.00 0.00 H new ATOM 0 HA VAL A 53 15.160 11.409 -18.489 1.00 0.00 H new ATOM 0 HB VAL A 53 13.940 9.392 -17.838 1.00 0.00 H new ATOM 0 HG11 VAL A 53 13.929 8.496 -20.200 1.00 0.00 H new ATOM 0 HG12 VAL A 53 13.949 10.274 -20.155 1.00 0.00 H new ATOM 0 HG13 VAL A 53 15.444 9.376 -20.510 1.00 0.00 H new ATOM 0 HG21 VAL A 53 14.819 7.174 -18.378 1.00 0.00 H new ATOM 0 HG22 VAL A 53 16.442 7.880 -18.568 1.00 0.00 H new ATOM 0 HG23 VAL A 53 15.628 7.932 -16.986 1.00 0.00 H new ATOM 803 N GLY A 54 16.858 11.308 -16.001 1.00 0.00 N ATOM 804 CA GLY A 54 17.013 11.756 -14.622 1.00 0.00 C ATOM 805 C GLY A 54 16.970 10.619 -13.597 1.00 0.00 C ATOM 806 O GLY A 54 16.819 10.884 -12.403 1.00 0.00 O ATOM 0 H GLY A 54 17.727 11.348 -16.534 1.00 0.00 H new ATOM 0 HA2 GLY A 54 17.961 12.285 -14.525 1.00 0.00 H new ATOM 0 HA3 GLY A 54 16.224 12.472 -14.391 1.00 0.00 H new ATOM 810 N ILE A 55 17.081 9.365 -14.040 1.00 0.00 N ATOM 811 CA ILE A 55 17.005 8.181 -13.192 1.00 0.00 C ATOM 812 C ILE A 55 18.405 7.792 -12.709 1.00 0.00 C ATOM 813 O ILE A 55 19.380 7.879 -13.456 1.00 0.00 O ATOM 814 CB ILE A 55 16.276 7.041 -13.927 1.00 0.00 C ATOM 815 CG1 ILE A 55 14.807 7.445 -14.174 1.00 0.00 C ATOM 816 CG2 ILE A 55 16.373 5.688 -13.192 1.00 0.00 C ATOM 817 CD1 ILE A 55 13.923 6.305 -14.681 1.00 0.00 C ATOM 0 H ILE A 55 17.230 9.143 -15.024 1.00 0.00 H new ATOM 0 HA ILE A 55 16.415 8.399 -12.302 1.00 0.00 H new ATOM 0 HB ILE A 55 16.777 6.890 -14.883 1.00 0.00 H new ATOM 0 HG12 ILE A 55 14.387 7.831 -13.245 1.00 0.00 H new ATOM 0 HG13 ILE A 55 14.782 8.259 -14.898 1.00 0.00 H new ATOM 0 HG21 ILE A 55 15.840 4.926 -13.760 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.420 5.401 -13.094 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.928 5.779 -12.201 1.00 0.00 H new ATOM 0 HD11 ILE A 55 12.907 6.671 -14.829 1.00 0.00 H new ATOM 0 HD12 ILE A 55 14.316 5.933 -15.627 1.00 0.00 H new ATOM 0 HD13 ILE A 55 13.915 5.498 -13.949 1.00 0.00 H new ATOM 829 N ASP A 56 18.478 7.307 -11.467 1.00 0.00 N ATOM 830 CA ASP A 56 19.661 6.669 -10.905 1.00 0.00 C ATOM 831 C ASP A 56 19.380 5.167 -10.885 1.00 0.00 C ATOM 832 O ASP A 56 18.355 4.744 -10.342 1.00 0.00 O ATOM 833 CB ASP A 56 19.951 7.193 -9.493 1.00 0.00 C ATOM 834 CG ASP A 56 21.187 6.503 -8.883 1.00 0.00 C ATOM 835 OD1 ASP A 56 21.122 5.293 -8.562 1.00 0.00 O ATOM 836 OD2 ASP A 56 22.223 7.188 -8.702 1.00 0.00 O ATOM 0 H ASP A 56 17.696 7.350 -10.813 1.00 0.00 H new ATOM 0 HA ASP A 56 20.544 6.891 -11.504 1.00 0.00 H new ATOM 0 HB2 ASP A 56 20.114 8.270 -9.529 1.00 0.00 H new ATOM 0 HB3 ASP A 56 19.084 7.023 -8.854 1.00 0.00 H new ATOM 841 N ILE A 57 20.259 4.379 -11.505 1.00 0.00 N ATOM 842 CA ILE A 57 20.287 2.910 -11.401 1.00 0.00 C ATOM 843 C ILE A 57 21.638 2.462 -10.826 1.00 0.00 C ATOM 844 O ILE A 57 21.738 1.371 -10.275 1.00 0.00 O ATOM 845 CB ILE A 57 19.985 2.225 -12.749 1.00 0.00 C ATOM 846 CG1 ILE A 57 20.788 2.839 -13.912 1.00 0.00 C ATOM 847 CG2 ILE A 57 18.478 2.255 -13.047 1.00 0.00 C ATOM 848 CD1 ILE A 57 20.967 1.861 -15.073 1.00 0.00 C ATOM 0 H ILE A 57 20.992 4.749 -12.110 1.00 0.00 H new ATOM 0 HA ILE A 57 19.494 2.599 -10.721 1.00 0.00 H new ATOM 0 HB ILE A 57 20.303 1.186 -12.659 1.00 0.00 H new ATOM 0 HG12 ILE A 57 20.279 3.734 -14.269 1.00 0.00 H new ATOM 0 HG13 ILE A 57 21.767 3.152 -13.549 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.286 1.767 -14.002 1.00 0.00 H new ATOM 0 HG22 ILE A 57 17.940 1.731 -12.257 1.00 0.00 H new ATOM 0 HG23 ILE A 57 18.137 3.289 -13.093 1.00 0.00 H new ATOM 0 HD11 ILE A 57 21.539 2.340 -15.868 1.00 0.00 H new ATOM 0 HD12 ILE A 57 21.500 0.977 -14.725 1.00 0.00 H new ATOM 0 HD13 ILE A 57 19.989 1.568 -15.456 1.00 0.00 H new ATOM 860 N SER A 58 22.662 3.309 -10.941 1.00 0.00 N ATOM 861 CA SER A 58 23.981 3.253 -10.319 1.00 0.00 C ATOM 862 C SER A 58 23.960 2.754 -8.865 1.00 0.00 C ATOM 863 O SER A 58 24.872 2.041 -8.448 1.00 0.00 O ATOM 864 CB SER A 58 24.561 4.683 -10.366 1.00 0.00 C ATOM 865 OG SER A 58 23.912 5.485 -11.349 1.00 0.00 O ATOM 0 H SER A 58 22.576 4.135 -11.533 1.00 0.00 H new ATOM 0 HA SER A 58 24.589 2.534 -10.868 1.00 0.00 H new ATOM 0 HB2 SER A 58 24.455 5.151 -9.387 1.00 0.00 H new ATOM 0 HB3 SER A 58 25.628 4.636 -10.582 1.00 0.00 H new ATOM 0 HG SER A 58 24.304 6.383 -11.349 1.00 0.00 H new ATOM 871 N GLY A 59 22.926 3.105 -8.100 1.00 0.00 N ATOM 872 CA GLY A 59 22.757 2.716 -6.709 1.00 0.00 C ATOM 873 C GLY A 59 22.390 1.239 -6.508 1.00 0.00 C ATOM 874 O GLY A 59 22.402 0.777 -5.365 1.00 0.00 O ATOM 0 H GLY A 59 22.162 3.686 -8.446 1.00 0.00 H new ATOM 0 HA2 GLY A 59 23.681 2.926 -6.170 1.00 0.00 H new ATOM 0 HA3 GLY A 59 21.980 3.336 -6.262 1.00 0.00 H new ATOM 878 N GLN A 60 22.062 0.484 -7.568 1.00 0.00 N ATOM 879 CA GLN A 60 21.773 -0.933 -7.450 1.00 0.00 C ATOM 880 C GLN A 60 23.031 -1.697 -7.082 1.00 0.00 C ATOM 881 O GLN A 60 24.111 -1.473 -7.630 1.00 0.00 O ATOM 882 CB GLN A 60 21.239 -1.558 -8.747 1.00 0.00 C ATOM 883 CG GLN A 60 19.742 -1.348 -8.956 1.00 0.00 C ATOM 884 CD GLN A 60 19.218 -2.375 -9.959 1.00 0.00 C ATOM 885 OE1 GLN A 60 18.856 -3.491 -9.594 1.00 0.00 O ATOM 886 NE2 GLN A 60 19.147 -2.031 -11.233 1.00 0.00 N ATOM 0 H GLN A 60 21.993 0.846 -8.519 1.00 0.00 H new ATOM 0 HA GLN A 60 21.006 -1.007 -6.679 1.00 0.00 H new ATOM 0 HB2 GLN A 60 21.778 -1.134 -9.594 1.00 0.00 H new ATOM 0 HB3 GLN A 60 21.450 -2.627 -8.739 1.00 0.00 H new ATOM 0 HG2 GLN A 60 19.214 -1.448 -8.008 1.00 0.00 H new ATOM 0 HG3 GLN A 60 19.553 -0.338 -9.321 1.00 0.00 H new ATOM 0 HE21 GLN A 60 19.449 -1.103 -11.528 1.00 0.00 H new ATOM 0 HE22 GLN A 60 18.790 -2.694 -11.921 1.00 0.00 H new ATOM 895 N THR A 61 22.840 -2.666 -6.202 1.00 0.00 N ATOM 896 CA THR A 61 23.790 -3.688 -5.854 1.00 0.00 C ATOM 897 C THR A 61 22.923 -4.841 -5.324 1.00 0.00 C ATOM 898 O THR A 61 22.949 -5.940 -5.880 1.00 0.00 O ATOM 899 CB THR A 61 24.842 -3.100 -4.910 1.00 0.00 C ATOM 900 OG1 THR A 61 25.899 -2.486 -5.627 1.00 0.00 O ATOM 901 CG2 THR A 61 25.407 -4.113 -3.918 1.00 0.00 C ATOM 0 H THR A 61 21.965 -2.758 -5.687 1.00 0.00 H new ATOM 0 HA THR A 61 24.399 -4.078 -6.669 1.00 0.00 H new ATOM 0 HB THR A 61 24.314 -2.344 -4.329 1.00 0.00 H new ATOM 0 HG1 THR A 61 25.539 -2.036 -6.419 1.00 0.00 H new ATOM 0 HG21 THR A 61 26.146 -3.626 -3.282 1.00 0.00 H new ATOM 0 HG22 THR A 61 24.600 -4.507 -3.300 1.00 0.00 H new ATOM 0 HG23 THR A 61 25.879 -4.931 -4.462 1.00 0.00 H new ATOM 909 N SER A 62 22.045 -4.508 -4.366 1.00 0.00 N ATOM 910 CA SER A 62 20.965 -5.336 -3.851 1.00 0.00 C ATOM 911 C SER A 62 21.439 -6.549 -3.038 1.00 0.00 C ATOM 912 O SER A 62 22.603 -6.958 -3.082 1.00 0.00 O ATOM 913 CB SER A 62 19.975 -5.674 -4.978 1.00 0.00 C ATOM 914 OG SER A 62 19.698 -4.521 -5.773 1.00 0.00 O ATOM 0 H SER A 62 22.080 -3.597 -3.908 1.00 0.00 H new ATOM 0 HA SER A 62 20.423 -4.749 -3.109 1.00 0.00 H new ATOM 0 HB2 SER A 62 20.388 -6.463 -5.606 1.00 0.00 H new ATOM 0 HB3 SER A 62 19.048 -6.058 -4.551 1.00 0.00 H new ATOM 0 HG SER A 62 18.960 -4.717 -6.388 1.00 0.00 H new ATOM 920 N ASP A 63 20.519 -7.068 -2.227 1.00 0.00 N ATOM 921 CA ASP A 63 20.766 -8.124 -1.247 1.00 0.00 C ATOM 922 C ASP A 63 20.412 -9.486 -1.853 1.00 0.00 C ATOM 923 O ASP A 63 19.693 -9.536 -2.863 1.00 0.00 O ATOM 924 CB ASP A 63 19.938 -7.844 0.021 1.00 0.00 C ATOM 925 CG ASP A 63 20.823 -7.413 1.204 1.00 0.00 C ATOM 926 OD1 ASP A 63 21.467 -6.340 1.117 1.00 0.00 O ATOM 927 OD2 ASP A 63 20.858 -8.133 2.229 1.00 0.00 O ATOM 0 H ASP A 63 19.548 -6.754 -2.234 1.00 0.00 H new ATOM 0 HA ASP A 63 21.821 -8.141 -0.974 1.00 0.00 H new ATOM 0 HB2 ASP A 63 19.207 -7.063 -0.188 1.00 0.00 H new ATOM 0 HB3 ASP A 63 19.379 -8.739 0.294 1.00 0.00 H new ATOM 932 N PRO A 64 20.869 -10.605 -1.258 1.00 0.00 N ATOM 933 CA PRO A 64 20.389 -11.914 -1.654 1.00 0.00 C ATOM 934 C PRO A 64 18.883 -11.976 -1.376 1.00 0.00 C ATOM 935 O PRO A 64 18.428 -11.581 -0.301 1.00 0.00 O ATOM 936 CB PRO A 64 21.190 -12.925 -0.828 1.00 0.00 C ATOM 937 CG PRO A 64 21.602 -12.143 0.419 1.00 0.00 C ATOM 938 CD PRO A 64 21.726 -10.709 -0.085 1.00 0.00 C ATOM 0 HA PRO A 64 20.526 -12.130 -2.714 1.00 0.00 H new ATOM 0 HB2 PRO A 64 20.588 -13.797 -0.571 1.00 0.00 H new ATOM 0 HB3 PRO A 64 22.059 -13.288 -1.376 1.00 0.00 H new ATOM 0 HG2 PRO A 64 20.857 -12.227 1.210 1.00 0.00 H new ATOM 0 HG3 PRO A 64 22.544 -12.508 0.828 1.00 0.00 H new ATOM 0 HD2 PRO A 64 21.418 -10.000 0.684 1.00 0.00 H new ATOM 0 HD3 PRO A 64 22.760 -10.475 -0.339 1.00 0.00 H new ATOM 946 N ILE A 65 18.106 -12.519 -2.314 1.00 0.00 N ATOM 947 CA ILE A 65 16.645 -12.615 -2.222 1.00 0.00 C ATOM 948 C ILE A 65 16.223 -13.471 -1.016 1.00 0.00 C ATOM 949 O ILE A 65 15.101 -13.377 -0.521 1.00 0.00 O ATOM 950 CB