USER MOD reduce.3.24.130724 H: found=0, std=0, add=795, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 791 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 ASN : amide:sc= -1.37 X(o=-1.4,f=-1.7) USER MOD Single : A 16 CYS SG : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= -0.141 USER MOD Single : A 38 CYS SG : rot 82:sc= -0.825 USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot -108:sc= 1.23 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 60 HIS : no HD1:sc= 0 X(o=0,f=-0.036) USER MOD Single : A 63 HIS : no HD1:sc= 0 X(o=0,f=-0.0087) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -1.05 K(o=-1,f=-4.9!) USER MOD Single : A 71 CYS SG : rot 180:sc= 0 USER MOD Single : A 77 MET CE :methyl -143:sc= -0.226 (180deg=-1.75!) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 85:sc= 0.183 USER MOD Single : A 84 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 GLN : amide:sc= -0.138 K(o=-0.14,f=-2.1!) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 27.955 18.824 15.874 1.00 0.00 N ATOM 2 CA MET A 1 28.071 17.489 15.312 1.00 0.00 C ATOM 3 C MET A 1 27.879 17.515 13.794 1.00 0.00 C ATOM 4 O MET A 1 26.833 17.936 13.304 1.00 0.00 O ATOM 5 CB MET A 1 27.019 16.576 15.945 1.00 0.00 C ATOM 6 CG MET A 1 27.536 15.964 17.248 1.00 0.00 C ATOM 7 SD MET A 1 27.850 14.222 17.022 1.00 0.00 S ATOM 8 CE MET A 1 28.320 13.774 18.685 1.00 0.00 C ATOM 0 H1 MET A 1 28.089 18.780 16.904 1.00 0.00 H new ATOM 0 H2 MET A 1 28.681 19.441 15.457 1.00 0.00 H new ATOM 0 H3 MET A 1 27.012 19.208 15.664 1.00 0.00 H new ATOM 0 HA MET A 1 29.070 17.110 15.526 1.00 0.00 H new ATOM 0 HB2 MET A 1 26.110 17.145 16.142 1.00 0.00 H new ATOM 0 HB3 MET A 1 26.754 15.782 15.247 1.00 0.00 H new ATOM 0 HG2 MET A 1 28.450 16.469 17.559 1.00 0.00 H new ATOM 0 HG3 MET A 1 26.805 16.110 18.043 1.00 0.00 H new ATOM 0 HE1 MET A 1 28.552 12.710 18.723 1.00 0.00 H new ATOM 0 HE2 MET A 1 29.198 14.348 18.982 1.00 0.00 H new ATOM 0 HE3 MET A 1 27.497 13.991 19.367 1.00 0.00 H new ATOM 18 N SER A 2 28.906 17.058 13.093 1.00 0.00 N ATOM 19 CA SER A 2 28.864 17.023 11.641 1.00 0.00 C ATOM 20 C SER A 2 29.415 15.689 11.133 1.00 0.00 C ATOM 21 O SER A 2 30.628 15.496 11.075 1.00 0.00 O ATOM 22 CB SER A 2 29.654 18.187 11.039 1.00 0.00 C ATOM 23 OG SER A 2 29.273 19.439 11.602 1.00 0.00 O ATOM 0 H SER A 2 29.772 16.709 13.503 1.00 0.00 H new ATOM 0 HA SER A 2 27.825 17.123 11.327 1.00 0.00 H new ATOM 0 HB2 SER A 2 30.719 18.025 11.203 1.00 0.00 H new ATOM 0 HB3 SER A 2 29.498 18.212 9.961 1.00 0.00 H new ATOM 0 HG SER A 2 29.801 20.156 11.193 1.00 0.00 H new ATOM 29 N ALA A 3 28.496 14.803 10.779 1.00 0.00 N ATOM 30 CA ALA A 3 28.874 13.492 10.279 1.00 0.00 C ATOM 31 C ALA A 3 27.768 12.961 9.366 1.00 0.00 C ATOM 32 O ALA A 3 26.673 13.519 9.322 1.00 0.00 O ATOM 33 CB ALA A 3 29.157 12.558 11.457 1.00 0.00 C ATOM 0 H ALA A 3 27.490 14.967 10.828 1.00 0.00 H new ATOM 0 HA ALA A 3 29.787 13.556 9.687 1.00 0.00 H new ATOM 0 HB1 ALA A 3 29.440 11.575 11.082 1.00 0.00 H new ATOM 0 HB2 ALA A 3 29.970 12.966 12.057 1.00 0.00 H new ATOM 0 HB3 ALA A 3 28.262 12.467 12.073 1.00 0.00 H new ATOM 39 N ASN A 4 28.092 11.888 8.659 1.00 0.00 N ATOM 40 CA ASN A 4 27.138 11.275 7.750 1.00 0.00 C ATOM 41 C ASN A 4 26.195 10.368 8.542 1.00 0.00 C ATOM 42 O ASN A 4 26.641 9.449 9.228 1.00 0.00 O ATOM 43 CB ASN A 4 27.850 10.416 6.702 1.00 0.00 C ATOM 44 CG ASN A 4 28.764 9.385 7.368 1.00 0.00 C ATOM 45 OD1 ASN A 4 28.356 8.291 7.720 1.00 0.00 O ATOM 46 ND2 ASN A 4 30.021 9.794 7.519 1.00 0.00 N ATOM 0 H ASN A 4 29.001 11.428 8.697 1.00 0.00 H new ATOM 0 HA ASN A 4 26.588 12.073 7.251 1.00 0.00 H new ATOM 0 HB2 ASN A 4 27.112 9.907 6.082 1.00 0.00 H new ATOM 0 HB3 ASN A 4 28.436 11.054 6.041 1.00 0.00 H new ATOM 0 HD21 ASN A 4 30.709 9.178 7.952 1.00 0.00 H new ATOM 0 HD22 ASN A 4 30.296 10.723 7.202 1.00 0.00 H new ATOM 53 N ARG A 5 24.908 10.657 8.422 1.00 0.00 N ATOM 54 CA ARG A 5 23.897 9.879 9.118 1.00 0.00 C ATOM 55 C ARG A 5 22.571 9.929 8.357 1.00 0.00 C ATOM 56 O ARG A 5 22.220 10.958 7.781 1.00 0.00 O ATOM 57 CB ARG A 5 23.682 10.403 10.540 1.00 0.00 C ATOM 58 CG ARG A 5 23.417 11.910 10.535 1.00 0.00 C ATOM 59 CD ARG A 5 22.352 12.283 11.568 1.00 0.00 C ATOM 60 NE ARG A 5 22.978 12.984 12.710 1.00 0.00 N ATOM 61 CZ ARG A 5 22.293 13.480 13.762 1.00 0.00 C ATOM 62 NH1 ARG A 5 20.950 13.354 13.826 1.00 0.00 N ATOM 63 NH2 ARG A 5 22.955 14.089 14.728 1.00 0.00 N ATOM 0 H ARG A 5 24.542 11.420 7.853 1.00 0.00 H new ATOM 0 HA ARG A 5 24.250 8.849 9.172 1.00 0.00 H new ATOM 0 HB2 ARG A 5 22.841 9.884 10.999 1.00 0.00 H new ATOM 0 HB3 ARG A 5 24.561 10.187 11.148 1.00 0.00 H new ATOM 0 HG2 ARG A 5 24.341 12.446 10.751 1.00 0.00 H new ATOM 0 HG3 ARG A 5 23.091 12.222 9.543 1.00 0.00 H new ATOM 0 HD2 ARG A 5 21.596 12.921 11.109 1.00 0.00 H new ATOM 0 HD3 ARG A 5 21.842 11.385 11.917 1.00 0.00 H new ATOM 0 HE ARG A 5 23.991 13.100 12.702 1.00 0.00 H new ATOM 0 HH11 ARG A 5 20.446 12.881 13.076 1.00 0.00 H new ATOM 0 HH12 ARG A 5 20.440 13.732 14.624 1.00 0.00 H new ATOM 0 HH21 ARG A 5 23.969 14.179 14.673 1.00 0.00 H new ATOM 0 HH22 ARG A 5 22.452 14.469 15.530 1.00 0.00 H new ATOM 77 N ARG A 6 21.869 8.806 8.380 1.00 0.00 N ATOM 78 CA ARG A 6 20.589 8.709 7.700 1.00 0.00 C ATOM 79 C ARG A 6 20.644 9.444 6.359 1.00 0.00 C ATOM 80 O ARG A 6 19.679 10.098 5.966 1.00 0.00 O ATOM 81 CB ARG A 6 19.465 9.301 8.553 1.00 0.00 C ATOM 82 CG ARG A 6 19.782 10.743 8.952 1.00 0.00 C ATOM 83 CD ARG A 6 18.593 11.387 9.669 1.00 0.00 C ATOM 84 NE ARG A 6 18.613 12.853 9.464 1.00 0.00 N ATOM 85 CZ ARG A 6 17.556 13.662 9.688 1.00 0.00 C ATOM 86 NH1 ARG A 6 16.384 13.154 10.125 1.00 0.00 N ATOM 87 NH2 ARG A 6 17.686 14.958 9.472 1.00 0.00 N ATOM 0 H ARG A 6 22.163 7.955 8.859 1.00 0.00 H new ATOM 0 HA ARG A 6 20.382 7.652 7.531 1.00 0.00 H new ATOM 0 HB2 ARG A 6 18.528 9.271 7.997 1.00 0.00 H new ATOM 0 HB3 ARG A 6 19.325 8.695 9.448 1.00 0.00 H new ATOM 0 HG2 ARG A 6 20.656 10.760 9.602 1.00 0.00 H new ATOM 0 HG3 ARG A 6 20.034 11.323 8.064 1.00 0.00 H new ATOM 0 HD2 ARG A 6 17.660 10.971 9.289 1.00 0.00 H new ATOM 0 HD3 ARG A 6 18.633 11.160 10.734 1.00 0.00 H new ATOM 0 HE ARG A 6 19.479 13.278 9.133 1.00 0.00 H new ATOM 0 HH11 ARG A 6 16.292 12.151 10.289 1.00 0.00 H new ATOM 0 HH12 ARG A 6 15.590 13.773 10.292 1.00 0.00 H new ATOM 0 HH21 ARG A 6 18.575 15.333 9.141 1.00 0.00 H new ATOM 0 HH22 ARG A 6 16.898 15.584 9.636 1.00 0.00 H new ATOM 101 N TRP A 7 21.782 9.312 5.694 1.00 0.00 N ATOM 102 CA TRP A 7 21.975 9.956 4.406 1.00 0.00 C ATOM 103 C TRP A 7 22.165 8.861 3.354 1.00 0.00 C ATOM 104 O TRP A 7 23.227 8.244 3.279 1.00 0.00 O ATOM 105 CB TRP A 7 23.141 10.945 4.456 1.00 0.00 C ATOM 106 CG TRP A 7 23.534 11.514 3.091 1.00 0.00 C ATOM 107 CD1 TRP A 7 22.741 12.098 2.182 1.00 0.00 C ATOM 108 CD2 TRP A 7 24.857 11.530 2.515 1.00 0.00 C ATOM 109 NE1 TRP A 7 23.453 12.488 1.066 1.00 0.00 N ATOM 110 CE2 TRP A 7 24.781 12.132 1.275 1.00 0.00 C ATOM 111 CE3 TRP A 7 26.077 11.053 3.024 1.00 0.00 C ATOM 112 CZ2 TRP A 7 25.891 12.311 0.441 1.00 0.00 C ATOM 113 CZ3 TRP A 7 27.177 11.239 2.178 1.00 0.00 C ATOM 114 CH2 TRP A 7 27.117 11.843 0.927 1.00 0.00 C ATOM 0 H TRP A 7 22.580 8.768 6.023 1.00 0.00 H new ATOM 0 HA TRP A 7 21.101 10.550 4.137 1.00 0.00 H new ATOM 0 HB2 TRP A 7 22.877 11.769 5.119 1.00 0.00 H new ATOM 0 HB3 TRP A 7 24.007 10.448 4.894 1.00 0.00 H new ATOM 0 HD1 TRP A 7 21.678 12.245 2.307 1.00 0.00 H new ATOM 0 HE1 TRP A 7 23.075 12.952 0.240 1.00 0.00 H new ATOM 0 HE3 TRP A 7 26.160 10.580 3.991 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 25.806 12.785 -0.526 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 28.139 10.889 2.521 1.00 0.00 H new ATOM 0 HH2 TRP A 7 28.013 11.950 0.333 1.00 0.00 H new ATOM 125 N TRP A 8 21.119 8.653 2.567 1.00 0.00 N ATOM 126 CA TRP A 8 21.158 7.643 1.523 1.00 0.00 C ATOM 127 C TRP A 8 19.796 7.632 0.825 1.00 0.00 C ATOM 128 O TRP A 8 18.775 7.927 1.445 1.00 0.00 O ATOM 129 CB TRP A 8 21.548 6.278 2.094 1.00 0.00 C ATOM 130 CG TRP A 8 20.830 5.920 3.396 1.00 0.00 C ATOM 131 CD1 TRP A 8 19.515 5.962 3.652 1.00 0.00 C ATOM 132 CD2 TRP A 8 21.445 5.461 4.619 1.00 0.00 C ATOM 133 NE1 TRP A 8 19.239 5.565 4.945 1.00 0.00 N ATOM 134 CE2 TRP A 8 20.449 5.251 5.551 1.00 0.00 C ATOM 135 CE3 TRP A 8 22.797 5.232 4.926 1.00 0.00 C ATOM 136 CZ2 TRP A 8 20.701 4.801 6.853 1.00 0.00 C ATOM 137 CZ3 TRP A 8 23.032 4.782 6.231 1.00 0.00 C ATOM 138 CH2 TRP A 8 22.041 4.565 7.182 1.00 0.00 C ATOM 0 H TRP A 8 20.240 9.166 2.631 1.00 0.00 H new ATOM 0 HA TRP A 8 21.925 7.880 0.786 1.00 0.00 H new ATOM 0 HB2 TRP A 8 21.334 5.510 1.350 1.00 0.00 H new ATOM 0 HB3 TRP A 8 22.624 6.263 2.268 1.00 0.00 H new ATOM 0 HD1 TRP A 8 18.766 6.268 2.937 1.00 0.00 H new ATOM 0 HE1 TRP A 8 18.316 5.512 5.376 1.00 0.00 H new ATOM 0 HE3 TRP A 8 23.592 5.390 4.212 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 19.904 4.644 7.565 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 24.055 4.590 6.519 1.00 0.00 H new ATOM 0 HH2 TRP A 8 22.304 4.216 8.170 1.00 0.00 H new ATOM 149 N VAL A 9 19.825 7.289 -0.454 1.00 0.00 N ATOM 150 CA VAL A 9 18.605 7.235 -1.242 1.00 0.00 C ATOM 151 C VAL A 9 18.822 6.320 -2.448 1.00 0.00 C ATOM 152 O VAL A 9 19.899 6.315 -3.043 1.00 0.00 O ATOM 153 CB VAL A 9 18.173 8.650 -1.635 1.00 0.00 C ATOM 154 CG1 VAL A 9 19.317 9.402 -2.318 1.00 0.00 C ATOM 155 CG2 VAL A 9 16.930 8.616 -2.525 1.00 0.00 C ATOM 0 H VAL A 9 20.674 7.046 -0.965 1.00 0.00 H new ATOM 0 HA VAL A 9 17.790 6.811 -0.655 1.00 0.00 H new ATOM 0 HB VAL A 9 17.916 9.188 -0.722 1.00 0.00 H new ATOM 0 HG11 VAL A 9 18.984 10.404 -2.587 1.00 0.00 H new ATOM 0 HG12 VAL A 9 20.165 9.472 -1.636 1.00 0.00 H new ATOM 0 HG13 VAL A 9 19.619 8.866 -3.218 1.00 0.00 H new ATOM 0 HG21 VAL A 9 16.644 9.634 -2.790 1.00 0.00 H new ATOM 0 HG22 VAL A 9 17.147 8.052 -3.432 1.00 0.00 H new ATOM 0 HG23 VAL A 9 16.111 8.137 -1.988 1.00 0.00 H new ATOM 165 N PRO A 10 17.754 5.547 -2.783 1.00 0.00 N ATOM 166 CA PRO A 10 17.818 4.629 -3.908 1.00 0.00 C ATOM 167 C PRO A 10 17.732 5.384 -5.236 1.00 0.00 C ATOM 168 O PRO A 10 17.455 6.582 -5.257 1.00 0.00 O ATOM 169 CB PRO A 10 16.661 3.666 -3.696 1.00 0.00 C ATOM 170 CG PRO A 10 15.719 4.355 -2.722 1.00 0.00 C ATOM 171 CD PRO A 10 16.463 5.526 -2.102 1.00 0.00 C ATOM 0 HA PRO A 10 18.764 4.089 -3.958 1.00 0.00 H new ATOM 0 HB2 PRO A 10 16.158 3.447 -4.638 1.00 0.00 H new ATOM 0 HB3 PRO A 10 17.012 2.716 -3.294 1.00 0.00 H new ATOM 0 HG2 PRO A 10 14.824 4.702 -3.238 1.00 0.00 H new ATOM 0 HG3 PRO A 10 15.392 3.659 -1.950 1.00 0.00 H new ATOM 0 HD2 PRO A 10 15.923 6.461 -2.249 1.00 0.00 H new ATOM 0 HD3 PRO A 10 16.584 5.394 -1.027 1.00 0.00 H new ATOM 179 N PRO A 11 17.981 4.632 -6.342 1.00 0.00 N ATOM 180 CA PRO A 11 17.935 5.216 -7.671 1.00 0.00 C ATOM 181 C PRO A 11 16.490 5.453 -8.116 1.00 0.00 C ATOM 182 O PRO A 11 16.200 6.432 -8.802 1.00 0.00 O ATOM 183 CB PRO A 11 18.676 4.231 -8.560 1.00 0.00 C ATOM 184 CG PRO A 11 18.705 2.919 -7.794 1.00 0.00 C ATOM 185 CD PRO A 11 18.312 3.210 -6.355 1.00 0.00 C ATOM 0 HA PRO A 11 18.402 6.200 -7.714 1.00 0.00 H new ATOM 0 HB2 PRO A 11 18.170 4.113 -9.518 1.00 0.00 H new ATOM 0 HB3 PRO A 11 19.686 4.581 -8.774 1.00 0.00 H new ATOM 0 HG2 PRO A 11 18.016 2.201 -8.240 1.00 0.00 H new ATOM 0 HG3 PRO A 11 19.699 2.475 -7.836 1.00 0.00 H new ATOM 0 HD2 PRO A 11 17.461 2.602 -6.046 1.00 0.00 H new ATOM 0 HD3 PRO A 11 19.129 2.987 -5.669 1.00 0.00 H new ATOM 193 N ASP A 12 15.621 4.540 -7.706 1.00 0.00 