USER MOD reduce.3.24.130724 H: found=0, std=0, add=1185, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1183 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 123 CYS SG : rot 50:sc= -0.339 USER MOD Set 1.2: A 133 SER OG : rot 165:sc= 1.07 USER MOD Set 1.3: A 135 THR OG1 : rot -122:sc= 1.13 USER MOD Set 2.1: A 46 LYS NZ :NH3+ -160:sc= 0.85 (180deg=0) USER MOD Set 2.2: A 62 HIS : no HD1:sc= 1.34 K(o=2.2,f=-7.2!) USER MOD Single : A 1 MET CE :methyl 173:sc= 0 (180deg=-0.104) USER MOD Single : A 1 MET N :NH3+ -158:sc= 1.06 (180deg=-0.284) USER MOD Single : A 4 SER OG : rot 126:sc= 1.12 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot -33:sc= 1.24 USER MOD Single : A 9 SER OG : rot 47:sc= 0.618 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= 0.849 K(o=0.85,f=-0.43) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 GLN : amide:sc= -0.0868 X(o=-0.087,f=-0.087) USER MOD Single : A 22 LYS NZ :NH3+ 171:sc= 1.1 (180deg=0.55) USER MOD Single : A 23 THR OG1 : rot 78:sc= 1.24 USER MOD Single : A 25 TYR OH : rot -147:sc= 0.00249 USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=0.091) USER MOD Single : A 29 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 GLN : amide:sc= 0.32 K(o=0.32,f=-3.7!) USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= 0.729 K(o=0.73,f=0) USER MOD Single : A 40 ASN : amide:sc= 1 K(o=1,f=-4!) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 55 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 169:sc= 1.67 (180deg=1.39) USER MOD Single : A 66 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 67 CYS SG : rot 180:sc= -0.056 USER MOD Single : A 69 SER OG : rot -173:sc= 0.779 USER MOD Single : A 70 CYS SG : rot 180:sc= -1.48 USER MOD Single : A 72 LYS NZ :NH3+ 162:sc= 1.16 (180deg=0.119!) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 170:sc= 0.102 USER MOD Single : A 80 GLN : amide:sc= 0.713 K(o=0.71,f=-3.5!) USER MOD Single : A 85 ASN : amide:sc= 0.00408 K(o=0.0041,f=-0.76) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= -0.011 X(o=-0.011,f=-0.32) USER MOD Single : A 94 LYS NZ :NH3+ -174:sc= 1.19 (180deg=0.891) USER MOD Single : A 95 GLN : amide:sc= 0.896 K(o=0.9,f=-6!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot -36:sc= 1.1 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 111:sc= -0.131! USER MOD Single : A 111 SER OG : rot -128:sc= 1.45 USER MOD Single : A 114 SER OG : rot -69:sc= -0.0689 USER MOD Single : A 117 CYS SG : rot 180:sc= -0.249 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 130 GLN : amide:sc= 0.335 K(o=0.34,f=-4!) USER MOD Single : A 136 ASN : amide:sc= 0.247 K(o=0.25,f=-1.5!) USER MOD Single : A 137 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 143 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 GLN : amide:sc= 0.695 K(o=0.7,f=-3.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -7.188 4.129 -3.289 1.00 0.00 N ATOM 2 CA MET A 1 -8.102 5.267 -3.579 1.00 0.00 C ATOM 3 C MET A 1 -9.116 5.413 -2.407 1.00 0.00 C ATOM 4 O MET A 1 -10.061 4.628 -2.307 1.00 0.00 O ATOM 5 CB MET A 1 -8.778 4.994 -4.951 1.00 0.00 C ATOM 6 CG MET A 1 -9.592 6.169 -5.531 1.00 0.00 C ATOM 7 SD MET A 1 -11.038 6.564 -4.526 1.00 0.00 S ATOM 8 CE MET A 1 -11.609 8.040 -5.379 1.00 0.00 C ATOM 0 H1 MET A 1 -6.310 4.241 -3.835 1.00 0.00 H new ATOM 0 H2 MET A 1 -6.965 4.113 -2.273 1.00 0.00 H new ATOM 0 H3 MET A 1 -7.650 3.236 -3.556 1.00 0.00 H new ATOM 0 HA MET A 1 -7.572 6.217 -3.652 1.00 0.00 H new ATOM 0 HB2 MET A 1 -8.006 4.719 -5.669 1.00 0.00 H new ATOM 0 HB3 MET A 1 -9.438 4.133 -4.847 1.00 0.00 H new ATOM 0 HG2 MET A 1 -8.953 7.049 -5.605 1.00 0.00 H new ATOM 0 HG3 MET A 1 -9.912 5.921 -6.543 1.00 0.00 H new ATOM 0 HE1 MET A 1 -12.569 8.350 -4.967 1.00 0.00 H new ATOM 0 HE2 MET A 1 -10.882 8.841 -5.247 1.00 0.00 H new ATOM 0 HE3 MET A 1 -11.723 7.825 -6.442 1.00 0.00 H new ATOM 20 N ARG A 2 -8.902 6.399 -1.520 1.00 0.00 N ATOM 21 CA ARG A 2 -9.800 6.661 -0.361 1.00 0.00 C ATOM 22 C ARG A 2 -10.679 7.921 -0.693 1.00 0.00 C ATOM 23 O ARG A 2 -10.128 9.023 -0.608 1.00 0.00 O ATOM 24 CB ARG A 2 -8.882 6.828 0.892 1.00 0.00 C ATOM 25 CG ARG A 2 -9.515 6.494 2.260 1.00 0.00 C ATOM 26 CD ARG A 2 -10.520 7.513 2.824 1.00 0.00 C ATOM 27 NE ARG A 2 -11.068 7.057 4.139 1.00 0.00 N ATOM 28 CZ ARG A 2 -12.103 6.223 4.292 1.00 0.00 C ATOM 29 NH1 ARG A 2 -12.725 5.662 3.286 1.00 0.00 N ATOM 30 NH2 ARG A 2 -12.509 5.944 5.495 1.00 0.00 N ATOM 0 H ARG A 2 -8.109 7.038 -1.577 1.00 0.00 H new ATOM 0 HA ARG A 2 -10.499 5.850 -0.154 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -8.005 6.195 0.759 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -8.530 7.859 0.922 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -10.018 5.531 2.176 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -8.711 6.371 2.986 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -10.033 8.480 2.945 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -11.336 7.654 2.115 1.00 0.00 H new ATOM 0 HE ARG A 2 -10.618 7.409 4.984 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -12.425 5.854 2.330 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -13.509 5.033 3.458 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -12.040 6.359 6.300 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -13.296 5.311 5.633 1.00 0.00 H new ATOM 44 N PRO A 3 -12.004 7.851 -1.049 1.00 0.00 N ATOM 45 CA PRO A 3 -12.816 9.051 -1.419 1.00 0.00 C ATOM 46 C PRO A 3 -12.854 10.213 -0.371 1.00 0.00 C ATOM 47 O PRO A 3 -13.453 10.088 0.703 1.00 0.00 O ATOM 48 CB PRO A 3 -14.214 8.445 -1.669 1.00 0.00 C ATOM 49 CG PRO A 3 -13.948 7.001 -2.080 1.00 0.00 C ATOM 50 CD PRO A 3 -12.756 6.588 -1.218 1.00 0.00 C ATOM 0 HA PRO A 3 -12.378 9.564 -2.275 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -14.832 8.493 -0.772 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -14.745 8.987 -2.451 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -14.815 6.366 -1.894 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -13.719 6.924 -3.143 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -13.075 6.179 -0.260 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -12.153 5.823 -1.706 1.00 0.00 H new ATOM 58 N SER A 4 -12.228 11.351 -0.716 1.00 0.00 N ATOM 59 CA SER A 4 -12.146 12.530 0.185 1.00 0.00 C ATOM 60 C SER A 4 -13.429 13.414 0.117 1.00 0.00 C ATOM 61 O SER A 4 -13.793 13.955 -0.933 1.00 0.00 O ATOM 62 CB SER A 4 -10.901 13.363 -0.196 1.00 0.00 C ATOM 63 OG SER A 4 -9.698 12.673 0.142 1.00 0.00 O ATOM 0 H SER A 4 -11.767 11.487 -1.616 1.00 0.00 H new ATOM 0 HA SER A 4 -12.063 12.172 1.211 1.00 0.00 H new ATOM 0 HB2 SER A 4 -10.914 13.575 -1.265 1.00 0.00 H new ATOM 0 HB3 SER A 4 -10.930 14.323 0.319 1.00 0.00 H new ATOM 0 HG SER A 4 -9.127 12.604 -0.651 1.00 0.00 H new ATOM 69 N GLY A 5 -14.114 13.542 1.263 1.00 0.00 N ATOM 70 CA GLY A 5 -15.318 14.400 1.390 1.00 0.00 C ATOM 71 C GLY A 5 -14.963 15.765 2.009 1.00 0.00 C ATOM 72 O GLY A 5 -14.505 15.817 3.154 1.00 0.00 O ATOM 0 H GLY A 5 -13.858 13.061 2.125 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -15.768 14.548 0.408 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -16.062 13.899 2.009 1.00 0.00 H new ATOM 76 N ARG A 6 -15.222 16.860 1.276 1.00 0.00 N ATOM 77 CA ARG A 6 -14.918 18.251 1.734 1.00 0.00 C ATOM 78 C ARG A 6 -15.565 18.607 3.124 1.00 0.00 C ATOM 79 O ARG A 6 -16.782 18.522 3.305 1.00 0.00 O ATOM 80 CB ARG A 6 -15.353 19.221 0.595 1.00 0.00 C ATOM 81 CG ARG A 6 -16.863 19.315 0.228 1.00 0.00 C ATOM 82 CD ARG A 6 -17.161 20.144 -1.041 1.00 0.00 C ATOM 83 NE ARG A 6 -16.765 19.440 -2.300 1.00 0.00 N ATOM 84 CZ ARG A 6 -17.526 18.590 -2.994 1.00 0.00 C ATOM 85 NH1 ARG A 6 -18.741 18.250 -2.641 1.00 0.00 N ATOM 86 NH2 ARG A 6 -17.034 18.063 -4.079 1.00 0.00 N ATOM 0 H ARG A 6 -15.647 16.820 0.350 1.00 0.00 H new ATOM 0 HA ARG A 6 -13.848 18.348 1.919 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -15.016 20.221 0.866 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -14.811 18.936 -0.307 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -17.254 18.307 0.089 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -17.402 19.753 1.068 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -18.226 20.373 -1.078 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -16.632 21.095 -0.980 1.00 0.00 H new ATOM 0 HE ARG A 6 -15.829 19.626 -2.661 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -19.154 18.640 -1.794 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -19.274 17.595 -3.213 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -16.089 18.303 -4.379 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -17.594 17.411 -4.628 1.00 0.00 H new ATOM 100 N LYS A 7 -14.709 18.974 4.102 1.00 0.00 N ATOM 101 CA LYS A 7 -15.097 19.237 5.533 1.00 0.00 C ATOM 102 C LYS A 7 -15.681 17.953 6.251 1.00 0.00 C ATOM 103 O LYS A 7 -16.730 17.994 6.900 1.00 0.00 O ATOM 104 CB LYS A 7 -16.045 20.477 5.637 1.00 0.00 C ATOM 105 CG LYS A 7 -15.414 21.835 5.232 1.00 0.00 C ATOM 106 CD LYS A 7 -16.368 23.046 5.336 1.00 0.00 C ATOM 107 CE LYS A 7 -16.689 23.473 6.782 1.00 0.00 C ATOM 108 NZ LYS A 7 -17.589 24.658 6.771 1.00 0.00 N ATOM 0 H LYS A 7 -13.711 19.102 3.932 1.00 0.00 H new ATOM 0 HA LYS A 7 -14.186 19.482 6.079 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -16.917 20.299 5.008 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -16.403 20.554 6.664 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -14.545 22.019 5.863 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -15.053 21.761 4.206 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -15.924 23.891 4.809 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -17.300 22.806 4.824 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -17.163 22.650 7.317 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -15.767 23.710 7.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -17.802 24.941 7.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -17.121 25.444 6.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -18.474 24.418 6.280 1.00 0.00 H new ATOM 122 N SER A 8 -14.954 16.818 6.173 1.00 0.00 N ATOM 123 CA SER A 8 -15.345 15.525 6.804 1.00 0.00 C ATOM 124 C SER A 8 -14.081 14.624 7.007 1.00 0.00 C ATOM 125 O SER A 8 -13.112 14.688 6.237 1.00 0.00 O ATOM 126 CB SER A 8 -16.406 14.800 5.929 1.00 0.00 C ATOM 127 OG SER A 8 -15.871 14.292 4.705 1.00 0.00 O ATOM 0 H SER A 8 -14.070 16.766 5.667 1.00 0.00 H new ATOM 0 HA SER A 8 -15.787 15.724 7.780 1.00 0.00 H new ATOM 0 HB2 SER A 8 -16.838 13.977 6.499 1.00 0.00 H new ATOM 0 HB3 SER A 8 -17.217 15.492 5.704 1.00 0.00 H new ATOM 0 HG SER A 8 -15.161 14.888 4.386 1.00 0.00 H new ATOM 133 N SER A 9 -14.097 13.737 8.019 1.00 0.00 N ATOM 134 CA SER A 9 -12.949 12.827 8.309 1.00 0.00 C ATOM 135 C SER A 9 -12.914 11.561 7.375 1.00 0.00 C ATOM 136 O SER A 9 -13.178 10.432 7.804 1.00 0.00 O ATOM 137 CB SER A 9 -13.052 12.463 9.814 1.00 0.00 C ATOM 138 OG SER A 9 -14.162 11.602 10.077 1.00 0.00 O ATOM 0 H SER A 9 -14.887 13.623 8.655 1.00 0.00 H new ATOM 0 HA SER A 9 -12.004 13.327 8.097 1.00 0.00 H new ATOM 0 HB2 SER A 9 -12.131 11.976 10.134 1.00 0.00 H new ATOM 0 HB3 SER A 9 -13.152 13.375 10.403 1.00 0.00 H new ATOM 0 HG SER A 9 -14.170 10.870 9.425 1.00 0.00 H new ATOM 144 N LYS A 10 -12.557 11.765 6.094 1.00 0.00 N ATOM 145 CA LYS A 10 -12.484 10.677 5.071 1.00 0.00 C ATOM 146 C LYS A 10 -11.161 10.769 4.226 1.00 0.00 C ATOM 147 O LYS A 10 -11.201 10.768 2.993 1.00 0.00 O ATOM 148 CB LYS A 10 -13.757 10.785 4.172 1.00 0.00 C ATOM 149 CG LYS A 10 -15.112 10.363 4.794 1.00 0.00 C ATOM 150 CD LYS A 10 -16.341 10.739 3.935 1.00 0.00 C ATOM 151 CE LYS A 10 -16.453 9.975 2.600 1.00 0.00 C ATOM 152 NZ LYS A 10 -17.702 10.366 1.892 1.00 0.00 N ATOM 0 H LYS A 10 -12.309 12.684 5.728 1.00 0.00 H new ATOM 0 HA LYS A 10 -12.459 9.703 5.559 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -13.847 11.819 3.840 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -13.592 10.178 3.282 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -15.108 9.284 4.952 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -15.211 10.828 5.775 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -17.244 10.558 4.518 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -16.307 11.808 3.724 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -15.587 10.192 1.974 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -16.451 8.901 2.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -17.769 9.846 0.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -18.524 10.137 2.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -17.687 11.388 1.700 1.00 0.00 H new ATOM 166 N MET A 11 -9.971 10.767 4.860 1.00 0.00 N ATOM 167 CA MET A 11 -8.668 10.880 4.137 1.00 0.00 C ATOM 168 C MET A 11 -7.583 10.037 4.873 1.00 0.00 C ATOM 169 O MET A 11 -7.262 10.324 6.032 1.00 0.00 O ATOM 170 CB MET A 11 -8.268 12.385 4.059 1.00 0.00 C ATOM 171 CG MET A 11 -7.263 12.756 2.945 1.00 0.00 C ATOM 172 SD MET A 11 -5.729 11.794 2.988 1.00 0.00 S ATOM 173 CE MET A 11 -4.830 12.586 4.333 1.00 0.00 C ATOM 0 H MET A 11 -9.875 10.689 5.872 1.00 0.00 H new ATOM 0 HA MET A 11 -8.758 10.490 3.123 1.00 0.00 H new ATOM 0 HB2 MET A 11 -9.173 12.975 3.917 1.00 0.00 H new ATOM 0 HB3 MET A 11 -7.843 12.679 5.019 1.00 0.00 H new ATOM 0 HG2 MET A 11 -7.742 12.615 1.976 1.00 0.00 H new ATOM 0 HG3 MET A 11 -7.018 13.815 3.028 1.00 0.00 H new ATOM 0 HE1 MET A 11 -3.867 12.093 4.467 1.00 0.00 H new ATOM 0 HE2 MET A 11 -4.669 13.637 4.094 1.00 0.00 H new ATOM 0 HE3 MET A 11 -5.409 12.508 5.253 1.00 0.00 H new ATOM 183 N GLN A 12 -7.015 9.004 4.219 1.00 0.00 N ATOM 184 CA GLN A 12 -5.928 8.188 4.825 1.00 0.00 C ATOM 185 C GLN A 12 -4.824 7.876 3.770 1.00 0.00 C ATOM 186 O GLN A 12 -4.869 6.858 3.061 1.00 0.00 O ATOM 187 CB GLN A 12 -6.522 6.898 5.466 1.00 0.00 C ATOM 188 CG GLN A 12 -6.801 7.061 6.982 1.00 0.00 C ATOM 189 CD GLN A 12 -7.065 5.763 7.739 1.00 0.00 C ATOM 190 OE1 GLN A 12 -8.186 5.469 8.139 1.00 0.00 O ATOM 191 NE2 GLN A 12 -6.048 4.969 7.990 1.00 0.00 N ATOM 0 H GLN A 12 -7.283 8.712 3.279 1.00 0.00 H new ATOM 0 HA GLN A 12 -5.450 8.757 5.623 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -7.449 6.637 4.956 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -5.830 6.069 5.314 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -5.948 7.562 7.440 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -7.662 7.717 7.108 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -5.115 5.214 7.657 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -6.191 4.108 8.518 1.00 0.00 H new ATOM 200 N ALA A 13 -3.806 8.767 3.737 1.00 0.00 N ATOM 201 CA ALA A 13 -2.570 8.607 2.926 1.00 0.00 C ATOM 202 C ALA A 13 -1.400 9.322 3.693 1.00 0.00 C ATOM 203 O ALA A 13 -1.397 10.545 3.870 1.00 0.00 O ATOM 204 CB ALA A 13 -2.802 9.114 1.504 1.00 0.00 C ATOM 0 H ALA A 13 -3.817 9.631 4.280 1.00 0.00 H new ATOM 0 HA ALA A 13 -2.291 7.560 2.806 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -1.890 8.991 0.921 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -3.608 8.544 1.041 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -3.074 10.169 1.534 1.00 0.00 H new ATOM 210 N PHE A 14 -0.429 8.528 4.177 1.00 0.00 N ATOM 211 CA PHE A 14 0.704 8.977 5.042 1.00 0.00 C ATOM 212 C PHE A 14 2.077 8.323 4.618 1.00 0.00 C ATOM 213 O PHE A 14 2.231 7.779 3.524 1.00 0.00 O ATOM 214 CB PHE A 14 0.245 8.745 6.496 1.00 0.00 C ATOM 215 CG PHE A 14 -0.127 7.445 7.200 1.00 0.00 C ATOM 216 CD1 PHE A 14 0.513 6.236 6.918 1.00 0.00 C ATOM 217 CD2 PHE A 14 -0.797 7.602 8.422 1.00 0.00 C ATOM 218 CE1 PHE A 14 0.532 5.225 7.870 1.00 0.00 C ATOM 219 CE2 PHE A 14 -0.756 6.599 9.379 1.00 0.00 C ATOM 220 CZ PHE A 14 -0.063 5.428 9.114 1.00 0.00 C ATOM 0 H PHE A 14 -0.399 7.528 3.979 1.00 0.00 H new ATOM 0 HA PHE A 14 0.932 10.036 4.925 1.00 0.00 H new ATOM 0 HB2 PHE A 14 1.038 9.174 7.108 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -0.630 9.384 6.615 1.00 0.00 H new ATOM 0 HD1 PHE A 14 0.992 6.088 5.962 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -1.348 8.510 8.619 1.00 0.00 H new ATOM 0 HE1 PHE A 14 1.008 4.282 7.646 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -1.261 6.729 10.325 1.00 0.00 H new ATOM 0 HZ PHE A 14 0.016 4.668 9.877 1.00 0.00 H new ATOM 230 N ARG A 15 3.160 8.504 5.389 1.00 0.00 N ATOM 231 CA ARG A 15 4.495 7.932 5.067 1.00 0.00 C ATOM 232 C ARG A 15 4.685 6.496 5.675 1.00 0.00 C ATOM 233 O ARG A 15 4.785 6.314 6.898 1.00 0.00 O ATOM 234 CB ARG A 15 5.547 8.955 5.585 1.00 0.00 C ATOM 235 CG ARG A 15 6.956 8.829 4.934 1.00 0.00 C ATOM 236 CD ARG A 15 7.846 10.099 5.002 1.00 0.00 C ATOM 237 NE ARG A 15 7.203 11.278 4.348 1.00 0.00 N ATOM 238 CZ ARG A 15 7.080 11.442 3.034 1.00 0.00 C ATOM 239 NH1 ARG A 15 7.892 10.954 2.137 1.00 0.00 N ATOM 240 NH2 ARG A 15 6.064 12.126 2.618 1.00 0.00 N ATOM 0 H ARG A 15 3.145 9.047 6.252 1.00 0.00 H new ATOM 0 HA ARG A 15 4.610 7.785 3.993 1.00 0.00 H new ATOM 0 HB2 ARG A 15 5.170 9.963 5.410 1.00 0.00 H new ATOM 0 HB3 ARG A 15 5.649 8.836 6.664 1.00 0.00 H new ATOM 0 HG2 ARG A 15 7.487 8.009 5.418 1.00 0.00 H new ATOM 0 HG3 ARG A 15 6.829 8.553 3.887 1.00 0.00 H new ATOM 0 HD2 ARG A 15 8.058 10.336 6.045 1.00 0.00 H new ATOM 0 HD3 ARG A 15 8.802 9.896 4.520 1.00 0.00 H new ATOM 0 HE ARG A 15 6.831 12.010 4.953 1.00 0.00 H new ATOM 0 HH11 ARG A 15 8.696 10.397 2.426 1.00 0.00 H new ATOM 0 HH12 ARG A 15 7.722 11.129 1.147 1.00 0.00 H new ATOM 0 HH21 ARG A 15 5.400 12.512 3.289 1.00 0.00 H new ATOM 0 HH22 ARG A 15 5.927 12.279 1.619 1.00 0.00 H new ATOM 254 N ILE A 16 4.742 5.467 4.799 1.00 0.00 N ATOM 255 CA ILE A 16 5.033 4.057 5.230 1.00 0.00 C ATOM 256 C ILE A 16 6.564 3.885 4.889 