USER MOD reduce.3.24.130724 H: found=0, std=0, add=771, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 782 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 56 SER OG : rot 109:sc= 0.91 USER MOD Set 1.2: A 69 THR OG1 : rot 112:sc= 1.24 USER MOD Set 1.3: A 89 LYS NZ :NH3+ -169:sc= 1.19 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -122:sc= 0.1 (180deg=-0.108) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 HIS : no HD1:sc= -0.0118 X(o=-0.012,f=0) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS :FLIP no HD1:sc= -0.451 F(o=-1.4,f=-0.45) USER MOD Single : A 8 HIS : no HD1:sc= -0.0188 X(o=-0.019,f=-0.095) USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=-0.00089) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 43:sc= 0.0489 USER MOD Single : A 16 ASN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 HIS : no HD1:sc= 0 X(o=0,f=-0.04) USER MOD Single : A 23 MET CE :methyl -156:sc= -0.192 (180deg=-0.849) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.0213 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot 41:sc= -0.159 USER MOD Single : A 44 LYS NZ :NH3+ 157:sc= 1.24 (180deg=1.01) USER MOD Single : A 48 MET CE :methyl -160:sc= -0.163 (180deg=-0.744) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 54 GLN : amide:sc= -0.894! C(o=-0.89!,f=-9.5!) USER MOD Single : A 55 ASN : amide:sc= -0.0975 K(o=-0.098,f=-3.9!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 89:sc= 0.689 USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ -147:sc= 1.25 (180deg=0.882) USER MOD Single : A 94 LYS NZ :NH3+ 156:sc= 2.34 (180deg=2.06) USER MOD Single : A 98 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 99 LYS NZ :NH3+ -107:sc= -0.87 (180deg=-3.19!) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 11.089 -63.371 67.128 1.00 0.00 N ATOM 2 CA MET A 1 10.192 -62.213 66.927 1.00 0.00 C ATOM 3 C MET A 1 10.975 -61.031 66.380 1.00 0.00 C ATOM 4 O MET A 1 12.208 -61.066 66.330 1.00 0.00 O ATOM 5 CB MET A 1 9.522 -61.824 68.245 1.00 0.00 C ATOM 6 CG MET A 1 8.570 -62.875 68.789 1.00 0.00 C ATOM 7 SD MET A 1 7.829 -62.380 70.355 1.00 0.00 S ATOM 8 CE MET A 1 6.794 -63.796 70.708 1.00 0.00 C ATOM 0 H1 MET A 1 10.742 -64.179 66.573 1.00 0.00 H new ATOM 0 H2 MET A 1 12.050 -63.124 66.817 1.00 0.00 H new ATOM 0 H3 MET A 1 11.107 -63.626 68.136 1.00 0.00 H new ATOM 0 HA MET A 1 9.422 -62.493 66.208 1.00 0.00 H new ATOM 0 HB2 MET A 1 10.294 -61.628 68.989 1.00 0.00 H new ATOM 0 HB3 MET A 1 8.975 -60.893 68.101 1.00 0.00 H new ATOM 0 HG2 MET A 1 7.782 -63.061 68.059 1.00 0.00 H new ATOM 0 HG3 MET A 1 9.107 -63.814 68.924 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.269 -63.637 71.650 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.068 -63.925 69.905 1.00 0.00 H new ATOM 0 HE3 MET A 1 7.414 -64.690 70.784 1.00 0.00 H new ATOM 18 N GLY A 2 10.260 -59.993 65.967 1.00 0.00 N ATOM 19 CA GLY A 2 10.909 -58.822 65.416 1.00 0.00 C ATOM 20 C GLY A 2 10.075 -57.572 65.579 1.00 0.00 C ATOM 21 O GLY A 2 8.950 -57.497 65.082 1.00 0.00 O ATOM 0 H GLY A 2 9.242 -59.942 66.004 1.00 0.00 H new ATOM 0 HA2 GLY A 2 11.872 -58.679 65.906 1.00 0.00 H new ATOM 0 HA3 GLY A 2 11.111 -58.986 64.357 1.00 0.00 H new ATOM 25 N SER A 3 10.623 -56.596 66.285 1.00 0.00 N ATOM 26 CA SER A 3 9.959 -55.320 66.485 1.00 0.00 C ATOM 27 C SER A 3 10.307 -54.367 65.344 1.00 0.00 C ATOM 28 O SER A 3 11.315 -54.545 64.662 1.00 0.00 O ATOM 29 CB SER A 3 10.373 -54.726 67.839 1.00 0.00 C ATOM 30 OG SER A 3 9.675 -53.525 68.124 1.00 0.00 O ATOM 0 H SER A 3 11.536 -56.666 66.733 1.00 0.00 H new ATOM 0 HA SER A 3 8.879 -55.470 66.489 