ILE A 65 16.114 -13.148 -3.575 1.00 0.00 C ATOM 951 CG1 ILE A 65 14.677 -12.673 -3.840 1.00 0.00 C ATOM 952 CG2 ILE A 65 16.267 -14.672 -3.720 1.00 0.00 C ATOM 953 CD1 ILE A 65 14.170 -13.006 -5.251 1.00 0.00 C ATOM 0 H ILE A 65 18.480 -12.913 -3.177 1.00 0.00 H new ATOM 0 HA ILE A 65 16.201 -11.636 -2.043 1.00 0.00 H new ATOM 0 HB ILE A 65 16.745 -12.716 -4.352 1.00 0.00 H new ATOM 0 HG12 ILE A 65 14.012 -13.129 -3.107 1.00 0.00 H new ATOM 0 HG13 ILE A 65 14.626 -11.595 -3.690 1.00 0.00 H new ATOM 0 HG21 ILE A 65 15.877 -14.986 -4.688 1.00 0.00 H new ATOM 0 HG22 ILE A 65 17.321 -14.940 -3.649 1.00 0.00 H new ATOM 0 HG23 ILE A 65 15.711 -15.171 -2.926 1.00 0.00 H new ATOM 0 HD11 ILE A 65 13.149 -12.641 -5.366 1.00 0.00 H new ATOM 0 HD12 ILE A 65 14.812 -12.528 -5.991 1.00 0.00 H new ATOM 0 HD13 ILE A 65 14.188 -14.086 -5.399 1.00 0.00 H new ATOM 965 N GLU A 66 17.156 -14.282 -0.516 1.00 0.00 N ATOM 966 CA GLU A 66 16.978 -15.179 0.612 1.00 0.00 C ATOM 967 C GLU A 66 16.779 -14.378 1.906 1.00 0.00 C ATOM 968 O GLU A 66 16.181 -14.864 2.867 1.00 0.00 O ATOM 969 CB GLU A 66 18.227 -16.063 0.779 1.00 0.00 C ATOM 970 CG GLU A 66 18.830 -16.552 -0.543 1.00 0.00 C ATOM 971 CD GLU A 66 19.967 -17.562 -0.310 1.00 0.00 C ATOM 972 OE1 GLU A 66 21.145 -17.141 -0.195 1.00 0.00 O ATOM 973 OE2 GLU A 66 19.695 -18.787 -0.248 1.00 0.00 O ATOM 0 H GLU A 66 18.096 -14.329 -0.908 1.00 0.00 H new ATOM 0 HA GLU A 66 16.100 -15.796 0.421 1.00 0.00 H new ATOM 0 HB2 GLU A 66 18.985 -15.502 1.326 1.00 0.00 H new ATOM 0 HB3 GLU A 66 17.968 -16.928 1.389 1.00 0.00 H new ATOM 0 HG2 GLU A 66 18.051 -17.014 -1.149 1.00 0.00 H new ATOM 0 HG3 GLU A 66 19.210 -15.700 -1.107 1.00 0.00 H new ATOM 980 N ASN A 67 17.302 -13.147 1.925 1.00 0.00 N ATOM 981 CA ASN A 67 17.229 -12.228 3.062 1.00 0.00 C ATOM 982 C ASN A 67 15.816 -11.652 3.285 1.00 0.00 C ATOM 983 O ASN A 67 15.603 -10.822 4.172 1.00 0.00 O ATOM 984 CB ASN A 67 18.269 -11.103 2.929 1.00 0.00 C ATOM 985 CG ASN A 67 18.712 -10.532 4.281 1.00 0.00 C ATOM 986 OD1 ASN A 67 18.323 -10.987 5.356 1.00 0.00 O ATOM 987 ND2 ASN A 67 19.607 -9.557 4.268 1.00 0.00 N ATOM 0 H ASN A 67 17.801 -12.754 1.127 1.00 0.00 H new ATOM 0 HA ASN A 67 17.464 -12.817 3.949 1.00 0.00 H new ATOM 0 HB2 ASN A 67 19.142 -11.484 2.398 1.00 0.00 H new ATOM 0 HB3 ASN A 67 17.852 -10.300 2.321 1.00 0.00 H new ATOM 0 HD21 ASN A 67 19.971 -9.187 5.146 1.00 0.00 H new ATOM 0 HD22 ASN A 67 19.933 -9.176 3.380 1.00 0.00 H new ATOM 994 N PHE A 68 14.847 -12.063 2.462 1.00 0.00 N ATOM 995 CA PHE A 68 13.456 -11.615 2.462 1.00 0.00 C ATOM 996 C PHE A 68 12.537 -12.835 2.441 1.00 0.00 C ATOM 997 O PHE A 68 12.996 -13.981 2.509 1.00 0.00 O ATOM 998 CB PHE A 68 13.186 -10.745 1.219 1.00 0.00 C ATOM 999 CG PHE A 68 14.169 -9.616 1.032 1.00 0.00 C ATOM 1000 CD1 PHE A 68 15.361 -9.861 0.340 1.00 0.00 C ATOM 1001 CD2 PHE A 68 13.918 -8.352 1.590 1.00 0.00 C ATOM 1002 CE1 PHE A 68 16.320 -8.844 0.207 1.00 0.00 C ATOM 1003 CE2 PHE A 68 14.868 -7.325 1.443 1.00 0.00 C ATOM 1004 CZ PHE A 68 16.071 -7.572 0.754 1.00 0.00 C ATOM 0 H PHE A 68 15.025 -12.758 1.737 1.00 0.00 H new ATOM 0 HA PHE A 68 13.265 -11.024 3.358 1.00 0.00 H new ATOM 0 HB2 PHE A 68 13.206 -11.380 0.333 1.00 0.00 H new ATOM 0 HB3 PHE A 68 12.181 -10.329 1.291 1.00 0.00 H new ATOM 0 HD1 PHE A 68 15.543 -10.834 -0.092 1.00 0.00 H new ATOM 0 HD2 PHE A 68 13.000 -8.169 2.129 1.00 0.00 H new ATOM 0 HE1 PHE A 68 17.246 -9.038 -0.314 1.00 0.00 H new ATOM 0 HE2 PHE A 68 14.675 -6.347 1.859 1.00 0.00 H new ATOM 0 HZ PHE A 68 16.803 -6.785 0.645 1.00 0.00 H new ATOM 1014 N ASN A 69 11.229 -12.590 2.317 1.00 0.00 N ATOM 1015 CA ASN A 69 10.246 -13.619 2.058 1.00 0.00 C ATOM 1016 C ASN A 69 9.320 -13.099 0.981 1.00 0.00 C ATOM 1017 O ASN A 69 8.926 -11.932 1.031 1.00 0.00 O ATOM 1018 CB ASN A 69 9.436 -13.943 3.317 1.00 0.00 C ATOM 1019 CG ASN A 69 8.556 -15.188 3.205 1.00 0.00 C ATOM 1020 OD1 ASN A 69 8.310 -15.715 2.125 1.00 0.00 O ATOM 1021 ND2 ASN A 69 8.030 -15.667 4.321 1.00 0.00 N ATOM 0 H ASN A 69 10.829 -11.655 2.397 1.00 0.00 H new ATOM 0 HA ASN A 69 10.747 -14.535 1.744 1.00 0.00 H new ATOM 0 HB2 ASN A 69 10.124 -14.075 4.152 1.00 0.00 H new ATOM 0 HB3 ASN A 69 8.804 -13.088 3.557 1.00 0.00 H new ATOM 0 HD21 ASN A 69 7.415 -16.480 4.287 1.00 0.00 H new ATOM 0 HD22 ASN A 69 8.240 -15.223 5.215 1.00 0.00 H new ATOM 1028 N ALA A 70 8.917 -13.950 0.042 1.00 0.00 N ATOM 1029 CA ALA A 70 8.070 -13.514 -1.031 1.00 0.00 C ATOM 1030 C ALA A 70 6.675 -13.260 -0.490 1.00 0.00 C ATOM 1031 O ALA A 70 5.949 -12.444 -1.048 1.00 0.00 O ATOM 1032 CB ALA A 70 8.053 -14.552 -2.153 1.00 0.00 C ATOM 0 H ALA A 70 9.169 -14.938 0.014 1.00 0.00 H new ATOM 0 HA ALA A 70 8.457 -12.586 -1.452 1.00 0.00 H new ATOM 0 HB1 ALA A 70 7.406 -14.206 -2.959 1.00 0.00 H new ATOM 0 HB2 ALA A 70 9.064 -14.692 -2.534 1.00 0.00 H new ATOM 0 HB3 ALA A 70 7.676 -15.499 -1.767 1.00 0.00 H new ATOM 1038 N ASP A 71 6.319 -13.923 0.618 1.00 0.00 N ATOM 1039 CA ASP A 71 5.010 -13.778 1.217 1.00 0.00 C ATOM 1040 C ASP A 71 4.765 -12.344 1.719 1.00 0.00 C ATOM 1041 O ASP A 71 3.616 -11.905 1.804 1.00 0.00 O ATOM 1042 CB ASP A 71 4.837 -14.783 2.359 1.00 0.00 C ATOM 1043 CG ASP A 71 3.438 -14.679 2.987 1.00 0.00 C ATOM 1044 OD1 ASP A 71 2.449 -15.085 2.329 1.00 0.00 O ATOM 1045 OD2 ASP A 71 3.328 -14.241 4.158 1.00 0.00 O ATOM 0 H ASP A 71 6.935 -14.568 1.113 1.00 0.00 H new ATOM 0 HA ASP A 71 4.268 -13.983 0.445 1.00 0.00 H new ATOM 0 HB2 ASP A 71 4.995 -15.794 1.984 1.00 0.00 H new ATOM 0 HB3 ASP A 71 5.595 -14.604 3.122 1.00 0.00 H new ATOM 1050 N ASP A 72 5.838 -11.601 2.025 1.00 0.00 N ATOM 1051 CA ASP A 72 5.760 -10.204 2.431 1.00 0.00 C ATOM 1052 C ASP A 72 5.544 -9.269 1.231 1.00 0.00 C ATOM 1053 O ASP A 72 4.961 -8.188 1.363 1.00 0.00 O ATOM 1054 CB ASP A 72 7.046 -9.806 3.153 1.00 0.00 C ATOM 1055 CG ASP A 72 6.913 -8.397 3.753 1.00 0.00 C ATOM 1056 OD1 ASP A 72 6.136 -8.223 4.725 1.00 0.00 O ATOM 1057 OD2 ASP A 72 7.610 -7.464 3.293 1.00 0.00 O ATOM 0 H ASP A 72 6.791 -11.963 1.995 1.00 0.00 H new ATOM 0 HA ASP A 72 4.903 -10.102 3.097 1.00 0.00 H new ATOM 0 HB2 ASP A 72 7.264 -10.525 3.943 1.00 0.00 H new ATOM 0 HB3 ASP A 72 7.884 -9.834 2.457 1.00 0.00 H new ATOM 1062 N TYR A 73 6.025 -9.693 0.061 1.00 0.00 N ATOM 1063 CA TYR A 73 5.964 -8.967 -1.197 1.00 0.00 C ATOM 1064 C TYR A 73 4.591 -9.109 -1.868 1.00 0.00 C ATOM 1065 O TYR A 73 3.741 -9.885 -1.424 1.00 0.00 O ATOM 1066 CB TYR A 73 7.137 -9.379 -2.109 1.00 0.00 C ATOM 1067 CG TYR A 73 8.417 -8.628 -1.786 1.00 0.00 C ATOM 1068 CD1 TYR A 73 9.070 -8.849 -0.558 1.00 0.00 C ATOM 1069 CD2 TYR A 73 8.912 -7.648 -2.671 1.00 0.00 C ATOM 1070 CE1 TYR A 73 10.165 -8.060 -0.179 1.00 0.00 C ATOM 1071 CE2 TYR A 73 10.013 -6.854 -2.300 1.00 0.00 C ATOM 1072 CZ TYR A 73 10.627 -7.040 -1.040 1.00 0.00 C ATOM 1073 OH TYR A 73 11.649 -6.229 -0.651 1.00 0.00 O ATOM 0 H TYR A 73 6.489 -10.596 -0.033 1.00 0.00 H new ATOM 0 HA TYR A 73 6.078 -7.902 -0.995 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.313 -10.450 -2.008 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.866 -9.197 -3.149 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.724 -9.634 0.098 1.00 0.00 H new ATOM 0 HD2 TYR A 73 8.446 -7.507 -3.635 1.00 0.00 H new ATOM 0 HE1 TYR A 73 10.654 -8.232 0.769 1.00 0.00 H new ATOM 0 HE2 TYR A 73 10.389 -6.102 -2.978 1.00 0.00 H new ATOM 0 HH TYR A 73 12.244 -6.720 -0.046 1.00 0.00 H new ATOM 1083 N ASP A 74 4.364 -8.330 -2.936 1.00 0.00 N ATOM 1084 CA ASP A 74 3.129 -8.386 -3.721 1.00 0.00 C ATOM 1085 C ASP A 74 3.404 -8.759 -5.175 1.00 0.00 C ATOM 1086 O ASP A 74 2.656 -9.552 -5.752 1.00 0.00 O ATOM 1087 CB ASP A 74 2.390 -7.050 -3.654 1.00 0.00 C ATOM 1088 CG ASP A 74 1.079 -7.120 -4.459 1.00 0.00 C ATOM 1089 OD1 ASP A 74 0.060 -7.587 -3.899 1.00 0.00 O ATOM 1090 OD2 ASP A 74 1.053 -6.666 -5.627 1.00 0.00 O ATOM 0 H ASP A 74 5.036 -7.643 -3.278 1.00 0.00 H new ATOM 0 HA ASP A 74 2.500 -9.164 -3.287 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.174 -6.799 -2.616 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.024 -6.256 -4.048 1.00 0.00 H new ATOM 1095 N VAL A 75 4.490 -8.244 -5.764 1.00 0.00 N ATOM 1096 CA VAL A 75 4.746 -8.355 -7.186 1.00 0.00 C ATOM 1097 C VAL A 75 6.222 -8.643 -7.446 1.00 0.00 C ATOM 1098 O VAL A 75 7.119 -8.011 -6.885 1.00 0.00 O ATOM 1099 CB VAL A 75 4.212 -7.097 -7.909 1.00 0.00 C ATOM 1100 CG1 VAL A 75 4.331 -5.750 -7.177 1.00 0.00 C ATOM 1101 CG2 VAL A 75 4.768 -6.987 -9.338 1.00 0.00 C ATOM 0 H VAL A 75 5.214 -7.737 -5.255 1.00 0.00 H new ATOM 0 HA VAL A 75 4.206 -9.206 -7.602 1.00 0.00 H new ATOM 0 HB VAL A 75 3.138 -7.280 -7.928 1.00 0.00 H new ATOM 0 HG11 VAL A 75 3.917 -4.959 -7.802 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.780 -5.796 -6.238 1.00 0.00 H new ATOM 0 HG13 VAL A 75 5.380 -5.539 -6.972 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.371 -6.091 -9.815 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.856 -6.927 -9.302 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.472 -7.865 -9.912 1.00 0.00 H new ATOM 1111 N VAL A 76 6.490 -9.604 -8.322 1.00 0.00 N ATOM 1112 CA VAL A 76 7.832 -10.051 -8.624 1.00 0.00 C ATOM 1113 C VAL A 76 7.843 -10.346 -10.119 1.00 0.00 C ATOM 1114 O VAL A 76 6.922 -10.982 -10.641 1.00 0.00 O ATOM 1115 CB VAL A 76 8.146 -11.287 -7.765 1.00 0.00 C ATOM 1116 CG1 VAL A 76 9.496 -11.914 -8.142 1.00 0.00 C ATOM 1117 CG2 VAL A 76 8.163 -11.006 -6.248 1.00 0.00 C ATOM 0 H VAL A 76 5.767 -10.097 -8.846 1.00 0.00 H new ATOM 0 HA VAL A 76 8.600 -9.313 -8.395 1.00 0.00 H new ATOM 0 HB VAL A 76 7.328 -11.975 -7.978 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.681 -12.784 -7.513 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.476 -12.220 -9.188 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.291 -11.183 -7.993 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.391 -11.926 -5.710 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.923 -10.257 -6.025 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.186 -10.636 -5.936 1.00 0.00 H new ATOM 1127 N ILE A 77 8.872 -9.861 -10.805 1.00 0.00 N ATOM 1128 CA ILE A 77 8.969 -9.886 -12.250 1.00 0.00 C ATOM 1129 C ILE A 77 10.278 -10.580 -12.581 1.00 0.00 C ATOM 1130 O ILE A 77 11.343 -10.115 -12.152 1.00 0.00 O ATOM 1131 CB ILE A 77 8.954 -8.440 -12.792 1.00 0.00 C ATOM 1132 CG1 ILE A 77 7.742 -7.612 -12.302 1.00 0.00 C ATOM 1133 CG2 ILE A 77 9.071 -8.404 -14.326 1.00 0.00 C ATOM 1134 CD1 ILE A 77 6.372 -8.093 -12.790 1.00 0.00 C ATOM 0 H ILE A 77 9.679 -9.430 -10.355 1.00 0.00 H new ATOM 0 HA ILE A 77 8.132 -10.415 -12.707 1.00 0.00 H new ATOM 0 HB ILE A 77 9.839 -7.960 -12.374 1.00 0.00 H new ATOM 0 HG12 ILE A 77 7.741 -7.613 -11.212 1.00 0.00 H new ATOM 0 HG13 ILE A 77 7.879 -6.578 -12.619 1.00 0.00 H new ATOM 0 HG21 ILE A 77 9.057 -7.369 -14.668 1.00 0.00 H new ATOM 0 HG22 ILE A 77 10.006 -8.874 -14.631 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.233 -8.944 -14.768 1.00 0.00 H new ATOM 0 HD11 ILE A 77 5.594 -7.443 -12.389 1.00 0.00 H new ATOM 0 HD12 ILE A 77 6.343 -8.064 -13.879 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.203 -9.115 -12.450 1.00 0.00 H new ATOM 1146 N SER A 78 10.216 -11.668 -13.343 1.00 0.00 N ATOM 1147 CA SER A 78 11.422 -12.237 -13.890 1.00 0.00 C ATOM 1148 C SER A 78 11.653 -11.499 -15.199 1.00 0.00 C ATOM 1149 O SER A 78 10.795 -11.465 -16.080 1.00 0.00 O ATOM 1150 CB SER A 78 11.336 -13.754 -14.044 1.00 0.00 C ATOM 1151 OG SER A 78 11.329 -14.357 -12.759 1.00 0.00 O ATOM 0 H SER A 78 9.356 -12.159 -13.587 1.00 0.00 H new ATOM 0 HA SER A 78 12.273 -12.107 -13.221 1.00 0.00 H new ATOM 0 HB2 SER A 78 10.432 -14.025 -14.590 1.00 0.00 H new ATOM 0 HB3 SER A 78 12.182 -14.120 -14.626 1.00 0.00 H new ATOM 0 HG SER A 78 11.272 -15.331 -12.855 1.00 0.00 H new ATOM 1157 N LEU A 79 12.814 -10.869 -15.331 1.00 0.00 N ATOM 1158 CA LEU A 79 13.224 -10.205 -16.564 1.00 0.00 C ATOM 1159 C LEU A 79 13.848 -11.214 -17.529 1.00 0.00 C ATOM 1160 O LEU A 79 14.371 -10.814 -18.565 1.00 0.00 O ATOM 1161 CB LEU A 79 14.186 -9.055 -16.237 1.00 0.00 C ATOM 1162 CG LEU A 79 13.567 -7.900 -15.432 1.00 0.00 C ATOM 1163 CD1 LEU A 79 14.740 -7.066 -14.929 1.00 0.00 C ATOM 1164 CD2 LEU A 79 12.666 -7.013 -16.288 1.00 0.00 C ATOM 0 H LEU A 79 13.502 -10.804 -14.581 1.00 0.00 H new ATOM 0 HA LEU A 79 12.350 -9.781 -17.059 1.00 0.00 H new ATOM 0 HB2 LEU A 79 15.031 -9.456 -15.678 1.00 0.00 H new ATOM 0 HB3 LEU A 79 14.582 -8.656 -17.171 1.00 0.00 H new ATOM 0 HG LEU A 79 12.948 -8.301 -14.630 1.00 0.00 H new ATOM 0 HD11 LEU A 79 14.365 -6.225 -14.346 1.00 0.00 H new ATOM 0 HD12 LEU A 79 15.383 -7.684 -14.302 1.00 0.00 H new ATOM 0 HD13 LEU A 79 15.312 -6.693 -15.779 1.00 0.00 H new ATOM 0 HD21 LEU A 79 12.253 -6.213 -15.674 1.00 0.00 H new ATOM 0 HD22 LEU A 79 13.248 -6.582 -17.103 1.00 0.00 H new ATOM 0 HD23 LEU A 79 11.853 -7.610 -16.700 1.00 0.00 H new ATOM 1176 N CYS A 80 13.872 -12.500 -17.178 1.00 0.00 N ATOM 1177 CA CYS A 80 14.230 -13.592 -18.060 1.00 0.00 C ATOM 1178 C CYS A 80 13.683 -14.896 -17.458 1.00 0.00 C ATOM 1179 O CYS A 80 13.771 -15.083 -16.242 1.00 0.00 O ATOM 1180 CB CYS A 80 15.764 -13.653 -18.221 1.00 0.00 C ATOM 1181 SG CYS A 80 16.717 -13.986 -16.701 1.00 0.00 S ATOM 0 H CYS A 80 13.633 -12.812 -16.237 1.00 0.00 H new ATOM 0 HA CYS A 80 13.798 -13.444 -19.050 1.00 0.00 H new ATOM 0 HB2 CYS A 80 16.002 -14.426 -18.952 1.00 0.00 H new ATOM 0 HB3 CYS A 80 16.103 -12.705 -18.638 1.00 0.00 H new ATOM 1186 N GLY A 81 13.184 -15.804 -18.302 1.00 0.00 N ATOM 1187 CA GLY A 81 12.813 -17.168 -17.929 1.00 0.00 C ATOM 1188 C GLY A 81 11.762 -17.260 -16.816 1.00 0.00 C ATOM 1189 O GLY A 81 11.042 -16.308 -16.504 1.00 0.00 O ATOM 0 H GLY A 81 13.024 -15.603 -19.289 1.00 0.00 H new ATOM 0 HA2 GLY A 81 12.434 -17.682 -18.812 1.00 0.00 H new ATOM 0 HA3 GLY A 81 13.709 -17.700 -17.610 1.00 0.00 H new ATOM 1193 N SER A 82 11.681 -18.445 -16.210 1.00 0.00 N ATOM 1194 CA SER A 82 10.912 -18.725 -15.002 1.00 0.00 C ATOM 1195 C SER A 82 11.601 -19.892 -14.274 1.00 0.00 C ATOM 1196 O SER A 82 12.223 -20.743 -14.918 1.00 0.00 O ATOM 1197 CB SER A 82 9.440 -19.021 -15.354 1.00 0.00 C ATOM 1198 OG SER A 82 9.296 -19.935 -16.440 1.00 0.00 O ATOM 0 H SER A 82 12.170 -19.268 -16.563 1.00 0.00 H new ATOM 0 HA SER A 82 10.889 -17.861 -14.338 1.00 0.00 H new ATOM 0 HB2 SER A 82 8.938 -19.427 -14.476 1.00 0.00 H new ATOM 0 HB3 SER A 82 8.938 -18.087 -15.605 1.00 0.00 H new ATOM 0 HG SER A 82 8.344 -20.086 -16.617 1.00 0.00 H new ATOM 1204 N GLY A 83 11.538 -19.911 -12.934 1.00 0.00 N ATOM 1205 CA GLY A 83 12.185 -20.942 -12.119 1.00 0.00 C ATOM 1206 C GLY A 83 13.698 -20.971 -12.363 1.00 0.00 C ATOM 1207 O GLY A 83 14.278 -22.043 -12.532 1.00 0.00 O ATOM 0 H GLY A 83 11.036 -19.211 -12.388 1.00 0.00 H new ATOM 0 HA2 GLY A 83 11.987 -20.753 -11.064 1.00 0.00 H new ATOM 0 HA3 GLY A 83 11.757 -21.917 -12.354 1.00 0.00 H new ATOM 1211 N VAL A 84 14.337 -19.793 -12.412 1.00 0.00 N ATOM 1212 CA VAL A 84 15.729 -19.610 -12.848 1.00 0.00 C ATOM 1213 C VAL A 84 16.753 -19.966 -11.747 1.00 0.00 C ATOM 1214 O VAL A 84 17.634 -19.171 -11.416 1.00 0.00 O ATOM 1215 CB VAL A 84 15.905 -18.216 -13.507 1.00 0.00 C ATOM 1216 CG1 VAL A 84 15.083 -18.119 -14.802 1.00 0.00 C ATOM 1217 CG2 VAL A 84 15.516 -17.032 -12.603 1.00 0.00 C ATOM 0 H VAL A 84 13.888 -18.918 -12.142 1.00 0.00 H new ATOM 0 HA VAL A 84 15.957 -20.336 -13.629 1.00 0.00 H new ATOM 0 HB VAL A 84 16.973 -18.138 -13.708 1.00 0.00 H new ATOM 0 HG11 VAL A 84 15.221 -17.134 -15.248 1.00 0.00 H new ATOM 0 HG12 VAL A 84 15.417 -18.884 -15.503 1.00 0.00 H new ATOM 0 HG13 VAL A 84 14.028 -18.270 -14.575 1.00 0.00 H new ATOM 0 HG21 VAL A 84 15.670 -16.097 -13.142 1.00 0.00 H new ATOM 0 HG22 VAL A 84 14.467 -17.120 -12.320 1.00 0.00 H new ATOM 0 HG23 VAL A 84 16.136 -17.040 -11.706 1.00 0.00 H new ATOM 1227 N ASN A 85 16.628 -21.172 -11.175 1.00 0.00 N ATOM 1228 CA ASN A 85 17.421 -21.688 -10.045 1.00 0.00 C ATOM 1229 C ASN A 85 17.294 -20.716 -8.867 1.00 0.00 C ATOM 1230 O ASN A 85 18.267 -20.182 -8.330 1.00 0.00 O ATOM 1231 CB ASN A 85 18.865 -22.029 -10.468 1.00 0.00 C ATOM 1232 CG ASN A 85 19.645 -22.717 -9.348 1.00 0.00 C ATOM 1233 OD1 ASN A 85 20.599 -22.171 -8.798 1.00 0.00 O ATOM 1234 ND2 ASN A 85 19.283 -23.945 -8.994 1.00 0.00 N ATOM 0 H ASN A 85 15.938 -21.849 -11.502 1.00 0.00 H new ATOM 0 HA ASN A 85 17.026 -22.645 -9.704 1.00 0.00 H new ATOM 0 HB2 ASN A 85 18.842 -22.677 -11.344 1.00 0.00 H new ATOM 0 HB3 ASN A 85 19.382 -21.115 -10.761 1.00 0.00 H new ATOM 0 HD21 ASN A 85 19.797 -24.438 -8.264 1.00 0.00 H new ATOM 0 HD22 ASN A 85 18.491 -24.395 -9.452 1.00 0.00 H new ATOM 1241 N LEU A 86 16.032 -20.441 -8.538 1.00 0.00 N ATOM 1242 CA LEU A 86 15.572 -19.404 -7.623 1.00 0.00 C ATOM 1243 C LEU A 86 14.295 -19.928 -6.940 1.00 0.00 C ATOM 1244 O LEU A 86 13.567 -20.684 -7.592 1.00 0.00 O ATOM 1245 CB LEU A 86 15.382 -18.133 -8.485 1.00 0.00 C ATOM 1246 CG LEU A 86 14.369 -17.093 -7.981 1.00 0.00 C ATOM 1247 CD1 LEU A 86 14.787 -15.681 -8.409 1.00 0.00 C ATOM 1248 CD2 LEU A 86 12.996 -17.368 -8.608 1.00 0.00 C ATOM 0 H LEU A 86 15.255 -20.973 -8.931 1.00 0.00 H new ATOM 0 HA LEU A 86 16.263 -19.154 -6.818 1.00 0.00 H new ATOM 0 HB2 LEU A 86 16.350 -17.643 -8.583 1.00 0.00 H new ATOM 0 HB3 LEU A 86 15.079 -18.444 -9.485 1.00 0.00 H new ATOM 0 HG LEU A 86 14.330 -17.162 -6.894 1.00 0.00 H