1.00 0.00 C ATOM 257 O ILE A 16 7.026 3.992 3.739 1.00 0.00 O ATOM 258 CB ILE A 16 4.056 2.955 4.655 1.00 0.00 C ATOM 259 CG1 ILE A 16 4.264 2.587 3.161 1.00 0.00 C ATOM 260 CG2 ILE A 16 2.580 3.381 4.896 1.00 0.00 C ATOM 261 CD1 ILE A 16 3.412 1.422 2.617 1.00 0.00 C ATOM 0 H ILE A 16 4.593 5.572 3.795 1.00 0.00 H new ATOM 0 HA ILE A 16 4.839 3.895 6.290 1.00 0.00 H new ATOM 0 HB ILE A 16 4.300 2.046 5.204 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.057 3.472 2.559 1.00 0.00 H new ATOM 0 HG13 ILE A 16 5.315 2.340 3.013 1.00 0.00 H new ATOM 0 HG21 ILE A 16 1.911 2.618 4.498 1.00 0.00 H new ATOM 0 HG22 ILE A 16 2.404 3.495 5.966 1.00 0.00 H new ATOM 0 HG23 ILE A 16 2.388 4.329 4.394 1.00 0.00 H new ATOM 0 HD11 ILE A 16 3.646 1.260 1.565 1.00 0.00 H new ATOM 0 HD12 ILE A 16 3.632 0.516 3.181 1.00 0.00 H new ATOM 0 HD13 ILE A 16 2.355 1.666 2.720 1.00 0.00 H new ATOM 273 N TRP A 17 7.368 3.729 5.951 1.00 0.00 N ATOM 274 CA TRP A 17 8.856 3.740 5.857 1.00 0.00 C ATOM 275 C TRP A 17 9.529 2.788 6.899 1.00 0.00 C ATOM 276 O TRP A 17 8.877 1.898 7.431 1.00 0.00 O ATOM 277 CB TRP A 17 9.225 5.266 6.007 1.00 0.00 C ATOM 278 CG TRP A 17 9.322 5.882 7.421 1.00 0.00 C ATOM 279 CD1 TRP A 17 8.327 5.862 8.427 1.00 0.00 C ATOM 280 CD2 TRP A 17 10.445 6.433 8.024 1.00 0.00 C ATOM 281 NE1 TRP A 17 8.812 6.363 9.649 1.00 0.00 N ATOM 282 CE2 TRP A 17 10.126 6.703 9.378 1.00 0.00 C ATOM 283 CE3 TRP A 17 11.754 6.692 7.530 1.00 0.00 C ATOM 284 CZ2 TRP A 17 11.112 7.214 10.252 1.00 0.00 C ATOM 285 CZ3 TRP A 17 12.708 7.206 8.410 1.00 0.00 C ATOM 286 CH2 TRP A 17 12.392 7.463 9.750 1.00 0.00 C ATOM 0 H TRP A 17 7.019 3.592 6.899 1.00 0.00 H new ATOM 0 HA TRP A 17 9.236 3.340 4.917 1.00 0.00 H new ATOM 0 HB2 TRP A 17 10.185 5.421 5.515 1.00 0.00 H new ATOM 0 HB3 TRP A 17 8.484 5.839 5.449 1.00 0.00 H new ATOM 0 HD1 TRP A 17 7.319 5.506 8.275 1.00 0.00 H new ATOM 0 HE1 TRP A 17 8.310 6.455 10.532 1.00 0.00 H new ATOM 0 HE3 TRP A 17 12.004 6.495 6.498 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 10.880 7.408 11.289 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 13.706 7.409 8.052 1.00 0.00 H new ATOM 0 HH2 TRP A 17 13.151 7.861 10.407 1.00 0.00 H new ATOM 297 N ASP A 18 10.837 2.902 7.175 1.00 0.00 N ATOM 298 CA ASP A 18 11.474 2.199 8.314 1.00 0.00 C ATOM 299 C ASP A 18 12.640 3.136 8.798 1.00 0.00 C ATOM 300 O ASP A 18 13.348 3.831 8.036 1.00 0.00 O ATOM 301 CB ASP A 18 11.834 0.712 8.013 1.00 0.00 C ATOM 302 CG ASP A 18 13.204 0.327 7.478 1.00 0.00 C ATOM 303 OD1 ASP A 18 14.221 0.609 8.152 1.00 0.00 O ATOM 304 OD2 ASP A 18 13.270 -0.288 6.393 1.00 0.00 O ATOM 0 H ASP A 18 11.480 3.474 6.628 1.00 0.00 H new ATOM 0 HA ASP A 18 10.784 2.051 9.145 1.00 0.00 H new ATOM 0 HB2 ASP A 18 11.685 0.155 8.938 1.00 0.00 H new ATOM 0 HB3 ASP A 18 11.098 0.345 7.298 1.00 0.00 H new ATOM 309 N VAL A 19 12.772 3.102 10.136 1.00 0.00 N ATOM 310 CA VAL A 19 13.714 3.957 10.935 1.00 0.00 C ATOM 311 C VAL A 19 15.228 3.912 10.518 1.00 0.00 C ATOM 312 O VAL A 19 15.938 4.861 10.866 1.00 0.00 O ATOM 313 CB VAL A 19 13.456 3.603 12.453 1.00 0.00 C ATOM 314 CG1 VAL A 19 14.523 4.075 13.473 1.00 0.00 C ATOM 315 CG2 VAL A 19 12.123 4.218 12.954 1.00 0.00 C ATOM 0 H VAL A 19 12.222 2.471 10.719 1.00 0.00 H new ATOM 0 HA VAL A 19 13.493 5.004 10.727 1.00 0.00 H new ATOM 0 HB VAL A 19 13.465 2.513 12.429 1.00 0.00 H new ATOM 0 HG11 VAL A 19 14.227 3.769 14.477 1.00 0.00 H new ATOM 0 HG12 VAL A 19 15.486 3.627 13.226 1.00 0.00 H new ATOM 0 HG13 VAL A 19 14.608 5.161 13.435 1.00 0.00 H new ATOM 0 HG21 VAL A 19 11.973 3.957 14.002 1.00 0.00 H new ATOM 0 HG22 VAL A 19 12.162 5.303 12.852 1.00 0.00 H new ATOM 0 HG23 VAL A 19 11.296 3.827 12.361 1.00 0.00 H new ATOM 325 N ASN A 20 15.757 2.906 9.792 1.00 0.00 N ATOM 326 CA ASN A 20 17.170 2.945 9.292 1.00 0.00 C ATOM 327 C ASN A 20 17.330 3.789 7.962 1.00 0.00 C ATOM 328 O ASN A 20 18.196 3.496 7.133 1.00 0.00 O ATOM 329 CB ASN A 20 17.628 1.465 9.118 1.00 0.00 C ATOM 330 CG ASN A 20 17.831 0.651 10.402 1.00 0.00 C ATOM 331 OD1 ASN A 20 17.061 -0.241 10.738 1.00 0.00 O ATOM 332 ND2 ASN A 20 18.881 0.902 11.150 1.00 0.00 N ATOM 0 H ASN A 20 15.245 2.062 9.535 1.00 0.00 H new ATOM 0 HA ASN A 20 17.807 3.460 10.011 1.00 0.00 H new ATOM 0 HB2 ASN A 20 16.890 0.951 8.502 1.00 0.00 H new ATOM 0 HB3 ASN A 20 18.565 1.462 8.562 1.00 0.00 H new ATOM 0 HD21 ASN A 20 19.046 0.358 11.997 1.00 0.00 H new ATOM 0 HD22 ASN A 20 19.532 1.641 10.884 1.00 0.00 H new ATOM 339 N GLN A 21 16.566 4.902 7.823 1.00 0.00 N ATOM 340 CA GLN A 21 16.510 5.802 6.624 1.00 0.00 C ATOM 341 C GLN A 21 16.127 5.001 5.340 1.00 0.00 C ATOM 342 O GLN A 21 16.896 4.868 4.384 1.00 0.00 O ATOM 343 CB GLN A 21 17.825 6.630 6.485 1.00 0.00 C ATOM 344 CG GLN A 21 18.014 7.770 7.523 1.00 0.00 C ATOM 345 CD GLN A 21 16.941 8.869 7.518 1.00 0.00 C ATOM 346 OE1 GLN A 21 16.043 8.902 8.352 1.00 0.00 O ATOM 347 NE2 GLN A 21 16.976 9.785 6.579 1.00 0.00 N ATOM 0 H GLN A 21 15.944 5.217 8.568 1.00 0.00 H new ATOM 0 HA GLN A 21 15.713 6.533 6.765 1.00 0.00 H new ATOM 0 HB2 GLN A 21 18.672 5.948 6.563 1.00 0.00 H new ATOM 0 HB3 GLN A 21 17.856 7.064 5.486 1.00 0.00 H new ATOM 0 HG2 GLN A 21 18.047 7.327 8.518 1.00 0.00 H new ATOM 0 HG3 GLN A 21 18.984 8.236 7.349 1.00 0.00 H new ATOM 0 HE21 GLN A 21 17.718 9.769 5.879 1.00 0.00 H new ATOM 0 HE22 GLN A 21 16.262 10.513 6.549 1.00 0.00 H new ATOM 356 N LYS A 22 14.898 4.464 5.345 1.00 0.00 N ATOM 357 CA LYS A 22 14.360 3.603 4.279 1.00 0.00 C ATOM 358 C LYS A 22 12.854 4.000 4.164 1.00 0.00 C ATOM 359 O LYS A 22 12.171 4.291 5.144 1.00 0.00 O ATOM 360 CB LYS A 22 14.592 2.137 4.749 1.00 0.00 C ATOM 361 CG LYS A 22 16.040 1.606 4.588 1.00 0.00 C ATOM 362 CD LYS A 22 16.202 0.221 5.238 1.00 0.00 C ATOM 363 CE LYS A 22 17.661 -0.194 5.452 1.00 0.00 C ATOM 364 NZ LYS A 22 17.646 -1.521 6.118 1.00 0.00 N ATOM 0 H LYS A 22 14.236 4.619 6.105 1.00 0.00 H new ATOM 0 HA LYS A 22 14.823 3.709 3.298 1.00 0.00 H new ATOM 0 HB2 LYS A 22 14.311 2.062 5.799 1.00 0.00 H new ATOM 0 HB3 LYS A 22 13.920 1.484 4.191 1.00 0.00 H new ATOM 0 HG2 LYS A 22 16.292 1.545 3.529 1.00 0.00 H new ATOM 0 HG3 LYS A 22 16.740 2.308 5.042 1.00 0.00 H new ATOM 0 HD2 LYS A 22 15.689 0.219 6.199 1.00 0.00 H new ATOM 0 HD3 LYS A 22 15.710 -0.524 4.612 1.00 0.00 H new ATOM 0 HE2 LYS A 22 18.190 -0.247 4.500 1.00 0.00 H new ATOM 0 HE3 LYS A 22 18.184 0.539 6.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 18.611 -1.907 6.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 17.288 -1.418 7.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 17.028 -2.168 5.588 1.00 0.00 H new ATOM 378 N THR A 23 12.347 4.043 2.945 1.00 0.00 N ATOM 379 CA THR A 23 10.986 4.548 2.596 1.00 0.00 C ATOM 380 C THR A 23 10.351 3.725 1.424 1.00 0.00 C ATOM 381 O THR A 23 11.048 3.154 0.576 1.00 0.00 O ATOM 382 CB THR A 23 11.085 6.068 2.196 1.00 0.00 C ATOM 383 OG1 THR A 23 12.059 6.258 1.179 1.00 0.00 O ATOM 384 CG2 THR A 23 11.504 7.030 3.324 1.00 0.00 C ATOM 0 H THR A 23 12.869 3.723 2.129 1.00 0.00 H new ATOM 0 HA THR A 23 10.341 4.433 3.467 1.00 0.00 H new ATOM 0 HB THR A 23 10.066 6.304 1.888 1.00 0.00 H new ATOM 0 HG1 THR A 23 11.686 5.986 0.314 1.00 0.00 H new ATOM 0 HG21 THR A 23 11.540 8.049 2.939 1.00 0.00 H new ATOM 0 HG22 THR A 23 10.780 6.975 4.137 1.00 0.00 H new ATOM 0 HG23 THR A 23 12.489 6.748 3.696 1.00 0.00 H new ATOM 392 N PHE A 24 9.006 3.685 1.351 1.00 0.00 N ATOM 393 CA PHE A 24 8.278 3.055 0.207 1.00 0.00 C ATOM 394 C PHE A 24 7.961 4.175 -0.846 1.00 0.00 C ATOM 395 O PHE A 24 7.180 5.085 -0.542 1.00 0.00 O ATOM 396 CB PHE A 24 7.009 2.410 0.816 1.00 0.00 C ATOM 397 CG PHE A 24 6.122 1.580 -0.121 1.00 0.00 C ATOM 398 CD1 PHE A 24 5.129 2.200 -0.890 1.00 0.00 C ATOM 399 CD2 PHE A 24 6.217 0.186 -0.118 1.00 0.00 C ATOM 400 CE1 PHE A 24 4.241 1.433 -1.640 1.00 0.00 C ATOM 401 CE2 PHE A 24 5.325 -0.578 -0.862 1.00 0.00 C ATOM 402 CZ PHE A 24 4.340 0.044 -1.627 1.00 0.00 C ATOM 0 H PHE A 24 8.393 4.078 2.065 1.00 0.00 H new ATOM 0 HA PHE A 24 8.850 2.287 -0.314 1.00 0.00 H new ATOM 0 HB2 PHE A 24 7.319 1.770 1.642 1.00 0.00 H new ATOM 0 HB3 PHE A 24 6.398 3.206 1.242 1.00 0.00 H new ATOM 0 HD1 PHE A 24 5.052 3.277 -0.901 1.00 0.00 H new ATOM 0 HD2 PHE A 24 6.986 -0.300 0.464 1.00 0.00 H new ATOM 0 HE1 PHE A 24 3.476 1.915 -2.231 1.00 0.00 H new ATOM 0 HE2 PHE A 24 5.396 -1.656 -0.847 1.00 0.00 H new ATOM 0 HZ PHE A 24 3.653 -0.552 -2.210 1.00 0.00 H new ATOM 412 N TYR A 25 8.537 4.136 -2.069 1.00 0.00 N ATOM 413 CA TYR A 25 8.350 5.251 -3.053 1.00 0.00 C ATOM 414 C TYR A 25 8.523 4.871 -4.557 1.00 0.00 C ATOM 415 O TYR A 25 9.337 4.028 -4.934 1.00 0.00 O ATOM 416 CB TYR A 25 9.354 6.386 -2.698 1.00 0.00 C ATOM 417 CG TYR A 25 10.877 6.190 -2.826 1.00 0.00 C ATOM 418 CD1 TYR A 25 11.583 5.569 -1.797 1.00 0.00 C ATOM 419 CD2 TYR A 25 11.582 6.786 -3.876 1.00 0.00 C ATOM 420 CE1 TYR A 25 12.973 5.587 -1.784 1.00 0.00 C ATOM 421 CE2 TYR A 25 12.974 6.822 -3.854 1.00 0.00 C ATOM 422 CZ TYR A 25 13.667 6.244 -2.794 1.00 0.00 C ATOM 423 OH TYR A 25 15.027 6.369 -2.723 1.00 0.00 O ATOM 0 H TYR A 25 9.122 3.370 -2.402 1.00 0.00 H new ATOM 0 HA TYR A 25 7.308 5.556 -2.960 1.00 0.00 H new ATOM 0 HB2 TYR A 25 9.093 7.244 -3.318 1.00 0.00 H new ATOM 0 HB3 TYR A 25 9.158 6.669 -1.664 1.00 0.00 H new ATOM 0 HD1 TYR A 25 11.046 5.070 -1.004 1.00 0.00 H new ATOM 0 HD2 TYR A 25 11.045 7.220 -4.707 1.00 0.00 H new ATOM 0 HE1 TYR A 25 13.513 5.091 -0.991 1.00 0.00 H new ATOM 0 HE2 TYR A 25 13.515 7.298 -4.658 1.00 0.00 H new ATOM 0 HH TYR A 25 15.300 7.212 -3.141 1.00 0.00 H new ATOM 433 N LEU A 26 7.768 5.560 -5.428 1.00 0.00 N ATOM 434 CA LEU A 26 7.832 5.385 -6.903 1.00 0.00 C ATOM 435 C LEU A 26 8.621 6.562 -7.577 1.00 0.00 C ATOM 436 O LEU A 26 8.444 7.733 -7.227 1.00 0.00 O ATOM 437 CB LEU A 26 6.367 5.258 -7.438 1.00 0.00 C ATOM 438 CG LEU A 26 5.481 6.527 -7.615 1.00 0.00 C ATOM 439 CD1 LEU A 26 4.122 6.171 -8.243 1.00 0.00 C ATOM 440 CD2 LEU A 26 5.206 7.303 -6.313 1.00 0.00 C ATOM 0 H LEU A 26 7.088 6.261 -5.134 1.00 0.00 H new ATOM 0 HA LEU A 26 8.381 4.478 -7.157 1.00 0.00 H new ATOM 0 HB2 LEU A 26 6.420 4.764 -8.408 1.00 0.00 H new ATOM 0 HB3 LEU A 26 5.835 4.585 -6.766 1.00 0.00 H new ATOM 0 HG LEU A 26 6.067 7.172 -8.270 1.00 0.00 H new ATOM 0 HD11 LEU A 26 3.525 7.076 -8.355 1.00 0.00 H new ATOM 0 HD12 LEU A 26 4.281 5.718 -9.222 1.00 0.00 H new ATOM 0 HD13 LEU A 26 3.597 5.467 -7.598 1.00 0.00 H new ATOM 0 HD21 LEU A 26 4.582 8.170 -6.531 1.00 0.00 H new ATOM 0 HD22 LEU A 26 4.691 6.654 -5.605 1.00 0.00 H new ATOM 0 HD23 LEU A 26 6.150 7.635 -5.881 1.00 0.00 H new ATOM 452 N ARG A 27 9.489 6.257 -8.557 1.00 0.00 N ATOM 453 CA ARG A 27 10.231 7.302 -9.335 1.00 0.00 C ATOM 454 C ARG A 27 9.493 7.502 -10.705 1.00 0.00 C ATOM 455 O ARG A 27 8.954 8.585 -10.938 1.00 0.00 O ATOM 456 CB ARG A 27 11.744 6.922 -9.441 1.00 0.00 C ATOM 457 CG ARG A 27 12.748 8.091 -9.257 1.00 0.00 C ATOM 458 CD ARG A 27 12.646 9.213 -10.309 1.00 0.00 C ATOM 459 NE ARG A 27 13.666 10.266 -10.042 1.00 0.00 N ATOM 460 CZ ARG A 27 13.761 11.426 -10.695 1.00 0.00 C ATOM 461 NH1 ARG A 27 12.940 11.788 -11.650 1.00 0.00 N ATOM 462 NH2 ARG A 27 14.716 12.250 -10.371 1.00 0.00 N ATOM 0 H ARG A 27 9.704 5.301 -8.840 1.00 0.00 H new ATOM 0 HA ARG A 27 10.228 8.269 -8.833 1.00 0.00 H new ATOM 0 HB2 ARG A 27 11.961 6.160 -8.692 1.00 0.00 H new ATOM 0 HB3 ARG A 27 11.918 6.469 -10.417 1.00 0.00 H new ATOM 0 HG2 ARG A 27 12.598 8.526 -8.269 1.00 0.00 H new ATOM 0 HG3 ARG A 27 13.760 7.687 -9.277 1.00 0.00 H new ATOM 0 HD2 ARG A 27 12.793 8.800 -11.307 1.00 0.00 H new ATOM 0 HD3 ARG A 27 11.648 9.650 -10.289 1.00 0.00 H new ATOM 0 HE ARG A 27 14.345 10.086 -9.302 1.00 0.00 H new ATOM 0 HH11 ARG A 27 12.179 11.170 -11.930 1.00 0.00 H new ATOM 0 HH12 ARG A 27 13.062 12.688 -12.114 1.00 0.00 H new ATOM 0 HH21 ARG A 27 15.373 12.003 -9.631 1.00 0.00 H new ATOM 0 HH22 ARG A 27 14.807 13.142 -10.857 1.00 0.00 H new ATOM 476 N ASN A 28 9.439 6.482 -11.588 1.00 0.00 N ATOM 477 CA ASN A 28 8.625 6.522 -12.843 1.00 0.00 C ATOM 478 C ASN A 28 7.637 5.298 -12.828 1.00 0.00 C ATOM 479 O ASN A 28 7.781 4.339 -13.587 1.00 0.00 O ATOM 480 CB ASN A 28 9.565 6.609 -14.086 1.00 0.00 C ATOM 481 CG ASN A 28 10.685 5.568 -14.278 1.00 0.00 C ATOM 482 OD1 ASN A 28 10.478 4.445 -14.719 1.00 0.00 O ATOM 483 ND2 ASN A 28 11.915 5.909 -13.979 1.00 0.00 N ATOM 0 H ASN A 28 9.951 5.609 -11.461 1.00 0.00 H new ATOM 0 HA ASN A 28 8.006 7.417 -12.905 1.00 0.00 H new ATOM 0 HB2 ASN A 28 8.933 6.573 -14.974 1.00 0.00 H new ATOM 0 HB3 ASN A 28 10.035 7.592 -14.069 1.00 0.00 H new ATOM 0 HD21 ASN A 28 12.676 5.244 -14.115 1.00 0.00 H new ATOM 0 HD22 ASN A 28 12.111 6.840 -13.610 1.00 0.00 H new ATOM 490 N ASN A 29 6.622 5.328 -11.927 1.00 0.00 N ATOM 491 CA ASN A 29 5.605 4.227 -11.732 1.00 0.00 C ATOM 492 C ASN A 29 6.202 2.803 -11.379 1.00 0.00 C ATOM 493 O ASN A 29 5.598 1.773 -11.692 1.00 0.00 O ATOM 494 CB ASN A 29 4.658 4.173 -12.977 1.00 0.00 C ATOM 495 CG ASN A 29 3.731 5.382 -13.152 1.00 0.00 C ATOM 496 OD1 ASN A 29 4.058 6.363 -13.809 1.00 0.00 O ATOM 497 ND2 ASN A 29 2.552 5.361 -12.576 1.00 0.00 N ATOM 0 H ASN A 29 6.473 6.120 -11.302 1.00 0.00 H new ATOM 0 HA ASN A 29 5.038 4.488 -10.838 1.00 0.00 H new ATOM 0 HB2 ASN A 29 5.270 4.073 -13.873 1.00 0.00 H new ATOM 0 HB3 ASN A 29 4.045 3.274 -12.907 1.00 0.00 H new ATOM 0 HD21 ASN A 29 1.920 6.155 -12.678 1.00 0.00 H new ATOM 0 HD22 ASN A 29 2.267 4.550 -12.026 1.00 0.00 H new ATOM 504 N GLN A 30 7.299 2.743 -10.600 1.00 0.00 N ATOM 505 CA GLN A 30 8.008 1.459 -10.273 1.00 0.00 C ATOM 506 C GLN A 30 7.785 0.799 -8.876 1.00 0.00 C ATOM 507 O GLN A 30 8.070 -0.387 -8.702 1.00 0.00 O ATOM 508 CB GLN A 30 9.531 1.760 -10.409 1.00 0.00 C ATOM 509 CG GLN A 30 10.088 2.167 -11.800 1.00 0.00 C ATOM 510 CD GLN A 30 11.391 2.963 -11.682 1.00 0.00 C ATOM 511 OE1 GLN A 30 11.391 4.123 -11.279 1.00 0.00 O ATOM 512 NE2 GLN A 30 12.525 2.378 -11.982 1.00 0.00 N ATOM 0 H GLN A 30 7.727 3.566 -10.176 1.00 0.00 H new ATOM 0 HA GLN A 30 7.584 0.729 -10.963 1.00 0.00 H new ATOM 0 HB2 GLN A 30 9.774 2.559 -9.709 1.00 0.00 H new ATOM 0 HB3 GLN A 30 10.074 0.873 -10.082 1.00 0.00 H new ATOM 0 HG2 GLN A 30 10.262 1.272 -12.398 1.00 0.00 H new ATOM 0 HG3 GLN A 30 9.345 2.764 -12.329 1.00 0.00 H new ATOM 0 HE21 GLN A 30 12.529 1.415 -12.317 1.00 0.00 H new ATOM 0 HE22 GLN A 30 13.404 2.886 -11.880 1.00 0.00 H new ATOM 521 N LEU A 31 7.360 1.600 -7.898 1.00 0.00 N ATOM 522 CA LEU A 31 7.170 1.220 -6.452 1.00 0.00 C ATOM 523 C LEU A 31 8.438 0.492 -5.856 1.00 0.00 C ATOM 524 O LEU A 31 8.490 -0.737 -5.726 1.00 0.00 O ATOM 525 CB LEU A 31 5.879 0.374 -6.279 1.00 0.00 C ATOM 526 CG LEU A 31 4.523 1.050 -6.626 1.00 0.00 C ATOM 527 CD1 LEU A 31 3.409 -0.001 -6.769 1.00 0.00 C ATOM 528 CD2 LEU A 31 4.103 2.093 -5.574 1.00 0.00 C ATOM 0 H LEU A 31 7.122 2.576 -8.074 1.00 0.00 H new ATOM 0 HA LEU A 31 7.051 2.139 -5.878 1.00 0.00 H new ATOM 0 HB2 LEU A 31 5.977 -0.519 -6.897 1.00 0.00 H new ATOM 0 HB3 LEU A 31 5.832 0.040 -5.242 1.00 0.00 H new ATOM 0 HG LEU A 31 4.668 1.565 -7.576 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.469 0.495 -7.012 1.00 0.00 H new ATOM 0 HD12 LEU A 31 3.667 -0.699 -7.566 1.00 0.00 H new ATOM 0 HD13 LEU A 31 3.300 -0.545 -5.831 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.150 2.537 -5.862 1.00 0.00 H new ATOM 0 HD22 LEU A 31 3.999 1.609 -4.603 1.00 0.00 H new ATOM 0 HD23 LEU A 31 4.862 2.873 -5.512 1.00 0.00 H new ATOM 540 N VAL A 32 9.466 1.301 -5.555 1.00 0.00 N ATOM 541 CA VAL A 32 10.816 0.837 -5.096 1.00 0.00 C ATOM 542 C VAL A 32 10.901 0.888 -3.521 1.00 0.00 C ATOM 543 O VAL A 32 10.028 1.420 -2.819 1.00 0.00 O ATOM 544 CB VAL A 32 11.945 1.624 -5.876 1.00 0.00 C ATOM 545 CG1 VAL A 32 13.330 0.938 -5.751 1.00 0.00 C ATOM 546 CG2 VAL A 32 11.710 1.745 -7.409 1.00 0.00 C ATOM 0 H VAL A 32 9.397 2.317 -5.620 1.00 0.00 H new ATOM 0 HA VAL A 32 10.982 -0.211 -5.344 1.00 0.00 H new ATOM 0 HB VAL A 32 11.913 2.607 -5.406 1.00 0.00 H new ATOM 0 HG11 VAL A 32 14.073 1.514 -6.303 1.00 0.00 H new ATOM 0 HG12 VAL A 32 13.617 0.887 -4.701 1.00 0.00 H new ATOM 0 HG13 VAL A 32 13.275 -0.070 -6.162 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.533 2.299 -7.861 1.00 0.00 H new ATOM 0 HG22 VAL A 32 11.658 0.749 -7.849 1.00 0.00 H new ATOM 0 HG23 VAL A 32 10.774 2.272 -7.593 1.00 0.00 H new ATOM 556 N ALA A 33 11.948 0.255 -2.962 1.00 0.00 N ATOM 557 CA ALA A 33 12.062 -0.006 -1.511 1.00 0.00 C ATOM 558 C ALA A 33 13.296 0.536 -0.794 1.00 0.00 C ATOM 559 O ALA A 33 14.437 0.308 -1.203 1.00 0.00 O ATOM 560 CB ALA A 33 12.214 -1.530 -1.388 1.00 0.00 C ATOM 0 H ALA A 33 12.741 -0.091 -3.502 1.00 0.00 H new ATOM 0 HA ALA A 33 11.194 0.475 -1.060 1.00 0.00 H new ATOM 0 HB1 ALA A 33 12.305 -1.803 -0.337 1.00 0.00 H new ATOM 0 HB2 ALA A 33 11.339 -2.019 -1.816 1.00 0.00 H new ATOM 0 HB3 ALA A 33 13.107 -1.851 -1.924 1.00 0.00 H new ATOM 566 N GLY A 34 13.071 1.071 0.406 1.00 0.00 N ATOM 567 CA GLY A 34 14.176 1.526 1.251 1.00 0.00 C ATOM 568 C GLY A 34 14.814 2.798 0.720 1.00 0.00 C ATOM 569 O GLY A 34 14.407 3.898 1.075 1.00 0.00 O ATOM 0 H GLY A 34 12.144 1.199 0.812 1.00 0.00 H new ATOM 0 HA2 GLY A 34 13.810 1.699 2.263 1.00 0.00 H new ATOM 0 HA3 GLY A 34 14.930 0.742 1.314 1.00 0.00 H new ATOM 573 N TYR A 35 15.869 2.645 -0.063 1.00 0.00 N ATOM 574 CA TYR A 35 16.546 3.831 -0.646 1.00 0.00 C ATOM 575 C TYR A 35 17.296 3.364 -1.936 1.00 0.00 C ATOM 576 O TYR A 35 18.413 2.848 -1.826 1.00 0.00 O ATOM 577 CB TYR A 35 17.508 4.555 0.371 1.00 0.00 C ATOM 578 CG TYR A 35 17.066 5.863 1.104 1.00 0.00 C ATOM 579 CD1 TYR A 35 15.824 6.506 0.960 1.00 0.00 C ATOM 580 CD2 TYR A 35 18.022 6.452 1.946 1.00 0.00 C ATOM 581 CE1 TYR A 35 