1.00 0.00 H new ATOM 0 HB2 SER A 3 10.182 -55.453 68.628 1.00 0.00 H new ATOM 0 HB3 SER A 3 11.445 -54.531 67.838 1.00 0.00 H new ATOM 0 HG SER A 3 9.963 -53.178 68.994 1.00 0.00 H new ATOM 36 N SER A 4 9.467 -53.364 65.133 1.00 0.00 N ATOM 37 CA SER A 4 9.671 -52.409 64.056 1.00 0.00 C ATOM 38 C SER A 4 10.839 -51.473 64.355 1.00 0.00 C ATOM 39 O SER A 4 10.830 -50.745 65.347 1.00 0.00 O ATOM 40 CB SER A 4 8.395 -51.604 63.836 1.00 0.00 C ATOM 41 OG SER A 4 7.307 -52.459 63.537 1.00 0.00 O ATOM 0 H SER A 4 8.635 -53.191 65.697 1.00 0.00 H new ATOM 0 HA SER A 4 9.914 -52.963 63.149 1.00 0.00 H new ATOM 0 HB2 SER A 4 8.170 -51.020 64.728 1.00 0.00 H new ATOM 0 HB3 SER A 4 8.542 -50.896 63.020 1.00 0.00 H new ATOM 0 HG SER A 4 6.498 -51.923 63.401 1.00 0.00 H new ATOM 47 N HIS A 5 11.850 -51.509 63.500 1.00 0.00 N ATOM 48 CA HIS A 5 13.008 -50.639 63.656 1.00 0.00 C ATOM 49 C HIS A 5 12.969 -49.509 62.636 1.00 0.00 C ATOM 50 O HIS A 5 12.791 -48.346 62.991 1.00 0.00 O ATOM 51 CB HIS A 5 14.310 -51.431 63.505 1.00 0.00 C ATOM 52 CG HIS A 5 14.650 -52.290 64.683 1.00 0.00 C ATOM 53 ND1 HIS A 5 15.945 -52.576 65.052 1.00 0.00 N ATOM 54 CD2 HIS A 5 13.860 -52.929 65.577 1.00 0.00 C ATOM 55 CE1 HIS A 5 15.938 -53.353 66.116 1.00 0.00 C ATOM 56 NE2 HIS A 5 14.684 -53.582 66.459 1.00 0.00 N ATOM 0 H HIS A 5 11.893 -52.130 62.692 1.00 0.00 H new ATOM 0 HA HIS A 5 12.974 -50.213 64.659 1.00 0.00 H new ATOM 0 HB2 HIS A 5 14.237 -52.062 62.619 1.00 0.00 H new ATOM 0 HB3 HIS A 5 15.128 -50.732 63.332 1.00 0.00 H new ATOM 0 HD2 HIS A 5 12.780 -52.926 65.593 1.00 0.00 H new ATOM 0 HE1 HIS A 5 16.811 -53.738 66.622 1.00 0.00 H new ATOM 0 HE2 HIS A 5 14.378 -54.150 67.249 1.00 0.00 H new ATOM 65 N HIS A 6 13.119 -49.858 61.365 1.00 0.00 N ATOM 66 CA HIS A 6 13.131 -48.869 60.296 1.00 0.00 C ATOM 67 C HIS A 6 11.734 -48.682 59.705 1.00 0.00 C ATOM 68 O HIS A 6 11.040 -49.654 59.406 1.00 0.00 O ATOM 69 CB HIS A 6 14.120 -49.290 59.202 1.00 0.00 C ATOM 70 CG HIS A 6 14.198 -48.335 58.048 1.00 0.00 C ATOM 71 ND1 HIS A 6 13.636 -48.597 56.819 1.00 0.00 N ATOM 72 CD2 HIS A 6 14.775 -47.114 57.940 1.00 0.00 C ATOM 73 CE1 HIS A 6 13.868 -47.586 56.006 1.00 0.00 C ATOM 74 NE2 HIS A 6 14.554 -46.670 56.659 1.00 0.00 N ATOM 0 H HIS A 6 13.234 -50.821 61.049 1.00 0.00 H new ATOM 0 HA HIS A 6 13.449 -47.915 60.716 1.00 0.00 H new ATOM 0 HB2 HIS A 6 15.112 -49.392 59.643 1.00 0.00 H new ATOM 0 HB3 HIS A 6 13.835 -50.273 58.828 1.00 0.00 H new ATOM 0 HD2 HIS A 6 15.310 -46.587 58.717 1.00 0.00 H new ATOM 0 HE1 HIS A 6 13.549 -47.519 54.976 1.00 0.00 H new ATOM 0 HE2 HIS A 6 14.869 -45.778 56.276 1.00 0.00 H new ATOM 83 N HIS A 7 11.334 -47.428 59.552 1.00 0.00 N ATOM 84 CA HIS A 7 10.076 -47.086 58.900 1.00 0.00 C ATOM 85 C HIS A 7 10.279 -45.909 57.962 1.00 0.00 C ATOM 86 O HIS A 7 10.603 -44.806 58.401 1.00 0.00 O ATOM 87 CB HIS A 7 8.987 -46.743 59.923 1.00 0.00 C ATOM 88 CG HIS A 7 8.202 -47.925 60.405 1.00 0.00 C ATOM 89 ND1 HIS A 7 7.692 -48.985 59.733 1.00 0.00 N flip ATOM 90 CD2 HIS A 7 7.832 -48.097 61.721 1.00 0.00 C flip ATOM 91 CE1 HIS A 7 7.024 -49.762 60.646 1.00 0.00 C flip ATOM 92 NE2 HIS A 7 7.125 -49.204 61.836 1.00 0.00 N flip ATOM 0 H HIS A 7 11.869 -46.621 59.874 1.00 0.00 H new ATOM 0 HA HIS A 7 9.749 -47.958 58.333 1.00 0.00 H new ATOM 0 HB2 HIS A 7 9.451 -46.255 60.780 1.00 0.00 H new ATOM 0 HB3 HIS A 7 8.301 -46.022 59.478 1.00 0.00 H new ATOM 0 HD2 HIS A 7 8.082 -47.429 62.532 1.00 0.00 H new ATOM 0 HE1 HIS A 7 6.501 -50.681 60.425 1.00 0.00 H new ATOM 0 HE2 HIS A 7 6.724 -49.567 62.700 1.00 0.00 H new ATOM 101 N HIS A 8 10.108 -46.147 