new ATOM 0 HD11 LEU A 86 14.057 -14.959 -8.043 1.00 0.00 H new ATOM 0 HD12 LEU A 86 15.767 -15.450 -7.992 1.00 0.00 H new ATOM 0 HD13 LEU A 86 14.834 -15.629 -9.497 1.00 0.00 H new ATOM 0 HD21 LEU A 86 12.278 -16.630 -8.250 1.00 0.00 H new ATOM 0 HD22 LEU A 86 13.072 -17.303 -9.693 1.00 0.00 H new ATOM 0 HD23 LEU A 86 12.661 -18.366 -8.327 1.00 0.00 H new ATOM 1260 N PRO A 87 14.002 -19.582 -5.666 1.00 0.00 N ATOM 1261 CA PRO A 87 12.893 -20.209 -4.953 1.00 0.00 C ATOM 1262 C PRO A 87 11.524 -19.897 -5.590 1.00 0.00 C ATOM 1263 O PRO A 87 11.287 -18.750 -5.983 1.00 0.00 O ATOM 1264 CB PRO A 87 13.001 -19.776 -3.489 1.00 0.00 C ATOM 1265 CG PRO A 87 14.473 -19.390 -3.343 1.00 0.00 C ATOM 1266 CD PRO A 87 14.826 -18.834 -4.721 1.00 0.00 C ATOM 0 HA PRO A 87 12.962 -21.295 -5.018 1.00 0.00 H new ATOM 0 HB2 PRO A 87 12.341 -18.937 -3.268 1.00 0.00 H new ATOM 0 HB3 PRO A 87 12.728 -20.583 -2.810 1.00 0.00 H new ATOM 0 HG2 PRO A 87 14.619 -18.646 -2.559 1.00 0.00 H new ATOM 0 HG3 PRO A 87 15.091 -20.250 -3.085 1.00 0.00 H new ATOM 0 HD2 PRO A 87 14.617 -17.766 -4.778 1.00 0.00 H new ATOM 0 HD3 PRO A 87 15.887 -18.964 -4.937 1.00 0.00 H new ATOM 1274 N PRO A 88 10.609 -20.878 -5.699 1.00 0.00 N ATOM 1275 CA PRO A 88 9.388 -20.732 -6.483 1.00 0.00 C ATOM 1276 C PRO A 88 8.400 -19.717 -5.926 1.00 0.00 C ATOM 1277 O PRO A 88 7.703 -19.096 -6.727 1.00 0.00 O ATOM 1278 CB PRO A 88 8.784 -22.137 -6.581 1.00 0.00 C ATOM 1279 CG PRO A 88 9.321 -22.843 -5.335 1.00 0.00 C ATOM 1280 CD PRO A 88 10.717 -22.238 -5.191 1.00 0.00 C ATOM 0 HA PRO A 88 9.629 -20.323 -7.464 1.00 0.00 H new ATOM 0 HB2 PRO A 88 7.694 -22.106 -6.587 1.00 0.00 H new ATOM 0 HB3 PRO A 88 9.093 -22.644 -7.495 1.00 0.00 H new ATOM 0 HG2 PRO A 88 8.702 -22.649 -4.459 1.00 0.00 H new ATOM 0 HG3 PRO A 88 9.358 -23.925 -5.465 1.00 0.00 H new ATOM 0 HD2 PRO A 88 11.041 -22.243 -4.150 1.00 0.00 H new ATOM 0 HD3 PRO A 88 11.452 -22.810 -5.756 1.00 0.00 H new ATOM 1288 N GLU A 89 8.357 -19.465 -4.617 1.00 0.00 N ATOM 1289 CA GLU A 89 7.395 -18.525 -4.054 1.00 0.00 C ATOM 1290 C GLU A 89 7.587 -17.097 -4.586 1.00 0.00 C ATOM 1291 O GLU A 89 6.684 -16.267 -4.471 1.00 0.00 O ATOM 1292 CB GLU A 89 7.404 -18.563 -2.515 1.00 0.00 C ATOM 1293 CG GLU A 89 8.744 -18.209 -1.848 1.00 0.00 C ATOM 1294 CD GLU A 89 9.566 -19.464 -1.489 1.00 0.00 C ATOM 1295 OE1 GLU A 89 9.902 -20.258 -2.399 1.00 0.00 O ATOM 1296 OE2 GLU A 89 9.877 -19.657 -0.288 1.00 0.00 O ATOM 0 H GLU A 89 8.976 -19.898 -3.932 1.00 0.00 H new ATOM 0 HA GLU A 89 6.409 -18.850 -4.387 1.00 0.00 H new ATOM 0 HB2 GLU A 89 6.643 -17.874 -2.148 1.00 0.00 H new ATOM 0 HB3 GLU A 89 7.111 -19.562 -2.193 1.00 0.00 H new ATOM 0 HG2 GLU A 89 9.325 -17.576 -2.518 1.00 0.00 H new ATOM 0 HG3 GLU A 89 8.556 -17.629 -0.944 1.00 0.00 H new ATOM 1303 N TRP A 90 8.739 -16.807 -5.197 1.00 0.00 N ATOM 1304 CA TRP A 90 8.997 -15.535 -5.846 1.00 0.00 C ATOM 1305 C TRP A 90 8.226 -15.428 -7.154 1.00 0.00 C ATOM 1306 O TRP A 90 7.512 -14.454 -7.382 1.00 0.00 O ATOM 1307 CB TRP A 90 10.510 -15.385 -6.014 1.00 0.00 C ATOM 1308 CG TRP A 90 11.202 -15.145 -4.709 1.00 0.00 C ATOM 1309 CD1 TRP A 90 11.952 -16.023 -4.010 1.00 0.00 C ATOM 1310 CD2 TRP A 90 11.111 -13.961 -3.870 1.00 0.00 C ATOM 1311 NE1 TRP A 90 12.282 -15.481 -2.781 1.00 0.00 N ATOM 1312 CE2 TRP A 90 11.743 -14.219 -2.622 1.00 0.00 C ATOM 1313 CE3 TRP A 90 10.515 -12.701 -4.042 1.00 0.00 C ATOM 1314 CZ2 TRP A 90 11.745 -13.277 -1.580 1.00 0.00 C ATOM 1315 CZ3 TRP A 90 10.481 -11.757 -3.003 1.00 0.00 C ATOM 1316 CH2 TRP A 90 11.099 -12.043 -1.777 1.00 0.00 C ATOM 0 H TRP A 90 9.521 -17.460 -5.251 1.00 0.00 H new ATOM 0 HA TRP A 90 8.640 -14.706 -5.235 1.00 0.00 H new ATOM 0 HB2 TRP A 90 10.914 -16.285 -6.477 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.718 -14.557 -6.692 1.00 0.00 H new ATOM 0 HD1 TRP A 90 12.250 -17.001 -4.358 1.00 0.00 H new ATOM 0 HE1 TRP A 90 12.852 -15.954 -2.080 1.00 0.00 H new ATOM 0 HE3 TRP A 90 10.073 -12.452 -4.995 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 12.235 -13.497 -0.643 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 9.979 -10.812 -3.148 1.00 0.00 H new ATOM 0 HH2 TRP A 90 11.079 -11.313 -0.981 1.00 0.00 H new ATOM 1327 N VAL A 91 8.316 -16.450 -7.997 1.00 0.00 N ATOM 1328 CA VAL A 91 7.666 -16.481 -9.295 1.00 0.00 C ATOM 1329 C VAL A 91 6.178 -16.844 -9.204 1.00 0.00 C ATOM 1330 O VAL A 91 5.506 -16.865 -10.233 1.00 0.00 O ATOM 1331 CB VAL A 91 8.472 -17.344 -10.284 1.00 0.00 C ATOM 1332 CG1 VAL A 91 9.844 -16.707 -10.551 1.00 0.00 C ATOM 1333 CG2 VAL A 91 8.690 -18.791 -9.821 1.00 0.00 C ATOM 0 H VAL A 91 8.852 -17.293 -7.791 1.00 0.00 H new ATOM 0 HA VAL A 91 7.665 -15.469 -9.701 1.00 0.00 H new ATOM 0 HB VAL A 91 7.869 -17.382 -11.191 1.00 0.00 H new ATOM 0 HG11 VAL A 91 10.403 -17.327 -11.252 1.00 0.00 H new ATOM 0 HG12 VAL A 91 9.707 -15.713 -10.976 1.00 0.00 H new ATOM 0 HG13 VAL A 91 10.397 -16.628 -9.615 1.00 0.00 H new ATOM 0 HG21 VAL A 91 9.265 -19.331 -10.573 1.00 0.00 H new ATOM 0 HG22 VAL A 91 9.235 -18.793 -8.877 1.00 0.00 H new ATOM 0 HG23 VAL A 91 7.725 -19.278 -9.684 1.00 0.00 H new ATOM 1343 N THR A 92 5.632 -17.094 -8.009 1.00 0.00 N ATOM 1344 CA THR A 92 4.205 -17.321 -7.821 1.00 0.00 C ATOM 1345 C THR A 92 3.520 -16.214 -7.011 1.00 0.00 C ATOM 1346 O THR A 92 2.495 -16.470 -6.368 1.00 0.00 O ATOM 1347 CB THR A 92 3.995 -18.726 -7.229 1.00 0.00 C ATOM 1348 OG1 THR A 92 4.545 -18.824 -5.928 1.00 0.00 O ATOM 1349 CG2 THR A 92 4.649 -19.812 -8.079 1.00 0.00 C ATOM 0 H THR A 92 6.173 -17.144 -7.146 1.00 0.00 H new ATOM 0 HA THR A 92 3.714 -17.277 -8.793 1.00 0.00 H new ATOM 0 HB THR A 92 2.916 -18.876 -7.203 1.00 0.00 H new ATOM 0 HG1 THR A 92 4.395 -19.727 -5.577 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.474 -20.786 -7.622 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.219 -19.799 -9.080 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.721 -19.628 -8.142 1.00 0.00 H new ATOM 1357 N GLN A 93 4.067 -14.990 -7.006 1.00 0.00 N ATOM 1358 CA GLN A 93 3.422 -13.880 -6.324 1.00 0.00 C ATOM 1359 C GLN A 93 2.092 -13.486 -6.990 1.00 0.00 C ATOM 1360 O GLN A 93 1.730 -14.040 -8.033 1.00 0.00 O ATOM 1361 CB GLN A 93 4.409 -12.709 -6.120 1.00 0.00 C ATOM 1362 CG GLN A 93 5.365 -12.985 -4.945 1.00 0.00 C ATOM 1363 CD GLN A 93 4.598 -13.382 -3.678 1.00 0.00 C ATOM 1364 OE1 GLN A 93 3.687 -12.681 -3.244 1.00 0.00 O ATOM 1365 NE2 GLN A 93 4.865 -14.562 -3.133 1.00 0.00 N ATOM 0 H GLN A 93 4.947 -14.754 -7.465 1.00 0.00 H new ATOM 0 HA GLN A 93 3.138 -14.206 -5.323 1.00 0.00 H new ATOM 0 HB2 GLN A 93 4.985 -12.552 -7.032 1.00 0.00 H new ATOM 0 HB3 GLN A 93 3.853 -11.790 -5.932 1.00 0.00 H new ATOM 0 HG2 GLN A 93 6.057 -13.782 -5.217 1.00 0.00 H new ATOM 0 HG3 GLN A 93 5.964 -12.097 -4.746 1.00 0.00 H new ATOM 0 HE21 GLN A 93 5.624 -15.134 -3.503 1.00 0.00 H new ATOM 0 HE22 GLN A 93 4.311 -14.897 -2.344 1.00 0.00 H new ATOM 1374 N GLU A 94 1.353 -12.551 -6.373 1.00 0.00 N ATOM 1375 CA GLU A 94 -0.031 -12.214 -6.748 1.00 0.00 C ATOM 1376 C GLU A 94 -0.144 -11.849 -8.235 1.00 0.00 C ATOM 1377 O GLU A 94 -1.175 -12.088 -8.868 1.00 0.00 O ATOM 1378 CB GLU A 94 -0.567 -11.071 -5.866 1.00 0.00 C ATOM 1379 CG GLU A 94 -0.623 -11.408 -4.367 1.00 0.00 C ATOM 1380 CD GLU A 94 -1.561 -12.595 -4.070 1.00 0.00 C ATOM 1381 OE1 GLU A 94 -2.802 -12.412 -4.086 1.00 0.00 O ATOM 1382 OE2 GLU A 94 -1.065 -13.718 -3.807 1.00 0.00 O ATOM 0 H GLU A 94 1.704 -12.000 -5.589 1.00 0.00 H new ATOM 0 HA GLU A 94 -0.642 -13.101 -6.581 1.00 0.00 H new ATOM 0 HB2 GLU A 94 0.062 -10.192 -6.007 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.568 -10.804 -6.205 1.00 0.00 H new ATOM 0 HG2 GLU A 94 0.380 -11.643 -4.012 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -0.961 -10.533 -3.812 1.00 0.00 H new ATOM 1389 N ILE A 95 0.938 -11.303 -8.790 1.00 0.00 N ATOM 1390 CA ILE A 95 1.169 -11.090 -10.201 1.00 0.00 C ATOM 1391 C ILE A 95 2.597 -11.595 -10.424 1.00 0.00 C ATOM 1392 O ILE A 95 3.519 -11.233 -9.681 1.00 0.00 O ATOM 1393 CB ILE A 95 0.949 -9.618 -10.624 1.00 0.00 C ATOM 1394 CG1 ILE A 95 1.563 -9.359 -12.024 1.00 0.00 C ATOM 1395 CG2 ILE A 95 1.504 -8.645 -9.570 1.00 0.00 C ATOM 1396 CD1 ILE A 95 1.194 -8.017 -12.665 1.00 0.00 C ATOM 0 H ILE A 95 1.721 -10.980 -8.221 1.00 0.00 H new ATOM 0 HA ILE A 95 0.457 -11.625 -10.830 1.00 0.00 H new ATOM 0 HB ILE A 95 -0.124 -9.437 -10.690 1.00 0.00 H new ATOM 0 HG12 ILE A 95 2.648 -9.417 -11.943 1.00 0.00 H new ATOM 0 HG13 ILE A 95 1.250 -10.160 -12.693 1.00 0.00 H new ATOM 0 HG21 ILE A 95 1.334 -7.619 -9.897 1.00 0.00 H new ATOM 0 HG22 ILE A 95 0.998 -8.812 -8.619 1.00 0.00 H new ATOM 0 HG23 ILE A 95 2.574 -8.814 -9.446 1.00 0.00 H new ATOM 