15.535 7.677 1.655 1.00 0.00 C ATOM 582 CE2 TYR A 35 17.738 7.633 2.630 1.00 0.00 C ATOM 583 CZ TYR A 35 16.495 8.238 2.490 1.00 0.00 C ATOM 584 OH TYR A 35 16.211 9.393 3.166 1.00 0.00 O ATOM 0 H TYR A 35 16.279 1.746 -0.315 1.00 0.00 H new ATOM 0 HA TYR A 35 15.798 4.583 -0.897 1.00 0.00 H new ATOM 0 HB2 TYR A 35 17.764 3.828 1.142 1.00 0.00 H new ATOM 0 HB3 TYR A 35 18.427 4.786 -0.168 1.00 0.00 H new ATOM 0 HD1 TYR A 35 15.081 6.084 0.299 1.00 0.00 H new ATOM 0 HD2 TYR A 35 18.988 5.985 2.065 1.00 0.00 H new ATOM 0 HE1 TYR A 35 14.569 8.148 1.546 1.00 0.00 H new ATOM 0 HE2 TYR A 35 18.485 8.078 3.270 1.00 0.00 H new ATOM 0 HH TYR A 35 16.985 9.654 3.707 1.00 0.00 H new ATOM 594 N LEU A 36 16.788 3.692 -3.145 1.00 0.00 N ATOM 595 CA LEU A 36 17.433 3.253 -4.426 1.00 0.00 C ATOM 596 C LEU A 36 18.770 3.995 -4.826 1.00 0.00 C ATOM 597 O LEU A 36 19.660 4.187 -3.992 1.00 0.00 O ATOM 598 CB LEU A 36 16.257 3.357 -5.474 1.00 0.00 C ATOM 599 CG LEU A 36 15.406 4.658 -5.686 1.00 0.00 C ATOM 600 CD1 LEU A 36 16.165 5.992 -5.819 1.00 0.00 C ATOM 601 CD2 LEU A 36 14.487 4.523 -6.908 1.00 0.00 C ATOM 0 H LEU A 36 15.945 4.252 -3.272 1.00 0.00 H new ATOM 0 HA LEU A 36 17.835 2.243 -4.349 1.00 0.00 H new ATOM 0 HB2 LEU A 36 16.686 3.108 -6.444 1.00 0.00 H new ATOM 0 HB3 LEU A 36 15.551 2.564 -5.225 1.00 0.00 H new ATOM 0 HG LEU A 36 14.857 4.722 -4.746 1.00 0.00 H new ATOM 0 HD11 LEU A 36 15.452 6.804 -5.961 1.00 0.00 H new ATOM 0 HD12 LEU A 36 16.745 6.172 -4.914 1.00 0.00 H new ATOM 0 HD13 LEU A 36 16.836 5.945 -6.677 1.00 0.00 H new ATOM 0 HD21 LEU A 36 13.909 5.439 -7.031 1.00 0.00 H new ATOM 0 HD22 LEU A 36 15.090 4.352 -7.800 1.00 0.00 H new ATOM 0 HD23 LEU A 36 13.809 3.683 -6.762 1.00 0.00 H new ATOM 613 N GLN A 37 18.913 4.472 -6.068 1.00 0.00 N ATOM 614 CA GLN A 37 20.149 5.142 -6.567 1.00 0.00 C ATOM 615 C GLN A 37 20.103 6.693 -6.354 1.00 0.00 C ATOM 616 O GLN A 37 20.058 7.479 -7.306 1.00 0.00 O ATOM 617 CB GLN A 37 20.303 4.722 -8.059 1.00 0.00 C ATOM 618 CG GLN A 37 20.711 3.239 -8.287 1.00 0.00 C ATOM 619 CD GLN A 37 20.555 2.766 -9.734 1.00 0.00 C ATOM 620 OE1 GLN A 37 21.401 3.003 -10.590 1.00 0.00 O ATOM 621 NE2 GLN A 37 19.485 2.079 -10.056 1.00 0.00 N ATOM 0 H GLN A 37 18.176 4.410 -6.771 1.00 0.00 H new ATOM 0 HA GLN A 37 21.027 4.828 -6.003 1.00 0.00 H new ATOM 0 HB2 GLN A 37 19.359 4.906 -8.572 1.00 0.00 H new ATOM 0 HB3 GLN A 37 21.050 5.364 -8.526 1.00 0.00 H new ATOM 0 HG2 GLN A 37 21.749 3.108 -7.983 1.00 0.00 H new ATOM 0 HG3 GLN A 37 20.106 2.603 -7.640 1.00 0.00 H new ATOM 0 HE21 GLN A 37 18.777 1.878 -9.350 1.00 0.00 H new ATOM 0 HE22 GLN A 37 19.361 1.746 -11.012 1.00 0.00 H new ATOM 630 N GLY A 38 20.158 7.126 -5.079 1.00 0.00 N ATOM 631 CA GLY A 38 20.178 8.568 -4.721 1.00 0.00 C ATOM 632 C GLY A 38 18.816 9.312 -4.669 1.00 0.00 C ATOM 633 O GLY A 38 18.392 9.773 -5.733 1.00 0.00 O ATOM 0 H GLY A 38 20.190 6.500 -4.274 1.00 0.00 H new ATOM 0 HA2 GLY A 38 20.652 8.666 -3.744 1.00 0.00 H new ATOM 0 HA3 GLY A 38 20.816 9.084 -5.438 1.00 0.00 H new ATOM 637 N PRO A 39 18.126 9.515 -3.503 1.00 0.00 N ATOM 638 CA PRO A 39 16.869 10.326 -3.429 1.00 0.00 C ATOM 639 C PRO A 39 17.019 11.804 -3.934 1.00 0.00 C ATOM 640 O PRO A 39 18.124 12.362 -3.906 1.00 0.00 O ATOM 641 CB PRO A 39 16.512 10.256 -1.928 1.00 0.00 C ATOM 642 CG PRO A 39 17.245 9.027 -1.389 1.00 0.00 C ATOM 643 CD PRO A 39 18.537 8.960 -2.199 1.00 0.00 C ATOM 0 HA PRO A 39 16.095 9.935 -4.090 1.00 0.00 H new ATOM 0 HB2 PRO A 39 16.827 11.160 -1.407 1.00 0.00 H new ATOM 0 HB3 PRO A 39 15.435 10.165 -1.785 1.00 0.00 H new ATOM 0 HG2 PRO A 39 17.451 9.124 -0.323 1.00 0.00 H new ATOM 0 HG3 PRO A 39 16.650 8.123 -1.517 1.00 0.00 H new ATOM 0 HD2 PRO A 39 19.334 9.547 -1.741 1.00 0.00 H new ATOM 0 HD3 PRO A 39 18.906 7.938 -2.291 1.00 0.00 H new ATOM 651 N ASN A 40 15.942 12.441 -4.440 1.00 0.00 N ATOM 652 CA ASN A 40 16.040 13.816 -5.003 1.00 0.00 C ATOM 653 C ASN A 40 14.925 14.685 -4.345 1.00 0.00 C ATOM 654 O ASN A 40 15.196 15.370 -3.357 1.00 0.00 O ATOM 655 CB ASN A 40 15.999 13.755 -6.574 1.00 0.00 C ATOM 656 CG ASN A 40 16.885 12.758 -7.343 1.00 0.00 C ATOM 657 OD1 ASN A 40 16.398 11.977 -8.158 1.00 0.00 O ATOM 658 ND2 ASN A 40 18.178 12.742 -7.133 1.00 0.00 N ATOM 0 H ASN A 40 15.006 12.038 -4.473 1.00 0.00 H new ATOM 0 HA ASN A 40 16.991 14.293 -4.769 1.00 0.00 H new ATOM 0 HB2 ASN A 40 14.967 13.555 -6.861 1.00 0.00 H new ATOM 0 HB3 ASN A 40 16.244 14.752 -6.941 1.00 0.00 H new ATOM 0 HD21 ASN A 40 18.769 12.086 -7.643 1.00 0.00 H new ATOM 0 HD22 ASN A 40 18.593 13.385 -6.459 1.00 0.00 H new ATOM 665 N VAL A 41 13.684 14.646 -4.865 1.00 0.00 N ATOM 666 CA VAL A 41 12.534 15.452 -4.368 1.00 0.00 C ATOM 667 C VAL A 41 11.224 14.934 -5.066 1.00 0.00 C ATOM 668 O VAL A 41 11.246 14.492 -6.221 1.00 0.00 O ATOM 669 CB VAL A 41 12.789 16.986 -4.622 1.00 0.00 C ATOM 670 CG1 VAL A 41 12.875 17.406 -6.109 1.00 0.00 C ATOM 671 CG2 VAL A 41 11.789 17.878 -3.867 1.00 0.00 C ATOM 0 H VAL A 41 13.440 14.047 -5.654 1.00 0.00 H new ATOM 0 HA VAL A 41 12.419 15.334 -3.291 1.00 0.00 H new ATOM 0 HB VAL A 41 13.787 17.147 -4.215 1.00 0.00 H new ATOM 0 HG11 VAL A 41 13.052 18.480 -6.174 1.00 0.00 H new ATOM 0 HG12 VAL A 41 13.695 16.873 -6.591 1.00 0.00 H new ATOM 0 HG13 VAL A 41 11.939 17.162 -6.611 1.00 0.00 H new ATOM 0 HG21 VAL A 41 12.007 18.926 -4.075 1.00 0.00 H new ATOM 0 HG22 VAL A 41 10.775 17.646 -4.194 1.00 0.00 H new ATOM 0 HG23 VAL A 41 11.875 17.695 -2.796 1.00 0.00 H new ATOM 681 N ASN A 42 10.079 14.975 -4.355 1.00 0.00 N ATOM 682 CA ASN A 42 8.721 14.564 -4.866 1.00 0.00 C ATOM 683 C ASN A 42 8.488 13.025 -5.075 1.00 0.00 C ATOM 684 O ASN A 42 7.330 12.621 -4.954 1.00 0.00 O ATOM 685 CB ASN A 42 8.314 15.323 -6.173 1.00 0.00 C ATOM 686 CG ASN A 42 8.155 16.840 -6.033 1.00 0.00 C ATOM 687 OD1 ASN A 42 9.055 17.621 -6.321 1.00 0.00 O ATOM 688 ND2 ASN A 42 7.011 17.311 -5.595 1.00 0.00 N ATOM 0 H ASN A 42 10.054 15.299 -3.388 1.00 0.00 H new ATOM 0 HA ASN A 42 8.074 14.856 -4.039 1.00 0.00 H new ATOM 0 HB2 ASN A 42 9.065 15.123 -6.937 1.00 0.00 H new ATOM 0 HB3 ASN A 42 7.373 14.909 -6.535 1.00 0.00 H new ATOM 0 HD21 ASN A 42 6.878 18.318 -5.497 1.00 0.00 H new ATOM 0 HD22 ASN A 42 6.255 16.671 -5.352 1.00 0.00 H new ATOM 695 N LEU A 43 9.490 12.161 -5.358 1.00 0.00 N ATOM 696 CA LEU A 43 9.261 10.690 -5.528 1.00 0.00 C ATOM 697 C LEU A 43 8.677 9.959 -4.260 1.00 0.00 C ATOM 698 O LEU A 43 7.838 9.070 -4.440 1.00 0.00 O ATOM 699 CB LEU A 43 10.554 9.996 -6.074 1.00 0.00 C ATOM 700 CG LEU A 43 12.017 10.223 -5.575 1.00 0.00 C ATOM 701 CD1 LEU A 43 12.745 11.323 -6.364 1.00 0.00 C ATOM 702 CD2 LEU A 43 12.208 10.447 -4.066 1.00 0.00 C ATOM 0 H LEU A 43 10.463 12.446 -5.475 1.00 0.00 H new ATOM 0 HA LEU A 43 8.469 10.593 -6.270 1.00 0.00 H new ATOM 0 HB2 LEU A 43 10.375 8.926 -5.972 1.00 0.00 H new ATOM 0 HB3 LEU A 43 10.573 10.216 -7.141 1.00 0.00 H new ATOM 0 HG LEU A 43 12.475 9.255 -5.776 1.00 0.00 H new ATOM 0 HD11 LEU A 43 13.757 11.440 -5.976 1.00 0.00 H new ATOM 0 HD12 LEU A 43 12.790 11.046 -7.417 1.00 0.00 H new ATOM 0 HD13 LEU A 43 12.205 12.264 -6.259 1.00 0.00 H new ATOM 0 HD21 LEU A 43 13.267 10.592 -3.851 1.00 0.00 H new ATOM 0 HD22 LEU A 43 11.651 11.331 -3.756 1.00 0.00 H new ATOM 0 HD23 LEU A 43 11.842 9.577 -3.520 1.00 0.00 H new ATOM 714 N GLU A 44 9.059 10.302 -3.010 1.00 0.00 N ATOM 715 CA GLU A 44 8.442 9.706 -1.790 1.00 0.00 C ATOM 716 C GLU A 44 7.202 10.576 -1.378 1.00 0.00 C ATOM 717 O GLU A 44 7.269 11.481 -0.538 1.00 0.00 O ATOM 718 CB GLU A 44 9.527 9.488 -0.692 1.00 0.00 C ATOM 719 CG GLU A 44 10.420 10.654 -0.186 1.00 0.00 C ATOM 720 CD GLU A 44 11.180 10.311 1.094 1.00 0.00 C ATOM 721 OE1 GLU A 44 10.543 10.306 2.175 1.00 0.00 O ATOM 722 OE2 GLU A 44 12.401 10.052 1.032 1.00 0.00 O ATOM 0 H GLU A 44 9.789 10.986 -2.813 1.00 0.00 H new ATOM 0 HA GLU A 44 8.049 8.706 -1.973 1.00 0.00 H new ATOM 0 HB2 GLU A 44 9.017 9.079 0.180 1.00 0.00 H new ATOM 0 HB3 GLU A 44 10.198 8.713 -1.061 1.00 0.00 H new ATOM 0 HG2 GLU A 44 11.134 10.922 -0.965 1.00 0.00 H new ATOM 0 HG3 GLU A 44 9.797 11.531 -0.008 1.00 0.00 H new ATOM 729 N GLU A 45 6.041 10.214 -1.963 1.00 0.00 N ATOM 730 CA GLU A 45 4.751 10.934 -1.788 1.00 0.00 C ATOM 731 C GLU A 45 4.053 10.589 -0.424 1.00 0.00 C ATOM 732 O GLU A 45 4.647 10.764 0.641 1.00 0.00 O ATOM 733 CB GLU A 45 3.931 10.588 -3.080 1.00 0.00 C ATOM 734 CG GLU A 45 4.414 11.154 -4.439 1.00 0.00 C ATOM 735 CD GLU A 45 3.354 11.055 -5.529 1.00 0.00 C ATOM 736 OE1 GLU A 45 2.888 9.938 -5.833 1.00 0.00 O ATOM 737 OE2 GLU A 45 2.939 12.109 -6.052 1.00 0.00 O ATOM 0 H GLU A 45 5.967 9.404 -2.579 1.00 0.00 H new ATOM 0 HA GLU A 45 4.868 12.014 -1.703 1.00 0.00 H new ATOM 0 HB2 GLU A 45 3.894 9.502 -3.168 1.00 0.00 H new ATOM 0 HB3 GLU A 45 2.908 10.930 -2.924 1.00 0.00 H new ATOM 0 HG2 GLU A 45 4.701 12.198 -4.311 1.00 0.00 H new ATOM 0 HG3 GLU A 45 5.306 10.614 -4.756 1.00 0.00 H new ATOM 744 N LYS A 46 2.803 10.121 -0.446 1.00 0.00 N ATOM 745 CA LYS A 46 2.033 9.725 0.763 1.00 0.00 C ATOM 746 C LYS A 46 1.019 8.607 0.347 1.00 0.00 C ATOM 747 O LYS A 46 0.169 8.779 -0.538 1.00 0.00 O ATOM 748 CB LYS A 46 1.368 10.962 1.434 1.00 0.00 C ATOM 749 CG LYS A 46 0.267 11.728 0.663 1.00 0.00 C ATOM 750 CD LYS A 46 -0.212 12.968 1.448 1.00 0.00 C ATOM 751 CE LYS A 46 -1.396 13.722 0.815 1.00 0.00 C ATOM 752 NZ LYS A 46 -0.995 14.410 -0.443 1.00 0.00 N ATOM 0 H LYS A 46 2.278 10.000 -1.312 1.00 0.00 H new ATOM 0 HA LYS A 46 2.692 9.315 1.529 1.00 0.00 H new ATOM 0 HB2 LYS A 46 0.939 10.633 2.381 1.00 0.00 H new ATOM 0 HB3 LYS A 46 2.159 11.673 1.672 1.00 0.00 H new ATOM 0 HG2 LYS A 46 0.650 12.037 -0.310 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -0.578 11.065 0.477 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -0.495 12.656 2.453 1.00 0.00 H new ATOM 0 HD3 LYS A 46 0.625 13.659 1.553 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -2.205 13.022 0.606 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -1.783 14.454 1.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -1.680 15.162 -0.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -0.050 14.827 -0.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -0.975 13.723 -1.223 1.00 0.00 H new ATOM 766 N ILE A 47 1.180 7.431 0.962 1.00 0.00 N ATOM 767 CA ILE A 47 0.353 6.218 0.718 1.00 0.00 C ATOM 768 C ILE A 47 -0.203 5.702 2.095 1.00 0.00 C ATOM 769 O ILE A 47 0.429 5.810 3.150 1.00 0.00 O ATOM 770 CB ILE A 47 1.255 5.176 -0.062 1.00 0.00 C ATOM 771 CG1 ILE A 47 0.488 4.175 -0.977 1.00 0.00 C ATOM 772 CG2 ILE A 47 2.154 4.365 0.892 1.00 0.00 C ATOM 773 CD1 ILE A 47 -0.281 2.981 -0.381 1.00 0.00 C ATOM 0 H ILE A 47 1.905 7.280 1.664 1.00 0.00 H new ATOM 0 HA ILE A 47 -0.522 6.412 0.097 1.00 0.00 H new ATOM 0 HB ILE A 47 1.852 5.812 -0.715 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -0.228 4.758 -1.557 1.00 0.00 H new ATOM 0 HG13 ILE A 47 1.213 3.768 -1.682 1.00 0.00 H new ATOM 0 HG21 ILE A 47 2.756 3.662 0.316 1.00 0.00 H new ATOM 0 HG22 ILE A 47 2.811 5.043 1.437 1.00 0.00 H new ATOM 0 HG23 ILE A 47 1.532 3.815 1.599 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -0.744 2.409 -1.185 1.00 0.00 H new ATOM 0 HD12 ILE A 47 0.409 2.341 0.169 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -1.054 3.347 0.295 1.00 0.00 H new ATOM 785 N ASP A 48 -1.436 5.218 2.083 1.00 0.00 N ATOM 786 CA ASP A 48 -2.045 4.538 3.262 1.00 0.00 C ATOM 787 C ASP A 48 -3.210 3.647 2.754 1.00 0.00 C ATOM 788 O ASP A 48 -2.949 2.708 1.989 1.00 0.00 O ATOM 789 CB ASP A 48 -2.294 5.460 4.506 1.00 0.00 C ATOM 790 CG ASP A 48 -2.783 4.806 5.798 1.00 0.00 C ATOM 791 OD1 ASP A 48 -2.315 3.700 6.130 1.00 0.00 O ATOM 792 OD2 ASP A 48 -3.661 5.386 6.475 1.00 0.00 O ATOM 0 H ASP A 48 -2.054 5.275 1.273 1.00 0.00 H new ATOM 0 HA ASP A 48 -1.326 3.864 3.728 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -1.362 5.981 4.727 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -3.023 6.218 4.219 1.00 0.00 H new ATOM 797 N VAL A 49 -4.448 3.855 3.217 1.00 0.00 N ATOM 798 CA VAL A 49 -5.505 2.792 3.086 1.00 0.00 C ATOM 799 C VAL A 49 -7.005 3.249 3.058 1.00 0.00 C ATOM 800 O VAL A 49 -7.379 4.365 3.422 1.00 0.00 O ATOM 801 CB VAL A 49 -5.328 1.759 4.294 1.00 0.00 C ATOM 802 CG1 VAL A 49 -3.999 0.966 4.328 1.00 0.00 C ATOM 803 CG2 VAL A 49 -5.587 2.350 5.703 1.00 0.00 C ATOM 0 H VAL A 49 -4.757 4.713 3.674 1.00 0.00 H new ATOM 0 HA VAL A 49 -5.333 2.370 2.096 1.00 0.00 H new ATOM 0 HB VAL A 49 -6.123 1.054 4.053 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -3.995 0.299 5.190 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -3.902 0.379 3.415 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -3.163 1.661 4.403 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -5.442 1.574 6.455 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -4.891 3.169 5.888 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -6.610 2.723 5.759 1.00 0.00 H new ATOM 813 N VAL A 50 -7.867 2.286 2.662 1.00 0.00 N ATOM 814 CA VAL A 50 -9.354 2.398 2.696 1.00 0.00 C ATOM 815 C VAL A 50 -9.798 1.343 3.790 1.00 0.00 C ATOM 816 O VAL A 50 -9.908 0.157 3.442 1.00 0.00 O ATOM 817 CB VAL A 50 -10.030 2.114 1.306 1.00 0.00 C ATOM 818 CG1 VAL A 50 -11.511 2.555 1.285 1.00 0.00 C ATOM 819 CG2 VAL A 50 -9.333 2.721 0.071 1.00 0.00 C ATOM 0 H VAL A 50 -7.548 1.387 2.301 1.00 0.00 H new ATOM 0 HA VAL A 50 -9.669 3.414 2.934 1.00 0.00 H new ATOM 0 HB VAL A 50 -9.934 1.032 1.218 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -11.941 2.341 0.306 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -12.064 2.011 2.051 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -11.575 3.625 1.483 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -9.891 2.457 -0.828 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -9.296 3.806 0.170 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -8.319 2.329 -0.004 1.00 0.00 H new ATOM 829 N PRO A 51 -10.074 1.696 5.084 1.00 0.00 N ATOM 830 CA PRO A 51 -10.408 0.701 6.145 1.00 0.00 C ATOM 831 C PRO A 51 -11.769 -0.073 6.081 1.00 0.00 C ATOM 832 O PRO A 51 -12.824 0.491 5.770 1.00 0.00 O ATOM 833 CB PRO A 51 -10.388 1.562 7.431 1.00 0.00 C ATOM 834 CG PRO A 51 -9.589 2.812 7.091 1.00 0.00 C ATOM 835 CD PRO A 51 -9.901 3.062 5.621 1.00 0.00 C ATOM 0 HA PRO A 51 -9.697 -0.120 6.056 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -11.400 1.820 7.743 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -9.928 1.019 8.257 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -9.887 3.657 7.711 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -8.522 2.659 7.252 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -10.802 3.663 5.496 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -9.091 3.593 5.121 1.00 0.00 H new ATOM 843 N ILE A 52 -11.714 -1.363 6.453 1.00 0.00 N ATOM 844 CA ILE A 52 -12.905 -2.247 6.676 1.00 0.00 C ATOM 845 C ILE A 52 -12.839 -2.630 8.220 1.00 0.00 C ATOM 846 O ILE A 52 -11.778 -2.596 8.862 1.00 0.00 O ATOM 847 CB ILE A 52 -12.946 -3.530 5.745 1.00 0.00 C ATOM 848 CG1 ILE A 52 -12.476 -3.339 4.271 1.00 0.00 C ATOM 849 CG2 ILE A 52 -14.381 -4.125 5.680 1.00 0.00 C ATOM 850 CD1 ILE A 52 -13.173 -2.269 3.417 1.00 0.00 C ATOM 0 H ILE A 52 -10.829 -1.844 6.614 1.00 0.00 H new ATOM 0 HA ILE A 52 -13.824 -1.725 6.410 1.00 0.00 H new ATOM 0 HB ILE A 52 -12.227 -4.192 6.228 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -11.411 -3.108 4.289 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -12.586 -4.296 3.760 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -14.382 -5.004 5.035 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -14.703 -4.410 6.682 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -15.066 -3.379 5.277 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -12.735 -2.258 2.419 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -14.236 -2.497 3.344 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -13.043 -1.291 3.881 1.00 0.00 H new ATOM 862 N GLU A 53 -13.922 -3.164 8.809 1.00 0.00 N ATOM 863 CA GLU A 53 -14.009 -3.411 10.282 1.00 0.00 C ATOM 864 C GLU A 53 -13.142 -4.614 10.838 1.00 0.00 C ATOM 865 O GLU A 53 -12.435 -4.339 11.815 1.00 0.00 O ATOM 866 CB GLU A 53 -15.509 -3.618 10.680 1.00 0.00 C ATOM 867 CG GLU A 53 -16.569 -2.576 10.221 1.00 0.00 C ATOM 868 CD GLU A 53 -17.035 -2.747 8.782 1.00 0.00 C ATOM 869 OE1 GLU A 53 -17.909 -3.591 8.513 1.00 0.00 O ATOM 870 OE2 GLU A 53 -16.498 -2.069 7.883 1.00 0.00 O ATOM 0 H GLU A 53 -14.760 -3.438 8.296 1.00 0.00 H new ATOM 0 HA GLU A 53 -13.578 -2.523 10.745 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -15.818 -4.590 10.297 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -15.555 -3.674 11.768 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -17.434 -2.641 10.881 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -16.153 -1.576 10.339 1.00 0.00 H new ATOM 877 N PRO A 54 -13.077 -5.894 10.341 1.00 0.00 N ATOM 878 CA PRO A 54 -12.225 -6.956 10.965 1.00 0.00 C ATOM 879 C PRO A 54 -10.714 -6.936 10.528 1.00 0.00 C ATOM 880 O PRO A 54 -10.200 -7.911 9.973 1.00 0.00 O ATOM 881 CB PRO A 54 -13.010 -8.208 10.517 1.00 0.00 C ATOM 882 CG PRO A 54 -13.508 -7.865 9.109 1.00 0.00 C ATOM 883 CD PRO A 54 -13.865 -6.378 9.189 1.00 0.00 C ATOM 0 HA PRO A 54 -12.097 -6.859 12.043 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -12.374 -9.093 10.508 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -13.840 -8.418 11.191 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -12.739 -8.050 8.359 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -14.373 -8.468 8.835 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -13.600 -5.852 8.272 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -14.934 -6.230 9.343 1.00 0.00 H new ATOM 891 N HIS A 55 -10.000 -5.819 10.788 1.00 0.00 N ATOM 892 CA HIS A 55 -8.563 -5.586 10.372 1.00 0.00 C ATOM 893 C HIS A 55 -8.271 -5.588 8.814 1.00 0.00 C ATOM 894 O HIS A 55 -7.120 -5.372 8.417 1.00 0.00 O ATOM 895 CB HIS A 55 -7.604 -6.591 11.093 1.00 0.00 C ATOM 896 CG HIS A 55 -7.448 -6.378 12.598 1.00 0.00 C ATOM 897 ND1 HIS A 55 -6.651 -5.386 13.156 1.00 0.00 N ATOM 898 CD2 HIS A 55 -8.042 -7.164 13.599 1.00 0.00 C ATOM 899 CE1 HIS A 55 -6.840 -5.677 14.483 1.00 0.00 C ATOM 900 NE2 HIS A 55 -7.657 -6.714 14.849 1.00 0.00 N ATOM 0 H HIS A 55 -10.395 -5.030 11.300 1.00 0.00 H new ATOM 0 HA HIS A 55 -8.368 -4.562 10.690 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -7.970 -7.603 10.922 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -6.620 -6.525 10.629 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -8.703 -7.999 13.419 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -6.344 -5.088 15.240 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -7.909 -7.056 15.776 1.00 0.00 H new ATOM 908 N ALA A 56 -9.266 -5.793 7.929 1.00 0.00 N ATOM 909 CA ALA A 56 -9.081 -5.790 6.459 1.00 0.00 C ATOM 910 C ALA A 56 -9.178 -4.355 5.854 1.00 0.00 C ATOM 911 O ALA A 56 -9.826 -3.470 6.415 1.00 0.00 O ATOM 912 CB ALA A 56 -10.144 -6.751 5.892 1.00 0.00 C ATOM 0 H ALA A 56 -10.230 -5.967 8.214 1.00 0.00 H new ATOM 0 HA ALA A 56 -8.080 -6.126 6.189 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -10.057 -6.791 4.806 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -9.990 -7.748 6.305 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -11.138 -6.395 6.163 1.00 0.00 H new ATOM 918 N LEU A 57 -8.536 -4.117 4.696 1.00 0.00 N ATOM 919 CA LEU A 57 -8.434 -2.760 4.074 1.00 0.00 C ATOM 920 C LEU A 57 -7.806 -2.796 2.633 1.00 0.00 C ATOM 921 O LEU A 57 -7.055 -3.708 2.281 1.00 0.00 O ATOM 922 CB LEU A 57 -7.582 -1.839 5.022 1.00 0.00 C ATOM 923 CG LEU A 57 -6.062 -2.071 5.301 1.00 0.00 C ATOM 924 CD1 LEU A 57 -5.688 -1.415 6.644 1.00 0.00 C ATOM 925 CD2 LEU A 57 -5.569 -3.525 5.365 1.00 0.00 C ATOM 0 H LEU A 57 -8.071 -4.848 4.158 1.00 0.00 H new ATOM 0 HA LEU A 57 -9.442 -2.363 3.956 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -7.672 -0.826 4.630 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -8.079 -1.851 5.992 1.00 0.00 H new ATOM 0 HG LEU A 57 -5.577 -1.630 4.430 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -4.628 -1.574 6.844 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -5.892 -0.345 6.596 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -6.279 -1.861 7.444 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -4.497 -3.537 5.565 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -6.093 -4.052 6.163 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -5.767 -4.018 4.413 1.00 0.00 H new ATOM 937 N PHE A 58 -8.127 -1.808 1.778 1.00 0.00 N ATOM 938 CA PHE A 58 -7.454 -1.640 0.435 1.00 0.00 C ATOM 939 C PHE A 58 -6.267 -0.621 0.569 1.00 0.00 C ATOM 940 O PHE A 58 -6.287 0.179 1.509 1.00 0.00 O ATOM 941 CB PHE A 58 -8.483 -1.116 -0.613 1.00 0.00 C ATOM 942 CG PHE A 58 -9.307 -2.148 -1.400 1.00 0.00 C ATOM 943 CD1 PHE A 58 -10.034 -3.152 -0.753 1.00 0.00 C ATOM 944 CD2 PHE A 58 -9.408 -2.022 -2.792 1.00 0.00 C ATOM 945 CE1 PHE A 58 -10.826 -4.028 -1.487 1.00 0.00 C ATOM 946 CE2 PHE A 58 -10.215 -2.889 -3.521 1.00 0.00 C ATOM 947 CZ PHE A 58 -10.917 -3.898 -2.869 1.00 0.00 C ATOM 0 H PHE A 58 -8.842 -1.107 1.973 1.00 0.00 H new ATOM 0 HA PHE A 58 -7.069 -2.604 0.102 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -9.181 -0.458 -0.095 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -7.942 -0.503 -1.333 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -9.980 -3.247 0.321 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -8.856 -1.247 -3.302 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -11.372 -4.812 -0.983 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -10.297 -2.779 -4.592 1.00 0.00 H new ATOM 0 HZ PHE A 58 -11.533 -4.580 -3.436 1.00 0.00 H new ATOM 957 N LEU A 59 -5.236 -0.585 -0.318 1.00 0.00 N ATOM 958 CA LEU A 59 -4.164 0.459 -0.180 1.00 0.00 C ATOM 959 C LEU A 59 -4.443 1.655 -1.169 1.00 0.00 C ATOM 960 O LEU A 59 -5.203 1.539 -2.144 1.00 0.00 O ATOM 961 CB LEU A 59 -2.770 -0.222 -0.343 1.00 0.00 C ATOM 962 CG LEU A 59 -2.060 -0.687 0.958 1.00 0.00 C ATOM 963 CD1 LEU A 59 -2.734 -1.892 1.632 1.00 0.00 C ATOM 964 CD2 LEU A 59 -0.593 -1.040 0.658 1.00 0.00 C ATOM 0 H LEU A 59 -5.118 -1.228 -1.101 1.00 0.00 H new ATOM 0 HA LEU A 59 -4.168 0.909 0.813 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -2.890 -1.089 -0.993 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -2.110 0.475 -0.859 1.00 0.00 H new ATOM 0 HG LEU A 59 -2.128 0.150 1.653 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -2.183 -2.160 2.534 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -3.760 -1.634 1.896 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -2.738 -2.738 0.945 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -0.102 -1.365 1.575 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.555 -1.843 -0.078 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.081 -0.162 0.264 1.00 0.00 H new ATOM 976 N GLY A 60 -3.822 2.833 -0.942 1.00 0.00 N ATOM 977 CA GLY A 60 -4.041 4.013 -1.828 1.00 0.00 C ATOM 978 C GLY A 60 -2.981 5.128 -1.879 1.00 0.00 C ATOM 979 O GLY A 60 -2.449 5.503 -0.835 1.00 0.00 O ATOM 0 H GLY A 60 -3.176 2.998 -0.170 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -4.172 3.639 -2.844 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -4.985 4.472 -1.533 1.00 0.00 H new ATOM 983 N ILE A 61 -2.678 5.653 -3.091 1.00 0.00 N ATOM 984 CA ILE A 61 -1.716 6.791 -3.277 1.00 0.00 C ATOM 985 C ILE A 61 -2.633 8.070 -3.315 1.00 0.00 C ATOM 986 O ILE A 61 -3.578 8.172 -4.125 1.00 0.00 O ATOM 987 CB ILE A 61 -0.768 6.539 -4.532 1.00 0.00 C ATOM 988 CG1 ILE A 61 0.692 6.149 -4.146 1.00 0.00 C ATOM 989 CG2 ILE A 61 -0.662 7.726 -5.535 1.00 0.00 C ATOM 990 CD1 ILE A 61 1.566 7.182 -3.404 1.00 0.00 C ATOM 0 H ILE A 61 -3.082 5.312 -3.963 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.986 6.911 -2.477 1.00 0.00 H new ATOM 0 HB ILE A 61 -1.276 5.706 -5.018 1.00 0.00 H new ATOM 0 HG12 ILE A 61 0.642 5.254 -3.526 1.00 0.00 H new ATOM 0 HG13 ILE A 61 1.213 5.873 -5.063 1.00 0.00 H new ATOM 0 HG21 ILE A 61 0.006 7.453 -6.352 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.650 7.954 -5.935 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.268 8.603 -5.021 1.00 0.00 H new ATOM 0 HD11 ILE A 61 2.550 6.754 -3.210 1.00 0.00 H new ATOM 0 HD12 ILE A 61 1.673 8.076 -4.018 1.00 0.00 H new ATOM 0 HD13 ILE A 61 1.093 7.446 -2.458 1.00 0.00 H new ATOM 1002 N HIS A 62 -2.318 9.001 -2.380 1.00 0.00 N ATOM 1003 CA HIS A 62 -3.052 10.282 -2.127 1.00 0.00 C ATOM 1004 C HIS A 62 -4.522 10.049 -1.613 1.00 0.00 C ATOM 1005 O HIS A 62 -5.046 8.926 -1.595 1.00 0.00 O ATOM 1006 CB HIS A 62 -2.993 11.217 -3.379 1.00 0.00 C ATOM 1007 CG HIS A 62 -1.603 11.743 -3.741 1.00 0.00 C ATOM 1008 ND1 HIS A 62 -0.842 12.579 -2.925 1.00 0.00 N ATOM 1009 CD2 HIS A 62 -0.912 11.432 -4.923 1.00 0.00 C ATOM 1010 CE1 HIS A 62 0.276 12.680 -3.720 1.00 0.00 C ATOM 1011 NE2 HIS A 62 0.316 12.056 -4.930 1.00 0.00 N ATOM 0 H HIS A 62 -1.520 8.883 -1.756 1.00 0.00 H new ATOM 0 HA HIS A 62 -2.539 10.795 -1.313 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -3.392 10.674 -4.236 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -3.651 12.068 -3.207 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -1.288 10.797 -5.711 1.00 0.00 H new ATOM 0 HE1 HIS A 62 1.125 13.256 -3.383 1.00 0.00 H new ATOM 0 HE2 HIS A 62 1.048 12.052 -5.640 1.00 0.00 H new ATOM 1019 N GLY A 63 -5.203 11.124 -1.160 1.00 0.00 N ATOM 1020 CA GLY A 63 -6.614 11.033 -0.676 1.00 0.00 C ATOM 1021 C GLY A 63 -7.699 10.865 -1.767 1.00 0.00 C ATOM 1022 O GLY A 63 -8.612 11.684 -1.883 1.00 0.00 O ATOM 0 H GLY A 63 -4.808 12.064 -1.116 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -6.687 10.191 0.013 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.839 11.933 -0.104 1.00 0.00 H new ATOM 1026 N GLY A 64 -7.608 9.761 -2.515 1.00 0.00 N ATOM 1027 CA GLY A 64 -8.541 9.445 -3.623 1.00 0.00 C ATOM 1028 C GLY A 64 -8.030 9.715 -5.046 1.00 0.00 C ATOM 1029 O GLY A 64 -8.674 10.427 -5.815 1.00 0.00 O ATOM 0 H GLY A 64 -6.886 9.054 -2.376 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -8.811 8.391 -3.552 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -9.455 10.020 -3.474 1.00 0.00 H new ATOM 1033 N LYS A 65 -6.921 9.066 -5.418 1.00 0.00 N ATOM 1034 CA LYS A 65 -6.337 9.164 -6.785 1.00 0.00 C ATOM 1035 C LYS A 65 -5.926 7.759 -7.333 1.00 0.00 C ATOM 1036 O LYS A 65 -6.287 7.440 -8.479 1.00 0.00 O ATOM 1037 CB LYS A 65 -5.151 10.174 -6.729 1.00 0.00 C ATOM 1038 CG LYS A 65 -4.352 10.451 -8.031 1.00 0.00 C ATOM 1039 CD LYS A 65 -4.972 11.418 -9.074 1.00 0.00 C ATOM 1040 CE LYS A 65 -6.307 11.045 -9.754 1.00 0.00 C ATOM 1041 NZ LYS A 65 -6.256 9.694 -10.382 1.00 0.00 N ATOM 0 H LYS A 65 -6.395 8.457 -4.791 1.00 0.00 H new ATOM 0 HA LYS A 65 -7.078 9.536 -7.492 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -5.543 11.126 -6.372 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -4.447 9.817 -5.977 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -3.377 10.847 -7.747 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -4.176 9.495 -8.525 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -5.113 12.381 -8.584 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -4.234 11.566 -9.862 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -7.109 11.072 -9.017 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -6.547 11.789 -10.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -7.215 9.405 -10.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -5.645 9.725 -11.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -5.873 9.009 -9.700 1.00 0.00 H new ATOM 1055 N MET A 66 -5.170 6.936 -6.569 1.00 0.00 N ATOM 1056 CA MET A 66 -4.707 5.618 -7.085 1.00 0.00 C ATOM 1057 C MET A 66 -5.093 4.457 -6.122 1.00 0.00 C ATOM 1058 O MET A 66 -4.913 4.543 -4.902 1.00 0.00 O ATOM 1059 CB MET A 66 -3.180 5.770 -7.259 1.00 0.00 C ATOM 1060 CG MET A 66 -2.420 4.594 -7.898 1.00 0.00 C ATOM 1061 SD MET A 66 -2.601 4.605 -9.692 1.00 0.00 S ATOM 1062 CE MET A 66 -1.275 5.728 -10.171 1.00 0.00 C ATOM 0 H MET A 66 -4.872 7.149 -5.617 1.00 0.00 H new ATOM 0 HA MET A 66 -5.183 5.355 -8.029 1.00 0.00 H new ATOM 0 HB2 MET A 66 -2.997 6.658 -7.864 1.00 0.00 H new ATOM 0 HB3 MET A 66 -2.746 5.958 -6.277 1.00 0.00 H new ATOM 0 HG2 MET A 66 -1.364 4.653 -7.635 1.00 0.00 H new ATOM 0 HG3 MET A 66 -2.796 3.653 -7.497 1.00 0.00 H new ATOM 0 HE1 MET A 66 -1.262 5.834 -11.256 1.00 0.00 H new ATOM 0 HE2 MET A 66 -1.441 6.703 -9.713 1.00 0.00 H new ATOM 0 HE3 MET A 66 -0.319 5.327 -9.835 1.00 0.00 H new ATOM 1072 N CYS A 67 -5.648 3.373 -6.676 1.00 0.00 N ATOM 1073 CA CYS A 67 -5.978 2.137 -5.928 1.00 0.00 C ATOM 1074 C CYS A 67 -4.770 1.154 -5.936 1.00 0.00 C ATOM 1075 O CYS A 67 -4.330 0.685 -6.984 1.00 0.00 O ATOM 1076 CB CYS A 67 -7.238 1.534 -6.581 1.00 0.00 C ATOM 1077 SG CYS A 67 -7.737 0.008 -5.714 1.00 0.00 S ATOM 0 H CYS A 67 -5.886 3.321 -7.666 1.00 0.00 H new ATOM 0 HA CYS A 67 -6.182 2.349 -4.878 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -8.052 2.258 -6.553 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -7.042 1.316 -7.631 1.00 0.00 H new ATOM 0 HG CYS A 67 -8.801 -0.483 -6.277 1.00 0.00 H new ATOM 1083 N LEU A 68 -4.185 0.871 -4.763 1.00 0.00 N ATOM 1084 CA LEU A 68 -3.095 -0.138 -4.647 1.00 0.00 C ATOM 1085 C LEU A 68 -3.838 -1.473 -4.280 1.00 0.00 C ATOM 1086 O LEU A 68 -4.368 -1.655 -3.166 1.00 0.00 O ATOM 1087 CB LEU A 68 -2.013 0.346 -3.643 1.00 0.00 C ATOM 1088 CG LEU A 68 -0.868 1.269 -4.148 1.00 0.00 C ATOM 1089 CD1 LEU A 68 0.108 0.548 -5.086 1.00 0.00 C ATOM 1090 CD2 LEU A 68 -1.354 2.573 -4.797 1.00 0.00 C ATOM 0 H LEU A 68 -4.438 1.317 -3.881 1.00 0.00 H new ATOM 0 HA LEU A 68 -2.518 -0.296 -5.558 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -2.525 0.870 -2.836 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -1.552 -0.539 -3.206 1.00 0.00 H new ATOM 0 HG LEU A 68 -0.334 1.544 -3.238 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.885 1.242 -5.406 1.00 0.00 H new ATOM 0 HD12 LEU A 68 0.565 -0.291 -4.561 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.431 0.180 -5.959 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -0.495 3.160 -5.122 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -1.981 2.339 -5.658 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -1.932 3.147 -4.072 1.00 0.00 H new ATOM 1102 N SER A 69 -3.900 -2.318 -5.330 1.00 0.00 N ATOM 1103 CA SER A 69 -4.651 -3.605 -5.390 1.00 0.00 C ATOM 1104 C SER A 69 -3.740 -4.793 -5.821 1.00 0.00 C ATOM 1105 O SER A 69 -2.707 -4.646 -6.489 1.00 0.00 O ATOM 1106 CB SER A 69 -5.793 -3.374 -6.421 1.00 0.00 C ATOM 1107 OG SER A 69 -5.337 -3.101 -7.754 1.00 0.00 O ATOM 0 H SER A 69 -3.409 -2.120 -6.202 1.00 0.00 H new ATOM 0 HA SER A 69 -5.038 -3.877 -4.408 1.00 0.00 H new ATOM 0 HB2 SER A 69 -6.432 -4.257 -6.442 1.00 0.00 H new ATOM 0 HB3 SER A 69 -6.410 -2.541 -6.083 1.00 0.00 H new ATOM 0 HG SER A 69 -6.101 -2.856 -8.317 1.00 0.00 H new ATOM 1113 N CYS A 70 -4.149 -6.009 -5.420 1.00 0.00 N ATOM 1114 CA CYS A 70 -3.491 -7.267 -5.850 1.00 0.00 C ATOM 1115 C CYS A 70 -4.179 -7.653 -7.200 1.00 0.00 C ATOM 1116 O CYS A 70 -5.215 -8.329 -7.218 1.00 0.00 O ATOM 1117 CB CYS A 70 -3.659 -8.272 -4.688 1.00 0.00 C ATOM 1118 SG CYS A 70 -2.524 -9.676 -4.883 1.00 0.00 S ATOM 0 H CYS A 70 -4.940 -6.153 -4.792 1.00 0.00 H new ATOM 0 HA CYS A 70 -2.419 -7.214 -6.043 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -3.467 -7.773 -3.738 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -4.688 -8.631 -4.657 1.00 0.00 H new ATOM 0 HG CYS A 70 -2.684 -10.504 -3.893 1.00 0.00 H new ATOM 1124 N VAL A 71 -3.655 -7.140 -8.329 1.00 0.00 N ATOM 1125 CA VAL A 71 -4.342 -7.237 -9.652 1.00 0.00 C ATOM 1126 C VAL A 71 -3.932 -8.526 -10.433 1.00 0.00 C ATOM 1127 O VAL A 71 -2.751 -8.895 -10.456 1.00 0.00 O ATOM 1128 CB VAL A 71 -4.065 -5.889 -10.427 1.00 0.00 C ATOM 1129 CG1 VAL A 71 -2.793 -5.847 -11.304 1.00 0.00 C ATOM 1130 CG2 VAL A 71 -5.260 -5.444 -11.296 1.00 0.00 C ATOM 0 H VAL A 71 -2.760 -6.653 -8.362 1.00 0.00 H new ATOM 0 HA VAL A 71 -5.419 -7.349 -9.526 1.00 0.00 H new ATOM 0 HB VAL A 71 -3.902 -5.196 -9.602 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -2.714 -4.871 -11.783 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -1.915 -6.018 -10.680 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -2.852 -6.623 -12.068 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -5.013 -4.512 -11.805 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -5.479 -6.214 -12.035 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -6.133 -5.290 -10.662 1.00 0.00 H new ATOM 1140 N LYS A 72 -4.908 -9.211 -11.065 1.00 0.00 N ATOM 1141 CA LYS A 72 -4.617 -10.420 -11.879 1.00 0.00 C ATOM 1142 C LYS A 72 -4.607 -10.067 -13.404 1.00 0.00 C ATOM 1143 O LYS A 72 -5.630 -9.692 -13.988 1.00 0.00 O ATOM 1144 CB LYS A 72 -5.608 -11.568 -11.529 1.00 0.00 C ATOM 1145 CG LYS A 72 -7.116 -11.498 -11.908 1.00 0.00 C ATOM 1146 CD LYS A 72 -7.777 -12.895 -11.821 1.00 0.00 C ATOM 1147 CE LYS A 72 -9.195 -12.996 -12.414 1.00 0.00 C ATOM 1148 NZ LYS A 72 -9.570 -14.437 -12.520 1.00 0.00 N ATOM 0 H LYS A 72 -5.895 -8.955 -11.031 1.00 0.00 H new ATOM 0 HA LYS A 72 -3.619 -10.784 -11.635 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -5.211 -12.476 -11.984 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -5.561 -11.706 -10.449 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -7.630 -10.807 -11.241 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -7.222 -11.104 -12.919 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -7.136 -13.613 -12.332 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -7.818 -13.194 -10.774 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -9.907 -12.466 -11.782 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -9.228 -12.524 -13.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -10.602 -14.521 -12.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -9.105 -14.857 -13.