56.670 1.00 0.00 N ATOM 102 CA HIS A 8 10.233 -45.079 55.687 1.00 0.00 C ATOM 103 C HIS A 8 9.008 -44.177 55.737 1.00 0.00 C ATOM 104 O HIS A 8 7.877 -44.658 55.803 1.00 0.00 O ATOM 105 CB HIS A 8 10.431 -45.641 54.265 1.00 0.00 C ATOM 106 CG HIS A 8 9.224 -46.313 53.663 1.00 0.00 C ATOM 107 ND1 HIS A 8 8.871 -47.614 53.939 1.00 0.00 N ATOM 108 CD2 HIS A 8 8.303 -45.861 52.774 1.00 0.00 C ATOM 109 CE1 HIS A 8 7.792 -47.934 53.251 1.00 0.00 C ATOM 110 NE2 HIS A 8 7.425 -46.890 52.534 1.00 0.00 N ATOM 0 H HIS A 8 9.884 -47.062 56.279 1.00 0.00 H new ATOM 0 HA HIS A 8 11.118 -44.493 55.936 1.00 0.00 H new ATOM 0 HB2 HIS A 8 10.737 -44.826 53.609 1.00 0.00 H new ATOM 0 HB3 HIS A 8 11.252 -46.358 54.287 1.00 0.00 H new ATOM 0 HD2 HIS A 8 8.267 -44.874 52.336 1.00 0.00 H new ATOM 0 HE1 HIS A 8 7.293 -48.891 53.272 1.00 0.00 H new ATOM 0 HE2 HIS A 8 6.622 -46.853 51.906 1.00 0.00 H new ATOM 119 N HIS A 9 9.235 -42.875 55.712 1.00 0.00 N ATOM 120 CA HIS A 9 8.140 -41.922 55.721 1.00 0.00 C ATOM 121 C HIS A 9 8.173 -41.074 54.461 1.00 0.00 C ATOM 122 O HIS A 9 9.110 -40.307 54.236 1.00 0.00 O ATOM 123 CB HIS A 9 8.194 -41.027 56.963 1.00 0.00 C ATOM 124 CG HIS A 9 7.017 -40.104 57.077 1.00 0.00 C ATOM 125 ND1 HIS A 9 7.105 -38.739 56.910 1.00 0.00 N ATOM 126 CD2 HIS A 9 5.715 -40.364 57.340 1.00 0.00 C ATOM 127 CE1 HIS A 9 5.909 -38.202 57.061 1.00 0.00 C ATOM 128 NE2 HIS A 9 5.048 -39.165 57.322 1.00 0.00 N ATOM 0 H HIS A 9 10.164 -42.455 55.685 1.00 0.00 H new ATOM 0 HA HIS A 9 7.205 -42.482 55.750 1.00 0.00 H new ATOM 0 HB2 HIS A 9 8.243 -41.654 57.853 1.00 0.00 H new ATOM 0 HB3 HIS A 9 9.110 -40.436 56.938 1.00 0.00 H new ATOM 0 HD2 HIS A 9 5.282 -41.335 57.529 1.00 0.00 H new ATOM 0 HE1 HIS A 9 5.675 -37.150 56.984 1.00 0.00 H new ATOM 0 HE2 HIS A 9 4.049 -39.040 57.484 1.00 0.00 H new ATOM 137 N HIS A 10 7.146 -41.224 53.645 1.00 0.00 N ATOM 138 CA HIS A 10 7.013 -40.449 52.424 1.00 0.00 C ATOM 139 C HIS A 10 6.470 -39.063 52.753 1.00 0.00 C ATOM 140 O HIS A 10 5.504 -38.929 53.504 1.00 0.00 O ATOM 141 CB HIS A 10 6.086 -41.174 51.439 1.00 0.00 C ATOM 142 CG HIS A 10 5.840 -40.425 50.162 1.00 0.00 C ATOM 143 ND1 HIS A 10 4.684 -39.725 49.919 1.00 0.00 N ATOM 144 CD2 HIS A 10 6.600 -40.288 49.049 1.00 0.00 C ATOM 145 CE1 HIS A 10 4.739 -39.188 48.717 1.00 0.00 C ATOM 146 NE2 HIS A 10 5.890 -39.512 48.162 1.00 0.00 N ATOM 0 H HIS A 10 6.384 -41.882 53.808 1.00 0.00 H new ATOM 0 HA HIS A 10 7.992 -40.340 51.957 1.00 0.00 H new ATOM 0 HB2 HIS A 10 6.517 -42.146 51.200 1.00 0.00 H new ATOM 0 HB3 HIS A 10 5.130 -41.361 51.928 1.00 0.00 H new ATOM 0 HD2 HIS A 10 7.581 -40.710 48.888 1.00 0.00 H new ATOM 0 HE1 HIS A 10 3.969 -38.583 48.262 1.00 0.00 H new ATOM 0 HE2 HIS A 10 6.202 -39.234 47.231 1.00 0.00 H new ATOM 155 N SER A 11 7.102 -38.042 52.206 1.00 0.00 N ATOM 156 CA SER A 11 6.680 -36.677 52.439 1.00 0.00 C ATOM 157 C SER A 11 6.288 -36.001 51.127 1.00 0.00 C ATOM 158 O SER A 11 6.883 -36.260 50.080 1.00 0.00 O ATOM 159 CB SER A 11 7.803 -35.905 53.135 1.00 0.00 C ATOM 160 OG SER A 11 9.054 -36.148 52.508 1.00 0.00 O ATOM 0 H SER A 11 7.913 -38.135 51.595 1.00 0.00 H new ATOM 0 HA SER A 11 5.802 -36.682 53.085 1.00 0.00 H new ATOM 0 HB2 SER A 11 7.583 -34.838 53.113 1.00 0.00 H new ATOM 0 HB3 SER A 11 7.855 -36.198 54.183 1.00 0.00 H new ATOM 0 HG SER A 11 9.755 -35.642 52.970 1.00 0.00 H new ATOM 166 N SER A 12 5.278 -35.153 51.187 1.00 0.00 N ATOM 167 CA SER A 12 4.823 -34.424 50.017 1.00 0.00 C ATOM 168 C SER A 12 5.309 -32.977 50.071 1.00 0.00 C ATOM 169 O SER A 12 4.883 -32.204 50.931 1.00 0.00 O ATOM 170 CB SER A 12 3.295 -34.486 49.930 1.00 0.00 C ATOM 171 OG SER A 12 2.700 -34.269 51.201 1.00 0.00 O ATOM 0 H SER A 12 4.754 -34.951 52.039 1.00 0.00 H new ATOM 0 HA SER A 12 5.240 -34.886 49.122 1.00 0.00 H new ATOM 0 HB2 SER A 12 2.937 -33.736 49.225 1.00 0.00 H new ATOM 0 HB3 SER A 12 2.989 -35.458 49.543 1.00 0.00 H new ATOM 0 HG SER A 12 3.158 -33.531 51.655 1.00 0.00 H new ATOM 177 N GLY A 13 6.212 -32.624 49.167 1.00 0.00 N ATOM 178 CA GLY A 13 6.772 -31.288 49.164 1.00 0.00 C ATOM 179 C GLY A 13 7.162 -30.824 47.778 1.00 0.00 C ATOM 180 O GLY A 13 6.947 -31.541 46.797 1.00 0.00 O ATOM 0 H GLY A 13 6.567 -33.240 48.435 1.00 0.00 H new ATOM 0 HA2 GLY A 13 6.046 -30.593 49.585 1.00 0.00 H new ATOM 0 HA3 GLY A 13 7.649 -31.264 49.811 1.00 0.00 H new ATOM 184 N ARG A 14 7.733 -29.622 47.713 1.00 0.00 N ATOM 185 CA ARG A 14 8.165 -29.003 46.460 1.00 0.00 C ATOM 186 C ARG A 14 6.953 -28.633 45.607 1.00 0.00 C ATOM 187 O ARG A 14 6.489 -29.420 44.780 1.00 0.00 O ATOM 188 CB ARG A 14 9.131 -29.924 45.690 1.00 0.00 C ATOM 189 CG ARG A 14 10.025 -29.209 44.681 1.00 0.00 C ATOM 190 CD ARG A 14 9.296 -28.866 43.387 1.00 0.00 C ATOM 191 NE ARG A 14 8.881 -30.061 42.653 1.00 0.00 N ATOM 192 CZ ARG A 14 9.335 -30.388 41.443 1.00 0.00 C ATOM 193 NH1 ARG A 14 10.174 -29.580 40.807 1.00 0.00 N ATOM 194 NH2 ARG A 14 8.922 -31.507 40.855 1.00 0.00 N ATOM 0 H ARG A 14 7.910 -29.045 48.535 1.00 0.00 H new ATOM 0 HA ARG A 14 8.708 -28.088 46.697 1.00 0.00 H new ATOM 0 HB2 ARG A 14 9.763 -30.447 46.408 1.00 0.00 H new ATOM 0 HB3 ARG A 14 8.549 -30.682 45.166 1.00 0.00 H new ATOM 0 HG2 ARG A 14 10.411 -28.293 45.129 1.00 0.00 H new ATOM 0 HG3 ARG A 14 10.884 -29.839 44.453 1.00 0.00 H new ATOM 0 HD2 ARG A 14 8.420 -28.260 43.616 1.00 0.00 H new ATOM 0 HD3 ARG A 14 9.946 -28.261 42.755 1.00 0.00 H new ATOM 0 HE ARG A 14 8.203 -30.682 43.094 1.00 0.00 H new ATOM 0 HH11 ARG A 14 10.472 -28.708 41.244 1.00 0.00 H new ATOM 0 HH12 ARG A 14 10.521 -29.831 39.881 1.00 0.00 H new ATOM 0 HH21 ARG A 14 8.257 -32.117 41.330 1.00 0.00 H new ATOM 0 HH22 ARG A 14 9.271 -31.755 39.929 1.00 0.00 H new ATOM 208 N GLU A 15 6.423 -27.438 45.846 1.00 0.00 N ATOM 209 CA GLU A 15 5.274 -26.942 45.096 1.00 0.00 C ATOM 210 C GLU A 15 5.668 -25.779 44.196 1.00 0.00 C ATOM 211 O GLU A 15 6.715 -25.150 44.388 1.00 0.00 O ATOM 212 CB GLU A 15 4.149 -26.479 46.035 1.00 0.00 C ATOM 213 CG GLU A 15 3.392 -27.603 46.734 1.00 0.00 C ATOM 214 CD GLU A 15 4.203 -28.302 47.805 1.00 0.00 C ATOM 215 OE1 GLU A 15 4.259 -29.545 47.793 1.00 0.00 O ATOM 216 OE2 GLU A 15 4.784 -27.610 48.667 1.00 0.00 O ATOM 0 H GLU A 15 6.772 -26.793 46.555 1.00 0.00 H new ATOM 0 HA GLU A 15 4.915 -27.771 44.486 1.00 0.00 H new ATOM 0 HB2 GLU A 15 4.576 -25.822 46.793 1.00 0.00 H new ATOM 0 HB3 GLU A 15 3.438 -25.884 45.461 1.00 0.00 H new ATOM 0 HG2 GLU A 15 2.486 -27.196 47.183 1.00 0.00 H new ATOM 0 HG3 GLU A 15 3.078 -28.336 45.991 1.00 0.00 H new ATOM 224 N ASN A 16 4.824 -25.510 43.211 1.00 0.00 N ATOM 225 CA ASN A 16 4.956 -24.331 42.363 1.00 0.00 C ATOM 226 C ASN A 16 3.583 -23.957 41.829 1.00 0.00 C ATOM 227 O ASN A 16 3.067 -24.598 40.915 1.00 0.00 O ATOM 228 CB ASN A 16 5.928 -24.584 41.207 1.00 0.00 C ATOM 229 CG ASN A 16 6.134 -23.351 40.345 1.00 0.00 C ATOM 230 OD1 ASN A 16 6.061 -22.222 40.827 1.00 0.00 O ATOM 231 ND2 ASN A 16 6.400 -23.560 39.066 1.00 0.00 N ATOM 0 H ASN A 16 4.028 -26.102 42.976 1.00 0.00 H new ATOM 0 HA ASN A 16 5.361 -23.510 42.955 1.00 0.00 H new ATOM 0 HB2 ASN A 16 6.888 -24.909 41.608 1.00 0.00 H new ATOM 0 HB3 ASN A 16 5.549 -25.398 40.588 1.00 0.00 H new ATOM 0 HD21 ASN A 16 6.553 -22.769 