0 HD11 ILE A 95 1.674 -7.935 -13.640 1.00 0.00 H new ATOM 0 HD12 ILE A 95 0.112 -7.957 -12.787 1.00 0.00 H new ATOM 0 HD13 ILE A 95 1.533 -7.203 -12.025 1.00 0.00 H new ATOM 1408 N PHE A 96 2.758 -12.432 -11.441 1.00 0.00 N ATOM 1409 CA PHE A 96 4.045 -12.847 -11.959 1.00 0.00 C ATOM 1410 C PHE A 96 4.063 -12.421 -13.430 1.00 0.00 C ATOM 1411 O PHE A 96 3.034 -12.534 -14.106 1.00 0.00 O ATOM 1412 CB PHE A 96 4.265 -14.352 -11.802 1.00 0.00 C ATOM 1413 CG PHE A 96 5.529 -14.799 -12.511 1.00 0.00 C ATOM 1414 CD1 PHE A 96 6.774 -14.288 -12.098 1.00 0.00 C ATOM 1415 CD2 PHE A 96 5.457 -15.645 -13.635 1.00 0.00 C ATOM 1416 CE1 PHE A 96 7.935 -14.606 -12.817 1.00 0.00 C ATOM 1417 CE2 PHE A 96 6.624 -15.974 -14.344 1.00 0.00 C ATOM 1418 CZ PHE A 96 7.866 -15.456 -13.935 1.00 0.00 C ATOM 0 H PHE A 96 1.972 -12.850 -11.939 1.00 0.00 H new ATOM 0 HA PHE A 96 4.859 -12.381 -11.404 1.00 0.00 H new ATOM 0 HB2 PHE A 96 4.330 -14.604 -10.744 1.00 0.00 H new ATOM 0 HB3 PHE A 96 3.408 -14.891 -12.206 1.00 0.00 H new ATOM 0 HD1 PHE A 96 6.835 -13.651 -11.228 1.00 0.00 H new ATOM 0 HD2 PHE A 96 4.504 -16.041 -13.952 1.00 0.00 H new ATOM 0 HE1 PHE A 96 8.886 -14.196 -12.511 1.00 0.00 H new ATOM 0 HE2 PHE A 96 6.568 -16.625 -15.204 1.00 0.00 H new ATOM 0 HZ PHE A 96 8.764 -15.710 -14.478 1.00 0.00 H new ATOM 1428 N GLU A 97 5.206 -11.959 -13.929 1.00 0.00 N ATOM 1429 CA GLU A 97 5.417 -11.719 -15.348 1.00 0.00 C ATOM 1430 C GLU A 97 6.832 -12.182 -15.690 1.00 0.00 C ATOM 1431 O GLU A 97 7.755 -12.010 -14.886 1.00 0.00 O ATOM 1432 CB GLU A 97 5.278 -10.231 -15.725 1.00 0.00 C ATOM 1433 CG GLU A 97 3.906 -9.577 -15.501 1.00 0.00 C ATOM 1434 CD GLU A 97 2.817 -9.966 -16.527 1.00 0.00 C ATOM 1435 OE1 GLU A 97 2.929 -10.998 -17.236 1.00 0.00 O ATOM 1436 OE2 GLU A 97 1.811 -9.216 -16.626 1.00 0.00 O ATOM 0 H GLU A 97 6.018 -11.739 -13.352 1.00 0.00 H new ATOM 0 HA GLU A 97 4.657 -12.266 -15.906 1.00 0.00 H new ATOM 0 HB2 GLU A 97 6.018 -9.668 -15.157 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.536 -10.124 -16.779 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.554 -9.841 -14.504 1.00 0.00 H new ATOM 0 HG3 GLU A 97 4.030 -8.494 -15.519 1.00 0.00 H new ATOM 1443 N ASP A 98 6.986 -12.731 -16.893 1.00 0.00 N ATOM 1444 CA ASP A 98 8.272 -13.031 -17.510 1.00 0.00 C ATOM 1445 C ASP A 98 8.400 -12.044 -18.666 1.00 0.00 C ATOM 1446 O ASP A 98 7.650 -12.135 -19.647 1.00 0.00 O ATOM 1447 CB ASP A 98 8.366 -14.479 -17.998 1.00 0.00 C ATOM 1448 CG ASP A 98 9.545 -14.680 -18.977 1.00 0.00 C ATOM 1449 OD1 ASP A 98 10.586 -13.987 -18.874 1.00 0.00 O ATOM 1450 OD2 ASP A 98 9.420 -15.549 -19.875 1.00 0.00 O ATOM 0 H ASP A 98 6.193 -12.986 -17.482 1.00 0.00 H new ATOM 0 HA ASP A 98 9.084 -12.929 -16.790 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.487 -15.144 -17.143 1.00 0.00 H new ATOM 0 HB3 ASP A 98 7.434 -14.758 -18.489 1.00 0.00 H new ATOM 1455 N TRP A 99 9.277 -11.052 -18.516 1.00 0.00 N ATOM 1456 CA TRP A 99 9.414 -9.956 -19.461 1.00 0.00 C ATOM 1457 C TRP A 99 10.598 -10.221 -20.380 1.00 0.00 C ATOM 1458 O TRP A 99 11.726 -10.384 -19.911 1.00 0.00 O ATOM 1459 CB TRP A 99 9.608 -8.620 -18.725 1.00 0.00 C ATOM 1460 CG TRP A 99 8.432 -7.850 -18.182 1.00 0.00 C ATOM 1461 CD1 TRP A 99 8.587 -6.776 -17.374 1.00 0.00 C ATOM 1462 CD2 TRP A 99 6.985 -7.931 -18.440 1.00 0.00 C ATOM 1463 NE1 TRP A 99 7.365 -6.200 -17.099 1.00 0.00 N ATOM 1464 CE2 TRP A 99 6.349 -6.840 -17.766 1.00 0.00 C ATOM 1465 CE3 TRP A 99 6.135 -8.769 -19.200 1.00 0.00 C ATOM 1466 CZ2 TRP A 99 4.978 -6.572 -17.874 1.00 0.00 C ATOM 1467 CZ3 TRP A 99 4.752 -8.516 -19.306 1.00 0.00 C ATOM 1468 CH2 TRP A 99 4.173 -7.415 -18.653 1.00 0.00 C ATOM 0 H TRP A 99 9.917 -10.991 -17.724 1.00 0.00 H new ATOM 0 HA TRP A 99 8.501 -9.889 -20.053 1.00 0.00 H new ATOM 0 HB2 TRP A 99 10.277 -8.813 -17.886 1.00 0.00 H new ATOM 0 HB3 TRP A 99 10.136 -7.954 -19.408 1.00 0.00 H new ATOM 0 HD1 TRP A 99 9.535 -6.420 -16.997 1.00 0.00 H new ATOM 0 HE1 TRP A 99 7.232 -5.401 -16.479 1.00 0.00 H new ATOM 0 HE3 TRP A 99 6.556 -9.623 -19.711 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 4.546 -5.725 -17.362 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 4.132 -9.175 -19.895 1.00 0.00 H new ATOM 0 HH2 TRP A 99 3.115 -7.219 -18.750 1.00 0.00 H new ATOM 1479 N GLN A 100 10.358 -10.194 -21.695 1.00 0.00 N ATOM 1480 CA GLN A 100 11.439 -10.193 -22.670 1.00 0.00 C ATOM 1481 C GLN A 100 11.778 -8.726 -22.897 1.00 0.00 C ATOM 1482 O GLN A 100 10.921 -7.946 -23.314 1.00 0.00 O ATOM 1483 CB GLN A 100 11.052 -10.949 -23.956 1.00 0.00 C ATOM 1484 CG GLN A 100 10.878 -12.470 -23.756 1.00 0.00 C ATOM 1485 CD GLN A 100 12.171 -13.245 -23.446 1.00 0.00 C ATOM 1486 OE1 GLN A 100 13.244 -12.681 -23.222 1.00 0.00 O ATOM 1487 NE2 GLN A 100 12.106 -14.568 -23.416 1.00 0.00 N ATOM 0 H GLN A 100 9.423 -10.173 -22.103 1.00 0.00 H new ATOM 0 HA GLN A 100 12.317 -10.731 -22.313 1.00 0.00 H new ATOM 0 HB2 GLN A 100 10.122 -10.534 -24.344 1.00 0.00 H new ATOM 0 HB3 GLN A 100 11.818 -10.777 -24.712 1.00 0.00 H new ATOM 0 HG2 GLN A 100 10.172 -12.634 -22.942 1.00 0.00 H new ATOM 0 HG3 GLN A 100 10.430 -12.889 -24.657 1.00 0.00 H new ATOM 0 HE21 GLN A 100 11.221 -15.039 -23.601 1.00 0.00 H new ATOM 0 HE22 GLN A 100 12.941 -15.115 -23.208 1.00 0.00 H new ATOM 1496 N LEU A 101 13.002 -8.334 -22.553 1.00 0.00 N ATOM 1497 CA LEU A 101 13.534 -6.986 -22.677 1.00 0.00 C ATOM 1498 C LEU A 101 14.988 -7.182 -23.078 1.00 0.00 C ATOM 1499 O LEU A 101 15.694 -7.937 -22.416 1.00 0.00 O ATOM 1500 CB LEU A 101 13.429 -6.242 -21.322 1.00 0.00 C ATOM 1501 CG LEU A 101 12.031 -5.680 -21.001 1.00 0.00 C ATOM 1502 CD1 LEU A 101 11.906 -5.302 -19.516 1.00 0.00 C ATOM 1503 CD2 LEU A 101 11.626 -4.552 -21.963 1.00 0.00 C ATOM 0 H LEU A 101 13.682 -8.984 -22.160 1.00 0.00 H new ATOM 0 HA LEU A 101 12.988 -6.385 -23.404 1.00 0.00 H new ATOM 0 HB2 LEU A 101 13.723 -6.925 -20.525 1.00 0.00 H new ATOM 0 HB3 LEU A 101 14.145 -5.420 -21.318 1.00 0.00 H new ATOM 0 HG LEU A 101 11.304 -6.474 -21.171 1.00 0.00 H new ATOM 0 HD11 LEU A 101 10.908 -4.909 -19.323 1.00 0.00 H new ATOM 0 HD12 LEU A 101 12.073 -6.186 -18.900 1.00 0.00 H new ATOM 0 HD13 LEU A 101 12.649 -4.543 -19.270 1.00 0.00 H new ATOM 0 HD21 LEU A 101 10.634 -4.187 -21.698 1.00 0.00 H new ATOM 0 HD22 LEU A 101 12.345 -3.736 -21.890 1.00 0.00 H new ATOM 0 HD23 LEU A 101 11.612 -4.932 -22.984 1.00 0.00 H new ATOM 1515 N GLU A 102 15.438 -6.538 -24.153 1.00 0.00 N ATOM 1516 CA GLU A 102 16.847 -6.538 -24.526 1.00 0.00 C ATOM 1517 C GLU A 102 17.657 -5.844 -23.424 1.00 0.00 C ATOM 1518 O GLU A 102 17.122 -5.021 -22.678 1.00 0.00 O ATOM 1519 CB GLU A 102 17.045 -5.841 -25.883 1.00 0.00 C ATOM 1520 CG GLU A 102 16.731 -6.733 -27.088 1.00 0.00 C ATOM 1521 CD GLU A 102 17.776 -7.852 -27.255 1.00 0.00 C ATOM 1522 OE1 GLU A 102 18.903 -7.559 -27.721 1.00 0.00 O ATOM 1523 OE2 GLU A 102 17.481 -9.020 -26.907 1.00 0.00 O ATOM 0 H GLU A 102 14.839 -6.006 -24.785 1.00 0.00 H new ATOM 0 HA GLU A 102 17.198 -7.565 -24.631 1.00 0.00 H new ATOM 0 HB2 GLU A 102 16.410 -4.956 -25.922 1.00 0.00 H new ATOM 0 HB3 GLU A 102 18.076 -5.496 -25.957 1.00 0.00 H new ATOM 0 HG2 GLU A 102 15.742 -7.174 -26.967 1.00 0.00 H new ATOM 0 HG3 GLU A 102 16.700 -6.126 -27.993 1.00 0.00 H new ATOM 1530 N ASP A 103 18.956 -6.136 -23.351 1.00 0.00 N ATOM 1531 CA ASP A 103 19.913 -5.426 -22.524 1.00 0.00 C ATOM 1532 C ASP A 103 20.948 -4.777 -23.445 1.00 0.00 C ATOM 1533 O ASP A 103 21.389 -5.424 -24.402 1.00 0.00 O ATOM 1534 CB ASP A 103 20.584 -6.355 -21.512 1.00 0.00 C ATOM 1535 CG ASP A 103 21.512 -5.524 -20.625 1.00 0.00 C ATOM 1536 OD1 ASP A 103 22.677 -5.290 -21.005 1.00 0.00 O ATOM 1537 OD2 ASP A 103 21.025 -5.051 -19.570 1.00 0.00 O ATOM 0 H ASP A 103 19.377 -6.897 -23.884 1.00 0.00 H new ATOM 0 HA ASP A 103 19.395 -4.662 -21.944 1.00 0.00 H new ATOM 0 HB2 ASP A 103 19.832 -6.859 -20.905 1.00 0.00 H new ATOM 0 HB3 ASP A 103 21.149 -7.131 -22.028 1.00 0.00 H new ATOM 1542 N PRO A 104 21.310 -3.508 -23.218 1.00 0.00 N ATOM 1543 CA PRO A 104 22.120 -2.752 -24.158 1.00 0.00 C ATOM 1544 C PRO A 104 23.639 -2.881 -23.946 1.00 0.00 C ATOM 1545 O PRO A 104 24.369 -2.403 -24.810 1.00 0.00 O ATOM 1546 CB PRO A 104 21.647 -1.320 -23.951 1.00 0.00 C ATOM 1547 CG PRO A 104 21.390 -1.251 -22.446 1.00 0.00 C ATOM 1548 CD PRO A 104 20.769 -2.617 -22.194 1.00 0.00 C ATOM 0 HA PRO A 104 21.989 -3.124 -25.174 1.00 0.00 H new ATOM 0 HB2 PRO A 104 22.401 -0.598 -24.264 1.00 0.00 H new ATOM 0 HB3 PRO A 104 20.744 -1.107 -24.524 1.00 0.00 H new ATOM 0 HG2 PRO A 104 22.308 -1.104 -21.877 1.00 0.00 H new ATOM 0 HG3 PRO A 104 20.716 -0.436 -22.180 1.00 0.00 H new ATOM 0 HD2 PRO A 104 21.015 -2.978 -21.195 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.682 -2.568 -22.256 1.00 0.00 H new ATOM 1556 N ASP A 105 24.126 -3.499 -22.859 1.00 0.00 N ATOM 1557 CA ASP A 105 25.549 -3.457 -22.483 1.00 0.00 C ATOM 1558 C ASP A 105 26.489 -3.831 -23.637 1.00 0.00 C ATOM 1559 O ASP A 105 27.422 -3.091 -23.969 1.00 0.00 O ATOM 1560 CB ASP A 105 25.858 -4.372 -21.296 1.00 0.00 C ATOM 1561 CG ASP A 105 27.386 -4.503 -21.110 1.00 0.00 C ATOM 1562 OD1 ASP A 105 28.074 -3.469 -20.931 1.00 0.00 O ATOM 1563 OD2 ASP A 105 27.908 -5.643 -21.188 1.00 0.00 O ATOM 0 H ASP A 105 23.547 -4.041 -22.217 1.00 0.00 H new ATOM 0 HA ASP A 105 25.730 -2.418 -22.207 1.00 0.00 H new ATOM 0 HB2 ASP A 105 25.407 -3.969 -20.389 1.00 0.00 H new ATOM 0 HB3 ASP A 105 25.418 -5.356 -21.461 1.00 0.00 H new ATOM 1568 N GLY A 106 26.217 -4.975 -24.269 1.00 0.00 N ATOM 1569 CA GLY A 106 27.044 -5.523 -25.337 1.00 0.00 C ATOM 1570 C GLY A 106 26.720 -4.941 -26.717 1.00 0.00 C ATOM 1571 O GLY A 106 27.140 -5.524 -27.719 1.00 0.00 O ATOM 0 H GLY A 106 25.405 -5.551 -24.048 1.00 0.00 H new ATOM 0 HA2 GLY A 106 28.093 -5.333 -25.108 1.00 0.00 H new ATOM 0 HA3 GLY A 106 26.915 -6.605 -25.368 1.00 0.00 H new ATOM 1575 N GLN A 107 25.931 -3.863 -26.794 1.00 0.00 N ATOM 1576 CA GLN A 107 25.365 -3.330 -28.030 1.00 0.00 C ATOM 1577 C GLN A 107 25.607 -1.810 -28.128 1.00 0.00 C ATOM 1578 O GLN A 107 26.189 -1.197 -27.228 1.00 0.00 O ATOM 1579 CB GLN A 107 23.865 -3.697 -28.131 1.00 0.00 C ATOM 1580 CG GLN A 107 23.482 -5.092 -27.591 1.00 0.00 C ATOM 1581 CD GLN A 107 22.152 -5.647 -28.116 1.00 0.00 C ATOM 1582 OE1 GLN A 107 21.912 -5.704 -29.322 1.00 0.00 O ATOM 1583 NE2 GLN A 107 21.276 -6.099 -27.229 1.00 0.00 N ATOM 0 H GLN A 107 25.663 -3.324 -25.971 1.00 0.00 H new ATOM 0 HA GLN A 107 25.869 -3.785 -28.882 1.00 0.00 H new ATOM 0 HB2 GLN A 107 23.289 -2.947 -27.590 1.00 0.00 H new ATOM 0 HB3 GLN A 107 23.564 -3.637 -29.177 1.00 0.00 H new ATOM 0 HG2 GLN A 107 24.277 -5.794 -27.844 1.00 0.00 H new ATOM 0 HG3 GLN A 107 23.434 -5.043 -26.503 1.00 0.00 H new ATOM 0 HE21 GLN A 107 21.486 -6.046 -26.232 1.00 0.00 H new ATOM 0 HE22 GLN A 107 20.392 -6.499 -27.543 1.00 0.00 H new ATOM 1592 N SER A 108 25.201 -1.210 -29.250 1.00 0.00 N ATOM 1593 CA SER A 108 25.461 0.189 -29.584 1.00 0.00 C ATOM 1594 C SER A 108 24.518 1.152 -28.837 1.00 0.00 C ATOM 1595 O SER A 108 23.515 0.727 -28.263 1.00 0.00 O ATOM 1596 CB SER A 108 25.366 0.343 -31.111 1.00 0.00 C ATOM 1597 OG SER A 108 26.155 -0.642 -31.768 1.00 0.00 O ATOM 0 H SER A 108 24.668 -1.699 -29.969 1.00 0.00 H new ATOM 0 HA SER A 108 26.463 0.462 -29.255 1.00 0.00 H new ATOM 0 HB2 SER A 108 24.327 0.252 -31.426 1.00 0.00 H new ATOM 0 HB3 SER A 108 25.702 1.338 -31.402 1.00 0.00 H new ATOM 0 HG SER A 108 26.079 -0.528 -32.738 1.00 0.00 H new ATOM 1603 N LEU A 109 24.797 2.464 -28.898 1.00 0.00 N ATOM 1604 CA LEU A 109 24.048 3.536 -28.226 1.00 0.00 C ATOM 1605 C LEU A 109 22.559 3.530 -28.567 1.00 0.00 C ATOM 1606 O LEU A 109 21.727 3.797 -27.700 1.00 0.00 O ATOM 1607 CB LEU A 109 24.706 4.870 -28.617 1.00 0.00 C ATOM 1608 CG LEU A 109 24.166 6.109 -27.879 1.00 0.00 C ATOM 1609 CD1 LEU A 109 24.300 5.974 -26.358 1.00 0.00 C ATOM 1610 CD2 LEU A 109 24.948 7.341 -28.349 1.00 0.00 C ATOM 0 H LEU A 109 25.584 2.821 -29.440 1.00 0.00 H new ATOM 0 HA LEU A 109 24.091 3.381 -27.148 1.00 0.00 H new ATOM 0 HB2 LEU A 109 25.778 4.796 -28.433 1.00 0.00 H new ATOM 0 HB3 LEU A 109 24.576 5.020 -29.689 1.00 0.00 H new ATOM 0 HG LEU A 109 23.105 6.209 -28.110 1.00 0.00 H new ATOM 0 HD11 LEU A 109 23.907 6.870 -25.877 1.00 0.00 H new ATOM 0 HD12 LEU A 109 23.738 5.104 -26.019 1.00 0.00 H new ATOM 0 HD13 LEU A 109 25.351 5.852 -26.095 1.00 0.00 H new ATOM 0 HD21 LEU A 109 24.576 8.227 -27.834 1.00 0.00 H new ATOM 0 HD22 LEU A 109 26.006 7.208 -28.124 1.00 0.00 H new ATOM 0 HD23 LEU A 109 24.819 7.465 -29.424 1.00 0.00 H new ATOM 1622 N GLU A 110 22.212 3.149 -29.798 1.00 0.00 N ATOM 1623 CA GLU A 110 20.824 2.988 -30.232 1.00 0.00 C ATOM 1624 C GLU A 110 20.070 1.995 -29.349 1.00 0.00 C ATOM 1625 O GLU A 110 18.888 2.190 -29.077 1.00 0.00 O ATOM 1626 CB GLU A 110 20.754 2.558 -31.711 1.00 0.00 C ATOM 1627 CG GLU A 110 21.719 1.441 -32.132 1.00 0.00 C ATOM 1628 CD GLU A 110 21.523 1.073 -33.614 1.00 0.00 C ATOM 1629 OE1 GLU A 110 20.679 0.195 -33.919 1.00 0.00 O ATOM 1630 OE2 GLU A 110 22.222 1.651 -34.484 1.00 0.00 O ATOM 0 H GLU A 110 22.894 2.942 -30.528 1.00 0.00 H new ATOM 0 HA GLU A 110 20.338 3.959 -30.132 1.00 0.00 H new ATOM 0 HB2 GLU A 110 19.736 2.233 -31.927 1.00 0.00 H new ATOM 0 HB3 GLU A 110 20.948 3.432 -32.333 1.00 0.00 H new ATOM 0 HG2 GLU A 110 22.747 1.762 -31.966 1.00 0.00 H new ATOM 0 HG3 GLU A 110 21.556 0.561 -31.510 1.00 0.00 H new ATOM 1637 N VAL A 111 20.741 0.955 -28.863 1.00 0.00 N ATOM 1638 CA VAL A 111 20.120 -0.086 -28.070 1.00 0.00 C ATOM 1639 C VAL A 111 19.882 0.418 -26.652 1.00 0.00 C ATOM 1640 O VAL A 111 18.813 0.155 -26.121 1.00 0.00 O ATOM 1641 CB VAL A 111 20.934 -1.386 -28.141 1.00 0.00 C ATOM 1642 CG1 VAL A 111 20.176 -2.568 -27.521 1.00 0.00 C ATOM 1643 CG2 VAL A 111 21.276 -1.725 -29.608 1.00 0.00 C ATOM 0 H VAL A 111 21.740 0.815 -29.013 1.00 0.00 H new ATOM 0 HA VAL A 111 19.141 -0.333 -28.481 1.00 0.00 H new ATOM 0 HB VAL A 111 21.849 -1.223 -27.571 1.00 0.00 H new ATOM 0 HG11 VAL A 111 20.786 -3.469 -27.591 1.00 0.00 H new ATOM 0 HG12 VAL A 111 19.963 -2.355 -26.473 1.00 0.00 H new ATOM 0 HG13 VAL A 111 19.240 -2.721 -28.057 1.00 0.00 H new ATOM 0 HG21 VAL A 111 21.853 -2.649 -29.643 1.00 0.00 H new ATOM 0 HG22 VAL A 111 20.355 -1.851 -30.177 1.00 0.00 H new ATOM 0 HG23 VAL A 111 21.862 -0.915 -30.042 1.00 0.00 H new ATOM 1653 N PHE A 112 20.788 1.201 -26.050 1.00 0.00 N ATOM 1654 CA PHE A 112 20.510 1.852 -24.760 1.00 0.00 C ATOM 1655 C PHE A 112 19.254 2.716 -24.883 1.00 0.00 C ATOM 1656 O PHE A 112 18.323 2.589 -24.089 1.00 0.00 O ATOM 1657 CB PHE A 112 21.709 2.697 -24.287 1.00 0.00 C ATOM 1658 CG PHE A 112 22.933 1.915 -23.846 1.00 0.00 C ATOM 1659 CD1 PHE A 112 23.908 1.520 -24.780 1.00 0.00 C ATOM 1660 CD2 PHE A 112 23.081 1.551 -22.494 1.00 0.00 C ATOM 1661 CE1 PHE A 112 25.004 0.744 -24.373 1.00 0.00 C ATOM 1662 CE2 PHE A 112 24.175 0.765 -22.087 1.00 0.00 C ATOM 1663 CZ PHE A 112 25.133 0.353 -23.030 1.00 0.00 C ATOM 0 H PHE A 112 21.713 1.399 -26.431 1.00 0.00 H new ATOM 0 HA PHE A 112 20.342 1.079 -24.010 1.00 0.00 H new ATOM 0 HB2 PHE A 112 22.000 3.366 -25.097 1.00 0.00 H new ATOM 0 HB3 PHE A 112 21.383 3.324 -23.457 1.00 0.00 H new ATOM 0 HD1 PHE A 112 23.813 1.815 -25.814 1.00 0.00 H new ATOM 0 HD2 PHE A 112 22.352 1.876 -21.766 1.00 0.00 H new ATOM 0 HE1 PHE A 112 25.751 0.446 -25.094 1.00 0.00 H new ATOM 0 HE2 PHE A 112 24.279 0.478 -21.051 1.00 0.00 H new ATOM 0 HZ PHE A 112 25.966 -0.262 -22.723 1.00 0.00 H new ATOM 1673 N ARG A 113 19.187 3.534 -25.935 1.00 0.00 N ATOM 1674 CA ARG A 113 18.051 4.425 -26.179 1.00 0.00 C ATOM 1675 C ARG A 113 16.763 3.629 -26.425 1.00 0.00 C ATOM 1676 O ARG A 113 15.716 3.989 -25.892 1.00 0.00 O ATOM 1677 CB ARG A 113 18.410 5.355 -27.351 1.00 0.00 C ATOM 1678 CG ARG A 113 19.501 6.368 -26.950 1.00 0.00 C ATOM 1679 CD ARG A 113 20.160 7.014 -28.171 1.00 0.00 C ATOM 1680 NE ARG A 113 21.002 8.164 -27.778 1.00 0.00 N ATOM 1681 CZ ARG A 113 21.574 9.046 -28.613 1.00 0.00 C ATOM 1682 NH1 ARG A 113 21.475 8.900 -29.932 1.00 0.00 N ATOM 1683 NH2 ARG A 113 22.249 10.075 -28.112 1.00 0.00 N ATOM 0 H ARG A 113 19.919 3.597 -26.642 1.00 0.00 H new ATOM 0 HA ARG A 113 17.853 5.035 -25.298 1.00 0.00 H new ATOM 0 HB2 ARG A 113 18.756 4.761 -28.197 1.00 0.00 H new ATOM 0 HB3 ARG A 113 17.519 5.889 -27.680 1.00 0.00 H new ATOM 0 HG2 ARG A 113 19.063 7.143 -26.322 1.00 0.00 H new ATOM 0 HG3 ARG A 113 20.261 5.865 -26.352 1.00 0.00 H new ATOM 0 HD2 ARG A 113 20.769 6.275 -28.692 1.00 0.00 H new ATOM 0 HD3 ARG A 113 19.392 7.344 -28.870 1.00 0.00 H new ATOM 0 HE ARG A 113 21.163 8.300 -26.780 1.00 0.00 H new ATOM 0 HH11 ARG A 113 20.959 8.110 -30.320 1.00 0.00 H new ATOM 0 HH12 ARG A 113 21.915 9.578 -30.555 1.00 0.00 H new ATOM 0 HH21 ARG A 113 22.329 10.189 -27.102 1.00 0.00 H new ATOM 0 HH22 ARG A 113 22.687 10.751 -28.738 1.00 0.00 H new ATOM 1697 N THR A 114 16.838 2.514 -27.152 1.00 0.00 N ATOM 1698 CA THR A 114 15.710 1.642 -27.428 1.00 0.00 C ATOM 1699 C THR A 114 15.240 0.963 -26.142 1.00 0.00 C ATOM 1700 O THR A 114 14.049 0.990 -25.837 1.00 0.00 O ATOM 1701 CB THR A 114 16.183 0.640 -28.493 1.00 0.00 C ATOM 1702 OG1 THR A 114 16.258 1.265 -29.763 1.00 0.00 O ATOM 1703 CG2 THR A 114 15.326 -0.616 -28.575 1.00 0.00 C ATOM 0 H THR A 114 17.709 2.190 -27.573 1.00 0.00 H new ATOM 0 HA THR A 114 14.847 2.192 -27.804 1.00 0.00 H new ATOM 0 HB THR A 114 17.175 0.315 -28.181 1.00 0.00 H new ATOM 0 HG1 THR A 114 17.122 1.718 -29.854 1.00 0.00 H new ATOM 0 HG21 THR A 114 15.720 -1.276 -29.348 1.00 0.00 H new ATOM 0 HG22 THR A 114 15.343 -1.131 -27.615 1.00 0.00 H new ATOM 0 HG23 THR A 114 14.300 -0.341 -28.821 1.00 0.00 H new ATOM 1711 N VAL A 115 16.153 0.364 -25.370 1.00 0.00 N ATOM 1712 CA VAL A 115 15.803 -0.425 -24.197 1.00 0.00 C ATOM 1713 C VAL A 115 15.183 0.486 -23.152 1.00 0.00 C ATOM 1714 O VAL A 115 14.213 0.088 -22.522 1.00 0.00 O ATOM 1715 CB VAL A 115 17.028 -1.219 -23.699 1.00 0.00 C ATOM 1716 CG1 VAL A 115 16.767 -1.888 -22.341 1.00 0.00 C ATOM 1717 CG2 VAL A 115 17.359 -2.328 -24.714 1.00 0.00 C ATOM 0 H VAL A 115 17.156 0.416 -25.546 1.00 0.00 H new ATOM 0 HA VAL A 115 15.053 -1.176 -24.443 1.00 0.00 H new ATOM 0 HB VAL A 115 17.852 -0.514 -23.591 1.00 0.00 H new ATOM 0 HG11 VAL A 115 17.656 -2.436 -22.029 1.00 0.00 H new ATOM 0 HG12 VAL A 115 16.532 -1.125 -21.599 1.00 0.00 H new ATOM 0 HG13 VAL A 115 15.928 -2.578 -22.431 1.00 0.00 H new ATOM 0 HG21 VAL A 115 18.224 -2.892 -24.367 1.00 0.00 H new ATOM 0 HG22 VAL A 115 16.505 -2.998 -24.813 1.00 0.00 H new ATOM 0 HG23 VAL A 115 17.583 -1.880 -25.682 1.00 0.00 H new ATOM 1727 N ARG A 116 15.642 1.732 -23.042 1.00 0.00 N ATOM 1728 CA ARG A 116 15.018 2.703 -22.156 1.00 0.00 C ATOM 1729 C ARG A 116 13.529 2.848 -22.510 1.00 0.00 C ATOM 1730 O ARG A 116 12.690 2.756 -21.621 1.00 0.00 O ATOM 1731 CB ARG A 116 15.832 4.008 -22.244 1.00 0.00 C ATOM 1732 CG ARG A 116 15.316 5.059 -21.263 1.00 0.00 C ATOM 1733 CD ARG A 116 16.189 6.314 -21.200 1.00 0.00 C ATOM 1734 NE ARG A 116 16.460 6.944 -22.515 1.00 0.00 N ATOM 1735 CZ ARG A 116 15.613 7.614 -23.316 1.00 0.00 C ATOM 1736 NH1 ARG A 116 14.315 7.690 -23.040 1.00 0.00 N ATOM 1737 NH2 ARG A 116 16.078 8.216 -24.406 1.00 0.00 N ATOM 0 H ARG A 116 16.446 2.090 -23.558 1.00 0.00 H new ATOM 0 HA ARG A 116 15.031 2.384 -21.114 1.00 0.00 H new ATOM 0 HB2 ARG A 116 16.881 3.798 -22.035 1.00 0.00 H new ATOM 0 HB3 ARG A 116 15.782 4.401 -23.259 1.00 0.00 H new ATOM 0 HG2 ARG A 116 14.303 5.344 -21.548 1.00 0.00 H new ATOM 0 HG3 ARG A 116 15.255 4.618 -20.268 1.00 0.00 H new ATOM 0 HD2 ARG A 116 15.704 7.046 -20.554 1.00 0.00 H new ATOM 0 HD3 ARG A 116 17.139 6.057 -20.732 1.00 0.00 H new ATOM 0 HE ARG A 116 17.417 6.857 -22.858 1.00 0.00 H new ATOM 0 HH11 ARG A 116 13.943 7.235 -22.206 1.00 0.00 H new ATOM 0 HH12 ARG A 116 13.691 8.204 -23.662 1.00 0.00 H new ATOM 0 HH21 ARG A 116 17.072 8.168 -24.630 1.00 0.00 H new ATOM 0 HH22 ARG A 116 15.441 8.726 -25.018 1.00 0.00 H new ATOM 1751 N GLY A 117 13.192 2.958 -23.794 1.00 0.00 N ATOM 1752 CA GLY A 117 11.806 3.014 -24.256 1.00 0.00 C ATOM 1753 C GLY A 117 11.045 1.720 -23.960 1.00 0.00 C ATOM 1754 O GLY A 117 9.982 1.762 -23.341 1.00 0.00 O ATOM 0 H GLY A 117 13.877 3.011 -24.548 1.00 0.00 H new ATOM 0 HA2 GLY A 117 11.298 3.850 -23.775 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.790 3.206 -25.329 1.00 0.00 H new ATOM 1758 N GLN A 118 11.591 0.559 -24.350 1.00 0.00 N ATOM 1759 CA GLN A 118 10.886 -0.719 -24.197 1.00 0.00 C ATOM 1760 C GLN A 118 10.605 -1.007 -22.727 1.00 0.00 C ATOM 1761 O GLN A 118 9.522 -1.452 -22.356 1.00 0.00 O ATOM 1762 CB GLN A 118 11.675 -1.895 -24.789 1.00 0.00 C ATOM 1763 CG GLN A 118 12.096 -1.737 -26.261 1.00 0.00 C ATOM 1764 CD GLN A 118 12.216 -3.092 -26.960 1.00 0.00 C ATOM 1765 OE1 GLN A 118 11.638 -3.325 -28.020 1.00 0.00 O ATOM 1766 NE2 GLN A 118 12.965 -4.018 -26.372 1.00 0.00 N ATOM 0 H GLN A 118 12.516 0.480 -24.772 1.00 0.00 H new ATOM 0 HA GLN A 118 9.949 -0.622 -24.746 1.00 0.00 H new ATOM 0 HB2 GLN A 118 12.571 -2.048 -24.188 1.00 0.00 H new ATOM 0 HB3 GLN A 118 11.071 -2.798 -24.697 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.366 -1.120 -26.785 1.00 0.00 H new ATOM 0 HG3 GLN A 118 13.051 -1.214 -26.313 1.00 0.00 H new ATOM 0 HE21 GLN A 118 13.438 -3.809 -25.493 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.067 -4.938 -26.800 1.00 0.00 H new ATOM 1775 N VAL A 119 11.600 -0.758 -21.880 1.00 0.00 N ATOM 1776 CA VAL A 119 11.494 -1.068 -20.466 1.00 0.00 C ATOM 1777 C VAL A 119 10.507 -0.107 -19.813 1.00 0.00 C ATOM 1778 O VAL A 119 9.672 -0.565 -19.037 1.00 0.00 O ATOM 1779 CB VAL A 119 12.878 -1.074 -19.803 1.00 0.00 C ATOM 1780 CG1 VAL A 119 12.753 -1.358 -18.306 1.00 0.00 C ATOM 1781 CG2 VAL A 119 13.764 -2.178 -20.395 1.00 0.00 C ATOM 0 H VAL A 119 12.490 -0.341 -22.154 1.00 0.00 H new ATOM 0 HA VAL A 119 11.101 -2.076 -20.329 1.00 0.00 H new ATOM 0 HB VAL A 119 13.320 -0.093 -19.979 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.744 -1.359 -17.852 1.00 0.00 H new ATOM 0 HG12 VAL A 119 12.140 -0.587 -17.839 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.286 -2.332 -18.158 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.739 -2.162 -19.909 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.294 -3.148 -20.233 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.889 -2.010 -21.465 1.00 0.00 H new ATOM 1791 N LYS A 120 10.520 1.186 -20.166 1.00 0.00 N ATOM 1792 CA LYS A 120 9.524 2.124 -19.652 1.00 0.00 C ATOM 1793 C LYS A 120 8.136 1.592 -19.959 1.00 0.00 C ATOM 1794 O LYS A 120 7.291 1.571 -19.074 1.00 0.00 O ATOM 1795 CB LYS A 120 9.711 3.489 -20.331 1.00 0.00 C ATOM 1796 CG LYS A 120 8.723 4.554 -19.824 1.00 0.00 C ATOM 1797 CD LYS A 120 9.066 5.911 -20.466 1.00 0.00 C ATOM 1798 CE LYS A 120 8.095 7.045 -20.084 1.00 0.00 C ATOM 1799 NZ LYS A 120 6.804 6.987 -20.824 1.00 0.00 N ATOM 0 H LYS A 120 11.204 1.599 -20.800 1.00 0.00 H new ATOM 0 HA LYS A 120 9.644 2.236 -18.574 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.730 3.837 -20.161 1.00 0.00 H new ATOM 0 HB3 LYS A 120 9.590 3.372 -21.408 1.00 0.00 H new ATOM 0 HG2 LYS A 120 7.701 4.268 -20.074 1.00 0.00 H new ATOM 0 HG3 LYS A 120 8.776 4.628 -18.738 1.00 0.00 H new ATOM 0 HD2 LYS A 120 10.076 6.196 -20.172 1.00 0.00 H new ATOM 0 HD3 LYS A 120 9.069 5.799 -21.550 1.00 0.00 H new ATOM 0 HE2 LYS A 120 7.895 6.998 -19.014 1.00 0.00 H new ATOM 0 HE3 LYS A 120 8.574 8.005 -20.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 6.237 7.829 -20.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 6.991 6.958 -21.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 6.281 6.133 -20.543 1.00 0.00 H new ATOM 1813 N GLU A 121 7.918 1.132 -21.187 1.00 0.00 N ATOM 1814 CA GLU A 121 6.607 0.719 -21.649 1.00 0.00 C ATOM 1815 C GLU A 121 6.130 -0.536 -20.904 1.00 0.00 C ATOM 1816 O GLU A 121 4.986 -0.573 -20.446 1.00 0.00 O ATOM 1817 CB GLU A 121 6.696 0.543 -23.167 1.00 0.00 C ATOM 1818 CG GLU A 121 5.356 0.135 -23.787 1.00 0.00 C ATOM 1819 CD GLU A 121 5.440 0.100 -25.323 1.00 0.00 C ATOM 1820 OE1 GLU A 121 5.857 -0.941 -25.886 1.00 0.00 O ATOM 1821 OE2 GLU A 121 5.076 1.108 -25.977 1.00 0.00 O ATOM 0 H GLU A 121 8.652 1.037 -21.889 1.00 0.00 H new ATOM 0 HA GLU A 121 5.850 1.472 -21.431 1.00 0.00 H new ATOM 0 HB2 GLU A 121 7.033 1.476 -23.619 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.446 -0.213 -23.399 1.00 0.00 H new ATOM 0 HG2 GLU A 121 5.064 -0.847 -23.414 1.00 0.00 H new ATOM 0 HG3 GLU A 121 4.581 0.837 -23.479 1.00 0.00 H new ATOM 1828 N ARG A 122 6.998 -1.536 -20.697 1.00 0.00 N ATOM 1829 CA ARG A 122 6.614 -2.731 -19.930 1.00 0.00 C ATOM 1830 C ARG A 122 6.343 -2.399 -18.465 1.00 0.00 C ATOM 1831 O ARG A 122 5.393 -2.917 -17.882 1.00 0.00 O ATOM 1832 CB ARG A 122 7.665 -3.843 -20.044 1.00 0.00 C ATOM 1833 CG ARG A 122 7.715 -4.492 -21.439 1.00 0.00 C ATOM 1834 CD ARG A 122 8.062 -5.979 -21.287 1.00 0.00 C ATOM 1835 NE ARG A 122 8.470 -6.611 -22.559 1.00 0.00 N ATOM 1836 CZ ARG A 122 7.686 -7.073 -23.542 1.00 0.00 C ATOM 1837 NH1 ARG A 122 6.361 -6.969 -23.481 1.00 0.00 N ATOM 1838 NH2 ARG A 122 8.258 -7.651 -24.593 1.00 0.00 N ATOM 0 H ARG A 122 7.957 -1.543 -21.044 1.00 0.00 H new ATOM 0 HA ARG A 122 5.687 -3.099 -20.369 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.646 -3.432 -19.807 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.453 -4.611 -19.301 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.754 -4.379 -21.941 1.00 0.00 H new ATOM 0 HG3 ARG A 122 8.460 -3.993 -22.060 1.00 0.00 H new ATOM 0 HD2 ARG A 122 8.867 -6.086 -20.560 1.00 0.00 H new ATOM 0 HD3 ARG A 122 7.198 -6.509 -20.886 1.00 0.00 H new ATOM 0 HE ARG A 122 9.475 -6.708 -22.707 1.00 0.00 H new ATOM 0 HH11 ARG A 122 5.921 -6.530 -22.673 1.00 0.00 H new ATOM 0 HH12 ARG A 122 5.786 -7.329 -24.243 1.00 0.00 H new ATOM 0 HH21 ARG A 122 9.273 -7.735 -24.639 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.682 -8.010 -25.354 1.00 0.00 H new ATOM 1852 N VAL A 123 7.155 -1.538 -17.855 1.00 