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -9.265 -14.939 -11.662 1.00 0.00 H new ATOM 1162 N SER A 73 -3.447 -10.209 -14.065 1.00 0.00 N ATOM 1163 CA SER A 73 -3.314 -9.966 -15.535 1.00 0.00 C ATOM 1164 C SER A 73 -3.587 -11.287 -16.330 1.00 0.00 C ATOM 1165 O SER A 73 -2.680 -11.883 -16.920 1.00 0.00 O ATOM 1166 CB SER A 73 -1.892 -9.400 -15.731 1.00 0.00 C ATOM 1167 OG SER A 73 -1.590 -9.239 -17.116 1.00 0.00 O ATOM 0 H SER A 73 -2.577 -10.492 -13.614 1.00 0.00 H new ATOM 0 HA SER A 73 -4.045 -9.256 -15.921 1.00 0.00 H new ATOM 0 HB2 SER A 73 -1.806 -8.440 -15.223 1.00 0.00 H new ATOM 0 HB3 SER A 73 -1.164 -10.069 -15.272 1.00 0.00 H new ATOM 0 HG SER A 73 -0.684 -8.878 -17.213 1.00 0.00 H new ATOM 1173 N GLY A 74 -4.864 -11.717 -16.367 1.00 0.00 N ATOM 1174 CA GLY A 74 -5.243 -13.057 -16.916 1.00 0.00 C ATOM 1175 C GLY A 74 -4.823 -14.217 -15.970 1.00 0.00 C ATOM 1176 O GLY A 74 -4.095 -15.122 -16.378 1.00 0.00 O ATOM 0 H GLY A 74 -5.654 -11.168 -16.028 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -6.321 -13.092 -17.075 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -4.773 -13.196 -17.890 1.00 0.00 H new ATOM 1180 N ASP A 75 -5.268 -14.139 -14.699 1.00 0.00 N ATOM 1181 CA ASP A 75 -4.864 -15.055 -13.574 1.00 0.00 C ATOM 1182 C ASP A 75 -3.300 -15.147 -13.338 1.00 0.00 C ATOM 1183 O ASP A 75 -2.727 -16.189 -13.013 1.00 0.00 O ATOM 1184 CB ASP A 75 -5.629 -16.402 -13.727 1.00 0.00 C ATOM 1185 CG ASP A 75 -7.082 -16.260 -13.253 1.00 0.00 C ATOM 1186 OD1 ASP A 75 -7.342 -16.378 -12.037 1.00 0.00 O ATOM 1187 OD2 ASP A 75 -7.965 -15.885 -14.057 1.00 0.00 O ATOM 0 H ASP A 75 -5.935 -13.426 -14.403 1.00 0.00 H new ATOM 0 HA ASP A 75 -5.175 -14.624 -12.622 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -5.611 -16.719 -14.770 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -5.127 -17.178 -13.149 1.00 0.00 H new ATOM 1192 N GLU A 76 -2.669 -13.956 -13.346 1.00 0.00 N ATOM 1193 CA GLU A 76 -1.228 -13.723 -13.067 1.00 0.00 C ATOM 1194 C GLU A 76 -1.237 -12.557 -12.023 1.00 0.00 C ATOM 1195 O GLU A 76 -1.383 -11.379 -12.375 1.00 0.00 O ATOM 1196 CB GLU A 76 -0.524 -13.440 -14.424 1.00 0.00 C ATOM 1197 CG GLU A 76 1.003 -13.166 -14.389 1.00 0.00 C ATOM 1198 CD GLU A 76 1.402 -11.700 -14.436 1.00 0.00 C ATOM 1199 OE1 GLU A 76 1.264 -11.054 -15.495 1.00 0.00 O ATOM 1200 OE2 GLU A 76 1.862 -11.163 -13.413 1.00 0.00 O ATOM 0 H GLU A 76 -3.166 -13.090 -13.555 1.00 0.00 H new ATOM 0 HA GLU A 76 -0.664 -14.554 -12.643 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -0.699 -14.293 -15.079 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -1.011 -12.580 -14.884 1.00 0.00 H new ATOM 0 HG2 GLU A 76 1.414 -13.608 -13.481 1.00 0.00 H new ATOM 0 HG3 GLU A 76 1.467 -13.679 -15.232 1.00 0.00 H new ATOM 1207 N THR A 77 -1.206 -12.906 -10.721 1.00 0.00 N ATOM 1208 CA THR A 77 -1.397 -11.922 -9.612 1.00 0.00 C ATOM 1209 C THR A 77 -0.081 -11.244 -9.109 1.00 0.00 C ATOM 1210 O THR A 77 0.891 -11.901 -8.725 1.00 0.00 O ATOM 1211 CB THR A 77 -2.142 -12.675 -8.461 1.00 0.00 C ATOM 1212 OG1 THR A 77 -3.467 -13.004 -8.884 1.00 0.00 O ATOM 1213 CG2 THR A 77 -2.310 -11.864 -7.165 1.00 0.00 C ATOM 0 H THR A 77 -1.051 -13.862 -10.401 1.00 0.00 H new ATOM 0 HA THR A 77 -1.983 -11.083 -9.987 1.00 0.00 H new ATOM 0 HB THR A 77 -1.518 -13.543 -8.250 1.00 0.00 H new ATOM 0 HG1 THR A 77 -3.877 -13.611 -8.233 1.00 0.00 H new ATOM 0 HG21 THR A 77 -2.837 -12.466 -6.425 1.00 0.00 H new ATOM 0 HG22 THR A 77 -1.329 -11.590 -6.778 1.00 0.00 H new ATOM 0 HG23 THR A 77 -2.884 -10.961 -7.373 1.00 0.00 H new ATOM 1221 N ARG A 78 -0.122 -9.901 -9.031 1.00 0.00 N ATOM 1222 CA ARG A 78 0.985 -9.072 -8.478 1.00 0.00 C ATOM 1223 C ARG A 78 0.399 -7.707 -7.966 1.00 0.00 C ATOM 1224 O ARG A 78 -0.686 -7.239 -8.344 1.00 0.00 O ATOM 1225 CB ARG A 78 2.183 -8.868 -9.477 1.00 0.00 C ATOM 1226 CG ARG A 78 2.042 -9.129 -10.993 1.00 0.00 C ATOM 1227 CD ARG A 78 1.233 -8.087 -11.783 1.00 0.00 C ATOM 1228 NE ARG A 78 1.239 -8.562 -13.191 1.00 0.00 N ATOM 1229 CZ ARG A 78 1.185 -7.811 -14.284 1.00 0.00 C ATOM 1230 NH1 ARG A 78 1.050 -6.509 -14.276 1.00 0.00 N ATOM 1231 NH2 ARG A 78 1.273 -8.408 -15.435 1.00 0.00 N ATOM 0 H ARG A 78 -0.921 -9.352 -9.348 1.00 0.00 H new ATOM 0 HA ARG A 78 1.422 -9.616 -7.640 1.00 0.00 H new ATOM 0 HB2 ARG A 78 2.512 -7.835 -9.366 1.00 0.00 H new ATOM 0 HB3 ARG A 78 2.997 -9.501 -9.124 1.00 0.00 H new ATOM 0 HG2 ARG A 78 3.041 -9.189 -11.426 1.00 0.00 H new ATOM 0 HG3 ARG A 78 1.575 -10.104 -11.132 1.00 0.00 H new ATOM 0 HD2 ARG A 78 0.216 -8.008 -11.400 1.00 0.00 H new ATOM 0 HD3 ARG A 78 1.682 -7.097 -11.701 1.00 0.00 H new ATOM 0 HE ARG A 78 1.290 -9.571 -13.332 1.00 0.00 H new ATOM 0 HH11 ARG A 78 0.979 -6.009 -13.390 1.00 0.00 H new ATOM 0 HH12 ARG A 78 1.016 -5.994 -15.156 1.00 0.00 H new ATOM 0 HH21 ARG A 78 1.380 -9.422 -15.477 1.00 0.00 H new ATOM 0 HH22 ARG A 78 1.235 -7.863 -16.296 1.00 0.00 H new ATOM 1245 N LEU A 79 1.147 -7.071 -7.042 1.00 0.00 N ATOM 1246 CA LEU A 79 0.781 -5.748 -6.464 1.00 0.00 C ATOM 1247 C LEU A 79 0.944 -4.625 -7.537 1.00 0.00 C ATOM 1248 O LEU A 79 2.007 -4.484 -8.154 1.00 0.00 O ATOM 1249 CB LEU A 79 1.704 -5.494 -5.240 1.00 0.00 C ATOM 1250 CG LEU A 79 1.312 -4.423 -4.188 1.00 0.00 C ATOM 1251 CD1 LEU A 79 1.376 -2.974 -4.687 1.00 0.00 C ATOM 1252 CD2 LEU A 79 -0.055 -4.693 -3.545 1.00 0.00 C ATOM 0 H LEU A 79 2.018 -7.452 -6.673 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.262 -5.742 -6.147 1.00 0.00 H new ATOM 0 HB2 LEU A 79 1.814 -6.442 -4.713 1.00 0.00 H new ATOM 0 HB3 LEU A 79 2.688 -5.227 -5.625 1.00 0.00 H new ATOM 0 HG LEU A 79 2.087 -4.525 -3.429 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.085 -2.299 -3.882 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.393 -2.743 -5.005 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.696 -2.849 -5.529 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.276 -3.912 -2.818 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.825 -4.699 -4.316 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -0.036 -5.661 -3.043 1.00 0.00 H new ATOM 1264 N GLN A 80 -0.116 -3.837 -7.753 1.00 0.00 N ATOM 1265 CA GLN A 80 -0.113 -2.783 -8.802 1.00 0.00 C ATOM 1266 C GLN A 80 -0.918 -1.502 -8.407 1.00 0.00 C ATOM 1267 O GLN A 80 -1.853 -1.510 -7.592 1.00 0.00 O ATOM 1268 CB GLN A 80 -0.687 -3.429 -10.102 1.00 0.00 C ATOM 1269 CG GLN A 80 -0.115 -2.891 -11.441 1.00 0.00 C ATOM 1270 CD GLN A 80 1.270 -3.451 -11.787 1.00 0.00 C ATOM 1271 OE1 GLN A 80 1.414 -4.604 -12.183 1.00 0.00 O ATOM 1272 NE2 GLN A 80 2.323 -2.678 -11.663 1.00 0.00 N ATOM 0 H GLN A 80 -0.986 -3.900 -7.225 1.00 0.00 H new ATOM 0 HA GLN A 80 0.909 -2.433 -8.947 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -0.508 -4.503 -10.059 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -1.768 -3.286 -10.108 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -0.808 -3.135 -12.246 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -0.056 -1.804 -11.390 1.00 0.00 H new ATOM 0 HE21 GLN A 80 2.215 -1.718 -11.335 1.00 0.00 H new ATOM 0 HE22 GLN A 80 3.249 -3.037 -11.895 1.00 0.00 H new ATOM 1281 N LEU A 81 -0.507 -0.399 -9.059 1.00 0.00 N ATOM 1282 CA LEU A 81 -1.124 0.941 -8.917 1.00 0.00 C ATOM 1283 C LEU A 81 -2.224 1.164 -10.020 1.00 0.00 C ATOM 1284 O LEU A 81 -2.013 1.741 -11.090 1.00 0.00 O ATOM 1285 CB LEU A 81 0.016 2.016 -8.904 1.00 0.00 C ATOM 1286 CG LEU A 81 1.288 1.947 -9.808 1.00 0.00 C ATOM 1287 CD1 LEU A 81 1.000 2.045 -11.315 1.00 0.00 C ATOM 1288 CD2 LEU A 81 2.269 3.068 -9.420 1.00 0.00 C ATOM 0 H LEU A 81 0.277 -0.410 -9.712 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.658 1.033 -7.971 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -0.462 2.971 -9.123 1.00 0.00 H new ATOM 0 HB3 LEU A 81 0.375 2.068 -7.876 1.00 0.00 H new ATOM 0 HG LEU A 81 1.718 0.961 -9.632 1.00 0.00 H new ATOM 0 HD11 LEU A 81 1.937 1.989 -11.869 1.00 0.00 H new ATOM 0 HD12 LEU A 81 0.351 1.223 -11.616 1.00 0.00 H new ATOM 0 HD13 LEU A 81 0.508 2.993 -11.530 1.00 0.00 H new ATOM 0 HD21 LEU A 81 3.153 3.013 -10.055 1.00 0.00 H new ATOM 0 HD22 LEU A 81 1.786 4.036 -9.553 1.00 0.00 H new ATOM 0 HD23 LEU A 81 2.563 2.949 -8.377 1.00 0.00 H new ATOM 1300 N GLU A 82 -3.447 0.739 -9.682 1.00 0.00 N ATOM 1301 CA GLU A 82 -4.673 0.863 -10.514 1.00 0.00 C ATOM 1302 C GLU A 82 -5.220 2.335 -10.444 1.00 0.00 C ATOM 1303 O GLU A 82 -5.795 2.766 -9.442 1.00 0.00 O ATOM 1304 CB GLU A 82 -5.583 -0.237 -9.886 1.00 0.00 C ATOM 1305 CG GLU A 82 -7.018 -0.494 -10.404 1.00 0.00 C ATOM 1306 CD GLU A 82 -7.774 -1.498 -9.522 1.00 0.00 C ATOM 1307 OE1 GLU A 82 -7.194 -2.539 -9.134 1.00 0.00 O ATOM 1308 OE2 GLU A 82 -8.947 -1.229 -9.187 1.00 0.00 O ATOM 0 H GLU A 82 -3.628 0.280 -8.789 1.00 0.00 H new ATOM 0 HA GLU A 82 -4.559 0.706 -11.587 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -5.043 -1.180 -9.969 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -5.666 -0.010 -8.823 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -7.567 0.447 -10.435 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -6.973 -0.870 -11.426 1.00 0.00 H new ATOM 1315 N ALA A 83 -5.044 3.127 -11.520 1.00 0.00 N ATOM 1316 CA ALA A 83 -5.411 4.573 -11.527 1.00 0.00 C ATOM 1317 C ALA A 83 -6.944 4.828 -11.652 1.00 0.00 C ATOM 1318 O ALA A 83 -7.591 4.326 -12.578 1.00 0.00 O ATOM 1319 CB ALA A 83 -4.642 5.194 -12.711 1.00 0.00 C ATOM 0 H ALA A 83 -4.650 2.797 -12.401 1.00 0.00 H new ATOM 0 HA ALA A 83 -5.141 5.029 -10.574 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -4.868 6.259 -12.773 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -3.571 5.058 -12.561 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -4.943 4.705 -13.637 1.00 0.00 H new ATOM 1325 N VAL A 84 -7.521 5.624 -10.724 1.00 0.00 N ATOM 1326 CA VAL A 84 -9.000 5.858 -10.693 1.00 0.00 C ATOM 1327 C VAL A 84 -9.309 7.384 -10.901 1.00 0.00 C ATOM 1328 O VAL A 84 -8.591 8.285 -10.453 1.00 0.00 O ATOM 1329 CB VAL A 84 -9.564 5.277 -9.345 1.00 0.00 C ATOM 1330 CG1 VAL A 84 -11.069 5.565 -9.102 1.00 0.00 C ATOM 1331 CG2 VAL A 84 -9.399 3.740 -9.212 1.00 0.00 C ATOM 0 H VAL A 84 -7.003 6.112 -9.993 1.00 0.00 H new ATOM 0 HA VAL A 84 -9.502 5.340 -11.511 1.00 0.00 H new ATOM 0 HB VAL A 84 -8.957 5.800 -8.606 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -11.374 5.129 -8.151 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -11.234 6.642 -9.077 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -11.658 5.127 -9.908 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -9.811 3.411 -8.258 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -9.929 3.245 -10.026 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -8.341 3.482 -9.259 1.00 0.00 H new ATOM 1341 N ASN A 85 -10.416 7.660 -11.604 1.00 0.00 N ATOM 1342 CA ASN A 85 -10.902 9.039 -11.894 1.00 0.00 C ATOM 1343 C ASN A 85 -11.847 9.534 -10.746 1.00 0.00 C ATOM 1344 O ASN A 85 -12.957 9.022 -10.574 1.00 0.00 O ATOM 1345 CB ASN A 85 -11.583 9.034 -13.297 1.00 0.00 C ATOM 1346 CG ASN A 85 -12.790 8.102 -13.533 1.00 0.00 C ATOM 1347 OD1 ASN A 85 -12.661 6.884 -13.587 1.00 0.00 O ATOM 1348 ND2 ASN A 85 -13.982 8.628 -13.673 1.00 0.00 N ATOM 0 H ASN A 85 -11.014 6.933 -11.997 1.00 0.00 H new ATOM 0 HA ASN A 85 -10.075 9.749 -11.926 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -11.906 10.053 -13.511 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -10.821 8.780 -14.033 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -14.791 8.025 -13.825 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -14.101 9.640 -13.630 1.00 0.00 H new ATOM 1355 N ILE A 86 -11.411 10.530 -9.952 1.00 0.00 N ATOM 1356 CA ILE A 86 -12.216 11.048 -8.803 1.00 0.00 C ATOM 1357 C ILE A 86 -13.159 12.213 -9.270 1.00 0.00 C ATOM 1358 O ILE A 86 -12.729 13.288 -9.695 1.00 0.00 O ATOM 1359 CB ILE A 86 -11.237 11.392 -7.618 1.00 0.00 C ATOM 1360 CG1 ILE A 86 -12.010 11.582 -6.271 1.00 0.00 C ATOM 1361 CG2 ILE A 86 -10.295 12.603 -7.873 1.00 0.00 C ATOM 1362 CD1 ILE A 86 -12.798 12.880 -5.996 1.00 0.00 C ATOM 0 H ILE A 86 -10.513 10.997 -10.075 1.00 0.00 H new ATOM 0 HA ILE A 86 -12.903 10.294 -8.418 1.00 0.00 H new ATOM 0 HB ILE A 86 -10.585 10.521 -7.547 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -12.714 10.754 -6.185 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -11.285 11.469 -5.465 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -9.660 12.760 -7.001 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -9.671 12.402 -8.744 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -10.892 13.497 -8.053 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -13.264 12.821 -5.012 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -12.118 13.732 -6.025 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -13.569 13.005 -6.756 1.00 0.00 H new ATOM 1374 N THR A 87 -14.470 11.938 -9.207 1.00 0.00 N ATOM 1375 CA THR A 87 -15.559 12.918 -9.533 1.00 0.00 C ATOM 1376 C THR A 87 -16.966 12.477 -8.975 1.00 0.00 C ATOM 1377 O THR A 87 -17.780 13.359 -8.697 1.00 0.00 O ATOM 1378 CB THR A 87 -15.639 13.179 -11.080 1.00 0.00 C ATOM 1379 OG1 THR A 87 -16.579 14.221 -11.326 1.00 0.00 O ATOM 1380 CG2 THR A 87 -16.073 11.990 -11.961 1.00 0.00 C ATOM 0 H THR A 87 -14.825 11.024 -8.927 1.00 0.00 H new ATOM 0 HA THR A 87 -15.295 13.849 -9.031 1.00 0.00 H new ATOM 0 HB THR A 87 -14.612 13.416 -11.358 1.00 0.00 H new ATOM 0 HG1 THR A 87 -16.634 14.391 -12.290 1.00 0.00 H new ATOM 0 HG21 THR A 87 -16.089 12.298 -13.006 1.00 0.00 H new ATOM 0 HG22 THR A 87 -15.368 11.168 -11.836 1.00 0.00 H new ATOM 0 HG23 THR A 87 -17.069 11.662 -11.664 1.00 0.00 H new ATOM 1388 N ASP A 88 -17.246 11.168 -8.781 1.00 0.00 N ATOM 1389 CA ASP A 88 -18.519 10.648 -8.210 1.00 0.00 C ATOM 1390 C ASP A 88 -18.250 9.171 -7.747 1.00 0.00 C ATOM 1391 O ASP A 88 -18.669 8.199 -8.384 1.00 0.00 O ATOM 1392 CB ASP A 88 -19.659 10.782 -9.262 1.00 0.00 C ATOM 1393 CG ASP A 88 -21.064 10.469 -8.744 1.00 0.00 C ATOM 1394 OD1 ASP A 88 -21.391 10.844 -7.596 1.00 0.00 O ATOM 1395 OD2 ASP A 88 -21.853 9.858 -9.495 1.00 0.00 O ATOM 0 H ASP A 88 -16.586 10.428 -9.019 1.00 0.00 H new ATOM 0 HA ASP A 88 -18.852 11.220 -7.344 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -19.652 11.799 -9.654 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -19.441 10.117 -10.097 1.00 0.00 H new ATOM 1400 N LEU A 89 -17.496 9.001 -6.642 1.00 0.00 N ATOM 1401 CA LEU A 89 -17.151 7.660 -6.090 1.00 0.00 C ATOM 1402 C LEU A 89 -17.826 7.505 -4.693 1.00 0.00 C ATOM 1403 O LEU A 89 -17.329 7.993 -3.671 1.00 0.00 O ATOM 1404 CB LEU A 89 -15.598 7.487 -6.018 1.00 0.00 C ATOM 1405 CG LEU A 89 -14.866 6.828 -7.222 1.00 0.00 C ATOM 1406 CD1 LEU A 89 -15.226 5.341 -7.403 1.00 0.00 C ATOM 1407 CD2 LEU A 89 -15.045 7.581 -8.549 1.00 0.00 C ATOM 0 H LEU A 89 -17.108 9.777 -6.106 1.00 0.00 H new ATOM 0 HA LEU A 89 -17.526 6.872 -6.743 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -15.162 8.474 -5.865 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -15.371 6.897 -5.130 1.00 0.00 H new ATOM 0 HG LEU A 89 -13.811 6.894 -6.956 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -14.684 4.937 -8.258 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -14.951 4.788 -6.505 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -16.298 5.244 -7.574 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -14.505 7.059 -9.339 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -16.104 7.626 -8.802 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -14.653 8.593 -8.449 1.00 0.00 H new ATOM 1419 N SER A 90 -18.961 6.790 -4.664 1.00 0.00 N ATOM 1420 CA SER A 90 -19.717 6.504 -3.408 1.00 0.00 C ATOM 1421 C SER A 90 -19.177 5.335 -2.504 1.00 0.00 C ATOM 1422 O SER A 90 -19.669 5.176 -1.382 1.00 0.00 O ATOM 1423 CB SER A 90 -21.171 6.206 -3.857 1.00 0.00 C ATOM 1424 OG SER A 90 -21.267 5.018 -4.651 1.00 0.00 O ATOM 0 H SER A 90 -19.389 6.390 -5.499 1.00 0.00 H new ATOM 0 HA SER A 90 -19.614 7.373 -2.758 1.00 0.00 H new ATOM 0 HB2 SER A 90 -21.806 6.103 -2.977 1.00 0.00 H new ATOM 0 HB3 SER A 90 -21.552 7.053 -4.428 1.00 0.00 H new ATOM 0 HG SER A 90 -22.201 4.871 -4.908 1.00 0.00 H new ATOM 1430 N GLU A 91 -18.170 4.550 -2.938 1.00 0.00 N ATOM 1431 CA GLU A 91 -17.645 3.390 -2.173 1.00 0.00 C ATOM 1432 C GLU A 91 -16.647 3.831 -1.043 1.00 0.00 C ATOM 1433 O GLU A 91 -15.428 3.908 -1.232 1.00 0.00 O ATOM 1434 CB GLU A 91 -16.981 2.407 -3.184 1.00 0.00 C ATOM 1435 CG GLU A 91 -17.923 1.734 -4.224 1.00 0.00 C ATOM 1436 CD GLU A 91 -17.253 0.667 -5.072 1.00 0.00 C ATOM 1437 OE1 GLU A 91 -16.541 1.001 -6.041 1.00 0.00 O ATOM 1438 OE2 GLU A 91 -17.380 -0.536 -4.752 1.00 0.00 O ATOM 0 H GLU A 91 -17.695 4.699 -3.828 1.00 0.00 H new ATOM 0 HA GLU A 91 -18.466 2.890 -1.658 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -16.206 2.949 -3.727 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -16.483 1.621 -2.617 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -18.767 1.287 -3.698 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -18.328 2.503 -4.881 1.00 0.00 H new ATOM 1445 N ASN A 92 -17.178 4.050 0.176 1.00 0.00 N ATOM 1446 CA ASN A 92 -16.349 4.417 1.370 1.00 0.00 C ATOM 1447 C ASN A 92 -15.581 3.203 2.034 1.00 0.00 C ATOM 1448 O ASN A 92 -14.568 3.428 2.704 1.00 0.00 O ATOM 1449 CB ASN A 92 -17.323 5.102 2.375 1.00 0.00 C ATOM 1450 CG ASN A 92 -16.653 5.841 3.545 1.00 0.00 C ATOM 1451 OD1 ASN A 92 -15.675 6.566 3.393 1.00 0.00 O ATOM 1452 ND2 ASN A 92 -17.162 5.713 4.747 1.00 0.00 N ATOM 0 H ASN A 92 -18.177 3.982 0.373 1.00 0.00 H new ATOM 0 HA ASN A 92 -15.544 5.082 1.058 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -17.943 5.811 1.827 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -17.991 4.343 2.782 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -16.745 6.211 5.533 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -17.975 5.115 4.896 1.00 0.00 H new ATOM 1459 N ARG A 93 -16.074 1.958 1.880 1.00 0.00 N ATOM 1460 CA ARG A 93 -15.442 0.718 2.404 1.00 0.00 C ATOM 1461 C ARG A 93 -15.569 -0.385 1.293 1.00 0.00 C ATOM 1462 O ARG A 93 -16.660 -0.900 1.021 1.00 0.00 O ATOM 1463 CB ARG A 93 -16.093 0.308 3.766 1.00 0.00 C ATOM 1464 CG ARG A 93 -17.634 0.106 3.808 1.00 0.00 C ATOM 1465 CD ARG A 93 -18.230 -0.323 5.167 1.00 0.00 C ATOM 1466 NE ARG A 93 -17.874 -1.691 5.649 1.00 0.00 N ATOM 1467 CZ ARG A 93 -18.344 -2.843 5.173 1.00 0.00 C ATOM 1468 NH1 ARG A 93 -18.974 -2.961 4.037 1.00 0.00 N ATOM 1469 NH2 ARG A 93 -18.170 -3.921 5.873 1.00 0.00 N ATOM 0 H ARG A 93 -16.943 1.776 1.377 1.00 0.00 H new ATOM 0 HA ARG A 93 -14.384 0.868 2.621 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -15.626 -0.621 4.093 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -15.836 1.070 4.502 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -18.110 1.038 3.505 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -17.901 -0.645 3.065 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -17.913 0.398 5.921 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -19.316 -0.257 5.099 1.00 0.00 H new ATOM 0 HE ARG A 93 -17.206 -1.749 6.418 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -19.132 -2.139 3.454 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -19.308 -3.875 3.732 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -17.682 -3.875 6.768 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -18.521 -4.815 5.529 1.00 0.00 H new ATOM 1483 N LYS A 94 -14.456 -0.749 0.629 1.00 0.00 N ATOM 1484 CA LYS A 94 -14.461 -1.794 -0.439 1.00 0.00 C ATOM 1485 C LYS A 94 -14.376 -3.235 0.177 1.00 0.00 C ATOM 1486 O LYS A 94 -13.299 -3.721 0.534 1.00 0.00 O ATOM 1487 CB LYS A 94 -13.270 -1.521 -1.398 1.00 0.00 C ATOM 1488 CG LYS A 94 -13.391 -0.342 -2.393 1.00 0.00 C ATOM 1489 CD LYS A 94 -14.405 -0.532 -3.541 1.00 0.00 C ATOM 1490 CE LYS A 94 -14.127 -1.687 -4.531 1.00 0.00 C ATOM 1491 NZ LYS A 94 -15.101 -1.570 -5.649 1.00 0.00 N ATOM 0 H LYS A 94 -13.538 -0.342 0.805 1.00 0.00 H new ATOM 0 HA LYS A 94 -15.397 -1.745 -0.995 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -12.382 -1.353 -0.788 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -13.092 -2.428 -1.976 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -13.667 0.553 -1.835 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -12.409 -0.156 -2.828 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -15.390 -0.690 -3.102 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -14.455 0.397 -4.108 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -13.105 -1.631 -4.907 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -14.231 -2.651 -4.