N ATOM 194 CA ASP A 12 14.214 4.637 -8.054 1.00 0.00 C ATOM 195 C ASP A 12 14.069 4.661 -9.577 1.00 0.00 C ATOM 196 O ASP A 12 15.026 4.961 -10.290 1.00 0.00 O ATOM 197 CB ASP A 12 13.598 5.924 -7.501 1.00 0.00 C ATOM 198 CG ASP A 12 13.316 5.912 -5.997 1.00 0.00 C ATOM 199 OD1 ASP A 12 12.489 5.003 -5.605 1.00 0.00 O ATOM 200 OD2 ASP A 12 13.860 6.729 -5.239 1.00 0.00 O ATOM 0 H ASP A 12 15.865 3.730 -7.136 1.00 0.00 H new ATOM 0 HA ASP A 12 13.701 3.777 -7.624 1.00 0.00 H new ATOM 0 HB2 ASP A 12 14.268 6.754 -7.723 1.00 0.00 H new ATOM 0 HB3 ASP A 12 12.664 6.118 -8.029 1.00 0.00 H new ATOM 205 N ASP A 13 12.867 4.339 -10.030 1.00 0.00 N ATOM 206 CA ASP A 13 12.585 4.320 -11.455 1.00 0.00 C ATOM 207 C ASP A 13 11.166 3.793 -11.683 1.00 0.00 C ATOM 208 O ASP A 13 10.568 3.203 -10.785 1.00 0.00 O ATOM 209 CB ASP A 13 13.556 3.398 -12.196 1.00 0.00 C ATOM 210 CG ASP A 13 14.679 4.113 -12.950 1.00 0.00 C ATOM 211 OD1 ASP A 13 14.475 5.191 -13.528 1.00 0.00 O ATOM 212 OD2 ASP A 13 15.819 3.511 -12.928 1.00 0.00 O ATOM 0 H ASP A 13 12.077 4.089 -9.435 1.00 0.00 H new ATOM 0 HA ASP A 13 12.692 5.337 -11.834 1.00 0.00 H new ATOM 0 HB2 ASP A 13 14.002 2.711 -11.477 1.00 0.00 H new ATOM 0 HB3 ASP A 13 12.990 2.794 -12.905 1.00 0.00 H new ATOM 217 N GLU A 14 10.669 4.026 -12.889 1.00 0.00 N ATOM 218 CA GLU A 14 9.333 3.583 -13.246 1.00 0.00 C ATOM 219 C GLU A 14 9.222 2.063 -13.105 1.00 0.00 C ATOM 220 O GLU A 14 9.872 1.319 -13.838 1.00 0.00 O ATOM 221 CB GLU A 14 8.967 4.030 -14.663 1.00 0.00 C ATOM 222 CG GLU A 14 8.296 5.405 -14.648 1.00 0.00 C ATOM 223 CD GLU A 14 8.942 6.341 -15.672 1.00 0.00 C ATOM 224 OE1 GLU A 14 9.401 5.882 -16.729 1.00 0.00 O ATOM 225 OE2 GLU A 14 8.957 7.587 -15.338 1.00 0.00 O ATOM 0 H GLU A 14 11.168 4.516 -13.631 1.00 0.00 H new ATOM 0 HA GLU A 14 8.623 4.045 -12.560 1.00 0.00 H new ATOM 0 HB2 GLU A 14 9.865 4.066 -15.280 1.00 0.00 H new ATOM 0 HB3 GLU A 14 8.297 3.300 -15.117 1.00 0.00 H new ATOM 0 HG2 GLU A 14 7.234 5.298 -14.867 1.00 0.00 H new ATOM 0 HG3 GLU A 14 8.373 5.841 -13.652 1.00 0.00 H new ATOM 232 N ASP A 15 8.394 1.648 -12.158 1.00 0.00 N ATOM 233 CA ASP A 15 8.190 0.231 -11.911 1.00 0.00 C ATOM 234 C ASP A 15 6.831 0.025 -11.239 1.00 0.00 C ATOM 235 O ASP A 15 6.165 0.991 -10.868 1.00 0.00 O ATOM 236 CB ASP A 15 9.267 -0.327 -10.979 1.00 0.00 C ATOM 237 CG ASP A 15 10.582 -0.706 -11.664 1.00 0.00 C ATOM 238 OD1 ASP A 15 10.494 -1.668 -12.518 1.00 0.00 O ATOM 239 OD2 ASP A 15 11.636 -0.112 -11.395 1.00 0.00 O ATOM 0 H ASP A 15 7.856 2.268 -11.552 1.00 0.00 H new ATOM 0 HA ASP A 15 8.238 -0.288 -12.868 1.00 0.00 H new ATOM 0 HB2 ASP A 15 9.477 0.413 -10.207 1.00 0.00 H new ATOM 0 HB3 ASP A 15 8.870 -1.208 -10.476 1.00 0.00 H new ATOM 244 N CYS A 16 6.459 -1.239 -11.102 1.00 0.00 N ATOM 245 CA CYS A 16 5.191 -1.584 -10.481 1.00 0.00 C ATOM 246 C CYS A 16 5.467 -2.561 -9.337 1.00 0.00 C ATOM 247 O CYS A 16 5.186 -2.260 -8.178 1.00 0.00 O ATOM 248 CB CYS A 16 4.202 -2.159 -11.497 1.00 0.00 C ATOM 249 SG CYS A 16 3.579 -0.828 -12.587 1.00 0.00 S ATOM 0 H CYS A 16 7.014 -2.037 -11.411 1.00 0.00 H new ATOM 0 HA CYS A 16 4.721 -0.685 -10.084 1.00 0.00 H new ATOM 0 HB2 CYS A 16 4.688 -2.931 -12.093 1.00 0.00 H new ATOM 0 HB3 CYS A 16 3.370 -2.634 -10.978 1.00 0.00 H new ATOM 0 HG CYS A 16 2.742 -1.328 -13.447 1.00 0.00 H new ATOM 255 N VAL A 17 6.014 -3.711 -9.702 1.00 0.00 N ATOM 256 CA VAL A 17 6.330 -4.734 -8.720 1.00 0.00 C ATOM 257 C VAL A 17 7.574 -5.502 -9.172 1.00 0.00 C ATOM 258 O VAL A 17 8.658 -5.315 -8.622 1.00 0.00 O ATOM 259 CB VAL A 17 5.117 -5.640 -8.497 1.00 0.00 C ATOM 260 CG1 VAL A 17 5.522 -6.936 -7.793 1.00 0.00 C ATOM 261 CG2 VAL A 17 4.024 -4.909 -7.715 1.00 0.00 C ATOM 0 H VAL A 17 6.246 -3.957 -10.664 1.00 0.00 H new ATOM 0 HA VAL A 17 6.560 -4.279 -7.757 1.00 0.00 H new ATOM 0 HB VAL A 17 4.711 -5.903 -9.474 1.00 0.00 H new ATOM 0 HG11 VAL A 17 4.641 -7.561 -7.647 1.00 0.00 H new ATOM 0 HG12 VAL A 17 6.249 -7.470 -8.405 1.00 0.00 H new ATOM 0 HG13 VAL A 17 5.965 -6.701 -6.825 1.00 0.00 H new ATOM 0 HG21 VAL A 17 3.173 -5.575 -7.570 1.00 0.00 H new ATOM 0 HG22 VAL A 17 4.414 -4.602 -6.745 1.00 0.00 H new ATOM 0 HG23 VAL A 17 3.705 -4.028 -8.273 1.00 0.00 H new ATOM 271 N SER A 18 7.376 -6.350 -10.171 1.00 0.00 N ATOM 272 CA SER A 18 8.468 -7.147 -10.704 1.00 0.00 C ATOM 273 C SER A 18 9.029 -8.062 -9.613 1.00 0.00 C ATOM 274 O SER A 18 8.569 -8.028 -8.473 1.00 0.00 O ATOM 275 CB SER A 18 9.575 -6.255 -11.270 1.00 0.00 C ATOM 276 OG SER A 18 10.128 -6.788 -12.471 1.00 0.00 O ATOM 0 H SER A 18 6.476 -6.502 -10.625 1.00 0.00 H new ATOM 0 HA SER A 18 8.080 -7.759 -11.518 1.00 0.00 H new ATOM 0 HB2 SER A 18 9.175 -5.260 -11.465 1.00 0.00 H new ATOM 0 HB3 SER A 18 10.364 -6.141 -10.527 1.00 0.00 H new ATOM 0 HG SER A 18 10.830 -6.189 -12.802 1.00 0.00 H new ATOM 282 N GLU A 19 10.014 -8.858 -10.002 1.00 0.00 N ATOM 283 CA GLU A 19 10.643 -9.780 -9.072 1.00 0.00 C ATOM 284 C GLU A 19 11.260 -9.014 -7.900 1.00 0.00 C ATOM 285 O GLU A 19 11.515 -9.589 -6.843 1.00 0.00 O ATOM 286 CB GLU A 19 11.692 -10.641 -9.778 1.00 0.00 C ATOM 287 CG GLU A 19 12.728 -9.769 -10.490 1.00 0.00 C ATOM 288 CD GLU A 19 13.033 -10.310 -11.888 1.00 0.00 C ATOM 289 OE1 GLU A 19 13.898 -11.265 -11.926 1.00 0.00 O ATOM 290 OE2 GLU A 19 12.461 -9.828 -12.877 1.00 0.00 O ATOM 0 H GLU A 19 10.392 -8.883 -10.949 1.00 0.00 H new ATOM 0 HA GLU A 19 9.877 -10.449 -8.680 1.00 0.00 H new ATOM 0 HB2 GLU A 19 12.190 -11.283 -9.051 1.00 0.00 H new ATOM 0 HB3 GLU A 19 11.204 -11.296 -10.500 1.00 0.00 H new ATOM 0 HG2 GLU A 19 12.358 -8.746 -10.565 1.00 0.00 H new ATOM 0 HG3 GLU A 19 13.645 -9.734 -9.902 1.00 0.00 H new ATOM 297 N LYS A 20 11.483 -7.728 -8.127 1.00 0.00 N ATOM 298 CA LYS A 20 12.066 -6.877 -7.104 1.00 0.00 C ATOM 299 C LYS A 20 11.121 -6.812 -5.902 1.00 0.00 C ATOM 300 O LYS A 20 11.421 -7.359 -4.842 1.00 0.00 O ATOM 301 CB LYS A 20 12.418 -5.505 -7.684 1.00 0.00 C ATOM 302 CG LYS A 20 12.913 -4.558 -6.589 1.00 0.00 C ATOM 303 CD LYS A 20 14.418 -4.719 -6.364 1.00 0.00 C ATOM 304 CE LYS A 20 14.790 -4.418 -4.910 1.00 0.00 C ATOM 305 NZ LYS A 20 16.091 -5.035 -4.570 1.00 0.00 N ATOM 0 H LYS A 20 11.270 -7.254 -9.005 1.00 0.00 H new ATOM 0 HA LYS A 20 13.007 -7.298 -6.749 1.00 0.00 H new ATOM 0 HB2 LYS A 20 13.187 -5.616 -8.449 1.00 0.00 H new ATOM 0 HB3 LYS A 20 11.542 -5.077 -8.172 1.00 0.00 H new ATOM 0 HG2 LYS A 20 12.691 -3.528 -6.867 1.00 0.00 H new ATOM 0 HG3 LYS A 20 12.379 -4.760 -5.660 1.00 0.00 H new ATOM 0 HD2 LYS A 20 14.721 -5.735 -6.618 1.00 0.00 H new ATOM 0 HD3 LYS A 20 14.963 -4.049 -7.029 1.00 0.00 H new ATOM 0 HE2 LYS A 20 14.841 -3.340 -4.757 1.00 0.00 H new ATOM 0 HE3 LYS A 20 14.015 -4.798 -4.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 16.329 -4.821 -3.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 16.030 -6.065 -4.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 16.830 -4.653 -5.194 1.00 0.00 H new ATOM 319 N LEU A 21 9.999 -6.139 -6.108 1.00 0.00 N ATOM 320 CA LEU A 21 9.008 -5.995 -5.054 1.00 0.00 C ATOM 321 C LEU A 21 8.570 -7.382 -4.580 1.00 0.00 C ATOM 322 O LEU A 21 8.473 -7.630 -3.379 1.00 0.00 O ATOM 323 CB LEU A 21 7.851 -5.111 -5.524 1.00 0.00 C ATOM 324 CG LEU A 21 7.650 -3.804 -4.755 1.00 0.00 C ATOM 325 CD1 LEU A 21 7.339 -4.077 -3.282 1.00 0.00 C ATOM 326 CD2 LEU A 21 8.857 -2.878 -4.923 1.00 0.00 C ATOM 0 H LEU A 21 9.754 -5.687 -6.989 1.00 0.00 H new ATOM 0 HA LEU A 21 9.438 -5.485 -4.192 1.00 0.00 H new ATOM 0 HB2 LEU A 21 8.008 -4.870 -6.575 1.00 0.00 H new ATOM 0 HB3 LEU A 21 6.930 -5.690 -5.464 1.00 0.00 H new ATOM 0 HG LEU A 21 6.787 -3.289 -5.177 1.00 0.00 H new ATOM 0 HD11 LEU A 21 7.201 -3.131 -2.758 1.00 0.00 H new ATOM 0 HD12 LEU A 21 6.428 -4.670 -3.206 1.00 0.00 H new ATOM 0 HD13 LEU A 21 8.167 -4.624 -2.831 1.00 0.00 H new ATOM 0 HD21 LEU A 21 8.689 -1.956 -4.366 1.00 0.00 H new ATOM 0 HD22 LEU A 21 9.751 -3.373 -4.543 1.00 0.00 H new ATOM 0 HD23 LEU A 21 8.992 -2.645 -5.979 1.00 0.00 H new ATOM 338 N LEU A 22 8.316 -8.251 -5.548 1.00 0.00 N ATOM 339 CA LEU A 22 7.890 -9.606 -5.245 1.00 0.00 C ATOM 340 C LEU A 22 8.856 -10.225 -4.233 1.00 0.00 C ATOM 341 O LEU A 22 8.494 -10.445 -3.078 1.00 0.00 O ATOM 342 CB LEU A 22 7.742 -10.422 -6.531 1.00 0.00 C ATOM 343 CG LEU A 22 6.444 -10.210 -7.313 1.00 0.00 C ATOM 344 CD1 LEU A 22 6.694 -10.280 -8.821 1.00 0.00 C ATOM 345 CD2 LEU A 22 5.366 -11.200 -6.865 1.00 0.00 C ATOM 0 H LEU A 22 8.397 -8.042 -6.543 1.00 0.00 H new ATOM 0 HA LEU A 22 6.903 -9.600 -4.783 1.00 0.00 H new ATOM 0 HB2 LEU A 22 8.581 -10.186 -7.186 1.00 0.00 H new ATOM 0 HB3 LEU A 22 7.822 -11.479 -6.278 1.00 0.00 H new ATOM 0 HG LEU A 22 6.074 -9.209 -7.094 1.00 0.00 H new ATOM 0 HD11 LEU A 22 5.755 -10.126 -9.353 1.00 0.00 H new ATOM 0 HD12 LEU A 22 7.405 -9.505 -9.108 1.00 0.00 H new ATOM 0 HD13 LEU A 22 7.100 -11.258 -9.077 1.00 0.00 H new ATOM 0 HD21 LEU A 22 4.454 -11.028 -7.436 1.00 0.00 H new ATOM 0 HD22 LEU A 22 5.714 -12.219 -7.035 1.00 0.00 H new ATOM 0 HD23 LEU A 22 5.161 -11.059 -5.804 1.00 0.00 H new ATOM 357 N ARG A 23 10.067 -10.489 -4.702 1.00 0.00 N ATOM 358 CA ARG A 23 11.087 -11.078 -3.853 1.00 0.00 C ATOM 359 C ARG A 23 11.068 -10.424 -2.469 1.00 0.00 C ATOM 360 O ARG A 23 11.031 -11.116 -1.453 1.00 0.00 O ATOM 361 CB ARG A 23 12.478 -10.914 -4.468 1.00 0.00 C ATOM 362 CG ARG A 23 12.753 -12.007 -5.502 1.00 0.00 C ATOM 363 CD ARG A 23 13.758 -11.529 -6.552 1.00 0.00 C ATOM 364 NE ARG A 23 15.135 -11.857 -6.120 1.00 0.00 N ATOM 365 CZ ARG A 23 16.248 -11.335 -6.679 1.00 0.00 C ATOM 366 NH1 ARG A 23 16.155 -10.454 -7.697 1.00 0.00 N ATOM 367 NH2 ARG A 23 17.429 -11.699 -6.214 1.00 0.00 N ATOM 0 H ARG A 23 10.364 -10.305 -5.660 1.00 0.00 H new ATOM 0 HA ARG A 23 10.867 -12.141 -3.759 1.00 0.00 H new ATOM 0 HB2 ARG A 23 12.558 -9.934 -4.939 1.00 0.00 H new ATOM 0 HB3 ARG A 23 13.233 -10.953 -3.683 1.00 0.00 H new ATOM 0 HG2 ARG A 23 13.139 -12.896 -5.003 1.00 0.00 H new ATOM 0 HG3 ARG A 23 11.821 -12.294 -5.989 1.00 0.00 H new ATOM 0 HD2 ARG A 23 13.547 -12.001 -7.511 1.00 0.00 H new ATOM 0 HD3 ARG A 23 13.660 -10.453 -6.698 1.00 0.00 H new ATOM 0 HE ARG A 23 15.251 -12.519 -5.352 1.00 0.00 H new ATOM 0 HH11 ARG A 23 15.239 -10.177 -8.050 1.00 0.00 H new ATOM 0 HH12 ARG A 23 17.001 -10.065 -8.113 1.00 0.00 H new ATOM 0 HH21 ARG A 23 17.491 -12.365 -5.444 1.00 0.00 H new ATOM 0 HH22 ARG A 23 18.280 -11.314 -6.625 1.00 0.00 H new ATOM 381 N LYS A 24 11.095 -9.100 -2.475 1.00 0.00 N ATOM 382 CA LYS A 24 11.082 -8.345 -1.234 1.00 0.00 C ATOM 383 C LYS A 24 10.024 -8.932 -0.297 1.00 0.00 C ATOM 384 O LYS A 24 10.336 -9.335 0.823 1.00 0.00 O ATOM 385 CB LYS A 24 10.894 -6.853 -1.516 1.00 0.00 C ATOM 386 CG LYS A 24 10.875 -6.048 -0.215 1.00 0.00 C ATOM 387 CD LYS A 24 12.292 -5.657 0.208 1.00 0.00 C ATOM 388 CE LYS A 24 12.544 -4.166 -0.028 1.00 0.00 C ATOM 389 NZ LYS A 24 13.570 -3.658 0.910 1.00 0.00 N ATOM 0 H LYS A 24 11.126 -8.530 -3.320 1.00 0.00 H new ATOM 0 HA LYS A 24 12.042 -8.431 -0.726 1.00 0.00 H new ATOM 0 HB2 LYS A 24 11.700 -6.496 -2.157 1.00 0.00 H new ATOM 0 HB3 LYS A 24 9.962 -6.696 -2.059 1.00 0.00 H new ATOM 0 HG2 LYS A 24 10.270 -5.151 -0.347 1.00 0.00 H new ATOM 0 HG3 LYS A 24 10.405 -6.636 0.574 1.00 0.00 H new ATOM 0 HD2 LYS A 24 12.438 -5.892 1.262 1.00 0.00 H new ATOM 0 HD3 LYS A 24 13.018 -6.245 -0.353 1.00 0.00 H new ATOM 0 HE2 LYS A 24 12.871 -4.005 -1.055 1.00 0.00 H new ATOM 0 HE3 LYS A 24 11.616 -3.609 0.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 13.728 -2.645 0.