38.441 1.00 0.00 H new ATOM 0 HD22 ASN A 16 6.452 -24.513 38.705 1.00 0.00 H new ATOM 238 N LEU A 17 2.977 -22.948 42.431 1.00 0.00 N ATOM 239 CA LEU A 17 1.594 -22.613 42.136 1.00 0.00 C ATOM 240 C LEU A 17 1.478 -21.266 41.440 1.00 0.00 C ATOM 241 O LEU A 17 0.374 -20.769 41.226 1.00 0.00 O ATOM 242 CB LEU A 17 0.774 -22.590 43.427 1.00 0.00 C ATOM 243 CG LEU A 17 0.756 -23.903 44.214 1.00 0.00 C ATOM 244 CD1 LEU A 17 0.020 -23.722 45.532 1.00 0.00 C ATOM 245 CD2 LEU A 17 0.115 -25.014 43.395 1.00 0.00 C ATOM 0 H LEU A 17 3.420 -22.347 43.126 1.00 0.00 H new ATOM 0 HA LEU A 17 1.207 -23.378 41.463 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.165 -21.804 44.073 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -0.253 -22.319 43.181 1.00 0.00 H new ATOM 0 HG LEU A 17 1.786 -24.187 44.428 1.00 0.00 H new ATOM 0 HD11 LEU A 17 0.016 -24.665 46.079 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.522 -22.959 46.127 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -1.007 -23.412 45.336 1.00 0.00 H new ATOM 0 HD21 LEU A 17 0.113 -25.938 43.974 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.910 -24.738 43.148 1.00 0.00 H new ATOM 0 HD23 LEU A 17 0.683 -25.163 42.476 1.00 0.00 H new ATOM 257 N TYR A 18 2.606 -20.675 41.082 1.00 0.00 N ATOM 258 CA TYR A 18 2.584 -19.358 40.471 1.00 0.00 C ATOM 259 C TYR A 18 2.916 -19.440 38.987 1.00 0.00 C ATOM 260 O TYR A 18 4.000 -19.887 38.597 1.00 0.00 O ATOM 261 CB TYR A 18 3.559 -18.408 41.172 1.00 0.00 C ATOM 262 CG TYR A 18 3.188 -16.946 41.001 1.00 0.00 C ATOM 263 CD1 TYR A 18 3.417 -16.277 39.802 1.00 0.00 C ATOM 264 CD2 TYR A 18 2.595 -16.238 42.041 1.00 0.00 C ATOM 265 CE1 TYR A 18 3.062 -14.951 39.646 1.00 0.00 C ATOM 266 CE2 TYR A 18 2.240 -14.910 41.892 1.00 0.00 C ATOM 267 CZ TYR A 18 2.474 -14.272 40.694 1.00 0.00 C ATOM 268 OH TYR A 18 2.116 -12.949 40.540 1.00 0.00 O ATOM 0 H TYR A 18 3.535 -21.079 41.202 1.00 0.00 H new ATOM 0 HA TYR A 18 1.574 -18.963 40.582 1.00 0.00 H new ATOM 0 HB2 TYR A 18 3.590 -18.647 42.235 1.00 0.00 H new ATOM 0 HB3 TYR A 18 4.563 -18.571 40.779 1.00 0.00 H new ATOM 0 HD1 TYR A 18 3.880 -16.803 38.980 1.00 0.00 H new ATOM 0 HD2 TYR A 18 2.408 -16.734 42.982 1.00 0.00 H new ATOM 0 HE1 TYR A 18 3.244 -14.448 38.708 1.00 0.00 H new ATOM 0 HE2 TYR A 18 1.782 -14.376 42.711 1.00 0.00 H new ATOM 0 HH TYR A 18 1.714 -12.620 41.371 1.00 0.00 H new ATOM 278 N PHE A 19 1.972 -19.005 38.171 1.00 0.00 N ATOM 279 CA PHE A 19 2.153 -18.937 36.733 1.00 0.00 C ATOM 280 C PHE A 19 1.097 -18.019 36.138 1.00 0.00 C ATOM 281 O PHE A 19 -0.046 -18.423 35.921 1.00 0.00 O ATOM 282 CB PHE A 19 2.072 -20.327 36.094 1.00 0.00 C ATOM 283 CG PHE A 19 2.348 -20.319 34.613 1.00 0.00 C ATOM 284 CD1 PHE A 19 3.645 -20.181 34.141 1.00 0.00 C ATOM 285 CD2 PHE A 19 1.315 -20.442 33.697 1.00 0.00 C ATOM 286 CE1 PHE A 19 3.903 -20.167 32.784 1.00 0.00 C ATOM 287 CE2 PHE A 19 1.570 -20.429 32.339 1.00 0.00 C ATOM 288 CZ PHE A 19 2.866 -20.290 31.882 1.00 0.00 C ATOM 0 H PHE A 19 1.056 -18.688 38.489 1.00 0.00 H new ATOM 0 HA PHE A 19 3.146 -18.538 36.525 1.00 0.00 H new ATOM 0 HB2 PHE A 19 2.786 -20.988 36.586 1.00 0.00 H new ATOM 0 HB3 PHE A 19 1.080 -20.743 36.269 1.00 0.00 H new ATOM 0 HD1 PHE A 19 4.461 -20.084 34.841 1.00 0.00 H new ATOM 0 HD2 PHE A 19 0.299 -20.549 34.049 1.00 0.00 H new ATOM 0 HE1 PHE A 19 4.917 -20.060 32.429 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.757 -20.527 31.635 1.00 0.00 H new ATOM 0 HZ PHE A 19 3.067 -20.278 30.821 1.00 0.00 H new ATOM 298 N GLN A 20 1.477 -16.777 35.903 1.00 0.00 N ATOM 299 CA GLN A 20 0.546 -15.773 35.417 