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -15.006 -2.391 -6.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -16.067 -1.538 -5.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -14.912 -0.699 -6.185 1.00 0.00 H new ATOM 1505 N GLN A 95 -15.524 -3.925 0.285 1.00 0.00 N ATOM 1506 CA GLN A 95 -15.599 -5.300 0.859 1.00 0.00 C ATOM 1507 C GLN A 95 -15.329 -6.374 -0.252 1.00 0.00 C ATOM 1508 O GLN A 95 -16.215 -6.680 -1.056 1.00 0.00 O ATOM 1509 CB GLN A 95 -17.006 -5.396 1.514 1.00 0.00 C ATOM 1510 CG GLN A 95 -17.271 -6.673 2.351 1.00 0.00 C ATOM 1511 CD GLN A 95 -18.657 -6.692 3.013 1.00 0.00 C ATOM 1512 OE1 GLN A 95 -19.004 -5.843 3.832 1.00 0.00 O ATOM 1513 NE2 GLN A 95 -19.497 -7.649 2.700 1.00 0.00 N ATOM 0 H GLN A 95 -16.426 -3.558 -0.018 1.00 0.00 H new ATOM 0 HA GLN A 95 -14.835 -5.496 1.611 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -17.148 -4.527 2.156 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -17.758 -5.337 0.727 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -17.172 -7.547 1.708 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -16.506 -6.757 3.123 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -19.228 -8.363 2.023 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -20.420 -7.680 3.134 1.00 0.00 H new ATOM 1522 N ASP A 96 -14.102 -6.933 -0.290 1.00 0.00 N ATOM 1523 CA ASP A 96 -13.681 -7.915 -1.336 1.00 0.00 C ATOM 1524 C ASP A 96 -12.638 -8.972 -0.805 1.00 0.00 C ATOM 1525 O ASP A 96 -12.102 -8.902 0.306 1.00 0.00 O ATOM 1526 CB ASP A 96 -13.116 -7.051 -2.514 1.00 0.00 C ATOM 1527 CG ASP A 96 -12.614 -7.782 -3.761 1.00 0.00 C ATOM 1528 OD1 ASP A 96 -13.229 -8.793 -4.163 1.00 0.00 O ATOM 1529 OD2 ASP A 96 -11.546 -7.403 -4.287 1.00 0.00 O ATOM 0 H ASP A 96 -13.373 -6.725 0.393 1.00 0.00 H new ATOM 0 HA ASP A 96 -14.523 -8.527 -1.659 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -13.897 -6.357 -2.825 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -12.294 -6.451 -2.124 1.00 0.00 H new ATOM 1534 N LYS A 97 -12.417 -10.005 -1.634 1.00 0.00 N ATOM 1535 CA LYS A 97 -11.374 -11.057 -1.421 1.00 0.00 C ATOM 1536 C LYS A 97 -10.471 -11.286 -2.701 1.00 0.00 C ATOM 1537 O LYS A 97 -10.005 -12.400 -2.960 1.00 0.00 O ATOM 1538 CB LYS A 97 -12.097 -12.349 -0.926 1.00 0.00 C ATOM 1539 CG LYS A 97 -13.120 -13.013 -1.890 1.00 0.00 C ATOM 1540 CD LYS A 97 -13.831 -14.258 -1.322 1.00 0.00 C ATOM 1541 CE LYS A 97 -12.949 -15.521 -1.307 1.00 0.00 C ATOM 1542 NZ LYS A 97 -13.750 -16.681 -0.827 1.00 0.00 N ATOM 0 H LYS A 97 -12.958 -10.147 -2.487 1.00 0.00 H new ATOM 0 HA LYS A 97 -10.665 -10.733 -0.659 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -11.334 -13.089 -0.683 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -12.616 -12.109 0.002 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -13.874 -12.274 -2.162 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -12.603 -13.294 -2.808 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -14.162 -14.045 -0.306 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -14.725 -14.457 -1.913 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -12.564 -15.720 -2.307 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -12.087 -15.368 -0.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -13.155 -17.534 -0.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -14.097 -16.489 0.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -14.559 -16.831 -1.463 1.00 0.00 H new ATOM 1556 N ARG A 98 -10.150 -10.210 -3.445 1.00 0.00 N ATOM 1557 CA ARG A 98 -9.343 -10.237 -4.704 1.00 0.00 C ATOM 1558 C ARG A 98 -8.322 -9.039 -4.699 1.00 0.00 C ATOM 1559 O ARG A 98 -7.115 -9.249 -4.832 1.00 0.00 O ATOM 1560 CB ARG A 98 -10.356 -10.228 -5.897 1.00 0.00 C ATOM 1561 CG ARG A 98 -9.951 -11.008 -7.170 1.00 0.00 C ATOM 1562 CD ARG A 98 -8.993 -10.309 -8.160 1.00 0.00 C ATOM 1563 NE ARG A 98 -7.561 -10.265 -7.744 1.00 0.00 N ATOM 1564 CZ ARG A 98 -6.701 -11.281 -7.795 1.00 0.00 C ATOM 1565 NH1 ARG A 98 -7.031 -12.508 -8.100 1.00 0.00 N ATOM 1566 NH2 ARG A 98 -5.460 -11.037 -7.527 1.00 0.00 N ATOM 0 H ARG A 98 -10.447 -9.268 -3.190 1.00 0.00 H new ATOM 0 HA ARG A 98 -8.729 -11.133 -4.798 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -11.303 -10.632 -5.540 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -10.538 -9.191 -6.179 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -9.488 -11.944 -6.858 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -10.862 -11.267 -7.710 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -9.058 -10.817 -9.122 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -9.340 -9.287 -8.315 1.00 0.00 H new ATOM 0 HE ARG A 98 -7.208 -9.376 -7.388 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -8.001 -12.736 -8.318 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -6.319 -13.238 -8.120 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -5.167 -10.090 -7.286 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -4.774 -11.791 -7.556 1.00 0.00 H new ATOM 1580 N PHE A 99 -8.806 -7.797 -4.544 1.00 0.00 N ATOM 1581 CA PHE A 99 -7.987 -6.556 -4.381 1.00 0.00 C ATOM 1582 C PHE A 99 -7.869 -6.099 -2.877 1.00 0.00 C ATOM 1583 O PHE A 99 -7.491 -4.942 -2.665 1.00 0.00 O ATOM 1584 CB PHE A 99 -8.717 -5.490 -5.259 1.00 0.00 C ATOM 1585 CG PHE A 99 -8.785 -5.588 -6.803 1.00 0.00 C ATOM 1586 CD1 PHE A 99 -8.109 -6.556 -7.555 1.00 0.00 C ATOM 1587 CD2 PHE A 99 -9.554 -4.627 -7.471 1.00 0.00 C ATOM 1588 CE1 PHE A 99 -8.221 -6.579 -8.943 1.00 0.00 C ATOM 1589 CE2 PHE A 99 -9.656 -4.644 -8.860 1.00 0.00 C ATOM 1590 CZ PHE A 99 -8.991 -5.621 -9.594 1.00 0.00 C ATOM 0 H PHE A 99 -9.808 -7.608 -4.526 1.00 0.00 H new ATOM 0 HA PHE A 99 -6.954 -6.713 -4.692 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -9.747 -5.446 -4.904 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -8.258 -4.529 -5.028 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -7.496 -7.291 -7.055 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -10.072 -3.867 -6.905 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -7.710 -7.340 -9.514 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -10.251 -3.899 -9.367 1.00 0.00 H new ATOM 0 HZ PHE A 99 -9.073 -5.636 -10.671 1.00 0.00 H new ATOM 1600 N ALA A 100 -8.172 -6.924 -1.835 1.00 0.00 N ATOM 1601 CA ALA A 100 -8.110 -6.475 -0.427 1.00 0.00 C ATOM 1602 C ALA A 100 -6.832 -7.009 0.279 1.00 0.00 C ATOM 1603 O ALA A 100 -6.091 -7.872 -0.211 1.00 0.00 O ATOM 1604 CB ALA A 100 -9.424 -6.949 0.234 1.00 0.00 C ATOM 0 H ALA A 100 -8.459 -7.896 -1.950 1.00 0.00 H new ATOM 0 HA ALA A 100 -8.030 -5.391 -0.347 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -9.435 -6.645 1.281 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -10.273 -6.502 -0.283 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -9.492 -8.035 0.171 1.00 0.00 H new ATOM 1610 N PHE A 101 -6.570 -6.451 1.462 1.00 0.00 N ATOM 1611 CA PHE A 101 -5.377 -6.796 2.277 1.00 0.00 C ATOM 1612 C PHE A 101 -5.788 -6.924 3.770 1.00 0.00 C ATOM 1613 O PHE A 101 -6.799 -6.347 4.184 1.00 0.00 O ATOM 1614 CB PHE A 101 -4.271 -5.702 2.083 1.00 0.00 C ATOM 1615 CG PHE A 101 -3.795 -5.477 0.635 1.00 0.00 C ATOM 1616 CD1 PHE A 101 -2.792 -6.266 0.069 1.00 0.00 C ATOM 1617 CD2 PHE A 101 -4.474 -4.555 -0.170 1.00 0.00 C ATOM 1618 CE1 PHE A 101 -2.495 -6.162 -1.287 1.00 0.00 C ATOM 1619 CE2 PHE A 101 -4.180 -4.454 -1.523 1.00 0.00 C ATOM 1620 CZ PHE A 101 -3.182 -5.247 -2.078 1.00 0.00 C ATOM 0 H PHE A 101 -7.170 -5.747 1.892 1.00 0.00 H new ATOM 0 HA PHE A 101 -4.968 -7.753 1.951 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -4.650 -4.757 2.472 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -3.408 -5.973 2.691 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -2.243 -6.961 0.687 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -5.231 -3.919 0.264 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -1.733 -6.790 -1.724 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -4.726 -3.760 -2.144 1.00 0.00 H new ATOM 0 HZ PHE A 101 -2.939 -5.152 -3.126 1.00 0.00 H new ATOM 1630 N ILE A 102 -5.036 -7.675 4.599 1.00 0.00 N ATOM 1631 CA ILE A 102 -5.388 -7.766 6.072 1.00 0.00 C ATOM 1632 C ILE A 102 -4.177 -7.233 6.889 1.00 0.00 C ATOM 1633 O ILE A 102 -3.056 -7.731 6.778 1.00 0.00 O ATOM 1634 CB ILE A 102 -5.859 -9.190 6.557 1.00 0.00 C ATOM 1635 CG1 ILE A 102 -7.086 -9.694 5.734 1.00 0.00 C ATOM 1636 CG2 ILE A 102 -6.255 -9.158 8.065 1.00 0.00 C ATOM 1637 CD1 ILE A 102 -7.604 -11.105 6.063 1.00 0.00 C ATOM 0 H ILE A 102 -4.216 -8.211 4.315 1.00 0.00 H new ATOM 0 HA ILE A 102 -6.269 -7.147 6.242 1.00 0.00 H new ATOM 0 HB ILE A 102 -5.020 -9.870 6.408 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -7.905 -8.989 5.877 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -6.822 -9.666 4.677 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -6.577 -10.151 8.378 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -5.395 -8.851 8.660 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -7.070 -8.450 8.212 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -8.457 -11.338 5.425 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -6.812 -11.833 5.890 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -7.911 -11.145 7.108 1.00 0.00 H new ATOM 1649 N ARG A 103 -4.416 -6.220 7.742 1.00 0.00 N ATOM 1650 CA ARG A 103 -3.345 -5.641 8.598 1.00 0.00 C ATOM 1651 C ARG A 103 -3.158 -6.483 9.906 1.00 0.00 C ATOM 1652 O ARG A 103 -3.802 -6.226 10.928 1.00 0.00 O ATOM 1653 CB ARG A 103 -3.717 -4.154 8.864 1.00 0.00 C ATOM 1654 CG ARG A 103 -2.554 -3.324 9.458 1.00 0.00 C ATOM 1655 CD ARG A 103 -2.920 -1.846 9.719 1.00 0.00 C ATOM 1656 NE ARG A 103 -1.774 -1.114 10.334 1.00 0.00 N ATOM 1657 CZ ARG A 103 -1.398 -1.207 11.610 1.00 0.00 C ATOM 1658 NH1 ARG A 103 -2.102 -1.811 12.532 1.00 0.00 N ATOM 1659 NH2 ARG A 103 -0.252 -0.706 11.963 1.00 0.00 N ATOM 0 H ARG A 103 -5.330 -5.784 7.862 1.00 0.00 H new ATOM 0 HA ARG A 103 -2.376 -5.675 8.101 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -4.040 -3.696 7.929 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -4.566 -4.117 9.547 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -2.233 -3.781 10.394 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -1.704 -3.364 8.776 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -3.202 -1.366 8.782 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -3.787 -1.793 10.378 1.00 0.00 H new ATOM 0 HE ARG A 103 -1.235 -0.493 9.730 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -2.993 -2.245 12.291 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -1.760 -1.848 13.492 1.00 0.00 H new ATOM 0 HH21 ARG A 103 0.342 -0.252 11.269 1.00 0.00 H new ATOM 0 HH22 ARG A 103 0.054 -0.767 12.934 1.00 0.00 H new ATOM 1673 N SER A 104 -2.241 -7.471 9.872 1.00 0.00 N ATOM 1674 CA SER A 104 -1.916 -8.320 11.062 1.00 0.00 C ATOM 1675 C SER A 104 -1.152 -7.533 12.185 1.00 0.00 C ATOM 1676 O SER A 104 -1.558 -7.602 13.346 1.00 0.00 O ATOM 1677 CB SER A 104 -1.113 -9.541 10.552 1.00 0.00 C ATOM 1678 OG SER A 104 -0.849 -10.456 11.616 1.00 0.00 O ATOM 0 H SER A 104 -1.706 -7.710 9.037 1.00 0.00 H new ATOM 0 HA SER A 104 -2.839 -8.647 11.541 1.00 0.00 H new ATOM 0 HB2 SER A 104 -1.671 -10.045 9.763 1.00 0.00 H new ATOM 0 HB3 SER A 104 -0.173 -9.206 10.113 1.00 0.00 H new ATOM 0 HG SER A 104 -0.342 -11.221 11.272 1.00 0.00 H new ATOM 1684 N ASP A 105 -0.056 -6.823 11.833 1.00 0.00 N ATOM 1685 CA ASP A 105 0.725 -5.915 12.726 1.00 0.00 C ATOM 1686 C ASP A 105 1.526 -6.568 13.908 1.00 0.00 C ATOM 1687 O ASP A 105 1.216 -7.641 14.434 1.00 0.00 O ATOM 1688 CB ASP A 105 -0.242 -4.802 13.260 1.00 0.00 C ATOM 1689 CG ASP A 105 0.399 -3.470 13.627 1.00 0.00 C ATOM 1690 OD1 ASP A 105 1.483 -3.158 13.093 1.00 0.00 O ATOM 1691 OD2 ASP A 105 -0.248 -2.656 14.321 1.00 0.00 O ATOM 0 H ASP A 105 0.328 -6.863 10.889 1.00 0.00 H new ATOM 0 HA ASP A 105 1.522 -5.517 12.098 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -1.003 -4.618 12.502 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -0.756 -5.189 14.140 1.00 0.00 H new ATOM 1696 N SER A 106 2.600 -5.860 14.305 1.00 0.00 N ATOM 1697 CA SER A 106 3.447 -6.213 15.482 1.00 0.00 C ATOM 1698 C SER A 106 3.815 -4.958 16.371 1.00 0.00 C ATOM 1699 O SER A 106 4.870 -4.956 17.019 1.00 0.00 O ATOM 1700 CB SER A 106 4.702 -6.934 14.927 1.00 0.00 C ATOM 1701 OG SER A 106 5.582 -7.296 15.991 1.00 0.00 O ATOM 0 H SER A 106 2.915 -5.019 13.821 1.00 0.00 H new ATOM 0 HA SER A 106 2.897 -6.867 16.159 1.00 0.00 H new ATOM 0 HB2 SER A 106 4.403 -7.825 14.376 1.00 0.00 H new ATOM 0 HB3 SER A 106 5.221 -6.283 14.223 1.00 0.00 H new ATOM 0 HG SER A 106 5.568 -6.598 16.679 1.00 0.00 H new ATOM 1707 N GLY A 107 2.941 -3.932 16.470 1.00 0.00 N ATOM 1708 CA GLY A 107 3.202 -2.697 17.256 1.00 0.00 C ATOM 1709 C GLY A 107 4.036 -1.641 16.476 1.00 0.00 C ATOM 1710 O GLY A 107 3.466 -1.057 15.549 1.00 0.00 O ATOM 0 H GLY A 107 2.032 -3.933 16.008 1.00 0.00 H new ATOM 0 HA2 GLY A 107 2.251 -2.254 17.551 1.00 0.00 H new ATOM 0 HA3 GLY A 107 3.729 -2.962 18.173 1.00 0.00 H new ATOM 1714 N PRO A 108 5.346 -1.362 16.756 1.00 0.00 N ATOM 1715 CA PRO A 108 6.154 -0.381 15.963 1.00 0.00 C ATOM 1716 C PRO A 108 6.309 -0.645 14.423 1.00 0.00 C ATOM 1717 O PRO A 108 6.353 0.310 13.644 1.00 0.00 O ATOM 1718 CB PRO A 108 7.519 -0.414 16.689 1.00 0.00 C ATOM 1719 CG PRO A 108 7.229 -0.951 18.089 1.00 0.00 C ATOM 1720 CD PRO A 108 6.102 -1.961 17.875 1.00 0.00 C ATOM 0 HA PRO A 108 5.649 0.584 15.942 1.00 0.00 H new ATOM 0 HB2 PRO A 108 8.227 -1.054 16.163 1.00 0.00 H new ATOM 0 HB3 PRO A 108 7.962 0.581 16.735 1.00 0.00 H new ATOM 0 HG2 PRO A 108 8.109 -1.423 18.525 1.00 0.00 H new ATOM 0 HG3 PRO A 108 6.926 -0.153 18.767 1.00 0.00 H new ATOM 0 HD2 PRO A 108 6.485 -2.950 17.623 1.00 0.00 H new ATOM 0 HD3 PRO A 108 5.485 -2.076 18.766 1.00 0.00 H new ATOM 1728 N THR A 109 6.452 -1.917 14.005 1.00 0.00 N ATOM 1729 CA THR A 109 6.589 -2.309 12.570 1.00 0.00 C ATOM 1730 C THR A 109 5.373 -3.189 12.136 1.00 0.00 C ATOM 1731 O THR A 109 4.935 -4.089 12.862 1.00 0.00 O ATOM 1732 CB THR A 109 7.917 -3.088 12.303 1.00 0.00 C ATOM 1733 OG1 THR A 109 8.088 -4.176 13.203 1.00 0.00 O ATOM 1734 CG2 THR A 109 9.176 -2.220 12.422 1.00 0.00 C ATOM 0 H THR A 109 6.477 -2.710 14.646 1.00 0.00 H new ATOM 0 HA THR A 109 6.612 -1.391 11.982 1.00 0.00 H new ATOM 0 HB THR A 109 7.811 -3.437 11.276 1.00 0.00 H new ATOM 0 HG1 THR A 109 8.929 -4.638 13.002 1.00 0.00 H new ATOM 0 HG21 THR A 109 10.058 -2.829 12.223 1.00 0.00 H new ATOM 0 HG22 THR A 109 9.127 -1.406 11.699 1.00 0.00 H new ATOM 0 HG23 THR A 109 9.239 -1.807 13.429 1.00 0.00 H new ATOM 1742 N THR A 110 4.869 -2.956 10.910 1.00 0.00 N ATOM 1743 CA THR A 110 3.693 -3.691 10.361 1.00 0.00 C ATOM 1744 C THR A 110 4.047 -4.465 9.033 1.00 0.00 C ATOM 1745 O THR A 110 5.175 -4.460 8.521 1.00 0.00 O ATOM 1746 CB THR A 110 2.513 -2.646 10.260 1.00 0.00 C ATOM 1747 OG1 THR A 110 1.325 -3.282 10.705 1.00 0.00 O ATOM 1748 CG2 THR A 110 2.180 -2.094 8.866 1.00 0.00 C ATOM 0 H THR A 110 5.254 -2.262 10.270 1.00 0.00 H new ATOM 0 HA THR A 110 3.369 -4.500 11.016 1.00 0.00 H new ATOM 0 HB THR A 110 2.858 -1.802 10.857 1.00 0.00 H new ATOM 0 HG1 THR A 110 1.048 -2.895 11.562 1.00 0.00 H new ATOM 0 HG21 THR A 110 1.352 -1.389 8.942 1.00 0.00 H new ATOM 0 HG22 THR A 110 3.054 -1.586 8.458 1.00 0.00 H new ATOM 0 HG23 THR A 110 1.897 -2.915 8.207 1.00 0.00 H new ATOM 1756 N SER A 111 3.036 -5.234 8.591 1.00 0.00 N ATOM 1757 CA SER A 111 3.043 -6.073 7.351 1.00 0.00 C ATOM 1758 C SER A 111 1.557 -6.431 6.956 1.00 0.00 C ATOM 1759 O SER A 111 0.637 -6.289 7.777 1.00 0.00 O ATOM 1760 CB SER A 111 3.899 -7.344 7.574 1.00 0.00 C ATOM 1761 OG SER A 111 4.209 -7.969 6.327 1.00 0.00 O ATOM 0 H SER A 111 2.153 -5.300 9.097 1.00 0.00 H new ATOM 0 HA SER A 111 3.491 -5.517 6.527 1.00 0.00 H new ATOM 0 HB2 SER A 111 4.820 -7.081 8.094 1.00 0.00 H new ATOM 0 HB3 SER A 111 3.361 -8.044 8.213 1.00 0.00 H new ATOM 0 HG SER A 111 3.971 -8.919 6.369 1.00 0.00 H new ATOM 1767 N PHE A 112 1.290 -6.935 5.726 1.00 0.00 N ATOM 1768 CA PHE A 112 -0.117 -7.200 5.272 1.00 0.00 C ATOM 1769 C PHE A 112 -0.388 -8.614 4.644 1.00 0.00 C ATOM 1770 O PHE A 112 0.498 -9.243 4.072 1.00 0.00 O ATOM 