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 13.244 -3.794 1.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 14.460 -4.177 0.766 1.00 0.00 H new ATOM 403 N THR A 25 8.794 -8.962 -0.789 1.00 0.00 N ATOM 404 CA THR A 25 7.688 -9.492 -0.010 1.00 0.00 C ATOM 405 C THR A 25 6.884 -10.494 -0.840 1.00 0.00 C ATOM 406 O THR A 25 6.407 -10.166 -1.926 1.00 0.00 O ATOM 407 CB THR A 25 6.855 -8.312 0.493 1.00 0.00 C ATOM 408 OG1 THR A 25 7.650 -7.742 1.529 1.00 0.00 O ATOM 409 CG2 THR A 25 5.578 -8.759 1.207 1.00 0.00 C ATOM 0 H THR A 25 8.539 -8.628 -1.718 1.00 0.00 H new ATOM 0 HA THR A 25 8.045 -10.048 0.857 1.00 0.00 H new ATOM 0 HB THR A 25 6.595 -7.668 -0.347 1.00 0.00 H new ATOM 0 HG1 THR A 25 7.185 -6.968 1.910 1.00 0.00 H new ATOM 0 HG21 THR A 25 5.024 -7.883 1.544 1.00 0.00 H new ATOM 0 HG22 THR A 25 4.960 -9.337 0.520 1.00 0.00 H new ATOM 0 HG23 THR A 25 5.839 -9.376 2.067 1.00 0.00 H new ATOM 417 N ARG A 26 6.757 -11.697 -0.298 1.00 0.00 N ATOM 418 CA ARG A 26 6.018 -12.749 -0.975 1.00 0.00 C ATOM 419 C ARG A 26 6.094 -14.050 -0.175 1.00 0.00 C ATOM 420 O ARG A 26 6.794 -14.984 -0.565 1.00 0.00 O ATOM 421 CB ARG A 26 6.569 -12.991 -2.382 1.00 0.00 C ATOM 422 CG ARG A 26 5.446 -13.356 -3.355 1.00 0.00 C ATOM 423 CD ARG A 26 5.449 -14.856 -3.658 1.00 0.00 C ATOM 424 NE ARG A 26 5.656 -15.079 -5.107 1.00 0.00 N ATOM 425 CZ ARG A 26 6.866 -15.105 -5.704 1.00 0.00 C ATOM 426 NH1 ARG A 26 7.991 -14.921 -4.980 1.00 0.00 N ATOM 427 NH2 ARG A 26 6.934 -15.312 -7.006 1.00 0.00 N ATOM 0 H ARG A 26 7.154 -11.966 0.602 1.00 0.00 H new ATOM 0 HA ARG A 26 4.980 -12.427 -1.054 1.00 0.00 H new ATOM 0 HB2 ARG A 26 7.084 -12.097 -2.734 1.00 0.00 H new ATOM 0 HB3 ARG A 26 7.306 -13.793 -2.355 1.00 0.00 H new ATOM 0 HG2 ARG A 26 4.484 -13.069 -2.930 1.00 0.00 H new ATOM 0 HG3 ARG A 26 5.566 -12.794 -4.281 1.00 0.00 H new ATOM 0 HD2 ARG A 26 6.238 -15.349 -3.089 1.00 0.00 H new ATOM 0 HD3 ARG A 26 4.505 -15.301 -3.344 1.00 0.00 H new ATOM 0 HE ARG A 26 4.832 -15.222 -5.691 1.00 0.00 H new ATOM 0 HH11 ARG A 26 7.930 -14.761 -3.974 1.00 0.00 H new ATOM 0 HH12 ARG A 26 8.902 -14.942 -5.439 1.00 0.00 H new ATOM 0 HH21 ARG A 26 6.080 -15.449 -7.546 1.00 0.00 H new ATOM 0 HH22 ARG A 26 7.841 -15.334 -7.472 1.00 0.00 H new ATOM 441 N GLU A 27 5.364 -14.071 0.931 1.00 0.00 N ATOM 442 CA GLU A 27 5.339 -15.243 1.790 1.00 0.00 C ATOM 443 C GLU A 27 4.359 -15.033 2.945 1.00 0.00 C ATOM 444 O GLU A 27 3.996 -13.900 3.259 1.00 0.00 O ATOM 445 CB GLU A 27 6.740 -15.569 2.312 1.00 0.00 C ATOM 446 CG GLU A 27 6.914 -17.076 2.510 1.00 0.00 C ATOM 447 CD GLU A 27 7.051 -17.421 3.994 1.00 0.00 C ATOM 448 OE1 GLU A 27 8.193 -17.128 4.519 1.00 0.00 O ATOM 449 OE2 GLU A 27 6.104 -17.945 4.600 1.00 0.00 O ATOM 0 H GLU A 27 4.785 -13.295 1.252 1.00 0.00 H new ATOM 0 HA GLU A 27 4.999 -16.095 1.201 1.00 0.00 H new ATOM 0 HB2 GLU A 27 7.488 -15.202 1.609 1.00 0.00 H new ATOM 0 HB3 GLU A 27 6.909 -15.052 3.257 1.00 0.00 H new ATOM 0 HG2 GLU A 27 6.058 -17.603 2.088 1.00 0.00 H new ATOM 0 HG3 GLU A 27 7.797 -17.418 1.970 1.00 0.00 H new ATOM 456 N SER A 28 3.957 -16.143 3.547 1.00 0.00 N ATOM 457 CA SER A 28 3.025 -16.095 4.661 1.00 0.00 C ATOM 458 C SER A 28 1.615 -15.794 4.151 1.00 0.00 C ATOM 459 O SER A 28 1.441 -15.372 3.009 1.00 0.00 O ATOM 460 CB SER A 28 3.452 -15.048 5.692 1.00 0.00 C ATOM 461 OG SER A 28 3.716 -15.629 6.966 1.00 0.00 O ATOM 0 H SER A 28 4.260 -17.081 3.284 1.00 0.00 H new ATOM 0 HA SER A 28 3.027 -17.069 5.151 1.00 0.00 H new ATOM 0 HB2 SER A 28 4.344 -14.533 5.337 1.00 0.00 H new ATOM 0 HB3 SER A 28 2.668 -14.297 5.792 1.00 0.00 H new ATOM 0 HG SER A 28 3.987 -14.928 7.595 1.00 0.00 H new ATOM 467 N PRO A 29 0.618 -16.029 5.046 1.00 0.00 N ATOM 468 CA PRO A 29 -0.772 -15.788 4.698 1.00 0.00 C ATOM 469 C PRO A 29 -1.083 -14.290 4.693 1.00 0.00 C ATOM 470 O PRO A 29 -0.424 -13.512 5.382 1.00 0.00 O ATOM 471 CB PRO A 29 -1.576 -16.558 5.733 1.00 0.00 C ATOM 472 CG PRO A 29 -0.625 -16.818 6.890 1.00 0.00 C ATOM 473 CD PRO A 29 0.787 -16.530 6.407 1.00 0.00 C ATOM 0 HA PRO A 29 -1.018 -16.125 3.691 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -2.442 -15.984 6.061 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -1.952 -17.493 5.319 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -0.875 -16.182 7.740 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -0.709 -17.851 7.229 1.00 0.00 H new ATOM 0 HD2 PRO A 29 1.280 -15.794 7.042 1.00 0.00 H new ATOM 0 HD3 PRO A 29 1.403 -17.429 6.424 1.00 0.00 H new ATOM 481 N LEU A 30 -2.088 -13.929 3.907 1.00 0.00 N ATOM 482 CA LEU A 30 -2.495 -12.538 3.803 1.00 0.00 C ATOM 483 C LEU A 30 -3.669 -12.283 4.749 1.00 0.00 C ATOM 484 O LEU A 30 -3.946 -11.138 5.106 1.00 0.00 O ATOM 485 CB LEU A 30 -2.788 -12.173 2.346 1.00 0.00 C ATOM 486 CG LEU A 30 -4.186 -12.526 1.835 1.00 0.00 C ATOM 487 CD1 LEU A 30 -5.080 -11.285 1.784 1.00 0.00 C ATOM 488 CD2 LEU A 30 -4.112 -13.235 0.481 1.00 0.00 C ATOM 0 H LEU A 30 -2.632 -14.576 3.336 1.00 0.00 H new ATOM 0 HA LEU A 30 -1.685 -11.879 4.115 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -2.638 -11.100 2.224 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -2.054 -12.672 1.713 1.00 0.00 H new ATOM 0 HG LEU A 30 -4.641 -13.223 2.539 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -6.068 -11.563 1.417 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -5.170 -10.860 2.784 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -4.639 -10.546 1.114 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -5.119 -13.475 0.140 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -3.629 -12.582 -0.246 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.535 -14.154 0.583 1.00 0.00 H new ATOM 500 N VAL A 31 -4.329 -13.367 5.129 1.00 0.00 N ATOM 501 CA VAL A 31 -5.468 -13.275 6.027 1.00 0.00 C ATOM 502 C VAL A 31 -5.088 -12.423 7.239 1.00 0.00 C ATOM 503 O VAL A 31 -5.816 -11.504 7.610 1.00 0.00 O ATOM 504 CB VAL A 31 -5.949 -14.676 6.407 1.00 0.00 C ATOM 505 CG1 VAL A 31 -6.331 -14.741 7.888 1.00 0.00 C ATOM 506 CG2 VAL A 31 -7.115 -15.115 5.520 1.00 0.00 C ATOM 0 H VAL A 31 -4.097 -14.314 4.831 1.00 0.00 H new ATOM 0 HA VAL A 31 -6.305 -12.782 5.533 1.00 0.00 H new ATOM 0 HB VAL A 31 -5.124 -15.370 6.243 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -6.670 -15.748 8.133 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -5.463 -14.492 8.499 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -7.132 -14.030 8.089 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -7.438 -16.115 5.811 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -7.944 -14.417 5.637 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -6.795 -15.126 4.478 1.00 0.00 H new ATOM 516 N PRO A 32 -3.917 -12.768 7.839 1.00 0.00 N ATOM 517 CA PRO A 32 -3.431 -12.045 9.003 1.00 0.00 C ATOM 518 C PRO A 32 -2.865 -10.681 8.604 1.00 0.00 C ATOM 519 O PRO A 32 -3.507 -9.653 8.812 1.00 0.00 O ATOM 520 CB PRO A 32 -2.390 -12.960 9.628 1.00 0.00 C ATOM 521 CG PRO A 32 -1.998 -13.948 8.542 1.00 0.00 C ATOM 522 CD PRO A 32 -3.028 -13.850 7.428 1.00 0.00 C ATOM 0 HA PRO A 32 -4.222 -11.817 9.717 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -1.525 -12.392 9.970 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -2.796 -13.476 10.498 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -1.002 -13.722 8.162 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -1.964 -14.961 8.942 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -2.556 -13.632 6.470 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -3.573 -14.787 7.309 1.00 0.00 H new ATOM 530 N ILE A 33 -1.668 -10.715 8.037 1.00 0.00 N ATOM 531 CA ILE A 33 -1.008 -9.494 7.607 1.00 0.00 C ATOM 532 C ILE A 33 -2.038 -8.561 6.967 1.00 0.00 C ATOM 533 O ILE A 33 -1.909 -7.341 7.046 1.00 0.00 O ATOM 534 CB ILE A 33 0.178 -9.818 6.696 1.00 0.00 C ATOM 535 CG1 ILE A 33 1.167 -8.652 6.647 1.00 0.00 C ATOM 536 CG2 ILE A 33 -0.298 -10.225 5.300 1.00 0.00 C ATOM 537 CD1 ILE A 33 2.376 -8.921 7.545 1.00 0.00 C ATOM 0 H ILE A 33 -1.138 -11.569 7.865 1.00 0.00 H new ATOM 0 HA ILE A 33 -0.588 -8.966 8.463 1.00 0.00 H new ATOM 0 HB ILE A 33 0.708 -10.672 7.117 1.00 0.00 H new ATOM 0 HG12 ILE A 33 1.499 -8.495 5.621 1.00 0.00 H new ATOM 0 HG13 ILE A 33 0.670 -7.735 6.965 1.00 0.00 H new ATOM 0 HG21 ILE A 33 0.565 -10.450 4.673 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -0.932 -11.108 5.375 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -0.866 -9.407 4.856 1.00 0.00 H new ATOM 0 HD11 ILE A 33 3.064 -8.077 7.492 1.00 0.00 H new ATOM 0 HD12 ILE A 33 2.042 -9.053 8.574 1.00 0.00 H new ATOM 0 HD13 ILE A 33 2.885 -9.825 7.209 1.00 0.00 H new ATOM 549 N GLY A 34 -3.037 -9.171 6.347 1.00 0.00 N ATOM 550 CA GLY A 34 -4.089 -8.410 5.694 1.00 0.00 C ATOM 551 C GLY A 34 -5.029 -7.779 6.723 1.00 0.00 C ATOM 552 O GLY A 34 -5.329 -6.589 6.647 1.00 0.00 O ATOM 0 H GLY A 34 -3.141 -10.184 6.283 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -3.647 -7.630 5.074 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -4.656 -9.062 5.030 1.00 0.00 H new ATOM 556 N LEU A 35 -5.466 -8.605 7.662 1.00 0.00 N ATOM 557 CA LEU A 35 -6.366 -8.142 8.706 1.00 0.00 C ATOM 558 C LEU A 35 -5.733 -6.950 9.427 1.00 0.00 C ATOM 559 O LEU A 35 -6.361 -5.902 9.570 1.00 0.00 O ATOM 560 CB LEU A 35 -6.744 -9.295 9.638 1.00 0.00 C ATOM 561 CG LEU A 35 -8.231 -9.650 9.696 1.00 0.00 C ATOM 562 CD1 LEU A 35 -8.705 -10.246 8.369 1.00 0.00 C ATOM 563 CD2 LEU A 35 -8.527 -10.575 10.879 1.00 0.00 C ATOM 0 H LEU A 35 -5.214 -9.592 7.722 1.00 0.00 H new ATOM 0 HA LEU A 35 -7.303 -7.792 8.274 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -6.191 -10.182 9.329 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -6.411 -9.046 10.645 1.00 0.00 H new ATOM 0 HG LEU A 35 -8.796 -8.732 9.856 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -9.765 -10.489 8.438 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -8.550 -9.522 7.569 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -8.138 -11.152 8.154 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -9.591 -10.812 10.898 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -7.952 -11.495 10.774 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -8.250 -10.077 11.808 1.00 0.00 H new ATOM 575 N GLY A 36 -4.498 -7.150 9.862 1.00 0.00 N ATOM 576 CA GLY A 36 -3.774 -6.105 10.565 1.00 0.00 C ATOM 577 C GLY A 36 -3.614 -4.863 9.686 1.00 0.00 C ATOM 578 O GLY A 36 -4.163 -3.806 9.993 1.00 0.00 O ATOM 0 H GLY A 36 -3.980 -8.020 9.741 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -4.305 -5.842 11.480 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -2.792 -6.474 10.862 1.00 0.00 H new ATOM 582 N GLY A 37 -2.858 -5.031 8.611 1.00 0.00 N ATOM 583 CA GLY A 37 -2.619 -3.936 7.685 1.00 0.00 C ATOM 584 C GLY A 37 -3.937 -3.301 7.236 1.00 0.00 C ATOM 585 O GLY A 37 -3.952 -2.167 6.758 1.00 0.00 O ATOM 0 H GLY A 37 -2.403 -5.909 8.360 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -1.992 -3.182 8.161 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -2.073 -4.302 6.816 1.00 0.00 H new ATOM 589 N CYS A 38 -5.010 -4.059 7.405 1.00 0.00 N ATOM 590 CA CYS A 38 -6.329 -3.584 7.022 1.00 0.00 C ATOM 591 C CYS A 38 -6.805 -2.584 8.078 1.00 0.00 C ATOM 592 O CYS A 38 -7.256 -1.490 7.744 1.00 0.00 O ATOM 593 CB CYS A 38 -7.317 -4.739 6.844 1.00 0.00 C ATOM 594 SG CYS A 38 -7.292 -5.321 5.110 1.00 0.00 S ATOM 0 H CYS A 38 -4.993 -4.998 7.802 1.00 0.00 H new ATOM 0 HA CYS A 38 -6.272 -3.088 6.053 