1.00 0.00 C ATOM 300 C GLN A 20 1.239 -14.855 34.420 1.00 0.00 C ATOM 301 O GLN A 20 2.397 -14.480 34.617 1.00 0.00 O ATOM 302 CB GLN A 20 -0.003 -14.964 36.594 1.00 0.00 C ATOM 303 CG GLN A 20 -1.047 -13.933 36.202 1.00 0.00 C ATOM 304 CD GLN A 20 -1.503 -13.099 37.377 1.00 0.00 C ATOM 305 OE1 GLN A 20 -0.922 -12.056 37.673 1.00 0.00 O ATOM 306 NE2 GLN A 20 -2.543 -13.549 38.057 1.00 0.00 N ATOM 0 H GLN A 20 2.429 -16.437 36.041 1.00 0.00 H new ATOM 0 HA GLN A 20 -0.283 -16.269 34.912 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -0.439 -15.649 37.321 1.00 0.00 H new ATOM 0 HB3 GLN A 20 0.824 -14.457 37.091 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -0.637 -13.279 35.433 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -1.907 -14.439 35.764 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -2.997 -14.419 37.778 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -2.892 -13.026 38.860 1.00 0.00 H new ATOM 315 N GLY A 21 0.538 -14.514 33.349 1.00 0.00 N ATOM 316 CA GLY A 21 1.099 -13.641 32.340 1.00 0.00 C ATOM 317 C GLY A 21 0.109 -13.332 31.239 1.00 0.00 C ATOM 318 O GLY A 21 -0.474 -14.242 30.648 1.00 0.00 O ATOM 0 H GLY A 21 -0.414 -14.828 33.161 1.00 0.00 H new ATOM 0 HA2 GLY A 21 1.424 -12.711 32.806 1.00 0.00 H new ATOM 0 HA3 GLY A 21 1.985 -14.108 31.910 1.00 0.00 H new ATOM 322 N HIS A 22 -0.096 -12.051 30.978 1.00 0.00 N ATOM 323 CA HIS A 22 -0.990 -11.616 29.914 1.00 0.00 C ATOM 324 C HIS A 22 -0.670 -10.177 29.538 1.00 0.00 C ATOM 325 O HIS A 22 -0.511 -9.325 30.416 1.00 0.00 O ATOM 326 CB HIS A 22 -2.456 -11.727 30.353 1.00 0.00 C ATOM 327 CG HIS A 22 -3.444 -11.488 29.245 1.00 0.00 C ATOM 328 ND1 HIS A 22 -3.937 -10.236 28.932 1.00 0.00 N ATOM 329 CD2 HIS A 22 -4.035 -12.346 28.378 1.00 0.00 C ATOM 330 CE1 HIS A 22 -4.780 -10.337 27.923 1.00 0.00 C ATOM 331 NE2 HIS A 22 -4.859 -11.604 27.570 1.00 0.00 N ATOM 0 H HIS A 22 0.347 -11.289 31.491 1.00 0.00 H new ATOM 0 HA HIS A 22 -0.842 -12.262 29.049 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -2.626 -12.720 30.770 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -2.641 -11.009 31.152 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -3.885 -13.415 28.332 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -5.315 -9.519 27.464 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -5.439 -11.974 26.817 1.00 0.00 H new ATOM 340 N MET A 23 -0.569 -9.914 28.244 1.00 0.00 N ATOM 341 CA MET A 23 -0.276 -8.577 27.748 1.00 0.00 C ATOM 342 C MET A 23 -0.515 -8.511 26.247 1.00 0.00 C ATOM 343 O MET A 23 0.327 -8.931 25.453 1.00 0.00 O ATOM 344 CB MET A 23 1.170 -8.182 28.080 1.00 0.00 C ATOM 345 CG MET A 23 1.538 -6.769 27.651 1.00 0.00 C ATOM 346 SD MET A 23 3.177 -6.274 28.224 1.00 0.00 S ATOM 347 CE MET A 23 2.933 -6.302 29.999 1.00 0.00 C ATOM 0 H MET A 23 -0.687 -10.615 27.513 1.00 0.00 H new ATOM 0 HA MET A 23 -0.944 -7.870 28.240 1.00 0.00 H new ATOM 0 HB2 MET A 23 1.324 -8.276 29.155 1.00 0.00 H new ATOM 0 HB3 MET A 23 1.848 -8.886 27.598 1.00 0.00 H new ATOM 0 HG2 MET A 23 1.502 -6.702 26.564 1.00 0.00 H new ATOM 0 HG3 MET A 23 0.796 -6.071 28.038 1.00 0.00 H new ATOM 0 HE1 MET A 23 3.657 -5.642 30.476 1.00 0.00 H new ATOM 0 HE2 MET A 23 1.924 -5.963 30.233 1.00 0.00 H new ATOM 0 HE3 MET A 23 3.069 -7.318 30.369 1.00 0.00 H new ATOM 357 N ALA A 24 -1.679 -8.011 25.868 1.00 0.00 N ATOM 358 CA ALA A 24 -2.038 -7.887 24.463 1.00 0.00 C ATOM 359 C ALA A 24 -2.329 -6.433 24.121 1.00 0.00 C ATOM 360 O ALA A 24 -3.353 -5.883 24.530 1.00 0.00 O ATOM 361 CB ALA A 24 -3.243 -8.756 24.143 1.00 0.00 C ATOM 0 H ALA A 24 -2.395 -7.683 26.516 