1771 CB PHE A 112 -0.436 -6.123 4.184 1.00 0.00 C ATOM 1772 CG PHE A 112 -0.578 -4.650 4.605 1.00 0.00 C ATOM 1773 CD1 PHE A 112 -1.630 -4.240 5.429 1.00 0.00 C ATOM 1774 CD2 PHE A 112 0.304 -3.691 4.094 1.00 0.00 C ATOM 1775 CE1 PHE A 112 -1.786 -2.892 5.748 1.00 0.00 C ATOM 1776 CE2 PHE A 112 0.137 -2.344 4.405 1.00 0.00 C ATOM 1777 CZ PHE A 112 -0.910 -1.947 5.229 1.00 0.00 C ATOM 0 H PHE A 112 2.006 -7.165 5.037 1.00 0.00 H new ATOM 0 HA PHE A 112 -0.745 -7.161 6.162 1.00 0.00 H new ATOM 0 HB2 PHE A 112 0.350 -6.175 3.431 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -1.365 -6.416 3.695 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -2.324 -4.970 5.820 1.00 0.00 H new ATOM 0 HD2 PHE A 112 1.119 -3.997 3.455 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -2.589 -2.582 6.400 1.00 0.00 H new ATOM 0 HE2 PHE A 112 0.820 -1.608 4.007 1.00 0.00 H new ATOM 0 HZ PHE A 112 -1.043 -0.902 5.466 1.00 0.00 H new ATOM 1787 N GLU A 113 -1.657 -9.071 4.694 1.00 0.00 N ATOM 1788 CA GLU A 113 -2.160 -10.243 3.898 1.00 0.00 C ATOM 1789 C GLU A 113 -2.744 -9.689 2.529 1.00 0.00 C ATOM 1790 O GLU A 113 -2.882 -8.472 2.392 1.00 0.00 O ATOM 1791 CB GLU A 113 -3.199 -11.030 4.739 1.00 0.00 C ATOM 1792 CG GLU A 113 -3.285 -12.551 4.453 1.00 0.00 C ATOM 1793 CD GLU A 113 -2.073 -13.361 4.885 1.00 0.00 C ATOM 1794 OE1 GLU A 113 -1.912 -13.604 6.099 1.00 0.00 O ATOM 1795 OE2 GLU A 113 -1.274 -13.753 4.010 1.00 0.00 O ATOM 0 H GLU A 113 -2.373 -8.647 5.284 1.00 0.00 H new ATOM 0 HA GLU A 113 -1.363 -10.947 3.660 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -2.965 -10.891 5.794 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -4.182 -10.591 4.570 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -4.166 -12.950 4.956 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -3.436 -12.695 3.383 1.00 0.00 H new ATOM 1802 N SER A 114 -3.036 -10.515 1.500 1.00 0.00 N ATOM 1803 CA SER A 114 -3.399 -10.069 0.108 1.00 0.00 C ATOM 1804 C SER A 114 -4.429 -11.028 -0.556 1.00 0.00 C ATOM 1805 O SER A 114 -4.358 -12.252 -0.396 1.00 0.00 O ATOM 1806 CB SER A 114 -2.147 -10.038 -0.800 1.00 0.00 C ATOM 1807 OG SER A 114 -1.169 -9.164 -0.275 1.00 0.00 O ATOM 0 H SER A 114 -3.030 -11.530 1.600 1.00 0.00 H new ATOM 0 HA SER A 114 -3.832 -9.074 0.208 1.00 0.00 H new ATOM 0 HB2 SER A 114 -1.733 -11.042 -0.891 1.00 0.00 H new ATOM 0 HB3 SER A 114 -2.427 -9.717 -1.803 1.00 0.00 H new ATOM 0 HG SER A 114 -1.485 -8.239 -0.345 1.00 0.00 H new ATOM 1813 N ALA A 115 -5.315 -10.450 -1.406 1.00 0.00 N ATOM 1814 CA ALA A 115 -6.579 -11.098 -1.907 1.00 0.00 C ATOM 1815 C ALA A 115 -7.494 -10.841 -0.691 1.00 0.00 C ATOM 1816 O ALA A 115 -8.166 -9.797 -0.688 1.00 0.00 O ATOM 1817 CB ALA A 115 -6.438 -12.489 -2.546 1.00 0.00 C ATOM 0 H ALA A 115 -5.180 -9.508 -1.774 1.00 0.00 H new ATOM 0 HA ALA A 115 -7.018 -10.698 -2.821 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -7.418 -12.844 -2.864 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -5.776 -12.427 -3.410 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -6.020 -13.183 -1.817 1.00 0.00 H new ATOM 1823 N ALA A 116 -7.442 -11.747 0.301 1.00 0.00 N ATOM 1824 CA ALA A 116 -7.771 -11.341 1.701 1.00 0.00 C ATOM 1825 C ALA A 116 -7.245 -12.386 2.722 1.00 0.00 C ATOM 1826 O ALA A 116 -6.229 -12.140 3.373 1.00 0.00 O ATOM 1827 CB ALA A 116 -9.276 -10.994 1.893 1.00 0.00 C ATOM 0 H ALA A 116 -7.188 -12.728 0.181 1.00 0.00 H new ATOM 0 HA ALA A 116 -7.244 -10.409 1.903 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -9.454 -10.707 2.929 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -9.545 -10.167 1.236 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -9.884 -11.865 1.649 1.00 0.00 H new ATOM 1833 N CYS A 117 -7.983 -13.480 2.948 1.00 0.00 N ATOM 1834 CA CYS A 117 -7.542 -14.591 3.839 1.00 0.00 C ATOM 1835 C CYS A 117 -6.728 -15.539 2.903 1.00 0.00 C ATOM 1836 O CYS A 117 -5.503 -15.531 3.066 1.00 0.00 O ATOM 1837 CB CYS A 117 -8.745 -15.188 4.605 1.00 0.00 C ATOM 1838 SG CYS A 117 -9.287 -14.042 5.917 1.00 0.00 S ATOM 0 H CYS A 117 -8.900 -13.632 2.527 1.00 0.00 H new ATOM 0 HA CYS A 117 -6.892 -14.299 4.664 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -9.567 -15.378 3.915 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -8.468 -16.147 5.042 1.00 0.00 H new ATOM 0 HG CYS A 117 -10.299 -14.555 6.551 1.00 0.00 H new ATOM 1844 N PRO A 118 -7.269 -16.295 1.894 1.00 0.00 N ATOM 1845 CA PRO A 118 -6.415 -16.942 0.879 1.00 0.00 C ATOM 1846 C PRO A 118 -5.814 -15.886 -0.124 1.00 0.00 C ATOM 1847 O PRO A 118 -6.199 -14.696 -0.170 1.00 0.00 O ATOM 1848 CB PRO A 118 -7.403 -17.947 0.250 1.00 0.00 C ATOM 1849 CG PRO A 118 -8.757 -17.233 0.301 1.00 0.00 C ATOM 1850 CD PRO A 118 -8.713 -16.448 1.614 1.00 0.00 C ATOM 0 HA PRO A 118 -5.519 -17.432 1.260 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -7.122 -18.193 -0.774 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -7.426 -18.883 0.808 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -8.892 -16.572 -0.555 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -9.584 -17.943 0.288 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -9.205 -15.480 1.517 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -9.220 -16.984 2.416 1.00 0.00 H new ATOM 1858 N GLY A 119 -4.858 -16.415 -0.904 1.00 0.00 N ATOM 1859 CA GLY A 119 -4.135 -15.661 -1.946 1.00 0.00 C ATOM 1860 C GLY A 119 -2.628 -15.535 -1.699 1.00 0.00 C ATOM 1861 O GLY A 119 -1.863 -16.425 -2.075 1.00 0.00 O ATOM 0 H GLY A 119 -4.561 -17.388 -0.830 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -4.295 -16.148 -2.908 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -4.564 -14.662 -2.020 1.00 0.00 H new ATOM 1865 N TRP A 120 -2.213 -14.387 -1.153 1.00 0.00 N ATOM 1866 CA TRP A 120 -0.769 -14.055 -0.954 1.00 0.00 C ATOM 1867 C TRP A 120 -0.529 -13.209 0.342 1.00 0.00 C ATOM 1868 O TRP A 120 -1.466 -12.782 1.019 1.00 0.00 O ATOM 1869 CB TRP A 120 -0.307 -13.288 -2.248 1.00 0.00 C ATOM 1870 CG TRP A 120 0.194 -14.180 -3.392 1.00 0.00 C ATOM 1871 CD1 TRP A 120 1.480 -14.751 -3.475 1.00 0.00 C ATOM 1872 CD2 TRP A 120 -0.503 -14.677 -4.483 1.00 0.00 C ATOM 1873 NE1 TRP A 120 1.607 -15.598 -4.590 1.00 0.00 N ATOM 1874 CE2 TRP A 120 0.362 -15.548 -5.191 1.00 0.00 C ATOM 1875 CE3 TRP A 120 -1.859 -14.538 -4.878 1.00 0.00 C ATOM 1876 CZ2 TRP A 120 -0.124 -16.294 -6.289 1.00 0.00 C ATOM 1877 CZ3 TRP A 120 -2.317 -15.286 -5.963 1.00 0.00 C ATOM 1878 CH2 TRP A 120 -1.462 -16.146 -6.663 1.00 0.00 C ATOM 0 H TRP A 120 -2.850 -13.657 -0.834 1.00 0.00 H new ATOM 0 HA TRP A 120 -0.184 -14.963 -0.810 1.00 0.00 H new ATOM 0 HB2 TRP A 120 -1.141 -12.690 -2.614 1.00 0.00 H new ATOM 0 HB3 TRP A 120 0.488 -12.594 -1.975 1.00 0.00 H new ATOM 0 HD1 TRP A 120 2.273 -14.561 -2.767 1.00 0.00 H new ATOM 0 HE1 TRP A 120 2.427 -16.127 -4.887 1.00 0.00 H new ATOM 0 HE3 TRP A 120 -2.522 -13.868 -4.350 1.00 0.00 H new ATOM 0 HZ2 TRP A 120 0.527 -16.966 -6.829 1.00 0.00 H new ATOM 0 HZ3 TRP A 120 -3.349 -15.200 -6.268 1.00 0.00 H new ATOM 0 HH2 TRP A 120 -1.843 -16.704 -7.506 1.00 0.00 H new ATOM 1889 N PHE A 121 0.748 -12.930 0.661 1.00 0.00 N ATOM 1890 CA PHE A 121 1.141 -12.058 1.805 1.00 0.00 C ATOM 1891 C PHE A 121 1.904 -10.811 1.235 1.00 0.00 C ATOM 1892 O PHE A 121 2.902 -10.966 0.528 1.00 0.00 O ATOM 1893 CB PHE A 121 1.981 -12.928 2.779 1.00 0.00 C ATOM 1894 CG PHE A 121 2.441 -12.226 4.068 1.00 0.00 C ATOM 1895 CD1 PHE A 121 1.610 -12.205 5.194 1.00 0.00 C ATOM 1896 CD2 PHE A 121 3.698 -11.615 4.136 1.00 0.00 C ATOM 1897 CE1 PHE A 121 2.029 -11.588 6.369 1.00 0.00 C ATOM 1898 CE2 PHE A 121 4.120 -11.005 5.314 1.00 0.00 C ATOM 1899 CZ PHE A 121 3.287 -10.996 6.431 1.00 0.00 C ATOM 0 H PHE A 121 1.543 -13.298 0.139 1.00 0.00 H new ATOM 0 HA PHE A 121 0.291 -11.668 2.365 1.00 0.00 H new ATOM 0 HB2 PHE A 121 1.394 -13.804 3.053 1.00 0.00 H new ATOM 0 HB3 PHE A 121 2.862 -13.288 2.248 1.00 0.00 H new ATOM 0 HD1 PHE A 121 0.637 -12.671 5.151 1.00 0.00 H new ATOM 0 HD2 PHE A 121 4.344 -11.617 3.270 1.00 0.00 H new ATOM 0 HE1 PHE A 121 1.379 -11.569 7.231 1.00 0.00 H new ATOM 0 HE2 PHE A 121 5.093 -10.539 5.362 1.00 0.00 H new ATOM 0 HZ PHE A 121 3.618 -10.529 7.347 1.00 0.00 H new ATOM 1909 N LEU A 122 1.416 -9.580 1.472 1.00 0.00 N ATOM 1910 CA LEU A 122 2.078 -8.335 0.988 1.00 0.00 C ATOM 1911 C LEU A 122 3.188 -7.866 1.989 1.00 0.00 C ATOM 1912 O LEU A 122 2.969 -7.571 3.176 1.00 0.00 O ATOM 1913 CB LEU A 122 1.014 -7.216 0.749 1.00 0.00 C ATOM 1914 CG LEU A 122 1.515 -5.753 0.551 1.00 0.00 C ATOM 1915 CD1 LEU A 122 2.365 -5.603 -0.722 1.00 0.00 C ATOM 1916 CD2 LEU A 122 0.358 -4.748 0.498 1.00 0.00 C ATOM 0 H LEU A 122 0.559 -9.411 1.999 1.00 0.00 H new ATOM 0 HA LEU A 122 2.567 -8.547 0.037 1.00 0.00 H new ATOM 0 HB2 LEU A 122 0.434 -7.491 -0.132 1.00 0.00 H new ATOM 0 HB3 LEU A 122 0.329 -7.221 1.597 1.00 0.00 H new ATOM 0 HG LEU A 122 2.134 -5.534 1.421 1.00 0.00 H new ATOM 0 HD11 LEU A 122 2.693 -4.568 -0.821 1.00 0.00 H new ATOM 0 HD12 LEU A 122 3.236 -6.255 -0.657 1.00 0.00 H new ATOM 0 HD13 LEU A 122 1.769 -5.879 -1.592 1.00 0.00 H new ATOM 0 HD21 LEU A 122 0.755 -3.743 0.359 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -0.301 -4.996 -0.334 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -0.204 -4.790 1.431 1.00 0.00 H new ATOM 1928 N CYS A 123 4.382 -7.747 1.398 1.00 0.00 N ATOM 1929 CA CYS A 123 5.603 -7.240 2.050 1.00 0.00 C ATOM 1930 C CYS A 123 6.448 -6.452 0.981 1.00 0.00 C ATOM 1931 O CYS A 123 5.963 -6.035 -0.080 1.00 0.00 O ATOM 1932 CB CYS A 123 6.294 -8.480 2.669 1.00 0.00 C ATOM 1933 SG CYS A 123 6.631 -9.746 1.394 1.00 0.00 S ATOM 0 H CYS A 123 4.534 -8.008 0.424 1.00 0.00 H new ATOM 0 HA CYS A 123 5.431 -6.523 2.853 1.00 0.00 H new ATOM 0 HB2 CYS A 123 7.228 -8.181 3.145 1.00 0.00 H new ATOM 0 HB3 CYS A 123 5.660 -8.903 3.448 1.00 0.00 H new ATOM 0 HG CYS A 123 7.227 -9.192 0.380 1.00 0.00 H new ATOM 1939 N THR A 124 7.725 -6.196 1.277 1.00 0.00 N ATOM 1940 CA THR A 124 8.656 -5.488 0.348 1.00 0.00 C ATOM 1941 C THR A 124 9.851 -6.446 -0.005 1.00 0.00 C ATOM 1942 O THR A 124 10.151 -7.375 0.750 1.00 0.00 O ATOM 1943 CB THR A 124 9.046 -4.147 1.046 1.00 0.00 C ATOM 1944 OG1 THR A 124 7.888 -3.377 1.366 1.00 0.00 O ATOM 1945 CG2 THR A 124 9.881 -3.221 0.168 1.00 0.00 C ATOM 0 H THR A 124 8.157 -6.466 2.161 1.00 0.00 H new ATOM 0 HA THR A 124 8.215 -5.232 -0.615 1.00 0.00 H new ATOM 0 HB THR A 124 9.610 -4.463 1.923 1.00 0.00 H new ATOM 0 HG1 THR A 124 8.160 -2.543 1.804 1.00 0.00 H new ATOM 0 HG21 THR A 124 10.114 -2.310 0.719 1.00 0.00 H new ATOM 0 HG22 THR A 124 10.807 -3.723 -0.112 1.00 0.00 H new ATOM 0 HG23 THR A 124 9.319 -2.968 -0.731 1.00 0.00 H new ATOM 1953 N ALA A 125 10.556 -6.280 -1.147 1.00 0.00 N ATOM 1954 CA ALA A 125 11.704 -7.172 -1.508 1.00 0.00 C ATOM 1955 C ALA A 125 12.972 -6.983 -0.588 1.00 0.00 C ATOM 1956 O ALA A 125 12.847 -6.570 0.568 1.00 0.00 O ATOM 1957 CB ALA A 125 11.938 -6.905 -3.009 1.00 0.00 C ATOM 0 H ALA A 125 10.361 -5.550 -1.832 1.00 0.00 H new ATOM 0 HA ALA A 125 11.480 -8.224 -1.331 1.00 0.00 H new ATOM 0 HB1 ALA A 125 12.766 -7.519 -3.363 1.00 0.00 H new ATOM 0 HB2 ALA A 125 11.036 -7.155 -3.568 1.00 0.00 H new ATOM 0 HB3 ALA A 125 12.177 -5.852 -3.158 1.00 0.00 H new ATOM 1963 N MET A 126 14.198 -7.325 -1.033 1.00 0.00 N ATOM 1964 CA MET A 126 15.433 -7.184 -0.189 1.00 0.00 C ATOM 1965 C MET A 126 16.126 -5.776 -0.316 1.00 0.00 C ATOM 1966 O MET A 126 17.341 -5.620 -0.466 1.00 0.00 O ATOM 1967 CB MET A 126 16.335 -8.375 -0.574 1.00 0.00 C ATOM 1968 CG MET A 126 17.451 -8.701 0.441 1.00 0.00 C ATOM 1969 SD MET A 126 18.405 -10.135 -0.102 1.00 0.00 S ATOM 1970 CE MET A 126 17.411 -11.484 0.564 1.00 0.00 C ATOM 0 H MET A 126 14.374 -7.700 -1.965 1.00 0.00 H new ATOM 0 HA MET A 126 15.191 -7.218 0.873 1.00 0.00 H new ATOM 0 HB2 MET A 126 15.710 -9.259 -0.701 1.00 0.00 H new ATOM 0 HB3 MET A 126 16.793 -8.167 -1.541 1.00 0.00 H new ATOM 0 HG2 MET A 126 18.110 -7.840 0.554 1.00 0.00 H new ATOM 0 HG3 MET A 126 17.014 -8.898 1.420 1.00 0.00 H new ATOM 0 HE1 MET A 126 17.874 -12.437 0.309 1.00 0.00 H new ATOM 0 HE2 MET A 126 17.348 -11.389 1.648 1.00 0.00 H new ATOM 0 HE3 MET A 126 16.409 -11.442 0.138 1.00 0.00 H new ATOM 1980 N GLU A 127 15.267 -4.769 -0.129 1.00 0.00 N ATOM 1981 CA GLU A 127 15.570 -3.304 -0.059 1.00 0.00 C ATOM 1982 C GLU A 127 16.564 -2.697 -1.112 1.00 0.00 C ATOM 1983 O GLU A 127 16.779 -3.244 -2.199 1.00 0.00 O ATOM 1984 CB GLU A 127 15.900 -3.023 1.454 1.00 0.00 C ATOM 1985 CG GLU A 127 17.190 -3.650 2.054 1.00 0.00 C ATOM 1986 CD GLU A 127 17.553 -3.189 3.450 1.00 0.00 C ATOM 1987 OE1 GLU A 127 16.757 -3.349 4.401 1.00 0.00 O ATOM 1988 OE2 GLU A 127 18.655 -2.632 3.618 1.00 0.00 O ATOM 0 H GLU A 127 14.270 -4.949 -0.013 1.00 0.00 H new ATOM 0 HA GLU A 127 14.698 -2.741 -0.391 1.00 0.00 H new ATOM 0 HB2 GLU A 127 15.963 -1.943 1.586 1.00 0.00 H new ATOM 0 HB3 GLU A 127 15.054 -3.368 2.049 1.00 0.00 H new ATOM 0 HG2 GLU A 127 17.074 -4.734 2.067 1.00 0.00 H new ATOM 0 HG3 GLU A 127 18.024 -3.427 1.389 1.00 0.00 H new ATOM 1995 N ALA A 128 17.053 -1.469 -0.824 1.00 0.00 N ATOM 1996 CA ALA A 128 17.940 -0.661 -1.706 1.00 0.00 C ATOM 1997 C ALA A 128 17.207 -0.260 -3.028 1.00 0.00 C ATOM 1998 O ALA A 128 16.371 0.642 -3.054 1.00 0.00 O ATOM 1999 CB ALA A 128 19.315 -1.384 -1.790 1.00 0.00 C ATOM 0 H ALA A 128 16.838 -0.995 0.053 1.00 0.00 H new ATOM 0 HA ALA A 128 18.177 0.324 -1.303 1.00 0.00 H new ATOM 0 HB1 ALA A 128 19.987 -0.814 -2.431 1.00 0.00 H new ATOM 0 HB2 ALA A 128 19.746 -1.464 -0.792 1.00 0.00 H new ATOM 0 HB3 ALA A 128 19.177 -2.382 -2.206 1.00 0.00 H new ATOM 2005 N ASP A 129 17.563 -0.913 -4.113 1.00 0.00 N ATOM 2006 CA ASP A 129 16.983 -0.673 -5.473 1.00 0.00 C ATOM 2007 C ASP A 129 15.871 -1.702 -5.912 1.00 0.00 C ATOM 2008 O ASP A 129 15.376 -1.629 -7.040 1.00 0.00 O ATOM 2009 CB ASP A 129 18.222 -0.652 -6.415 1.00 0.00 C ATOM 2010 CG ASP A 129 18.025 0.084 -7.738 1.00 0.00 C ATOM 2011 OD1 ASP A 129 17.928 1.331 -7.727 1.00 0.00 O ATOM 2012 OD2 ASP A 129 18.025 -0.566 -8.802 1.00 0.00 O ATOM 0 H ASP A 129 18.274 -1.644 -4.105 1.00 0.00 H new ATOM 0 HA ASP A 129 16.423 0.262 -5.502 1.00 0.00 H new ATOM 0 HB2 ASP A 129 19.054 -0.192 -5.883 1.00 0.00 H new ATOM 0 HB3 ASP A 129 18.511 -1.681 -6.630 1.00 0.00 H new ATOM 2017 N GLN A 130 15.416 -2.620 -5.035 1.00 0.00 N ATOM 2018 CA GLN A 130 14.390 -3.640 -5.375 1.00 0.00 C ATOM 2019 C GLN A 130 12.910 -3.127 -5.156 1.00 0.00 C ATOM 2020 O GLN A 130 12.696 -2.202 -4.358 1.00 0.00 O ATOM 2021 CB GLN A 130 14.698 -4.901 -4.519 1.00 0.00 C ATOM 2022 CG GLN A 130 16.032 -5.623 -4.856 1.00 0.00 C ATOM 2023 CD GLN A 130 16.223 -7.005 -4.221 1.00 0.00 C ATOM 2024 OE1 GLN A 130 15.297 -7.703 -3.817 1.00 0.00 O ATOM 2025 NE2 GLN A 130 17.448 -7.469 -4.155 1.00 0.00 N ATOM 0 H GLN A 130 15.746 -2.679 -4.072 1.00 0.00 H new ATOM 0 HA GLN A 130 14.445 -3.871 -6.439 1.00 0.00 H new ATOM 0 HB2 GLN A 130 14.716 -4.611 -3.468 1.00 0.00 H new ATOM 0 HB3 GLN A 130 13.879 -5.611 -4.640 1.00 0.00 H new ATOM 0 HG2 GLN A 130 16.102 -5.729 -5.939 1.00 0.00 H new ATOM 0 HG3 GLN A 130 16.858 -4.984 -4.544 1.00 0.00 H new ATOM 0 HE21 GLN A 130 18.227 -6.901 -4.487 1.00 0.00 H new ATOM 0 HE22 GLN A 130 17.621 -8.398 -3.772 1.00 0.00 H new ATOM 2034 N PRO A 131 11.851 -3.710 -5.804 1.00 0.00 N ATOM 2035 CA PRO A 131 10.448 -3.231 -5.653 1.00 0.00 C ATOM 2036 C PRO A 131 9.590 -3.864 -4.503 1.00 0.00 C ATOM 2037 O PRO A 131 10.047 -4.673 -3.692 1.00 0.00 O ATOM 2038 CB PRO A 131 9.933 -3.559 -7.076 1.00 0.00 C ATOM 2039 CG PRO A 131 10.589 -4.896 -7.425 1.00 0.00 C ATOM 2040 CD PRO A 131 11.991 -4.771 -6.829 1.00 0.00 C ATOM 0 HA PRO A 131 10.379 -2.191 -5.334 1.00 0.00 H new ATOM 0 HB2 PRO A 131 8.846 -3.634 -7.097 1.00 0.00 H new ATOM 0 HB3 PRO A 131 10.213 -2.782 -7.788 1.00 0.00 H new ATOM 0 HG2 PRO A 131 10.043 -5.736 -6.995 1.00 0.00 H new ATOM 0 HG3 PRO A 131 10.624 -5.057 -8.502 1.00 0.00 H new ATOM 0 HD2 PRO A 131 12.323 -5.711 -6.388 1.00 0.00 H new ATOM 0 HD3 PRO A 131 12.725 -4.499 -7.588 1.00 0.00 H new ATOM 2048 N VAL A 132 8.299 -3.488 -4.455 1.00 0.00 N ATOM 2049 CA VAL A 132 7.287 -4.127 -3.548 1.00 0.00 C ATOM 2050 C VAL A 132 7.042 -5.634 -3.963 1.00 0.00 C ATOM 2051 O VAL A 132 7.074 -5.970 -5.154 1.00 0.00 O ATOM 2052 CB VAL A 132 5.986 -3.254 -3.562 1.00 0.00 C ATOM 2053 CG1 VAL A 132 5.279 -3.094 -4.928 1.00 0.00 C ATOM 2054 CG2 VAL A 132 4.943 -3.744 -2.533 1.00 0.00 C ATOM 0 H VAL A 132 7.915 -2.740 -5.033 1.00 0.00 H new ATOM 0 HA VAL A 132 7.652 -4.162 -2.522 1.00 0.00 H new ATOM 0 HB VAL A 132 6.372 -2.270 -3.296 1.00 0.00 H new ATOM 0 HG11 VAL A 132 4.393 -2.470 -4.808 1.00 0.00 H new ATOM 0 HG12 VAL A 132 5.960 -2.625 -5.638 1.00 0.00 H new ATOM 0 HG13 VAL A 132 4.984 -4.074 -5.302 1.00 0.00 H new ATOM 0 HG21 VAL A 132 4.059 -3.108 -2.580 1.00 0.00 H new ATOM 0 HG22 VAL A 132 4.663 -4.772 -2.761 1.00 0.00 H new ATOM 0 HG23 VAL A 132 5.370 -3.698 -1.531 1.00 0.00 H new ATOM 2064 N SER A 133 6.820 -6.546 -2.992 1.00 0.00 N ATOM 2065 CA SER A 133 6.702 -8.007 -3.282 1.00 0.00 C ATOM 2066 C SER A 133 5.516 -8.748 -2.584 1.00 0.00 C ATOM 2067 O SER A 133 4.889 -8.273 -1.628 1.00 0.00 O ATOM 2068 CB SER A 133 8.059 -8.636 -2.847 1.00 0.00 C ATOM 2069 OG SER A 133 8.191 -8.682 -1.422 1.00 0.00 O ATOM 0 H SER A 133 6.718 -6.307 -2.006 1.00 0.00 H new ATOM 0 HA SER A 133 6.481 -8.122 -4.343 1.00 0.00 H new ATOM 0 HB2 SER A 133 8.139 -9.645 -3.252 1.00 0.00 H new ATOM 0 HB3 SER A 133 8.880 -8.057 -3.270 1.00 0.00 H new ATOM 0 HG SER A 133 8.921 -9.290 -1.181 1.00 0.00 H new ATOM 2075 N LEU A 134 5.230 -9.959 -3.104 1.00 0.00 N ATOM 2076 CA LEU A 134 4.216 -10.874 -2.525 1.00 0.00 C ATOM 2077 C LEU A 134 