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -7.057 -5.558 7.515 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -8.322 -4.414 7.113 1.00 0.00 H new ATOM 0 HG CYS A 38 -6.288 -6.128 4.938 1.00 0.00 H new ATOM 600 N LEU A 39 -6.687 -2.996 9.332 1.00 0.00 N ATOM 601 CA LEU A 39 -7.099 -2.150 10.439 1.00 0.00 C ATOM 602 C LEU A 39 -6.214 -0.903 10.480 1.00 0.00 C ATOM 603 O LEU A 39 -6.629 0.141 10.980 1.00 0.00 O ATOM 604 CB LEU A 39 -7.103 -2.944 11.748 1.00 0.00 C ATOM 605 CG LEU A 39 -8.388 -2.867 12.575 1.00 0.00 C ATOM 606 CD1 LEU A 39 -9.514 -3.665 11.914 1.00 0.00 C ATOM 607 CD2 LEU A 39 -8.139 -3.313 14.017 1.00 0.00 C ATOM 0 H LEU A 39 -6.312 -3.904 9.606 1.00 0.00 H new ATOM 0 HA LEU A 39 -8.124 -1.809 10.296 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -6.906 -3.991 11.516 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.276 -2.593 12.365 1.00 0.00 H new ATOM 0 HG LEU A 39 -8.710 -1.826 12.611 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -10.416 -3.594 12.522 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -9.713 -3.260 10.922 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -9.217 -4.710 11.827 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -9.068 -3.249 14.583 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -7.781 -4.342 14.023 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -7.390 -2.666 14.474 1.00 0.00 H new ATOM 619 N VAL A 40 -5.011 -1.053 9.946 1.00 0.00 N ATOM 620 CA VAL A 40 -4.063 0.049 9.915 1.00 0.00 C ATOM 621 C VAL A 40 -4.494 1.056 8.847 1.00 0.00 C ATOM 622 O VAL A 40 -4.921 2.163 9.170 1.00 0.00 O ATOM 623 CB VAL A 40 -2.646 -0.486 9.696 1.00 0.00 C ATOM 624 CG1 VAL A 40 -1.656 0.660 9.476 1.00 0.00 C ATOM 625 CG2 VAL A 40 -2.209 -1.373 10.863 1.00 0.00 C ATOM 0 H VAL A 40 -4.670 -1.920 9.531 1.00 0.00 H new ATOM 0 HA VAL A 40 -4.054 0.573 10.871 1.00 0.00 H new ATOM 0 HB VAL A 40 -2.654 -1.099 8.795 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -0.656 0.253 9.323 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -1.953 1.234 8.598 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.653 1.311 10.350 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -1.199 -1.740 10.682 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -2.225 -0.794 11.786 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.891 -2.218 10.953 1.00 0.00 H new ATOM 635 N VAL A 41 -4.367 0.636 7.597 1.00 0.00 N ATOM 636 CA VAL A 41 -4.737 1.488 6.480 1.00 0.00 C ATOM 637 C VAL A 41 -6.157 2.017 6.697 1.00 0.00 C ATOM 638 O VAL A 41 -6.438 3.181 6.418 1.00 0.00 O ATOM 639 CB VAL A 41 -4.579 0.723 5.164 1.00 0.00 C ATOM 640 CG1 VAL A 41 -5.333 -0.607 5.208 1.00 0.00 C ATOM 641 CG2 VAL A 41 -5.036 1.574 3.977 1.00 0.00 C ATOM 0 H VAL A 41 -4.013 -0.283 7.333 1.00 0.00 H new ATOM 0 HA VAL A 41 -4.073 2.351 6.421 1.00 0.00 H new ATOM 0 HB VAL A 41 -3.520 0.502 5.030 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.204 -1.130 4.260 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.940 -1.221 6.018 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -6.393 -0.419 5.377 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -4.913 1.007 3.054 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -6.086 1.840 4.103 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.435 2.482 3.928 1.00 0.00 H new ATOM 651 N ALA A 42 -7.013 1.135 7.191 1.00 0.00 N ATOM 652 CA ALA A 42 -8.396 1.499 7.448 1.00 0.00 C ATOM 653 C ALA A 42 -8.445 2.544 8.565 1.00 0.00 C ATOM 654 O ALA A 42 -9.151 3.545 8.452 1.00 0.00 O ATOM 655 CB ALA A 42 -9.200 0.242 7.790 1.00 0.00 C ATOM 0 H ALA A 42 -6.776 0.170 7.420 1.00 0.00 H new ATOM 0 HA ALA A 42 -8.847 1.943 6.561 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -10.237 0.515 7.983 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -9.158 -0.456 6.954 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -8.778 -0.230 8.677 1.00 0.00 H new ATOM 661 N ALA A 43 -7.687 2.274 9.618 1.00 0.00 N ATOM 662 CA ALA A 43 -7.636 3.179 10.754 1.00 0.00 C ATOM 663 C ALA A 43 -7.344 4.596 10.258 1.00 0.00 C ATOM 664 O ALA A 43 -8.014 5.547 10.657 1.00 0.00 O ATOM 665 CB ALA A 43 -6.589 2.683 11.753 1.00 0.00 C ATOM 0 H ALA A 43 -7.104 1.442 9.708 1.00 0.00 H new ATOM 0 HA ALA A 43 -8.595 3.202 11.271 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.550 3.361 12.606 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -6.858 1.684 12.096 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -5.612 2.650 11.270 1.00 0.00 H new ATOM 671 N TYR A 44 -6.342 4.693 9.396 1.00 0.00 N ATOM 672 CA TYR A 44 -5.954 5.979 8.842 1.00 0.00 C ATOM 673 C TYR A 44 -7.081 6.576 7.998 1.00 0.00 C ATOM 674 O TYR A 44 -7.414 7.751 8.142 1.00 0.00 O ATOM 675 CB TYR A 44 -4.749 5.703 7.940 1.00 0.00 C ATOM 676 CG TYR A 44 -3.397 5.910 8.626 1.00 0.00 C ATOM 677 CD1 TYR A 44 -2.928 7.188 8.854 1.00 0.00 C ATOM 678 CD2 TYR A 44 -2.647 4.820 9.018 1.00 0.00 C ATOM 679 CE1 TYR A 44 -1.656 7.384 9.500 1.00 0.00 C ATOM 680 CE2 TYR A 44 -1.375 5.015 9.663 1.00 0.00 C ATOM 681 CZ TYR A 44 -0.942 6.287 9.873 1.00 0.00 C ATOM 682 OH TYR A 44 0.259 6.472 10.483 1.00 0.00 O ATOM 0 H TYR A 44 -5.788 3.902 9.068 1.00 0.00 H new ATOM 0 HA TYR A 44 -5.727 6.687 9.639 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -4.807 4.677 7.577 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -4.805 6.353 7.067 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -3.515 8.041 8.548 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -3.015 3.820 8.841 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -1.277 8.379 9.684 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -0.778 4.170 9.973 1.00 0.00 H new ATOM 0 HH TYR A 44 0.656 5.601 10.694 1.00 0.00 H new ATOM 692 N ARG A 45 -7.638 5.739 7.135 1.00 0.00 N ATOM 693 CA ARG A 45 -8.722 6.169 6.267 1.00 0.00 C ATOM 694 C ARG A 45 -9.844 6.800 7.093 1.00 0.00 C ATOM 695 O ARG A 45 -10.215 7.951 6.868 1.00 0.00 O ATOM 696 CB ARG A 45 -9.285 4.994 5.466 1.00 0.00 C ATOM 697 CG ARG A 45 -9.439 5.361 3.989 1.00 0.00 C ATOM 698 CD ARG A 45 -9.718 4.118 3.141 1.00 0.00 C ATOM 699 NE ARG A 45 -11.039 3.552 3.493 1.00 0.00 N ATOM 700 CZ ARG A 45 -11.699 2.645 2.740 1.00 0.00 C ATOM 701 NH1 ARG A 45 -11.164 2.194 1.586 1.00 0.00 N ATOM 702 NH2 ARG A 45 -12.874 2.207 3.150 1.00 0.00 N ATOM 0 H ARG A 45 -7.359 4.765 7.018 1.00 0.00 H new ATOM 0 HA ARG A 45 -8.319 6.906 5.573 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -8.624 4.133 5.563 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -10.252 4.701 5.874 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -10.253 6.076 3.871 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -8.531 5.850 3.636 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -9.694 4.377 2.082 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -8.939 3.374 3.305 1.00 0.00 H new ATOM 0 HE ARG A 45 -11.479 3.866 4.358 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -10.255 2.538 1.277 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -11.669 1.509 1.023 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -13.271 2.553 4.024 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -13.386 1.522 2.593 1.00 0.00 H new ATOM 716 N ILE A 46 -10.355 6.018 8.033 1.00 0.00 N ATOM 717 CA ILE A 46 -11.428 6.485 8.894 1.00 0.00 C ATOM 718 C ILE A 46 -11.025 7.819 9.525 1.00 0.00 C ATOM 719 O ILE A 46 -11.660 8.844 9.279 1.00 0.00 O ATOM 720 CB ILE A 46 -11.803 5.410 9.916 1.00 0.00 C ATOM 721 CG1 ILE A 46 -12.310 4.145 9.219 1.00 0.00 C ATOM 722 CG2 ILE A 46 -12.811 5.947 10.933 1.00 0.00 C ATOM 723 CD1 ILE A 46 -12.225 2.934 10.151 1.00 0.00 C ATOM 0 H ILE A 46 -10.045 5.064 8.217 1.00 0.00 H new ATOM 0 HA ILE A 46 -12.331 6.666 8.312 1.00 0.00 H new ATOM 0 HB ILE A 46 -10.904 5.136 10.469 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -13.342 4.290 8.899 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -11.721 3.959 8.321 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -13.060 5.162 11.647 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -12.377 6.795 11.462 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -13.715 6.267 10.415 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -12.591 2.049 9.631 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -11.189 2.777 10.450 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -12.835 3.113 11.037 1.00 0.00 H new ATOM 735 N TYR A 47 -9.972 7.764 10.328 1.00 0.00 N ATOM 736 CA TYR A 47 -9.477 8.955 10.996 1.00 0.00 C ATOM 737 C TYR A 47 -9.524 10.167 10.063 1.00 0.00 C ATOM 738 O TYR A 47 -10.086 11.203 10.414 1.00 0.00 O ATOM 739 CB TYR A 47 -8.020 8.661 11.358 1.00 0.00 C ATOM 740 CG TYR A 47 -7.758 8.573 12.863 1.00 0.00 C ATOM 741 CD1 TYR A 47 -7.875 9.700 13.651 1.00 0.00 C ATOM 742 CD2 TYR A 47 -7.404 7.366 13.432 1.00 0.00 C ATOM 743 CE1 TYR A 47 -7.628 9.617 15.067 1.00 0.00 C ATOM 744 CE2 TYR A 47 -7.157 7.284 14.849 1.00 0.00 C ATOM 745 CZ TYR A 47 -7.282 8.413 15.596 1.00 0.00 C ATOM 746 OH TYR A 47 -7.049 8.335 16.934 1.00 0.00 O ATOM 0 H TYR A 47 -9.448 6.913 10.531 1.00 0.00 H new ATOM 0 HA TYR A 47 -10.086 9.186 11.870 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -7.723 7.721 10.892 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -7.387 9.440 10.934 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -8.152 10.644 13.206 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -7.312 6.484 12.815 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -7.716 10.491 15.695 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -6.879 6.347 15.308 1.00 0.00 H new ATOM 0 HH TYR A 47 -6.812 7.414 17.172 1.00 0.00 H new ATOM 756 N ARG A 48 -8.926 9.996 8.894 1.00 0.00 N ATOM 757 CA ARG A 48 -8.892 11.063 7.908 1.00 0.00 C ATOM 758 C ARG A 48 -10.298 11.623 7.683 1.00 0.00 C ATOM 759 O ARG A 48 -10.523 12.823 7.834 1.00 0.00 O ATOM 760 CB ARG A 48 -8.331 10.564 6.575 1.00 0.00 C ATOM 761 CG ARG A 48 -7.563 11.673 5.853 1.00 0.00 C ATOM 762 CD ARG A 48 -8.468 12.412 4.865 1.00 0.00 C ATOM 763 NE ARG A 48 -7.648 13.070 3.823 1.00 0.00 N ATOM 764 CZ ARG A 48 -8.131 13.958 2.928 1.00 0.00 C ATOM 765 NH1 ARG A 48 -9.437 14.301 2.940 1.00 0.00 N ATOM 766 NH2 ARG A 48 -7.308 14.485 2.041 1.00 0.00 N ATOM 0 H ARG A 48 -8.461 9.135 8.607 1.00 0.00 H new ATOM 0 HA ARG A 48 -8.241 11.848 8.292 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -7.671 9.714 6.750 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -9.146 10.210 5.943 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -7.163 12.377 6.582 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -6.712 11.245 5.323 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -9.164 11.712 4.403 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -9.066 13.155 5.392 1.00 0.00 H new ATOM 0 HE ARG A 48 -6.656 12.838 3.778 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -10.066 13.888 3.629 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -9.794 14.973 2.260 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -6.323 14.220 2.039 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -7.657 15.157 1.358 1.00 0.00 H new ATOM 780 N LEU A 49 -11.207 10.728 7.327 1.00 0.00 N ATOM 781 CA LEU A 49 -12.585 11.118 7.081 1.00 0.00 C ATOM 782 C LEU A 49 -13.110 11.906 8.282 1.00 0.00 C ATOM 783 O LEU A 49 -13.418 13.091 8.165 1.00 0.00 O ATOM 784 CB LEU A 49 -13.434 9.894 6.729 1.00 0.00 C ATOM 785 CG LEU A 49 -14.176 9.953 5.393 1.00 0.00 C ATOM 786 CD1 LEU A 49 -14.530 8.549 4.899 1.00 0.00 C ATOM 