1.00 0.00 H new ATOM 0 HA ALA A 24 -1.197 -8.227 23.859 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -3.498 -8.651 23.088 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -3.007 -9.798 24.357 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -4.090 -8.443 24.754 1.00 0.00 H new ATOM 367 N ALA A 25 -1.418 -5.807 23.391 1.00 0.00 N ATOM 368 CA ALA A 25 -1.566 -4.404 23.039 1.00 0.00 C ATOM 369 C ALA A 25 -1.022 -4.122 21.642 1.00 0.00 C ATOM 370 O ALA A 25 0.146 -4.379 21.357 1.00 0.00 O ATOM 371 CB ALA A 25 -0.863 -3.527 24.066 1.00 0.00 C ATOM 0 H ALA A 25 -0.571 -6.247 23.032 1.00 0.00 H new ATOM 0 HA ALA A 25 -2.630 -4.168 23.038 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -0.981 -2.479 23.791 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -1.301 -3.696 25.050 1.00 0.00 H new ATOM 0 HB3 ALA A 25 0.197 -3.778 24.093 1.00 0.00 H new ATOM 377 N ARG A 26 -1.880 -3.602 20.776 1.00 0.00 N ATOM 378 CA ARG A 26 -1.471 -3.186 19.441 1.00 0.00 C ATOM 379 C ARG A 26 -1.533 -1.671 19.322 1.00 0.00 C ATOM 380 O ARG A 26 -2.557 -1.059 19.618 1.00 0.00 O ATOM 381 CB ARG A 26 -2.356 -3.829 18.366 1.00 0.00 C ATOM 382 CG ARG A 26 -1.916 -5.224 17.961 1.00 0.00 C ATOM 383 CD ARG A 26 -2.835 -5.805 16.901 1.00 0.00 C ATOM 384 NE ARG A 26 -4.136 -6.187 17.450 1.00 0.00 N ATOM 385 CZ ARG A 26 -5.271 -6.227 16.749 1.00 0.00 C ATOM 386 NH1 ARG A 26 -5.302 -5.803 15.491 1.00 0.00 N ATOM 387 NH2 ARG A 26 -6.387 -6.669 17.318 1.00 0.00 N ATOM 0 H ARG A 26 -2.870 -3.457 20.975 1.00 0.00 H new ATOM 0 HA ARG A 26 -0.445 -3.519 19.284 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -3.381 -3.874 18.733 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -2.361 -3.190 17.483 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -0.895 -5.190 17.581 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -1.909 -5.874 18.836 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -2.978 -5.074 16.106 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -2.362 -6.677 16.450 1.00 0.00 H new ATOM 0 HE ARG A 26 -4.179 -6.440 18.437 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -4.454 -5.443 15.053 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -6.174 -5.837 14.963 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -6.376 -6.978 18.290 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -7.255 -6.700 16.783 1.00 0.00 H new ATOM 401 N ILE A 27 -0.431 -1.070 18.904 1.00 0.00 N ATOM 402 CA ILE A 27 -0.374 0.371 18.734 1.00 0.00 C ATOM 403 C ILE A 27 -0.753 0.744 17.306 1.00 0.00 C ATOM 404 O ILE A 27 0.021 0.530 16.371 1.00 0.00 O ATOM 405 CB ILE A 27 1.031 0.925 19.059 1.00 0.00 C ATOM 406 CG1 ILE A 27 1.445 0.507 20.476 1.00 0.00 C ATOM 407 CG2 ILE A 27 1.047 2.443 18.922 1.00 0.00 C ATOM 408 CD1 ILE A 27 2.856 0.914 20.848 1.00 0.00 C ATOM 0 H ILE A 27 0.435 -1.558 18.676 1.00 0.00 H new ATOM 0 HA ILE A 27 -1.084 0.816 19.431 1.00 0.00 H new ATOM 0 HB ILE A 27 1.747 0.510 18.350 1.00 0.00 H new ATOM 0 HG12 ILE A 27 0.750 0.946 21.192 1.00 0.00 H new ATOM 0 HG13 ILE A 27 1.354 -0.575 20.566 1.00 0.00 H new ATOM 0 HG21 ILE A 27 2.043 2.819 19.154 1.00 0.00 H new ATOM 0 HG22 ILE A 27 0.784 2.719 17.901 1.00 0.00 H new ATOM 0 HG23 ILE A 27 0.325 2.878 19.613 1.00 0.00 H new ATOM 0 HD11 ILE A 27 3.074 0.583 21.863 1.00 0.00 H new ATOM 0 HD12 ILE A 27 3.562 0.453 20.157 1.00 0.00 H new ATOM 0 HD13 ILE A 27 2.949 1.999 20.792 1.00 0.00 H new ATOM 420 N THR A 28 -1.956 1.273 17.143 1.00 0.00 N ATOM 421 CA THR A 28 -2.462 1.635 15.833 1.00 0.00 C ATOM 422 C THR A 28 -2.078 3.066 15.471 1.00 0.00 C ATOM 423 O THR A 28 -2.129 3.963 