4.918 -12.222 -2.153 1.00 0.00 C ATOM 2078 O LEU A 134 5.565 -12.874 -2.980 1.00 0.00 O ATOM 2079 CB LEU A 134 3.053 -11.176 -3.506 1.00 0.00 C ATOM 2080 CG LEU A 134 2.184 -10.012 -4.052 1.00 0.00 C ATOM 2081 CD1 LEU A 134 1.084 -10.584 -4.964 1.00 0.00 C ATOM 2082 CD2 LEU A 134 1.533 -9.161 -2.945 1.00 0.00 C ATOM 0 H LEU A 134 5.691 -10.332 -3.934 1.00 0.00 H new ATOM 0 HA LEU A 134 3.790 -10.384 -1.650 1.00 0.00 H new ATOM 0 HB2 LEU A 134 3.478 -11.695 -4.365 1.00 0.00 H new ATOM 0 HB3 LEU A 134 2.382 -11.877 -3.010 1.00 0.00 H new ATOM 0 HG LEU A 134 2.853 -9.353 -4.605 1.00 0.00 H new ATOM 0 HD11 LEU A 134 0.471 -9.769 -5.350 1.00 0.00 H new ATOM 0 HD12 LEU A 134 1.543 -11.118 -5.796 1.00 0.00 H new ATOM 0 HD13 LEU A 134 0.458 -11.270 -4.393 1.00 0.00 H new ATOM 0 HD21 LEU A 134 0.940 -8.366 -3.398 1.00 0.00 H new ATOM 0 HD22 LEU A 134 0.887 -9.791 -2.334 1.00 0.00 H new ATOM 0 HD23 LEU A 134 2.310 -8.722 -2.319 1.00 0.00 H new ATOM 2094 N THR A 135 4.760 -12.633 -0.894 1.00 0.00 N ATOM 2095 CA THR A 135 5.288 -13.925 -0.367 1.00 0.00 C ATOM 2096 C THR A 135 4.166 -15.009 -0.519 1.00 0.00 C ATOM 2097 O THR A 135 2.986 -14.775 -0.231 1.00 0.00 O ATOM 2098 CB THR A 135 5.760 -13.719 1.113 1.00 0.00 C ATOM 2099 OG1 THR A 135 6.989 -12.992 1.112 1.00 0.00 O ATOM 2100 CG2 THR A 135 6.044 -15.000 1.915 1.00 0.00 C ATOM 0 H THR A 135 4.260 -12.085 -0.193 1.00 0.00 H new ATOM 0 HA THR A 135 6.157 -14.271 -0.926 1.00 0.00 H new ATOM 0 HB THR A 135 4.924 -13.207 1.589 1.00 0.00 H new ATOM 0 HG1 THR A 135 7.680 -13.517 1.567 1.00 0.00 H new ATOM 0 HG21 THR A 135 6.363 -14.735 2.923 1.00 0.00 H new ATOM 0 HG22 THR A 135 5.138 -15.604 1.968 1.00 0.00 H new ATOM 0 HG23 THR A 135 6.832 -15.570 1.423 1.00 0.00 H new ATOM 2108 N ASN A 136 4.560 -16.219 -0.957 1.00 0.00 N ATOM 2109 CA ASN A 136 3.621 -17.374 -1.102 1.00 0.00 C ATOM 2110 C ASN A 136 3.349 -18.027 0.300 1.00 0.00 C ATOM 2111 O ASN A 136 2.199 -18.045 0.743 1.00 0.00 O ATOM 2112 CB ASN A 136 4.212 -18.381 -2.134 1.00 0.00 C ATOM 2113 CG ASN A 136 4.219 -17.919 -3.598 1.00 0.00 C ATOM 2114 OD1 ASN A 136 3.226 -18.006 -4.309 1.00 0.00 O ATOM 2115 ND2 ASN A 136 5.323 -17.431 -4.111 1.00 0.00 N ATOM 0 H ASN A 136 5.522 -16.434 -1.220 1.00 0.00 H new ATOM 0 HA ASN A 136 2.656 -17.039 -1.481 1.00 0.00 H new ATOM 0 HB2 ASN A 136 5.237 -18.611 -1.842 1.00 0.00 H new ATOM 0 HB3 ASN A 136 3.646 -19.310 -2.070 1.00 0.00 H new ATOM 0 HD21 ASN A 136 5.344 -17.132 -5.086 1.00 0.00 H new ATOM 0 HD22 ASN A 136 6.161 -17.350 -3.535 1.00 0.00 H new ATOM 2122 N MET A 137 4.379 -18.575 0.979 1.00 0.00 N ATOM 2123 CA MET A 137 4.262 -19.124 2.361 1.00 0.00 C ATOM 2124 C MET A 137 5.686 -19.141 3.042 1.00 0.00 C ATOM 2125 O MET A 137 5.768 -18.520 4.107 1.00 0.00 O ATOM 2126 CB MET A 137 3.531 -20.504 2.374 1.00 0.00 C ATOM 2127 CG MET A 137 3.263 -21.079 3.780 1.00 0.00 C ATOM 2128 SD MET A 137 2.227 -19.946 4.731 1.00 0.00 S ATOM 2129 CE MET A 137 2.330 -20.723 6.352 1.00 0.00 C ATOM 0 H MET A 137 5.319 -18.653 0.590 1.00 0.00 H new ATOM 0 HA MET A 137 3.628 -18.473 2.963 1.00 0.00 H new ATOM 0 HB2 MET A 137 2.580 -20.401 1.851 1.00 0.00 H new ATOM 0 HB3 MET A 137 4.128 -21.221 1.811 1.00 0.00 H new ATOM 0 HG2 MET A 137 2.772 -22.049 3.697 1.00 0.00 H new ATOM 0 HG3 MET A 137 4.207 -21.243 4.300 1.00 0.00 H new ATOM 0 HE1 MET A 137 1.742 -20.149 7.069 1.00 0.00 H new ATOM 0 HE2 MET A 137 1.940 -21.739 6.294 1.00 0.00 H new ATOM 0 HE3 MET A 137 3.370 -20.752 6.676 1.00 0.00 H new ATOM 2139 N PRO A 138 6.819 -19.748 2.551 1.00 0.00 N ATOM 2140 CA PRO A 138 8.121 -19.738 3.273 1.00 0.00 C ATOM 2141 C PRO A 138 8.930 -18.409 3.097 1.00 0.00 C ATOM 2142 O PRO A 138 9.338 -18.067 1.981 1.00 0.00 O ATOM 2143 CB PRO A 138 8.853 -20.966 2.675 1.00 0.00 C ATOM 2144 CG PRO A 138 7.847 -21.664 1.752 1.00 0.00 C ATOM 2145 CD PRO A 138 6.898 -20.550 1.315 1.00 0.00 C ATOM 0 HA PRO A 138 7.995 -19.793 4.354 1.00 0.00 H new ATOM 0 HB2 PRO A 138 9.739 -20.657 2.121 1.00 0.00 H new ATOM 0 HB3 PRO A 138 9.189 -21.640 3.463 1.00 0.00 H new ATOM 0 HG2 PRO A 138 8.344 -22.122 0.896 1.00 0.00 H new ATOM 0 HG3 PRO A 138 7.314 -22.459 2.274 1.00 0.00 H new ATOM 0 HD2 PRO A 138 7.293 -19.977 0.476 1.00 0.00 H new ATOM 0 HD3 PRO A 138 5.925 -20.934 1.009 1.00 0.00 H new ATOM 2153 N ASP A 139 9.180 -17.688 4.203 1.00 0.00 N ATOM 2154 CA ASP A 139 9.969 -16.421 4.189 1.00 0.00 C ATOM 2155 C ASP A 139 11.081 -16.533 5.285 1.00 0.00 C ATOM 2156 O ASP A 139 10.912 -16.087 6.426 1.00 0.00 O ATOM 2157 CB ASP A 139 8.981 -15.232 4.395 1.00 0.00 C ATOM 2158 CG ASP A 139 9.370 -13.923 3.702 1.00 0.00 C ATOM 2159 OD1 ASP A 139 10.521 -13.454 3.868 1.00 0.00 O ATOM 2160 OD2 ASP A 139 8.517 -13.365 2.972 1.00 0.00 O ATOM 0 H ASP A 139 8.849 -17.955 5.130 1.00 0.00 H new ATOM 0 HA ASP A 139 10.478 -16.243 3.241 1.00 0.00 H new ATOM 0 HB2 ASP A 139 7.997 -15.534 4.036 1.00 0.00 H new ATOM 0 HB3 ASP A 139 8.886 -15.042 5.464 1.00 0.00 H new ATOM 2165 N GLU A 140 12.230 -17.160 4.953 1.00 0.00 N ATOM 2166 CA GLU A 140 13.349 -17.360 5.931 1.00 0.00 C ATOM 2167 C GLU A 140 14.361 -16.161 5.878 1.00 0.00 C ATOM 2168 O GLU A 140 15.551 -16.308 5.585 1.00 0.00 O ATOM 2169 CB GLU A 140 13.963 -18.754 5.602 1.00 0.00 C ATOM 2170 CG GLU A 140 14.950 -19.297 6.668 1.00 0.00 C ATOM 2171 CD GLU A 140 15.477 -20.697 6.382 1.00 0.00 C ATOM 2172 OE1 GLU A 140 14.832 -21.676 6.812 1.00 0.00 O ATOM 2173 OE2 GLU A 140 16.542 -20.821 5.743 1.00 0.00 O ATOM 0 H GLU A 140 12.417 -17.538 4.024 1.00 0.00 H new ATOM 0 HA GLU A 140 13.011 -17.363 6.967 1.00 0.00 H new ATOM 0 HB2 GLU A 140 13.153 -19.472 5.478 1.00 0.00 H new ATOM 0 HB3 GLU A 140 14.482 -18.690 4.646 1.00 0.00 H new ATOM 0 HG2 GLU A 140 15.795 -18.613 6.745 1.00 0.00 H new ATOM 0 HG3 GLU A 140 14.453 -19.300 7.638 1.00 0.00 H new ATOM 2180 N GLY A 141 13.872 -14.955 6.233 1.00 0.00 N ATOM 2181 CA GLY A 141 14.664 -13.695 6.114 1.00 0.00 C ATOM 2182 C GLY A 141 14.965 -13.270 4.654 1.00 0.00 C ATOM 2183 O GLY A 141 16.100 -12.913 4.332 1.00 0.00 O ATOM 0 H GLY A 141 12.932 -14.818 6.606 1.00 0.00 H new ATOM 0 HA2 GLY A 141 14.122 -12.890 6.611 1.00 0.00 H new ATOM 0 HA3 GLY A 141 15.607 -13.820 6.646 1.00 0.00 H new ATOM 2187 N VAL A 142 13.933 -13.288 3.797 1.00 0.00 N ATOM 2188 CA VAL A 142 14.072 -13.042 2.329 1.00 0.00 C ATOM 2189 C VAL A 142 13.443 -11.655 1.980 1.00 0.00 C ATOM 2190 O VAL A 142 14.126 -10.769 1.458 1.00 0.00 O ATOM 2191 CB VAL A 142 13.469 -14.320 1.604 1.00 0.00 C ATOM 2192 CG1 VAL A 142 12.105 -14.231 0.876 1.00 0.00 C ATOM 2193 CG2 VAL A 142 14.450 -14.835 0.524 1.00 0.00 C ATOM 0 H VAL A 142 12.973 -13.472 4.089 1.00 0.00 H new ATOM 0 HA VAL A 142 15.098 -12.946 1.975 1.00 0.00 H new ATOM 0 HB VAL A 142 13.307 -14.963 2.469 1.00 0.00 H new ATOM 0 HG11 VAL A 142 11.860 -15.201 0.443 1.00 0.00 H new ATOM 0 HG12 VAL A 142 11.331 -13.945 1.588 1.00 0.00 H new ATOM 0 HG13 VAL A 142 12.163 -13.485 0.084 1.00 0.00 H new ATOM 0 HG21 VAL A 142 14.025 -15.711 0.034 1.00 0.00 H new ATOM 0 HG22 VAL A 142 14.620 -14.053 -0.216 1.00 0.00 H new ATOM 0 HG23 VAL A 142 15.397 -15.104 0.991 1.00 0.00 H new ATOM 2203 N MET A 143 12.155 -11.473 2.306 1.00 0.00 N ATOM 2204 CA MET A 143 11.428 -10.194 2.094 1.00 0.00 C ATOM 2205 C MET A 143 11.480 -9.292 3.377 1.00 0.00 C ATOM 2206 O MET A 143 11.639 -9.748 4.519 1.00 0.00 O ATOM 2207 CB MET A 143 9.954 -10.513 1.711 1.00 0.00 C ATOM 2208 CG MET A 143 9.703 -11.306 0.409 1.00 0.00 C ATOM 2209 SD MET A 143 10.742 -10.742 -0.951 1.00 0.00 S ATOM 2210 CE MET A 143 10.179 -11.871 -2.235 1.00 0.00 C ATOM 0 H MET A 143 11.580 -12.204 2.725 1.00 0.00 H new ATOM 0 HA MET A 143 11.908 -9.640 1.287 1.00 0.00 H new ATOM 0 HB2 MET A 143 9.507 -11.071 2.534 1.00 0.00 H new ATOM 0 HB3 MET A 143 9.415 -9.568 1.637 1.00 0.00 H new ATOM 0 HG2 MET A 143 9.889 -12.365 0.590 1.00 0.00 H new ATOM 0 HG3 MET A 143 8.655 -11.211 0.125 1.00 0.00 H new ATOM 0 HE1 MET A 143 10.718 -11.668 -3.160 1.00 0.00 H new ATOM 0 HE2 MET A 143 10.367 -12.899 -1.924 1.00 0.00 H new ATOM 0 HE3 MET A 143 9.111 -11.731 -2.400 1.00 0.00 H new ATOM 2220 N VAL A 144 11.332 -7.968 3.188 1.00 0.00 N ATOM 2221 CA VAL A 144 11.287 -6.990 4.314 1.00 0.00 C ATOM 2222 C VAL A 144 9.788 -6.905 4.782 1.00 0.00 C ATOM 2223 O VAL A 144 9.005 -6.035 4.391 1.00 0.00 O ATOM 2224 CB VAL A 144 11.944 -5.631 3.883 1.00 0.00 C ATOM 2225 CG1 VAL A 144 11.748 -4.471 4.892 1.00 0.00 C ATOM 2226 CG2 VAL A 144 13.475 -5.767 3.687 1.00 0.00 C ATOM 0 H VAL A 144 11.240 -7.540 2.267 1.00 0.00 H new ATOM 0 HA VAL A 144 11.880 -7.301 5.174 1.00 0.00 H new ATOM 0 HB VAL A 144 11.428 -5.392 2.953 1.00 0.00 H new ATOM 0 HG11 VAL A 144 12.234 -3.572 4.512 1.00 0.00 H new ATOM 0 HG12 VAL A 144 10.683 -4.279 5.023 1.00 0.00 H new ATOM 0 HG13 VAL A 144 12.188 -4.744 5.851 1.00 0.00 H new ATOM 0 HG21 VAL A 144 13.891 -4.804 3.389 1.00 0.00 H new ATOM 0 HG22 VAL A 144 13.935 -6.087 4.622 1.00 0.00 H new ATOM 0 HG23 VAL A 144 13.678 -6.506 2.912 1.00 0.00 H new ATOM 2236 N THR A 145 9.432 -7.817 5.703 1.00 0.00 N ATOM 2237 CA THR A 145 8.062 -7.926 6.316 1.00 0.00 C ATOM 2238 C THR A 145 7.912 -7.095 7.645 1.00 0.00 C ATOM 2239 O THR A 145 7.254 -7.510 8.605 1.00 0.00 O ATOM 2240 CB THR A 145 7.763 -9.436 6.610 1.00 0.00 C ATOM 2241 OG1 THR A 145 8.565 -9.906 7.694 1.00 0.00 O ATOM 2242 CG2 THR A 145 8.022 -10.389 5.441 1.00 0.00 C ATOM 0 H THR A 145 10.084 -8.516 6.059 1.00 0.00 H new ATOM 0 HA THR A 145 7.349 -7.511 5.603 1.00 0.00 H new ATOM 0 HB THR A 145 6.696 -9.449 6.833 1.00 0.00 H new ATOM 0 HG1 THR A 145 8.364 -10.850 7.865 1.00 0.00 H new ATOM 0 HG21 THR A 145 7.786 -11.409 5.744 1.00 0.00 H new ATOM 0 HG22 THR A 145 7.394 -10.107 4.596 1.00 0.00 H new ATOM 0 HG23 THR A 145 9.071 -10.331 5.150 1.00 0.00 H new ATOM 2250 N LYS A 146 8.560 -5.929 7.692 1.00 0.00 N ATOM 2251 CA LYS A 146 8.581 -5.047 8.891 1.00 0.00 C ATOM 2252 C LYS A 146 8.794 -3.545 8.492 1.00 0.00 C ATOM 2253 O LYS A 146 9.902 -3.129 8.142 1.00 0.00 O ATOM 2254 CB LYS A 146 9.664 -5.589 9.893 1.00 0.00 C ATOM 2255 CG LYS A 146 11.186 -5.483 9.554 1.00 0.00 C ATOM 2256 CD LYS A 146 11.996 -6.802 9.539 1.00 0.00 C ATOM 2257 CE LYS A 146 11.809 -7.589 8.230 1.00 0.00 C ATOM 2258 NZ LYS A 146 12.683 -8.793 8.178 1.00 0.00 N ATOM 0 H LYS A 146 9.090 -5.557 6.904 1.00 0.00 H new ATOM 0 HA LYS A 146 7.615 -5.071 9.394 1.00 0.00 H new ATOM 0 HB2 LYS A 146 9.510 -5.075 10.842 1.00 0.00 H new ATOM 0 HB3 LYS A 146 9.445 -6.643 10.063 1.00 0.00 H new ATOM 0 HG2 LYS A 146 11.283 -5.015 8.575 1.00 0.00 H new ATOM 0 HG3 LYS A 146 11.648 -4.810 10.276 1.00 0.00 H new ATOM 0 HD2 LYS A 146 13.054 -6.578 9.677 1.00 0.00 H new ATOM 0 HD3 LYS A 146 11.689 -7.423 10.381 1.00 0.00 H new ATOM 0 HE2 LYS A 146 10.766 -7.892 8.134 1.00 0.00 H new ATOM 0 HE3 LYS A 146 12.032 -6.942 7.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 12.528 -9.296 7.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 13.679 -8.502 8.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 12.453 -9.423 8.973 1.00 0.00 H new ATOM 2272 N PHE A 147 7.747 -2.706 8.594 1.00 0.00 N ATOM 2273 CA PHE A 147 7.854 -1.247 8.257 1.00 0.00 C ATOM 2274 C PHE A 147 6.953 -0.361 9.188 1.00 0.00 C ATOM 2275 O PHE A 147 5.860 -0.736 9.616 1.00 0.00 O ATOM 2276 CB PHE A 147 7.533 -1.049 6.739 1.00 0.00 C ATOM 2277 CG PHE A 147 6.201 -1.573 6.169 1.00 0.00 C ATOM 2278 CD1 PHE A 147 5.048 -0.783 6.206 1.00 0.00 C ATOM 2279 CD2 PHE A 147 6.146 -2.845 5.585 1.00 0.00 C ATOM 2280 CE1 PHE A 147 3.855 -1.259 5.667 1.00 0.00 C ATOM 2281 CE2 PHE A 147 4.953 -3.321 5.051 1.00 0.00 C ATOM 2282 CZ PHE A 147 3.811 -2.528 5.093 1.00 0.00 C ATOM 0 H PHE A 147 6.819 -2.996 8.903 1.00 0.00 H new ATOM 0 HA PHE A 147 8.874 -0.910 8.440 1.00 0.00 H new ATOM 0 HB2 PHE A 147 7.578 0.020 6.533 1.00 0.00 H new ATOM 0 HB3 PHE A 147 8.337 -1.517 6.172 1.00 0.00 H new ATOM 0 HD1 PHE A 147 5.082 0.199 6.654 1.00 0.00 H new ATOM 0 HD2 PHE A 147 7.034 -3.459 5.549 1.00 0.00 H new ATOM 0 HE1 PHE A 147 2.966 -0.646 5.694 1.00 0.00 H new ATOM 0 HE2 PHE A 147 4.914 -4.304 4.605 1.00 0.00 H new ATOM 0 HZ PHE A 147 2.885 -2.898 4.678 1.00 0.00 H new ATOM 2292 N TYR A 148 7.458 0.837 9.513 1.00 0.00 N ATOM 2293 CA TYR A 148 6.792 1.843 10.378 1.00 0.00 C ATOM 2294 C TYR A 148 5.661 2.595 9.603 1.00 0.00 C ATOM 2295 O TYR A 148 5.797 3.016 8.448 1.00 0.00 O ATOM 2296 CB TYR A 148 7.873 2.854 10.874 1.00 0.00 C ATOM 2297 CG TYR A 148 8.673 2.393 12.105 1.00 0.00 C ATOM 2298 CD1 TYR A 148 9.712 1.464 11.981 1.00 0.00 C ATOM 2299 CD2 TYR A 148 8.350 2.892 13.373 1.00 0.00 C ATOM 2300 CE1 TYR A 148 10.405 1.028 13.108 1.00 0.00 C ATOM 2301 CE2 TYR A 148 9.041 2.451 14.499 1.00 0.00 C ATOM 2302 CZ TYR A 148 10.063 1.516 14.366 1.00 0.00 C ATOM 2303 OH TYR A 148 10.736 1.085 15.477 1.00 0.00 O ATOM 0 H TYR A 148 8.368 1.150 9.175 1.00 0.00 H new ATOM 0 HA TYR A 148 6.326 1.340 11.226 1.00 0.00 H new ATOM 0 HB2 TYR A 148 8.569 3.049 10.058 1.00 0.00 H new ATOM 0 HB3 TYR A 148 7.385 3.800 11.109 1.00 0.00 H new ATOM 0 HD1 TYR A 148 9.978 1.083 11.006 1.00 0.00 H new ATOM 0 HD2 TYR A 148 7.561 3.622 13.478 1.00 0.00 H new ATOM 0 HE1 TYR A 148 11.207 0.312 13.006 1.00 0.00 H new ATOM 0 HE2 TYR A 148 8.784 2.835 15.475 1.00 0.00 H new ATOM 0 HH TYR A 148 10.371 1.526 16.272 1.00 0.00 H new ATOM 2313 N PHE A 149 4.540 2.766 10.308 1.00 0.00 N ATOM 2314 CA PHE A 149 3.287 3.350 9.767 1.00 0.00 C ATOM 2315 C PHE A 149 3.086 4.780 10.382 1.00 0.00 C ATOM 2316 O PHE A 149 2.628 4.867 11.526 1.00 0.00 O ATOM 2317 CB PHE A 149 2.207 2.267 10.151 1.00 0.00 C ATOM 2318 CG PHE A 149 1.125 1.926 9.122 1.00 0.00 C ATOM 2319 CD1 PHE A 149 1.479 1.425 7.863 1.00 0.00 C ATOM 2320 CD2 PHE A 149 -0.228 2.039 9.457 1.00 0.00 C ATOM 2321 CE1 PHE A 149 0.493 1.095 6.937 1.00 0.00 C ATOM 2322 CE2 PHE A 149 -1.212 1.723 8.525 1.00 0.00 C ATOM 2323 CZ PHE A 149 -0.850 1.249 7.268 1.00 0.00 C ATOM 0 H PHE A 149 4.465 2.501 11.290 1.00 0.00 H new ATOM 0 HA PHE A 149 3.254 3.532 8.693 1.00 0.00 H new ATOM 0 HB2 PHE A 149 2.733 1.345 10.398 1.00 0.00 H new ATOM 0 HB3 PHE A 149 1.708 2.603 11.060 1.00 0.00 H new ATOM 0 HD1 PHE A 149 2.521 1.294 7.609 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -0.511 2.373 10.444 1.00 0.00 H new ATOM 0 HE1 PHE A 149 0.770 0.720 5.963 1.00 0.00 H new ATOM 0 HE2 PHE A 149 -2.255 1.846 8.777 1.00 0.00 H new ATOM 0 HZ PHE A 149 -1.614 1.000 6.546 1.00 0.00 H new ATOM 2333 N GLN A 150 3.445 5.895 9.688 1.00 0.00 N ATOM 2334 CA GLN A 150 3.385 7.266 10.311 1.00 0.00 C ATOM 2335 C GLN A 150 2.921 8.429 9.362 1.00 0.00 C ATOM 2336 O GLN A 150 3.251 8.478 8.180 1.00 0.00 O ATOM 2337 CB GLN A 150 4.820 7.607 10.831 1.00 0.00 C ATOM 2338 CG GLN A 150 5.288 6.819 12.085 1.00 0.00 C ATOM 2339 CD GLN A 150 6.702 7.145 12.566 1.00 0.00 C ATOM 2340 OE1 GLN A 150 7.655 6.410 12.328 1.00 0.00 O ATOM 2341 NE2 GLN A 150 6.889 8.242 13.261 1.00 0.00 N ATOM 0 H GLN A 150 3.772 5.884 8.722 1.00 0.00 H new ATOM 0 HA GLN A 150 2.628 7.210 11.094 1.00 0.00 H new ATOM 0 HB2 GLN A 150 5.531 7.426 10.025 1.00 0.00 H new ATOM 0 HB3 GLN A 150 4.860 8.672 11.058 1.00 0.00 H new ATOM 0 HG2 GLN A 150 4.590 7.015 12.899 1.00 0.00 H new ATOM 0 HG3 GLN A 150 5.232 5.753 11.866 1.00 0.00 H new ATOM 0 HE21 GLN A 150 6.102 8.858 13.463 1.00 0.00 H new ATOM 0 HE22 GLN A 150 7.822 8.479 13.599 1.00 0.00 H new ATOM 2350 N GLU A 151 2.254 9.440 9.941 1.00 0.00 N ATOM 2351 CA GLU A 151 1.776 10.684 9.256 1.00 0.00 C ATOM 2352 C GLU A 151 2.900 11.744 8.973 1.00 0.00 C ATOM 2353 O GLU A 151 3.954 11.799 9.614 1.00 0.00 O ATOM 2354 CB GLU A 151 0.635 11.250 10.165 1.00 0.00 C ATOM 2355 CG GLU A 151 0.930 11.578 11.666 1.00 0.00 C ATOM 2356 CD GLU A 151 0.756 10.425 12.657 1.00 0.00 C ATOM 2357 OE1 GLU A 151 1.589 9.491 12.653 1.00 0.00 O ATOM 2358 OE2 GLU A 151 -0.218 10.450 13.437 1.00 0.00 O ATOM 0 H GLU A 151 2.017 9.428 10.933 1.00 0.00 H new ATOM 0 HA GLU A 151 1.419 10.443 8.255 1.00 0.00 H new ATOM 0 HB2 GLU A 151 0.270 12.164 9.698 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -0.185 10.532 10.144 1.00 0.00 H new ATOM 0 HG2 GLU A 151 1.954 11.943 11.742 1.00 0.00 H new ATOM 0 HG3 GLU A 151 0.277 12.395 11.973 1.00 0.00 H new ATOM 2365 N ASP A 152 2.636 12.585 7.956 1.00 0.00 N ATOM 2366 CA ASP A 152 3.580 13.626 7.469 1.00 0.00 C ATOM 2367 C ASP A 152 3.548 14.944 8.322 1.00 0.00 C ATOM 2368 O ASP A 152 2.475 15.456 8.662 1.00 0.00 O ATOM 2369 CB ASP A 152 3.187 13.932 5.991 1.00 0.00 C ATOM 2370 CG ASP A 152 3.457 12.820 4.975 1.00 0.00 C ATOM 2371 OD1 ASP A 152 4.643 12.464 4.796 1.00 0.00 O ATOM 2372 OD2 ASP A 152 2.509 12.303 4.345 1.00 0.00 O ATOM 0 H ASP A 152 1.756 12.567 7.440 1.00 0.00 H new ATOM 0 HA ASP A 152 4.599 13.249 7.555 1.00 0.00 H new ATOM 0 HB2 ASP A 152 2.124 14.172 5.962 1.00 0.00 H new ATOM 0 HB3 ASP A 152 3.724 14.825 5.672 1.00 0.00 H new ATOM 2377 N GLU A 153 4.740 15.481 8.646 1.00 0.00 N ATOM 2378 CA GLU A 153 4.896 16.758 9.401 1.00 0.00 C ATOM 2379 C GLU A 153 5.458 17.854 8.446 1.00 0.00 C ATOM 2380 O GLU A 153 4.786 18.899 8.277 1.00 0.00 O ATOM 2381 CB GLU A 153 5.840 16.562 10.624 1.00 0.00 C ATOM 2382 CG GLU A 153 5.279 15.723 11.804 1.00 0.00 C ATOM 2383 CD GLU A 153 6.162 15.711 13.049 1.00 0.00 C ATOM 2384 OE1 GLU A 153 7.035 14.824 13.162 1.00 0.00 O ATOM 2385 OE2 GLU A 153 5.970 16.577 13.928 1.00 0.00 O ATOM 2386 OXT GLU A 153 6.565 17.691 7.872 1.00 0.00 O ATOM 0 H GLU A 153 5.629 15.048 8.395 1.00 0.00 H new ATOM 0 HA GLU A 153 3.923 17.073 9.778 1.00 0.00 H new ATOM 0 HB2 GLU A 153 6.757 16.089 10.274 1.00 0.00 H new ATOM 0 HB3 GLU A 153 6.114 17.546 11.005 1.00 0.00 H new ATOM 0 HG2 GLU A 153 4.297 16.111 12.074 1.00 0.00 H new ATOM 0 HG3 GLU A 153 5.134 14.697 11.467 1.00 0.00 H new