787 CD2 LEU A 49 -15.409 10.854 5.490 1.00 0.00 C ATOM 0 H LEU A 49 -11.016 9.734 7.203 1.00 0.00 H new ATOM 0 HA LEU A 49 -12.645 11.778 6.216 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -12.787 9.017 6.724 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -14.166 9.745 7.522 1.00 0.00 H new ATOM 0 HG LEU A 49 -13.510 10.396 4.652 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -15.057 8.620 3.947 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -13.617 7.969 4.766 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -15.169 8.056 5.632 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -15.918 10.879 4.527 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -16.087 10.463 6.249 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -15.101 11.863 5.764 1.00 0.00 H new ATOM 799 N ARG A 50 -13.197 11.216 9.410 1.00 0.00 N ATOM 800 CA ARG A 50 -13.679 11.836 10.632 1.00 0.00 C ATOM 801 C ARG A 50 -12.899 13.121 10.919 1.00 0.00 C ATOM 802 O ARG A 50 -11.787 13.072 11.443 1.00 0.00 O ATOM 803 CB ARG A 50 -13.541 10.887 11.824 1.00 0.00 C ATOM 804 CG ARG A 50 -14.750 10.996 12.755 1.00 0.00 C ATOM 805 CD ARG A 50 -15.848 10.012 12.347 1.00 0.00 C ATOM 806 NE ARG A 50 -16.037 8.997 13.407 1.00 0.00 N ATOM 807 CZ ARG A 50 -17.188 8.320 13.610 1.00 0.00 C ATOM 808 NH1 ARG A 50 -18.263 8.545 12.824 1.00 0.00 N ATOM 809 NH2 ARG A 50 -17.246 7.435 14.587 1.00 0.00 N ATOM 0 H ARG A 50 -12.942 10.233 9.503 1.00 0.00 H new ATOM 0 HA ARG A 50 -14.734 12.071 10.490 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -13.443 9.862 11.467 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -12.630 11.121 12.376 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -14.442 10.797 13.781 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -15.141 12.013 12.731 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -16.782 10.547 12.174 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -15.581 9.525 11.409 1.00 0.00 H new ATOM 0 HE ARG A 50 -15.249 8.796 14.023 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -18.209 9.230 12.070 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -19.129 8.030 12.984 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -16.429 7.271 15.175 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -18.108 6.915 14.754 1.00 0.00 H new ATOM 823 N SER A 51 -13.513 14.240 10.563 1.00 0.00 N ATOM 824 CA SER A 51 -12.890 15.535 10.776 1.00 0.00 C ATOM 825 C SER A 51 -13.730 16.634 10.120 1.00 0.00 C ATOM 826 O SER A 51 -14.748 16.350 9.491 1.00 0.00 O ATOM 827 CB SER A 51 -11.463 15.558 10.224 1.00 0.00 C ATOM 828 OG SER A 51 -11.382 14.965 8.930 1.00 0.00 O ATOM 0 H SER A 51 -14.435 14.276 10.129 1.00 0.00 H new ATOM 0 HA SER A 51 -12.838 15.717 11.849 1.00 0.00 H new ATOM 0 HB2 SER A 51 -11.110 16.588 10.174 1.00 0.00 H new ATOM 0 HB3 SER A 51 -10.801 15.027 10.908 1.00 0.00 H new ATOM 0 HG SER A 51 -10.934 14.096 8.996 1.00 0.00 H new ATOM 834 N ARG A 52 -13.272 17.865 10.291 1.00 0.00 N ATOM 835 CA ARG A 52 -13.969 19.008 9.724 1.00 0.00 C ATOM 836 C ARG A 52 -13.028 19.809 8.822 1.00 0.00 C ATOM 837 O ARG A 52 -12.548 20.873 9.209 1.00 0.00 O ATOM 838 CB ARG A 52 -14.512 19.923 10.824 1.00 0.00 C ATOM 839 CG ARG A 52 -15.299 21.090 10.226 1.00 0.00 C ATOM 840 CD ARG A 52 -16.725 20.665 9.869 1.00 0.00 C ATOM 841 NE ARG A 52 -17.646 21.815 10.005 1.00 0.00 N ATOM 842 CZ ARG A 52 -18.969 21.760 9.745 1.00 0.00 C ATOM 843 NH1 ARG A 52 -19.539 20.608 9.332 1.00 0.00 N ATOM 844 NH2 ARG A 52 -19.698 22.850 9.900 1.00 0.00 N ATOM 0 H ARG A 52 -12.427 18.097 10.814 1.00 0.00 H new ATOM 0 HA ARG A 52 -14.805 18.629 9.137 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -15.155 19.351 11.493 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -13.687 20.306 11.424 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -15.329 21.915 10.937 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -14.791 21.457 9.334 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -16.755 20.284 8.848 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -17.045 19.853 10.522 1.00 0.00 H new ATOM 0 HE ARG A 52 -17.256 22.705 10.315 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -18.969 19.770 9.214 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -20.540 20.575 9.138 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -19.260 23.717 10.212 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -20.699 22.825 9.708 1.00 0.00 H new ATOM 858 N GLY A 53 -12.792 19.266 7.637 1.00 0.00 N ATOM 859 CA GLY A 53 -11.917 19.917 6.677 1.00 0.00 C ATOM 860 C GLY A 53 -10.875 18.938 6.132 1.00 0.00 C ATOM 861 O GLY A 53 -10.984 18.477 4.997 1.00 0.00 O ATOM 0 H GLY A 53 -13.191 18.383 7.320 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -12.509 20.319 5.855 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -11.415 20.761 7.151 1.00 0.00 H new ATOM 865 N SER A 54 -9.888 18.648 6.968 1.00 0.00 N ATOM 866 CA SER A 54 -8.827 17.732 6.585 1.00 0.00 C ATOM 867 C SER A 54 -7.936 17.430 7.791 1.00 0.00 C ATOM 868 O SER A 54 -7.847 16.284 8.230 1.00 0.00 O ATOM 869 CB SER A 54 -7.992 18.305 5.438 1.00 0.00 C ATOM 870 OG SER A 54 -7.231 17.298 4.777 1.00 0.00 O ATOM 0 H SER A 54 -9.801 19.031 7.909 1.00 0.00 H new ATOM 0 HA SER A 54 -9.284 16.805 6.238 1.00 0.00 H new ATOM 0 HB2 SER A 54 -8.650 18.793 4.719 1.00 0.00 H new ATOM 0 HB3 SER A 54 -7.320 19.071 5.826 1.00 0.00 H new ATOM 0 HG SER A 54 -6.713 17.703 4.050 1.00 0.00 H new ATOM 876 N THR A 55 -7.299 18.477 8.293 1.00 0.00 N ATOM 877 CA THR A 55 -6.418 18.338 9.440 1.00 0.00 C ATOM 878 C THR A 55 -5.895 19.707 9.880 1.00 0.00 C ATOM 879 O THR A 55 -5.881 20.017 11.070 1.00 0.00 O ATOM 880 CB THR A 55 -5.307 17.355 9.066 1.00 0.00 C ATOM 881 OG1 THR A 55 -4.420 17.393 10.181 1.00 0.00 O ATOM 882 CG2 THR A 55 -4.455 17.851 7.896 1.00 0.00 C ATOM 0 H THR A 55 -7.375 19.426 7.926 1.00 0.00 H new ATOM 0 HA THR A 55 -6.951 17.936 10.302 1.00 0.00 H new ATOM 0 HB THR A 55 -5.747 16.391 8.812 1.00 0.00 H new ATOM 0 HG1 THR A 55 -3.670 16.782 10.023 1.00 0.00 H new ATOM 0 HG21 THR A 55 -3.682 17.116 7.672 1.00 0.00 H new ATOM 0 HG22 THR A 55 -5.087 17.992 7.019 1.00 0.00 H new ATOM 0 HG23 THR A 55 -3.988 18.799 8.162 1.00 0.00 H new ATOM 890 N LYS A 56 -5.478 20.490 8.896 1.00 0.00 N ATOM 891 CA LYS A 56 -4.955 21.819 9.166 1.00 0.00 C ATOM 892 C LYS A 56 -4.565 22.487 7.847 1.00 0.00 C ATOM 893 O LYS A 56 -3.384 22.565 7.512 1.00 0.00 O ATOM 894 CB LYS A 56 -3.814 21.749 10.182 1.00 0.00 C ATOM 895 CG LYS A 56 -4.003 22.784 11.293 1.00 0.00 C ATOM 896 CD LYS A 56 -3.726 24.198 10.778 1.00 0.00 C ATOM 897 CE LYS A 56 -3.086 25.062 11.866 1.00 0.00 C ATOM 898 NZ LYS A 56 -1.810 25.639 11.386 1.00 0.00 N ATOM 0 H LYS A 56 -5.492 20.230 7.910 1.00 0.00 H new ATOM 0 HA LYS A 56 -5.721 22.444 9.625 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -3.769 20.750 10.615 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -2.863 21.921 9.678 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -5.021 22.727 11.679 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -3.334 22.558 12.123 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -3.067 24.151 9.911 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -4.657 24.657 10.445 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -3.769 25.862 12.152 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -2.908 24.461 12.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -1.389 26.223 12.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -1.155 24.871 11.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -1.989 26.229 10.548 1.00 0.00 H new ATOM 912 N MET A 57 -5.579 22.952 7.133 1.00 0.00 N ATOM 913 CA MET A 57 -5.356 23.611 5.857 1.00 0.00 C ATOM 914 C MET A 57 -4.901 22.609 4.794 1.00 0.00 C ATOM 915 O MET A 57 -5.555 22.451 3.764 1.00 0.00 O ATOM 916 CB MET A 57 -4.292 24.698 6.023 1.00 0.00 C ATOM 917 CG MET A 57 -4.864 26.079 5.695 1.00 0.00 C ATOM 918 SD MET A 57 -4.023 27.331 6.650 1.00 0.00 S ATOM 919 CE MET A 57 -4.975 27.261 8.159 1.00 0.00 C ATOM 0 H MET A 57 -6.557 22.886 7.414 1.00 0.00 H new ATOM 0 HA MET A 57 -6.296 24.056 5.530 1.00 0.00 H new ATOM 0 HB2 MET A 57 -3.915 24.690 7.046 1.00 0.00 H new ATOM 0 HB3 MET A 57 -3.446 24.486 5.370 1.00 0.00 H new ATOM 0 HG2 MET A 57 -4.751 26.285 4.631 1.00 0.00 H new ATOM 0 HG3 MET A 57 -5.932 26.100 5.912 1.00 0.00 H new ATOM 0 HE1 MET A 57 -4.581 27.986 8.872 1.00 0.00 H new ATOM 0 HE2 MET A 57 -6.017 27.495 7.943 1.00 0.00 H new ATOM 0 HE3 MET A 57 -4.908 26.260 8.585 1.00 0.00 H new ATOM 929 N SER A 58 -3.784 21.958 5.081 1.00 0.00 N ATOM 930 CA SER A 58 -3.234 20.975 4.162 1.00 0.00 C ATOM 931 C SER A 58 -2.840 21.651 2.847 1.00 0.00 C ATOM 932 O SER A 58 -3.676 21.831 1.963 1.00 0.00 O ATOM 933 CB SER A 58 -4.232 19.846 3.901 1.00 0.00 C ATOM 934 OG SER A 58 -3.586 18.650 3.475 1.00 0.00 O ATOM 0 H SER A 58 -3.245 22.091 5.936 1.00 0.00 H new ATOM 0 HA SER A 58 -2.346 20.539 4.619 1.00 0.00 H new ATOM 0 HB2 SER A 58 -4.800 19.647 4.810 1.00 0.00 H new ATOM 0 HB3 SER A 58 -4.947 20.162 3.141 1.00 0.00 H new ATOM 0 HG SER A 58 -4.257 17.953 3.321 1.00 0.00 H new ATOM 940 N ILE A 59 -1.567 22.007 2.760 1.00 0.00 N ATOM 941 CA ILE A 59 -1.052 22.659 1.567 1.00 0.00 C ATOM 942 C ILE A 59 -0.543 21.597 0.591 1.00 0.00 C ATOM 943 O ILE A 59 0.664 21.452 0.399 1.00 0.00 O ATOM 944 CB ILE A 59 -0.001 23.706 1.941 1.00 0.00 C ATOM 945 CG1 ILE A 59 -0.551 24.691 2.974 1.00 0.00 C ATOM 946 CG2 ILE A 59 0.529 24.419 0.695 1.00 0.00 C ATOM 947 CD1 ILE A 59 -1.548 25.658 2.334 1.00 0.00 C ATOM 0 H ILE A 59 -0.877 21.857 3.496 1.00 0.00 H new ATOM 0 HA ILE A 59 -1.846 23.206 1.058 1.00 0.00 H new ATOM 0 HB ILE A 59 0.843 23.193 2.403 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -1.037 24.143 3.781 1.00 0.00 H new ATOM 0 HG13 ILE A 59 0.270 25.252 3.420 1.00 0.00 H new ATOM 0 HG21 ILE A 59 1.275 25.158 0.988 1.00 0.00 H new ATOM 0 HG22 ILE A 59 0.985 23.690 0.025 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -0.294 24.917 0.183 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -1.923 26.347 3.091 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -1.052 26.222 1.544 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -2.380 25.095 1.911 1.00 0.00 H new ATOM 959 N HIS A 60 -1.488 20.882 -0.002 1.00 0.00 N ATOM 960 CA HIS A 60 -1.150 19.838 -0.955 1.00 0.00 C ATOM 961 C HIS A 60 -0.493 18.667 -0.221 1.00 0.00 C ATOM 962 O HIS A 60 0.679 18.368 -0.445 1.00 0.00 O ATOM 963 CB HIS A 60 -0.279 20.394 -2.084 1.00 0.00 C ATOM 964 CG HIS A 60 -0.748 20.009 -3.467 1.00 0.00 C ATOM 965 ND1 HIS A 60 -0.983 18.697 -3.840 1.00 0.00 N ATOM 966 CD2 HIS A 60 -1.023 20.776 -4.560 1.00 0.00 C ATOM 967 CE1 HIS A 60 -1.381 18.688 -5.104 1.00 0.00 C ATOM 968 NE2 HIS A 60 -1.404 19.977 -5.549 1.00 0.00 N ATOM 0 H HIS A 60 -2.488 21.005 0.159 1.00 0.00 H new ATOM 0 HA HIS A 60 -2.058 19.463 -1.427 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -0.255 21.481 -2.009 1.00 0.00 H new ATOM 0 HB3 HIS A 60 0.744 20.042 -1.947 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -0.944 21.852 -4.612 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -1.642 17.813 -5.681 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -1.670 20.277 -6.487 1.00 0.00 H new ATOM 976 N LEU A 61 -1.277 18.036 0.641 1.00 0.00 N ATOM 977 CA LEU A 61 -0.787 16.904 1.409 1.00 0.00 C ATOM 978 C LEU A 61 0.605 17.229 1.954 1.00 0.00 C ATOM 979 O LEU A 61 1.611 16.967 1.296 1.00 0.00 O ATOM 980 