0.00 N ATOM 1853 CA VAL A 123 6.959 -1.153 -16.460 1.00 0.00 C ATOM 1854 C VAL A 123 5.678 -0.309 -16.350 1.00 0.00 C ATOM 1855 O VAL A 123 4.908 -0.505 -15.412 1.00 0.00 O ATOM 1856 CB VAL A 123 8.231 -0.482 -15.920 1.00 0.00 C ATOM 1857 CG1 VAL A 123 8.081 -0.027 -14.467 1.00 0.00 C ATOM 1858 CG2 VAL A 123 9.460 -1.410 -15.959 1.00 0.00 C ATOM 0 H VAL A 123 7.955 -1.094 -18.306 1.00 0.00 H new ATOM 0 HA VAL A 123 6.803 -2.021 -15.820 1.00 0.00 H new ATOM 0 HB VAL A 123 8.379 0.373 -16.580 1.00 0.00 H new ATOM 0 HG11 VAL A 123 9.008 0.440 -14.135 1.00 0.00 H new ATOM 0 HG12 VAL A 123 7.265 0.692 -14.393 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.863 -0.889 -13.836 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.328 -0.881 -15.565 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.268 -2.294 -15.351 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.655 -1.712 -16.988 1.00 0.00 H new ATOM 1868 N GLU A 124 5.380 0.558 -17.323 1.00 0.00 N ATOM 1869 CA GLU A 124 4.130 1.306 -17.364 1.00 0.00 C ATOM 1870 C GLU A 124 2.948 0.346 -17.424 1.00 0.00 C ATOM 1871 O GLU A 124 1.988 0.532 -16.685 1.00 0.00 O ATOM 1872 CB GLU A 124 4.085 2.282 -18.559 1.00 0.00 C ATOM 1873 CG GLU A 124 4.638 3.668 -18.228 1.00 0.00 C ATOM 1874 CD GLU A 124 4.251 4.696 -19.304 1.00 0.00 C ATOM 1875 OE1 GLU A 124 3.155 5.297 -19.204 1.00 0.00 O ATOM 1876 OE2 GLU A 124 5.057 4.941 -20.234 1.00 0.00 O ATOM 0 H GLU A 124 6.004 0.758 -18.104 1.00 0.00 H new ATOM 0 HA GLU A 124 4.068 1.899 -16.452 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.655 1.859 -19.386 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.054 2.381 -18.900 1.00 0.00 H new ATOM 0 HG2 GLU A 124 4.257 3.992 -17.259 1.00 0.00 H new ATOM 0 HG3 GLU A 124 5.724 3.618 -18.144 1.00 0.00 H new ATOM 1883 N ASN A 125 3.028 -0.699 -18.249 1.00 0.00 N ATOM 1884 CA ASN A 125 1.950 -1.674 -18.393 1.00 0.00 C ATOM 1885 C ASN A 125 1.698 -2.415 -17.078 1.00 0.00 C ATOM 1886 O ASN A 125 0.551 -2.535 -16.651 1.00 0.00 O ATOM 1887 CB ASN A 125 2.272 -2.670 -19.515 1.00 0.00 C ATOM 1888 CG ASN A 125 1.148 -3.691 -19.667 1.00 0.00 C ATOM 1889 OD1 ASN A 125 1.228 -4.798 -19.142 1.00 0.00 O ATOM 1890 ND2 ASN A 125 0.072 -3.336 -20.354 1.00 0.00 N ATOM 0 H ASN A 125 3.841 -0.892 -18.834 1.00 0.00 H new ATOM 0 HA ASN A 125 1.041 -1.133 -18.656 1.00 0.00 H new ATOM 0 HB2 ASN A 125 2.414 -2.135 -20.454 1.00 0.00 H new ATOM 0 HB3 ASN A 125 3.209 -3.182 -19.296 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -0.707 -3.987 -20.453 1.00 0.00 H new ATOM 0 HD22 ASN A 125 0.023 -2.412 -20.783 1.00 0.00 H new ATOM 1897 N LEU A 126 2.766 -2.859 -16.408 1.00 0.00 N ATOM 1898 CA LEU A 126 2.715 -3.519 -15.116 1.00 0.00 C ATOM 1899 C LEU A 126 2.035 -2.621 -14.083 1.00 0.00 C ATOM 1900 O LEU A 126 1.125 -3.063 -13.389 1.00 0.00 O ATOM 1901 CB LEU A 126 4.166 -3.832 -14.705 1.00 0.00 C ATOM 1902 CG LEU A 126 4.335 -4.315 -13.259 1.00 0.00 C ATOM 1903 CD1 LEU A 126 3.548 -5.600 -13.013 1.00 0.00 C ATOM 1904 CD2 LEU A 126 5.818 -4.548 -12.995 1.00 0.00 C ATOM 0 H LEU A 126 3.715 -2.762 -16.768 1.00 0.00 H new ATOM 0 HA LEU A 126 2.132 -4.438 -15.174 1.00 0.00 H new ATOM 0 HB2 LEU A 126 4.563 -4.594 -15.376 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.770 -2.936 -14.847 1.00 0.00 H new ATOM 0 HG LEU A 126 3.947 -3.556 -12.580 1.00 0.00 H new ATOM 0 HD11 LEU A 126 3.686 -5.919 -11.980 1.00 0.00 H new ATOM 0 HD12 LEU A 126 2.489 -5.419 -13.198 1.00 0.00 H new ATOM 0 HD13 LEU A 126 3.906 -6.380 -13.685 1.00 0.00 H new ATOM 0 HD21 LEU A 126 5.955 -4.892 -11.970 1.00 0.00 H new ATOM 0 HD22 LEU A 126 6.196 -5.302 -13.685 1.00 0.00 H new ATOM 0 HD23 LEU A 126 6.364 -3.616 -13.141 1.00 0.00 H new ATOM 1916 N ILE A 127 2.450 -1.360 -13.991 1.00 0.00 N ATOM 1917 CA ILE A 127 1.898 -0.403 -13.043 1.00 0.00 C ATOM 1918 C ILE A 127 0.426 -0.189 -13.387 1.00 0.00 C ATOM 1919 O ILE A 127 -0.417 -0.274 -12.501 1.00 0.00 O ATOM 1920 CB ILE A 127 2.747 0.873 -13.134 1.00 0.00 C ATOM 1921 CG1 ILE A 127 4.104 0.550 -12.479 1.00 0.00 C ATOM 1922 CG2 ILE A 127 2.076 2.069 -12.445 1.00 0.00 C ATOM 1923 CD1 ILE A 127 5.150 1.618 -12.738 1.00 0.00 C ATOM 0 H ILE A 127 3.187 -0.972 -14.580 1.00 0.00 H new ATOM 0 HA ILE A 127 1.933 -0.749 -12.010 1.00 0.00 H new ATOM 0 HB ILE A 127 2.869 1.165 -14.177 1.00 0.00 H new ATOM 0 HG12 ILE A 127 3.966 0.436 -11.404 1.00 0.00 H new ATOM 0 HG13 ILE A 127 4.466 -0.406 -12.857 1.00 0.00 H new ATOM 0 HG21 ILE A 127 2.715 2.947 -12.537 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.115 2.269 -12.918 1.00 0.00 H new ATOM 0 HG23 ILE A 127 1.921 1.841 -11.390 1.00 0.00 H new ATOM 0 HD11 ILE A 127 6.085 1.337 -12.253 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.313 1.715 -13.811 1.00 0.00 H new ATOM 0 HD13 ILE A 127 4.805 2.571 -12.336 1.00 0.00 H new ATOM 1935 N ALA A 128 0.108 0.022 -14.666 1.00 0.00 N ATOM 1936 CA ALA A 128 -1.250 0.272 -15.120 1.00 0.00 C ATOM 1937 C ALA A 128 -2.201 -0.881 -14.771 1.00 0.00 C ATOM 1938 O ALA A 128 -3.389 -0.618 -14.564 1.00 0.00 O ATOM 1939 CB ALA A 128 -1.245 0.532 -16.629 1.00 0.00 C ATOM 0 H ALA A 128 0.797 0.023 -15.418 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.622 1.154 -14.598 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.263 0.719 -16.969 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.624 1.401 -16.846 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.844 -0.339 -17.147 1.00 0.00 H new ATOM 1945 N LYS A 129 -1.721 -2.133 -14.688 1.00 0.00 N ATOM 1946 CA LYS A 129 -2.560 -3.250 -14.264 1.00 0.00 C ATOM 1947 C LYS A 129 -2.660 -3.366 -12.742 1.00 0.00 C ATOM 1948 O LYS A 129 -3.755 -3.663 -12.257 1.00 0.00 O ATOM 1949 CB LYS A 129 -2.230 -4.568 -14.992 1.00 0.00 C ATOM 1950 CG LYS A 129 -0.823 -5.120 -14.748 1.00 0.00 C ATOM 1951 CD LYS A 129 -0.546 -6.473 -15.420 1.00 0.00 C ATOM 1952 CE LYS A 129 -0.622 -6.441 -16.954 1.00 0.00 C ATOM 1953 NZ LYS A 129 -0.377 -7.784 -17.549 1.00 0.00 N ATOM 0 H LYS A 129 -0.759 -2.389 -14.910 1.00 0.00 H new ATOM 0 HA LYS A 129 -3.574 -3.018 -14.590 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -2.955 -5.323 -14.688 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -2.360 -4.414 -16.063 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -0.094 -4.394 -15.107 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -0.668 -5.223 -13.674 1.00 0.00 H new ATOM 0 HD2 LYS A 129 0.445 -6.817 -15.124 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -1.263 -7.205 -15.047 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -1.604 -6.081 -17.262 1.00 0.00 H new ATOM 0 HE3 LYS A 129 0.112 -5.733 -17.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -0.420 -7.717 -18.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 0.563 -8.124 -17.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -1.103 -8.450 -17.215 1.00 0.00 H new ATOM 1967 N ILE A 130 -1.584 -3.137 -11.976 1.00 0.00 N ATOM 1968 CA ILE A 130 -1.626 -3.342 -10.534 1.00 0.00 C ATOM 1969 C ILE A 130 -2.227 -2.158 -9.765 1.00 0.00 C ATOM 1970 O ILE A 130 -2.951 -2.374 -8.791 1.00 0.00 O ATOM 1971 CB ILE A 130 -0.264 -3.784 -9.979 1.00 0.00 C ATOM 1972 CG1 ILE A 130 0.796 -2.671 -10.023 1.00 0.00 C ATOM 1973 CG2 ILE A 130 0.199 -5.075 -10.673 1.00 0.00 C ATOM 1974 CD1 ILE A 130 2.196 -3.108 -9.596 1.00 0.00 C ATOM 0 H ILE A 130 -0.685 -2.813 -12.333 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.318 -4.167 -10.366 1.00 0.00 H new ATOM 0 HB ILE A 130 -0.395 -4.000 -8.919 1.00 0.00 H new ATOM 0 HG12 ILE A 130 0.847 -2.276 -11.038 1.00 0.00 H new ATOM 0 HG13 ILE A 130 0.472 -1.854 -9.378 1.00 0.00 H new ATOM 0 HG21 ILE A 130 1.166 -5.378 -10.271 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.531 -5.865 -10.496 1.00 0.00 H new ATOM 0 HG23 ILE A 130 0.291 -4.899 -11.745 1.00 0.00 H new ATOM 0 HD11 ILE A 130 2.877 -2.259 -9.658 1.00 0.00 H new ATOM 0 HD12 ILE A 130 2.166 -3.474 -8.570 1.00 0.00 H new ATOM 0 HD13 ILE A 130 2.546 -3.903 -10.255 1.00 0.00 H new ATOM 1986 N SER A 131 -1.905 -0.931 -10.163 1.00 0.00 N ATOM 1987 CA SER A 131 -2.202 0.292 -9.451 1.00 0.00 C ATOM 1988 C SER A 131 -3.517 0.881 -9.958 1.00 0.00 C ATOM 1989 O SER A 131 -4.464 1.001 -9.147 1.00 0.00 O ATOM 1990 CB SER A 131 -1.020 1.249 -9.581 1.00 0.00 C ATOM 1991 OG SER A 131 0.118 0.681 -8.939 1.00 0.00 O ATOM 1992 OXT SER A 131 -3.619 1.212 -11.163 1.00 0.00 O ATOM 0 H SER A 131 -1.405 -0.762 -11.036 1.00 0.00 H new ATOM 0 HA SER A 131 -2.341 0.097 -8.388 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.803 1.436 -10.633 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.264 2.211 -9.130 1.00 0.00 H new ATOM 0 HG SER A 131 0.879 1.292 -9.022 1.00 0.00 H new