CB LEU A 61 -0.835 15.626 0.570 1.00 0.00 C ATOM 981 CG LEU A 61 -0.841 14.310 1.351 1.00 0.00 C ATOM 982 CD1 LEU A 61 -1.987 13.406 0.895 1.00 0.00 C ATOM 983 CD2 LEU A 61 0.516 13.609 1.253 1.00 0.00 C ATOM 0 H LEU A 61 -2.248 18.287 0.825 1.00 0.00 H new ATOM 0 HA LEU A 61 -1.432 16.718 2.268 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -1.728 15.659 -0.055 1.00 0.00 H new ATOM 0 HB3 LEU A 61 0.024 15.623 -0.101 1.00 0.00 H new ATOM 0 HG LEU A 61 -1.011 14.538 2.403 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -1.968 12.478 1.466 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -2.938 13.913 1.059 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -1.874 13.182 -0.166 1.00 0.00 H new ATOM 0 HD21 LEU A 61 0.485 12.676 1.816 1.00 0.00 H new ATOM 0 HD22 LEU A 61 0.740 13.394 0.208 1.00 0.00 H new ATOM 0 HD23 LEU A 61 1.290 14.256 1.665 1.00 0.00 H new ATOM 995 N ILE A 62 0.619 17.794 3.153 1.00 0.00 N ATOM 996 CA ILE A 62 1.871 18.157 3.795 1.00 0.00 C ATOM 997 C ILE A 62 1.758 17.910 5.300 1.00 0.00 C ATOM 998 O ILE A 62 0.716 17.468 5.784 1.00 0.00 O ATOM 999 CB ILE A 62 2.261 19.592 3.435 1.00 0.00 C ATOM 1000 CG1 ILE A 62 1.139 20.570 3.789 1.00 0.00 C ATOM 1001 CG2 ILE A 62 2.671 19.696 1.964 1.00 0.00 C ATOM 1002 CD1 ILE A 62 1.622 21.618 4.793 1.00 0.00 C ATOM 0 H ILE A 62 -0.217 18.009 3.696 1.00 0.00 H new ATOM 0 HA ILE A 62 2.683 17.529 3.429 1.00 0.00 H new ATOM 0 HB ILE A 62 3.130 19.870 4.031 1.00 0.00 H new ATOM 0 HG12 ILE A 62 0.784 21.064 2.885 1.00 0.00 H new ATOM 0 HG13 ILE A 62 0.294 20.023 4.207 1.00 0.00 H new ATOM 0 HG21 ILE A 62 2.943 20.726 1.734 1.00 0.00 H new ATOM 0 HG22 ILE A 62 3.525 19.045 1.777 1.00 0.00 H new ATOM 0 HG23 ILE A 62 1.837 19.391 1.331 1.00 0.00 H new ATOM 0 HD11 ILE A 62 0.805 22.301 5.028 1.00 0.00 H new ATOM 0 HD12 ILE A 62 1.954 21.122 5.705 1.00 0.00 H new ATOM 0 HD13 ILE A 62 2.452 22.179 4.363 1.00 0.00 H new ATOM 1014 N HIS A 63 2.843 18.205 6.000 1.00 0.00 N ATOM 1015 CA HIS A 63 2.879 18.021 7.440 1.00 0.00 C ATOM 1016 C HIS A 63 2.884 16.526 7.766 1.00 0.00 C ATOM 1017 O HIS A 63 2.032 15.779 7.288 1.00 0.00 O ATOM 1018 CB HIS A 63 1.727 18.770 8.113 1.00 0.00 C ATOM 1019 CG HIS A 63 1.985 19.124 9.558 1.00 0.00 C ATOM 1020 ND1 HIS A 63 1.940 20.425 10.030 1.00 0.00 N ATOM 1021 CD2 HIS A 63 2.290 18.336 10.628 1.00 0.00 C ATOM 1022 CE1 HIS A 63 2.209 20.408 11.327 1.00 0.00 C ATOM 1023 NE2 HIS A 63 2.426 19.113 11.696 1.00 0.00 N ATOM 0 H HIS A 63 3.705 18.571 5.596 1.00 0.00 H new ATOM 0 HA HIS A 63 3.797 18.449 7.842 1.00 0.00 H new ATOM 0 HB2 HIS A 63 1.528 19.685 7.556 1.00 0.00 H new ATOM 0 HB3 HIS A 63 0.827 18.159 8.055 1.00 0.00 H new ATOM 0 HD2 HIS A 63 2.402 17.262 10.610 1.00 0.00 H new ATOM 0 HE1 HIS A 63 2.249 21.269 11.978 1.00 0.00 H new ATOM 0 HE2 HIS A 63 2.655 18.794 12.637 1.00 0.00 H new ATOM 1031 N THR A 64 3.855 16.133 8.578 1.00 0.00 N ATOM 1032 CA THR A 64 3.983 14.741 8.973 1.00 0.00 C ATOM 1033 C THR A 64 4.347 13.875 7.765 1.00 0.00 C ATOM 1034 O THR A 64 3.565 13.758 6.823 1.00 0.00 O ATOM 1035 CB THR A 64 2.678 14.320 9.652 1.00 0.00 C ATOM 1036 OG1 THR A 64 2.967 14.407 11.044 1.00 0.00 O ATOM 1037 CG2 THR A 64 2.353 12.842 9.430 1.00 0.00 C ATOM 0 H THR A 64 4.560 16.755 8.973 1.00 0.00 H new ATOM 0 HA THR A 64 4.796 14.606 9.687 1.00 0.00 H new ATOM 0 HB THR A 64 1.859 14.932 9.275 1.00 0.00 H new ATOM 0 HG1 THR A 64 2.173 14.152 11.559 1.00 0.00 H new ATOM 0 HG21 THR A 64 1.418 12.596 9.933 1.00 0.00 H new ATOM 0 HG22 THR A 64 2.253 12.648 8.362 1.00 0.00 H new ATOM 0 HG23 THR A 64 3.156 12.228 9.837 1.00 0.00 H new ATOM 1045 N ARG A 65 5.534 13.290 7.833 1.00 0.00 N ATOM 1046 CA ARG A 65 6.010 12.438 6.756 1.00 0.00 C ATOM 1047 C ARG A 65 5.318 11.075 6.812 1.00 0.00 C ATOM 1048 O ARG A 65 5.132 10.427 5.783 1.00 0.00 O ATOM 1049 CB ARG A 65 7.525 12.237 6.843 1.00 0.00 C ATOM 1050 CG ARG A 65 8.118 11.942 5.464 1.00 0.00 C ATOM 1051 CD ARG A 65 9.350 12.810 5.199 1.00 0.00 C ATOM 1052 NE ARG A 65 10.554 11.957 5.081 1.00 0.00 N ATOM 1053 CZ ARG A 65 11.114 11.291 6.112 1.00 0.00 C ATOM 1054 NH1 ARG A 65 10.582 11.372 7.350 1.00 0.00 N ATOM 1055 NH2 ARG A 65 12.189 10.558 5.892 1.00 0.00 N ATOM 0 H ARG A 65 6.180 13.389 8.616 1.00 0.00 H new ATOM 0 HA ARG A 65 5.773 12.931 5.813 1.00 0.00 H new ATOM 0 HB2 ARG A 65 7.991 13.130 7.260 1.00 0.00 H new ATOM 0 HB3 ARG A 65 7.748 11.414 7.522 1.00 0.00 H new ATOM 0 HG2 ARG A 65 8.390 10.889 5.399 1.00 0.00 H new ATOM 0 HG3 ARG A 65 7.368 12.125 4.695 1.00 0.00 H new ATOM 0 HD2 ARG A 65 9.210 13.385 4.283 1.00 0.00 H new ATOM 0 HD3 ARG A 65 9.481 13.528 6.009 1.00 0.00 H new ATOM 0 HE ARG A 65 10.988 11.867 4.162 1.00 0.00 H new ATOM 0 HH11 ARG A 65 9.750 11.940 7.512 1.00 0.00 H new ATOM 0 HH12 ARG A 65 11.012 10.865 8.124 1.00 0.00 H new ATOM 0 HH21 ARG A 65 12.584 10.501 4.953 1.00 0.00 H new ATOM 0 HH22 ARG A 65 12.625 10.048 6.661 1.00 0.00 H new ATOM 1069 N VAL A 66 4.955 10.680 8.024 1.00 0.00 N ATOM 1070 CA VAL A 66 4.287 9.406 8.227 1.00 0.00 C ATOM 1071 C VAL A 66 3.133 9.276 7.231 1.00 0.00 C ATOM 1072 O VAL A 66 3.129 8.374 6.395 1.00 0.00 O ATOM 1073 CB VAL A 66 3.837 9.278 9.684 1.00 0.00 C ATOM 1074 CG1 VAL A 66 2.912 8.072 9.867 1.00 0.00 C ATOM 1075 CG2 VAL A 66 5.041 9.193 10.624 1.00 0.00 C ATOM 0 H VAL A 66 5.111 11.220 8.875 1.00 0.00 H new ATOM 0 HA VAL A 66 4.973 8.580 8.039 1.00 0.00 H new ATOM 0 HB VAL A 66 3.274 10.175 9.942 1.00 0.00 H new ATOM 0 HG11 VAL A 66 2.606 8.003 10.911 1.00 0.00 H new ATOM 0 HG12 VAL A 66 2.030 8.191 9.238 1.00 0.00 H new ATOM 0 HG13 VAL A 66 3.440 7.162 9.583 1.00 0.00 H new ATOM 0 HG21 VAL A 66 4.693 9.103 11.653 1.00 0.00 H new ATOM 0 HG22 VAL A 66 5.643 8.322 10.366 1.00 0.00 H new ATOM 0 HG23 VAL A 66 5.646 10.094 10.523 1.00 0.00 H new ATOM 1085 N ALA A 67 2.181 10.190 7.354 1.00 0.00 N ATOM 1086 CA ALA A 67 1.024 10.188 6.475 1.00 0.00 C ATOM 1087 C ALA A 67 1.474 9.871 5.047 1.00 0.00 C ATOM 1088 O ALA A 67 1.062 8.864 4.472 1.00 0.00 O ATOM 1089 CB ALA A 67 0.306 11.536 6.574 1.00 0.00 C ATOM 0 H ALA A 67 2.188 10.937 8.049 1.00 0.00 H new ATOM 0 HA ALA A 67 0.315 9.417 6.776 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.562 11.535 5.915 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -0.019 11.701 7.601 1.00 0.00 H new ATOM 0 HB3 ALA A 67 0.987 12.334 6.276 1.00 0.00 H new ATOM 1095 N ALA A 68 2.314 10.747 4.517 1.00 0.00 N ATOM 1096 CA ALA A 68 2.824 10.573 3.167 1.00 0.00 C ATOM 1097 C ALA A 68 3.195 9.104 2.953 1.00 0.00 C ATOM 1098 O ALA A 68 2.678 8.456 2.045 1.00 0.00 O ATOM 1099 CB ALA A 68 4.010 11.513 2.944 1.00 0.00 C ATOM 0 H ALA A 68 2.655 11.580 4.998 1.00 0.00 H new ATOM 0 HA ALA A 68 2.062 10.831 2.432 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.392 11.382 1.932 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.687 12.545 3.080 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.797 11.282 3.662 1.00 0.00 H new ATOM 1105 N GLN A 69 4.089 8.623 3.805 1.00 0.00 N ATOM 1106 CA GLN A 69 4.535 7.242 3.720 1.00 0.00 C ATOM 1107 C GLN A 69 3.333 6.300 3.628 1.00 0.00 C ATOM 1108 O GLN A 69 3.164 5.599 2.632 1.00 0.00 O ATOM 1109 CB GLN A 69 5.426 6.880 4.910 1.00 0.00 C ATOM 1110 CG GLN A 69 6.413 5.772 4.538 1.00 0.00 C ATOM 1111 CD GLN A 69 7.549 6.318 3.670 1.00 0.00 C ATOM 1112 OE1 GLN A 69 7.338 7.021 2.696 1.00 0.00 O ATOM 1113 NE2 GLN A 69 8.763 5.955 4.077 1.00 0.00 N ATOM 0 H GLN A 69 4.516 9.164 4.557 1.00 0.00 H new ATOM 0 HA GLN A 69 5.130 7.128 2.814 1.00 0.00 H new ATOM 0 HB2 GLN A 69 5.973 7.763 5.242 1.00 0.00 H new ATOM 0 HB3 GLN A 69 4.807 6.555 5.747 1.00 0.00 H new ATOM 0 HG2 GLN A 69 6.824 5.327 5.444 1.00 0.00 H new ATOM 0 HG3 GLN A 69 5.890 4.979 4.003 1.00 0.00 H new ATOM 0 HE21 GLN A 69 8.869 5.364 4.902 1.00 0.00 H new ATOM 0 HE22 GLN A 69 9.587 6.268 3.564 1.00 0.00 H new ATOM 1122 N ALA A 70 2.529 6.315 4.681 1.00 0.00 N ATOM 1123 CA ALA A 70 1.348 5.470 4.732 1.00 0.00 C ATOM 1124 C ALA A 70 0.620 5.536 3.388 1.00 0.00 C ATOM 1125 O ALA A 70 -0.032 4.575 2.983 1.00 0.00 O ATOM 1126 CB ALA A 70 0.458 5.906 5.898 1.00 0.00 C ATOM 0 H ALA A 70 2.672 6.899 5.505 1.00 0.00 H new ATOM 0 HA ALA A 70 1.628 4.431 4.905 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -0.428 5.272 5.936 1.00 0.00 H new ATOM 0 HB2 ALA A 70 1.011 5.813 6.833 1.00 0.00 H new ATOM 0 HB3 ALA A 70 0.156 6.944 5.757 1.00 0.00 H new ATOM 1132 N CYS A 71 0.757 6.680 2.733 1.00 0.00 N ATOM 1133 CA CYS A 71 0.121 6.884 1.442 1.00 0.00 C ATOM 1134 C CYS A 71 0.839 6.013 0.410 1.00 0.00 C ATOM 1135 O CYS A 71 0.217 5.176 -0.242 1.00 0.00 O ATOM 1136 CB CYS A 71 0.118 8.360 1.040 1.00 0.00 C ATOM 1137 SG CYS A 71 -1.517 8.820 0.361 1.00 0.00 S ATOM 0 H CYS A 71 1.299 7.475 3.072 1.00 0.00 H new ATOM 0 HA CYS A 71 -0.927 6.589 1.499 1.00 0.00 H new ATOM 0 HB2 CYS A 71 0.350 8.981 1.905 1.00 0.00 H new ATOM 0 HB3 CYS A 71 0.894 8.545 0.298 1.00 0.00 H new ATOM 0 HG CYS A 71 -1.510 10.076 0.025 1.00 0.00 H new ATOM 1143 N ALA A 72 2.139 6.239 0.293 1.00 0.00 N ATOM 1144 CA ALA A 72 2.949 5.485 -0.649 1.00 0.00 C ATOM 1145 C ALA A 72 2.756 3.988 -0.397 1.00 0.00 C ATOM 1146 O ALA A 72 2.178 3.285 -1.224 1.00 0.00 O ATOM 1147 CB ALA A 72 4.412 5.914 -0.522 1.00 0.00 C ATOM 0 H ALA A 72 2.652 6.934 0.835 1.00 0.00 H new ATOM 0 HA ALA A 72 2.637 5.690 -1.673 1.00 0.00 H new ATOM 0 HB1 ALA A 72 5.020 5.349 -1.228 1.00 0.00 H new ATOM 0 HB2 ALA A 72 4.499 6.979 -0.739 1.00 0.00 H new ATOM 0 HB3 ALA A 72 4.761 5.721 0.492 1.00 0.00 H new ATOM 1153 N VAL A 73 3.252 3.545 0.750 1.00 0.00 N ATOM 1154 CA VAL A 73 3.141 2.145 1.121 1.00 0.00 C ATOM 1155 C VAL A 73 1.689 1.692 0.960 1.00 0.00 C ATOM 1156 O VAL A 73 1.404 0.766 0.202 1.00 0.00 O ATOM 1157 CB VAL A 73 3.679 1.935 2.538 1.00 0.00 C ATOM 1158 CG1 VAL A 73 3.481 0.487 2.991 1.00 0.00 C ATOM 1159 CG2 VAL A 73 5.150 2.344 2.632 1.00 0.00 C ATOM 0 H VAL A 73 3.731 4.131 1.434 1.00 0.00 H new ATOM 0 HA VAL A 73 3.749 1.526 0.461 1.00 0.00 H new ATOM 0 HB VAL A 73 3.110 2.576 3.211 1.00 0.00 H new ATOM 0 HG11 VAL A 73 3.872 0.365 4.001 1.00 0.00 H new ATOM 0 HG12 VAL A 73 2.418 0.245 2.982 1.00 0.00 H new ATOM 0 HG13 VAL A 73 4.012 -0.182 2.313 1.00 0.00 H new ATOM 0 HG21 VAL A 73 5.508 2.185 3.649 1.00 0.00 H new ATOM 0 HG22 VAL A 73 5.740 1.741 1.941 1.00 0.00 H new ATOM 0 HG23 VAL A 73 5.252 3.398 2.372 1.00 0.00 H new ATOM 1169 N GLY A 74 0.808 2.366 1.685 1.00 0.00 N ATOM 1170 CA GLY A 74 -0.608 2.045 1.631 1.00 0.00 C ATOM 1171 C GLY A 74 -1.052 1.760 0.195 1.00 0.00 C ATOM 1172 O GLY A 74 -1.764 0.790 -0.058 1.00 0.00 O ATOM 0 H GLY A 74 1.048 3.133 2.313 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -0.812 1.176 2.257 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -1.188 2.874 2.037 1.00 0.00 H new ATOM 1176 N ALA A 75 -0.612 2.624 -0.708 1.00 0.00 N ATOM 1177 CA ALA A 75 -0.956 2.478 -2.113 1.00 0.00 C ATOM 1178 C ALA A 75 -0.436 1.132 -2.623 1.00 0.00 C ATOM 1179 O ALA A 75 -1.217 0.285 -3.053 1.00 0.00 O ATOM 1180 CB ALA A 75 -0.388 3.659 -2.903 1.00 0.00 C ATOM 0 H ALA A 75 -0.021 3.427 -0.495 1.00 0.00 H new ATOM 0 HA ALA A 75 -2.038 2.486 -2.246 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -0.646 3.550 -3.956 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -0.809 4.589 -2.521 1.00 0.00 H new ATOM 0 HB3 ALA A 75 0.696 3.681 -2.795 1.00 0.00 H new ATOM 1186 N ILE A 76 0.878 0.978 -2.558 1.00 0.00 N ATOM 1187 CA ILE A 76 1.511 -0.250 -3.008 1.00 0.00 C ATOM 1188 C ILE A 76 0.806 -1.447 -2.365 1.00 0.00 C ATOM 1189 O ILE A 76 0.114 -2.202 -3.046 1.00 0.00 O ATOM 1190 CB ILE A 76 3.016 -0.207 -2.740 1.00 0.00 C ATOM 1191 CG1 ILE A 76 3.684 0.912 -3.542 1.00 0.00 C ATOM 1192 CG2 ILE A 76 3.661 -1.568 -3.009 1.00 0.00 C ATOM 1193 CD1 ILE A 76 4.760 1.615 -2.711 1.00 0.00 C ATOM 0 H ILE A 76 1.522 1.683 -2.200 1.00 0.00 H new ATOM 0 HA ILE A 76 1.406 -0.359 -4.087 1.00 0.00 H new ATOM 0 HB ILE A 76 3.168 0.018 -1.684 1.00 0.00 H new ATOM 0 HG12 ILE A 76 4.130 0.499 -4.447 1.00 0.00 H new ATOM 0 HG13 ILE A 76 2.933 1.636 -3.858 1.00 0.00 H new ATOM 0 HG21 ILE A 76 4.731 -1.509 -2.811 1.00 0.00 H new ATOM 0 HG22 ILE A 76 3.212 -2.318 -2.358 1.00 0.00 H new ATOM 0 HG23 ILE A 76 3.500 -1.848 -4.050 1.00 0.00 H new ATOM 0 HD11 ILE A 76 5.219 2.406 -3.304 1.00 0.00 H new ATOM 0 HD12 ILE A 76 4.306 2.047 -1.819 1.00 0.00 H new ATOM 0 HD13 ILE A 76 5.522 0.893 -2.417 1.00 0.00 H new ATOM 1205 N MET A 77 1.007 -1.582 -1.063 1.00 0.00 N ATOM 1206 CA MET A 77 0.399 -2.673 -0.321 1.00 0.00 C ATOM 1207 C MET A 77 -1.038 -2.917 -0.784 1.00 0.00 C ATOM 1208 O MET A 77 -1.368 -4.007 -1.251 1.00 0.00 O ATOM 1209 CB MET A 77 0.406 -2.342 1.173 1.00 0.00 C ATOM 1210 CG MET A 77 0.078 -3.580 2.010 1.00 0.00 C ATOM 1211 SD MET A 77 -0.228 -3.107 3.704 1.00 0.00 S ATOM 1212 CE MET A 77 -1.754 -3.985 4.000 1.00 0.00 C ATOM 0 H MET A 77 1.583 -0.954 -0.502 1.00 0.00 H new ATOM 0 HA MET A 77 0.978 -3.578 -0.503 1.00 0.00 H new ATOM 0 HB2 MET A 77 1.384 -1.954 1.459 1.00 0.00 H new ATOM 0 HB3 MET A 77 -0.321 -1.556 1.379 1.00 0.00 H new ATOM 0 HG2 MET A 77 -0.797 -4.085 1.601 1.00 0.00 H new ATOM 0 HG3 MET A 77 0.905 -4.289 1.965 1.00 0.00 H new ATOM 0 HE1 MET A 77 -2.405 -3.381 4.632 1.00 0.00 H new ATOM 0 HE2 MET A 77 -2.251 -4.181 3.050 1.00 0.00 H new ATOM 0 HE3 MET A 77 -1.539 -4.930 4.499 1.00 0.00 H new ATOM 1222 N LEU A 78 -1.856 -1.885 -0.638 1.00 0.00 N ATOM 1223 CA LEU A 78 -3.251 -1.974 -1.036 1.00 0.00 C ATOM 1224 C LEU A 78 -3.345 -2.655 -2.402 1.00 0.00 C ATOM 1225 O LEU A 78 -3.891 -3.752 -2.517 1.00 0.00 O ATOM 1226 CB LEU A 78 -3.910 -0.594 -0.990 1.00 0.00 C ATOM 1227 CG LEU A 78 -5.411 -0.557 -1.284 1.00 0.00 C ATOM 1228 CD1 LEU A 78 -6.205 -0.161 -0.038 1.00 0.00 C ATOM 1229 CD2 LEU A 78 -5.715 0.359 -2.472 1.00 0.00 C ATOM 0 H LEU A 78 -1.580 -0.983 -0.250 1.00 0.00 H new ATOM 0 HA LEU A 78 -3.809 -2.592 -0.333 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -3.743 -0.166 -0.001 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -3.404 0.053 -1.707 1.00 0.00 H new ATOM 0 HG LEU A 78 -5.729 -1.562 -1.562 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -7.269 -0.142 -0.275 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -6.023 -0.886 0.755 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -5.890 0.828 0.295 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -6.789 0.367 -2.660 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -5.378 1.371 -2.247 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -5.195 -0.008 -3.357 1.00 0.00 H new ATOM 1241 N GLY A 79 -2.806 -1.977 -3.404 1.00 0.00 N ATOM 1242 CA GLY A 79 -2.822 -2.503 -4.759 1.00 0.00 C ATOM 1243 C GLY A 79 -2.611 -4.018 -4.761 1.00 0.00 C ATOM 1244 O GLY A 79 -3.405 -4.759 -5.339 1.00 0.00 O ATOM 0 H GLY A 79 -2.355 -1.067 -3.305 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -3.773 -2.264 -5.235 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -2.041 -2.023 -5.349 1.00 0.00 H new ATOM 1248 N ALA A 80 -1.536 -4.435 -4.108 1.00 0.00 N ATOM 1249 CA ALA A 80 -1.211 -5.849 -4.027 1.00 0.00 C ATOM 1250 C ALA A 80 -2.389 -6.604 -3.409 1.00 0.00 C ATOM 1251 O ALA A 80 -2.818 -7.630 -3.935 1.00 0.00 O ATOM 1252 CB ALA A 80 0.082 -6.030 -3.229 1.00 0.00 C ATOM 0 H ALA A 80 -0.879 -3.818 -3.630 1.00 0.00 H new ATOM 0 HA ALA A 80 -1.041 -6.262 -5.021 1.00 0.00 H new ATOM 0 HB1 ALA A 80 0.326 -7.090 -3.168 1.00 0.00 H new ATOM 0 HB2 ALA A 80 0.894 -5.499 -3.726 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -0.052 -5.630 -2.224 1.00 0.00 H new ATOM 1258 N VAL A 81 -2.878 -6.069 -2.300 1.00 0.00 N ATOM 1259 CA VAL A 81 -3.998 -6.680 -1.605 1.00 0.00 C ATOM 1260 C VAL A 81 -5.163 -6.858 -2.580 1.00 0.00 C ATOM 1261 O VAL A 81 -5.591 -7.980 -2.843 1.00 0.00 O ATOM 1262 CB VAL A 81 -4.369 -5.846 -0.376 1.00 0.00 C ATOM 1263 CG1 VAL A 81 -5.667 -6.351 0.257 1.00 0.00 C ATOM 1264 CG2 VAL A 81 -3.229 -5.835 0.643 1.00 0.00 C ATOM 0 H VAL A 81 -2.519 -5.219 -1.865 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.726 -7.670 -1.240 1.00 0.00 H new ATOM 0 HB VAL A 81 -4.534 -4.820 -0.704 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -5.908 -5.742 1.128 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -6.477 -6.282 -0.469 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -5.542 -7.389 0.564 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -3.518 -5.236 1.506 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -3.018 -6.855 0.964 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -2.337 -5.406 0.186 1.00 0.00 H new ATOM 1274 N TYR A 82 -5.643 -5.733 -3.091 1.00 0.00 N ATOM 1275 CA TYR A 82 -6.750 -5.750 -4.032 1.00 0.00 C ATOM 1276 C TYR A 82 -6.561 -6.848 -5.081 1.00 0.00 C ATOM 1277 O TYR A 82 -7.495 -7.588 -5.386 1.00 0.00 O ATOM 1278 CB TYR A 82 -6.733 -4.388 -4.728 1.00 0.00 C ATOM 1279 CG TYR A 82 -8.073 -3.991 -5.350 1.00 0.00 C ATOM 1280 CD1 TYR A 82 -9.105 -3.553 -4.545 1.00 0.00 C ATOM 1281 CD2 TYR A 82 -8.250 -4.071 -6.717 1.00 0.00 C ATOM 1282 CE1 TYR A 82 -10.367 -3.179 -5.131 1.00 0.00 C ATOM 1283 CE2 TYR A 82 -9.512 -3.697 -7.302 1.00 0.00 C ATOM 1284 CZ TYR A 82 -10.507 -3.270 -6.481 1.00 0.00 C ATOM 1285 OH TYR A 82 -11.699 -2.916 -7.034 1.00 0.00 O ATOM 0 H TYR A 82 -5.285 -4.804 -2.871 1.00 0.00 H new ATOM 0 HA TYR A 82 -7.690 -5.944 -3.515 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -6.439 -3.626 -4.006 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -5.971 -4.399 -5.508 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -8.967 -3.491 -3.476 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -7.443 -4.414 -7.347 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -11.183 -2.834 -4.513 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -9.664 -3.755 -8.370 1.00 0.00 H new ATOM 0 HH TYR A 82 -11.655 -3.030 -8.006 1.00 0.00 H new ATOM 1295 N THR A 83 -5.345 -6.920 -5.603 1.00 0.00 N ATOM 1296 CA THR A 83 -5.021 -7.915 -6.611 1.00 0.00 C ATOM 1297 C THR A 83 -5.329 -9.321 -6.091 1.00 0.00 C ATOM 1298 O THR A 83 -6.031 -10.089 -6.747 1.00 0.00 O ATOM 1299 CB THR A 83 -3.557 -7.722 -7.012 1.00 0.00 C ATOM 1300 OG1 THR A 83 -3.571 -6.551 -7.824 1.00 0.00 O ATOM 1301 CG2 THR A 83 -3.059 -8.822 -7.953 1.00 0.00 C ATOM 0 H THR A 83 -4.572 -6.305 -5.347 1.00 0.00 H new ATOM 0 HA THR A 83 -5.636 -7.791 -7.502 1.00 0.00 H new ATOM 0 HB THR A 83 -2.935 -7.700 -6.117 1.00 0.00 H new ATOM 0 HG1 THR A 83 -3.526 -5.756 -7.253 1.00 0.00 H new ATOM 0 HG21 THR A 83 -2.015 -8.638 -8.207 1.00 0.00 H new ATOM 0 HG22 THR A 83 -3.148 -9.790 -7.460 1.00 0.00 H new ATOM 0 HG23 THR A 83 -3.659 -8.822 -8.863 1.00 0.00 H new ATOM 1309 N MET A 84 -4.789 -9.614 -4.917 1.00 0.00 N ATOM 1310 CA MET A 84 -4.997 -10.914 -4.302 1.00 0.00 C ATOM 1311 C MET A 84 -6.463 -11.104 -3.906 1.00 0.00 C ATOM 1312 O MET A 84 -7.174 -11.905 -4.511 1.00 0.00 O ATOM 1313 CB MET A 84 -4.112 -11.038 -3.060 1.00 0.00 C ATOM 1314 CG MET A 84 -3.407 -12.395 -3.024 1.00 0.00 C ATOM 1315 SD MET A 84 -2.261 -12.524 -4.386 1.00 0.00 S ATOM 1316 CE MET A 84 -1.121 -13.725 -3.720 1.00 0.00 C ATOM 0 H MET A 84 -4.208 -8.974 -4.376 1.00 0.00 H new ATOM 0 HA MET A 84 -4.733 -11.685 -5.026 1.00 0.00 H new ATOM 0 HB2 MET A 84 -3.371 -10.239 -3.056 1.00 0.00 H new ATOM 0 HB3 MET A 84 -4.719 -10.915 -2.163 1.00 0.00 H new ATOM 0 HG2 MET A 84 -2.876 -12.513 -2.079 1.00 0.00 H new ATOM 0 HG3 MET A 84 -4.142 -13.198 -3.079 1.00 0.00 H new ATOM 0 HE1 MET A 84 -0.335 -13.923 -4.448 1.00 0.00 H new ATOM 0 HE2 MET A 84 -0.677 -13.336 -2.803 1.00 0.00 H new ATOM 0 HE3 MET A 84 -1.654 -14.650 -3.501 1.00 0.00 H new ATOM 1326 N TYR A 85 -6.871 -10.356 -2.892 1.00 0.00 N ATOM 1327 CA TYR A 85 -8.239 -10.432 -2.408 1.00 0.00 C ATOM 1328 C TYR A 85 -9.219 -10.634 -3.565 1.00 0.00 C ATOM 1329 O TYR A 85 -10.025 -11.563 -3.545 1.00 0.00 O ATOM 1330 CB TYR A 85 -8.526 -9.086 -1.740 1.00 0.00 C ATOM 1331 CG TYR A 85 -9.196 -9.201 -0.370 1.00 0.00 C ATOM 1332 CD1 TYR A 85 -8.473 -9.653 0.716 1.00 0.00 C ATOM 1333 CD2 TYR A 85 -10.523 -8.853 -0.219 1.00 0.00 C ATOM 1334 CE1 TYR A 85 -9.104 -9.761 2.006 1.00 0.00 C ATOM 1335 CE2 TYR A 85 -11.153 -8.961 1.071 1.00 0.00 C ATOM 1336 CZ TYR A 85 -10.413 -9.410 2.120 1.00 0.00 C ATOM 1337 OH TYR A 85 -11.009 -9.512 3.338 1.00 0.00 O ATOM 0 H TYR A 85 -6.278 -9.694 -2.392 1.00 0.00 H new ATOM 0 HA TYR A 85 -8.358 -11.272 -1.723 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -7.589 -8.540 -1.630 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -9.164 -8.495 -2.397 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -7.435 -9.925 0.598 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -11.089 -8.500 -1.068 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -8.550 -10.113 2.864 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -12.190 -8.691 1.203 1.00 0.00 H new ATOM 0 HH TYR A 85 -11.944 -9.226 3.270 1.00 0.00 H new ATOM 1347 N SER A 86 -9.118 -9.749 -4.545 1.00 0.00 N ATOM 1348 CA SER A 86 -9.986 -9.818 -5.708 1.00 0.00 C ATOM 1349 C SER A 86 -9.799 -11.158 -6.422 1.00 0.00 C ATOM 1350 O SER A 86 -10.773 -11.851 -6.714 1.00 0.00 O ATOM 1351 CB SER A 86 -9.710 -8.661 -6.671 1.00 0.00 C ATOM 1352 OG SER A 86 -10.672 -8.598 -7.720 1.00 0.00 O ATOM 0 H SER A 86 -8.448 -8.980 -4.558 1.00 0.00 H new ATOM 0 HA SER A 86 -11.019 -9.735 -5.369 1.00 0.00 H new ATOM 0 HB2 SER A 86 -9.714 -7.721 -6.119 1.00 0.00 H new ATOM 0 HB3 SER A 86 -8.714 -8.775 -7.099 1.00 0.00 H new ATOM 0 HG SER A 86 -10.462 -7.846 -8.312 1.00 0.00 H new ATOM 1358 N ASP A 87 -8.541 -11.484 -6.681 1.00 0.00 N ATOM 1359 CA ASP A 87 -8.215 -12.729 -7.355 1.00 0.00 C ATOM 1360 C ASP A 87 -8.990 -13.876 -6.702 1.00 0.00 C ATOM 1361 O ASP A 87 -9.613 -14.680 -7.393 1.00 0.00 O ATOM 1362 CB ASP A 87 -6.722 -13.042 -7.240 1.00 0.00 C ATOM 1363 CG ASP A 87 -5.974 -13.128 -8.572 1.00 0.00 C ATOM 1364 OD1 ASP A 87 -5.829 -12.004 -9.189 1.00 0.00 O ATOM 1365 OD2 ASP A 87 -5.552 -14.212 -9.000 1.00 0.00 O ATOM 0 H ASP A 87 -7.736 -10.908 -6.436 1.00 0.00 H new ATOM 0 HA ASP A 87 -8.482 -12.623 -8.407 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -6.252 -12.274 -6.625 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -6.604 -13.989 -6.713 1.00 0.00 H new ATOM 1370 N TYR A 88 -8.925 -13.913 -5.380 1.00 0.00 N ATOM 1371 CA TYR A 88 -9.613 -14.948 -4.626 1.00 0.00 C ATOM 1372 C TYR A 88 -10.981 -15.255 -5.239 1.00 0.00 C ATOM 1373 O TYR A 88 -11.357 -16.418 -5.375 1.00 0.00 O ATOM 1374 CB TYR A 88 -9.814 -14.382 -3.219 1.00 0.00 C ATOM 1375 CG TYR A 88 -9.757 -15.435 -2.111 1.00 0.00 C ATOM 1376 CD1 TYR A 88 -8.564 -16.063 -1.817 1.00 0.00 C ATOM 1377 CD2 TYR A 88 -10.899 -15.756 -1.405 1.00 0.00 C ATOM 1378 CE1 TYR A 88 -8.510 -17.054 -0.773 1.00 0.00 C ATOM 1379 CE2 TYR A 88 -10.845 -16.747 -0.361 1.00 0.00 C ATOM 1380 CZ TYR A 88 -9.653 -17.348 -0.097 1.00 0.00 C ATOM 1381 OH TYR A 88 -9.603 -18.284 0.888 1.00 0.00 O ATOM 0 H TYR A 88 -8.407 -13.244 -4.811 1.00 0.00 H new ATOM 0 HA TYR A 88 -9.034 -15.872 -4.626 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -9.050 -13.628 -3.029 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -10.779 -13.876 -3.176 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -7.671 -15.812 -2.370 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -11.833 -15.264 -1.635 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -7.583 -17.552 -0.532 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -11.731 -17.007 0.200 1.00 0.00 H new ATOM 0 HH TYR A 88 -10.493 -18.390 1.284 1.00 0.00 H new ATOM 1391 N VAL A 89 -11.688 -14.191 -5.593 1.00 0.00 N ATOM 1392 CA VAL A 89 -13.005 -14.333 -6.189 1.00 0.00 C ATOM 1393 C VAL A 89 -12.952 -15.396 -7.287 1.00 0.00 C ATOM 1394 O VAL A 89 -12.174 -15.279 -8.233 1.00 0.00 O ATOM 1395 CB VAL A 89 -13.500 -12.976 -6.694 1.00 0.00 C ATOM 1396 CG1 VAL A 89 -14.817 -13.122 -7.458 1.00 0.00 C ATOM 1397 CG2 VAL A 89 -13.642 -11.980 -5.541 1.00 0.00 C ATOM 0 H VAL A 89 -11.373 -13.228 -5.478 1.00 0.00 H new ATOM 0 HA VAL A 89 -13.726 -14.671 -5.445 1.00 0.00 H new ATOM 0 HB VAL A 89 -12.754 -12.584 -7.385 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -15.146 -12.143 -7.806 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -14.670 -13.781 -8.314 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -15.575 -13.547 -6.799 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -13.995 -11.024 -5.927 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -14.358 -12.364 -4.814 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -12.674 -11.841 -5.059 1.00 0.00 H new ATOM 1407 N LYS A 90 -13.790 -16.410 -7.126 1.00 0.00 N ATOM 1408 CA LYS A 90 -13.849 -17.493 -8.093 1.00 0.00 C ATOM 1409 C LYS A 90 -14.751 -17.083 -9.258 1.00 0.00 C ATOM 1410 O LYS A 90 -15.758 -17.736 -9.528 1.00 0.00 O ATOM 1411 CB LYS A 90 -14.277 -18.795 -7.413 1.00 0.00 C ATOM 1412 CG LYS A 90 -13.201 -19.873 -7.565 1.00 0.00 C ATOM 1413 CD LYS A 90 -13.127 -20.754 -6.317 1.00 0.00 C ATOM 1414 CE LYS A 90 -11.838 -21.579 -6.303 1.00 0.00 C ATOM 1415 NZ LYS A 90 -12.087 -22.921 -5.732 1.00 0.00 N ATOM 0 H LYS A 90 -14.434 -16.504 -6.340 1.00 0.00 H new ATOM 0 HA LYS A 90 -12.860 -17.687 -8.508 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -14.466 -18.612 -6.355 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -15.213 -19.146 -7.848 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -13.419 -20.489 -8.437 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -12.233 -19.403 -7.741 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -13.173 -20.130 -5.424 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -13.989 -21.420 -6.286 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -11.450 -21.675 -7.317 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -11.076 -21.064 -5.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -11.202 -23.467 -5.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -12.436 -22.824 -4.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -12.798 -23.416 -6.307 1.00 0.00 H new ATOM 1429 N ARG A 91 -14.358 -16.004 -9.918 1.00 0.00 N ATOM 1430 CA ARG A 91 -15.118 -15.499 -11.049 1.00 0.00 C ATOM 1431 C ARG A 91 -14.178 -14.899 -12.096 1.00 0.00 C ATOM 1432 O ARG A 91 -13.975 -13.687 -12.131 1.00 0.00 O ATOM 1433 CB ARG A 91 -16.122 -14.433 -10.605 1.00 0.00 C ATOM 1434 CG ARG A 91 -17.552 -14.977 -10.643 1.00 0.00 C ATOM 1435 CD ARG A 91 -18.524 -14.012 -9.962 1.00 0.00 C ATOM 1436 NE ARG A 91 -19.308 -14.728 -8.930 1.00 0.00 N ATOM 1437 CZ ARG A 91 -20.181 -15.722 -9.197 1.00 0.00 C ATOM 1438 NH1 ARG A 91 -20.389 -16.128 -10.468 1.00 0.00 N ATOM 1439 NH2 ARG A 91 -20.827 -16.292 -8.197 1.00 0.00 N ATOM 0 H ARG A 91 -13.522 -15.465 -9.691 1.00 0.00 H new ATOM 0 HA ARG A 91 -15.662 -16.338 -11.483 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -15.882 -14.101 -9.595 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -16.043 -13.561 -11.255 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -17.857 -15.136 -11.677 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -17.589 -15.947 -10.147 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -17.973 -13.189 -9.506 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -19.195 -13.575 -10.702 1.00 0.00 H new ATOM 0 HE ARG A 91 -19.180 -14.453 -7.956 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -19.885 -15.683 -11.235 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -21.050 -16.880 -10.661 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -20.663 -15.980 -7.240 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -21.490 -17.045 -8.381 1.00 0.00 H new ATOM 1453 N MET A 92 -13.629 -15.776 -12.924 1.00 0.00 N ATOM 1454 CA MET A 92 -12.715 -15.349 -13.969 1.00 0.00 C ATOM 1455 C MET A 92 -12.267 -16.535 -14.825 1.00 0.00 C ATOM 1456 O MET A 92 -12.203 -17.664 -14.342 1.00 0.00 O ATOM 1457 CB MET A 92 -11.491 -14.684 -13.336 1.00 0.00 C ATOM 1458 CG MET A 92 -10.926 -13.594 -14.249 1.00 0.00 C ATOM 1459 SD MET A 92 -10.698 -12.082 -13.327 1.00 0.00 S ATOM 1460 CE MET A 92 -10.643 -10.906 -14.669 1.00 0.00 C ATOM 0 H MET A 92 -13.800 -16.781 -12.892 1.00 0.00 H new ATOM 0 HA MET A 92 -13.234 -14.638 -14.612 1.00 0.00 H new ATOM 0 HB2 MET A 92 -11.765 -14.252 -12.374 1.00 0.00 H new ATOM 0 HB3 MET A 92 -10.725 -15.434 -13.142 1.00 0.00 H new ATOM 0 HG2 MET A 92 -9.975 -13.919 -14.671 1.00 0.00 H new ATOM 0 HG3 MET A 92 -11.604 -13.421 -15.085 1.00 0.00 H new ATOM 0 HE1 MET A 92 -10.504 -9.902 -14.268 1.00 0.00 H new ATOM 0 HE2 MET A 92 -9.813 -11.150 -15.332 1.00 0.00 H new ATOM 0 HE3 MET A 92 -11.578 -10.947 -15.228 1.00 0.00 H new ATOM 1470 N ALA A 93 -11.968 -16.238 -16.081 1.00 0.00 N ATOM 1471 CA ALA A 93 -11.528 -17.266 -17.009 1.00 0.00 C ATOM 1472 C ALA A 93 -11.192 -16.622 -18.355 1.00 0.00 C ATOM 1473 O ALA A 93 -11.627 -17.100 -19.402 1.00 0.00 O ATOM 1474 CB ALA A 93 -12.609 -18.342 -17.130 1.00 0.00 C ATOM 0 H ALA A 93 -12.022 -15.300 -16.478 1.00 0.00 H new ATOM 0 HA ALA A 93 -10.624 -17.753 -16.642 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -12.279 -19.113 -17.826 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -12.789 -18.789 -16.152 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -13.531 -17.892 -17.498 1.00 0.00 H new ATOM 1480 N GLN A 94 -10.421 -15.547 -18.285 1.00 0.00 N ATOM 1481 CA GLN A 94 -10.022 -14.833 -19.486 1.00 0.00 C ATOM 1482 C GLN A 94 -8.722 -14.065 -19.239 1.00 0.00 C ATOM 1483 O GLN A 94 -7.730 -14.278 -19.934 1.00 0.00 O ATOM 1484 CB GLN A 94 -11.133 -13.892 -19.959 1.00 0.00 C ATOM 1485 CG GLN A 94 -11.551 -14.217 -21.394 1.00 0.00 C ATOM 1486 CD GLN A 94 -12.149 -12.988 -22.082 1.00 0.00 C ATOM 1487 OE1 GLN A 94 -11.982 -11.859 -21.649 1.00 0.00 O ATOM 1488 NE2 GLN A 94 -12.853 -13.268 -23.175 1.00 0.00 N ATOM 0 H GLN A 94 -10.062 -15.153 -17.415 1.00 0.00 H new ATOM 0 HA GLN A 94 -9.846 -15.562 -20.277 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -11.994 -13.979 -19.297 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -10.789 -12.859 -19.901 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -10.687 -14.569 -21.957 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -12.281 -15.027 -21.390 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -12.954 -14.235 -23.483 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -13.292 -12.516 -23.705 1.00 0.00 H new ATOM 1497 N ASP A 95 -8.769 -13.187 -18.248 1.00 0.00 N ATOM 1498 CA ASP A 95 -7.607 -12.387 -17.901 1.00 0.00 C ATOM 1499 C ASP A 95 -7.181 -11.560 -19.116 1.00 0.00 C ATOM 1500 O ASP A 95 -6.137 -11.819 -19.711 1.00 0.00 O ATOM 1501 CB ASP A 95 -6.428 -13.274 -17.496 1.00 0.00 C ATOM 1502 CG ASP A 95 -5.431 -12.625 -16.535 1.00 0.00 C ATOM 1503 OD1 ASP A 95 -5.818 -12.022 -15.522 1.00 0.00 O ATOM 1504 OD2 ASP A 95 -4.190 -12.757 -16.864 1.00 0.00 O ATOM 0 H ASP A 95 -9.594 -13.012 -17.674 1.00 0.00 H new ATOM 0 HA ASP A 95 -7.879 -11.744 -17.064 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -6.817 -14.181 -17.034 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -5.896 -13.579 -18.397 1.00 0.00 H new ATOM 1509 N ALA A 96 -8.013 -10.584 -19.448 1.00 0.00 N ATOM 1510 CA ALA A 96 -7.735 -9.718 -20.581 1.00 0.00 C ATOM 1511 C ALA A 96 -7.761 -10.545 -21.868 1.00 0.00 C ATOM 1512 O ALA A 96 -8.740 -10.511 -22.612 1.00 0.00 O ATOM 1513 CB ALA A 96 -6.395 -9.012 -20.369 1.00 0.00 C ATOM 0 H ALA A 96 -8.879 -10.374 -18.953 1.00 0.00 H new ATOM 0 HA ALA A 96 -8.499 -8.946 -20.669 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -6.187 -8.363 -21.219 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -6.439 -8.415 -19.458 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -5.603 -9.755 -20.278 1.00 0.00 H new ATOM 1519 N GLY A 97 -6.674 -11.269 -22.090 1.00 0.00 N ATOM 1520 CA GLY A 97 -6.559 -12.103 -23.274 1.00 0.00 C ATOM 1521 C GLY A 97 -5.455 -13.148 -23.103 1.00 0.00 C ATOM 1522 O GLY A 97 -4.350 -12.824 -22.671 1.00 0.00 O ATOM 0 H GLY A 97 -5.865 -11.295 -21.470 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -7.509 -12.601 -23.466 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -6.344 -11.480 -24.142 1.00 0.00 H new ATOM 1526 N GLU A 98 -5.792 -14.381 -23.452 1.00 0.00 N ATOM 1527 CA GLU A 98 -4.843 -15.476 -23.342 1.00 0.00 C ATOM 1528 C GLU A 98 -5.222 -16.605 -24.302 1.00 0.00 C ATOM 1529 O GLU A 98 -6.399 -16.935 -24.445 1.00 0.00 O ATOM 1530 CB GLU A 98 -4.758 -15.986 -21.902 1.00 0.00 C ATOM 1531 CG GLU A 98 -6.093 -16.582 -21.452 1.00 0.00 C ATOM 1532 CD GLU A 98 -5.945 -18.067 -21.115 1.00 0.00 C ATOM 1533 OE1 GLU A 98 -5.569 -18.317 -19.906 1.00 0.00 O ATOM 1534 OE2 GLU A 98 -6.181 -18.925 -21.978 1.00 0.00 O ATOM 0 H GLU A 98 -6.709 -14.646 -23.811 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.856 -15.105 -23.620 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -3.975 -16.740 -21.825 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -4.479 -15.168 -21.238 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -6.460 -16.042 -20.579 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -6.835 -16.457 -22.240 1.00 0.00 H new ATOM 1541 N LYS A 99 -4.203 -17.168 -24.936 1.00 0.00 N ATOM 1542 CA LYS A 99 -4.415 -18.253 -25.879 1.00 0.00 C ATOM 1543 C LYS A 99 -4.113 -19.586 -25.191 1.00 0.00 C ATOM 1544 O LYS A 99 -3.762 -20.563 -25.851 1.00 0.00 O ATOM 1545 CB LYS A 99 -3.603 -18.021 -27.154 1.00 0.00 C ATOM 1546 CG LYS A 99 -4.515 -17.658 -28.327 1.00 0.00 C ATOM 1547 CD LYS A 99 -4.957 -18.910 -29.087 1.00 0.00 C ATOM 1548 CE LYS A 99 -6.472 -19.100 -28.998 1.00 0.00 C ATOM 1549 NZ LYS A 99 -7.006 -19.618 -30.277 1.00 0.00 N ATOM 0 H LYS A 99 -3.228 -16.893 -24.815 1.00 0.00 H new ATOM 0 HA LYS A 99 -5.458 -18.286 -26.195 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -2.881 -17.221 -26.989 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -3.034 -18.919 -27.395 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -5.391 -17.124 -27.959 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -3.991 -16.983 -29.004 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -4.658 -18.830 -30.132 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -4.453 -19.785 -28.677 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -6.711 -19.792 -28.191 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -6.950 -18.151 -28.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -8.036 -19.741 -30.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -6.795 -18.944 -31.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -6.563 -20.534 -30.492 1.00 0.00 H new TER 1563 LYS A 99