16.313 1.00 0.00 O ATOM 424 CB THR A 28 -3.993 1.485 15.788 1.00 0.00 C ATOM 425 OG1 THR A 28 -4.582 2.132 16.927 1.00 0.00 O ATOM 426 CG2 THR A 28 -4.395 0.018 15.768 1.00 0.00 C ATOM 0 H THR A 28 -2.602 1.461 17.909 1.00 0.00 H new ATOM 0 HA THR A 28 -2.012 0.960 15.106 1.00 0.00 H new ATOM 0 HB THR A 28 -4.355 1.955 14.874 1.00 0.00 H new ATOM 0 HG1 THR A 28 -5.556 2.034 16.891 1.00 0.00 H new ATOM 0 HG21 THR A 28 -5.482 -0.061 15.736 1.00 0.00 H new ATOM 0 HG22 THR A 28 -3.970 -0.464 14.887 1.00 0.00 H new ATOM 0 HG23 THR A 28 -4.022 -0.474 16.666 1.00 0.00 H new ATOM 434 N GLY A 29 -1.664 3.274 14.228 1.00 0.00 N ATOM 435 CA GLY A 29 -1.353 4.610 13.766 1.00 0.00 C ATOM 436 C GLY A 29 -1.137 4.666 12.266 1.00 0.00 C ATOM 437 O GLY A 29 -0.296 5.425 11.780 1.00 0.00 O ATOM 0 H GLY A 29 -1.538 2.539 13.532 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -2.165 5.284 14.039 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -0.457 4.968 14.273 1.00 0.00 H new ATOM 441 N GLU A 30 -1.896 3.864 11.531 1.00 0.00 N ATOM 442 CA GLU A 30 -1.758 3.798 10.082 1.00 0.00 C ATOM 443 C GLU A 30 -2.945 4.476 9.400 1.00 0.00 C ATOM 444 O GLU A 30 -4.030 4.559 9.977 1.00 0.00 O ATOM 445 CB GLU A 30 -1.660 2.344 9.598 1.00 0.00 C ATOM 446 CG GLU A 30 -0.463 1.574 10.134 1.00 0.00 C ATOM 447 CD GLU A 30 -0.721 0.944 11.490 1.00 0.00 C ATOM 448 OE1 GLU A 30 -1.213 -0.201 11.533 1.00 0.00 O ATOM 449 OE2 GLU A 30 -0.414 1.581 12.519 1.00 0.00 O ATOM 0 H GLU A 30 -2.614 3.250 11.915 1.00 0.00 H new ATOM 0 HA GLU A 30 -0.838 4.319 9.817 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -2.571 1.818 9.884 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -1.619 2.340 8.509 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -0.192 0.794 9.423 1.00 0.00 H new ATOM 0 HG3 GLU A 30 0.391 2.247 10.209 1.00 0.00 H new ATOM 457 N PRO A 31 -2.749 4.981 8.169 1.00 0.00 N ATOM 458 CA PRO A 31 -3.840 5.540 7.363 1.00 0.00 C ATOM 459 C PRO A 31 -4.831 4.463 6.931 1.00 0.00 C ATOM 460 O PRO A 31 -4.561 3.267 7.069 1.00 0.00 O ATOM 461 CB PRO A 31 -3.123 6.131 6.145 1.00 0.00 C ATOM 462 CG PRO A 31 -1.835 5.388 6.059 1.00 0.00 C ATOM 463 CD PRO A 31 -1.453 5.065 7.476 1.00 0.00 C ATOM 0 HA PRO A 31 -4.428 6.273 7.916 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -3.714 6.003 5.238 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -2.954 7.201 6.267 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -1.947 4.479 5.467 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -1.067 5.991 5.575 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -0.902 4.127 7.540 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -0.817 5.838 7.907 1.00 0.00 H new ATOM 471 N SER A 32 -5.968 4.879 6.396 1.00 0.00 N ATOM 472 CA SER A 32 -7.017 3.940 6.034 1.00 0.00 C ATOM 473 C SER A 32 -6.824 3.420 4.608 1.00 0.00 C ATOM 474 O SER A 32 -6.593 2.226 4.398 1.00 0.00 O ATOM 475 CB SER A 32 -8.393 4.604 6.181 1.00 0.00 C ATOM 476 OG SER A 32 -9.442 3.677 5.943 1.00 0.00 O ATOM 0 H SER A 32 -6.187 5.856 6.204 1.00 0.00 H new ATOM 0 HA SER A 32 -6.961 3.088 6.711 1.00 0.00 H new ATOM 0 HB2 SER A 32 -8.493 5.020 7.184 1.00 0.00 H new ATOM 0 HB3 SER A 32 -8.474 5.436 5.481 1.00 0.00 H new ATOM 0 HG SER A 32 -10.306 4.128 6.045 1.00 0.00 H new ATOM 482 N LYS A 33 -6.894 4.319 3.635 1.00 0.00 N ATOM 483 CA LYS A 33 -6.886 3.918 2.235 1.00 0.00 C ATOM 484 C LYS A 33 -5.564 4.267 1.554 1.00 0.00 C ATOM 485 O LYS A 33 -5.325 3.865 0.419 1.00 0.00 O ATOM 486 CB LYS A 33 -8.053 4.575 1.487 1.00 0.00 C ATOM 487 CG LYS A 33 -9.414 4.256 2.090 1.00 0.00 C ATOM 488 CD LYS A 33 -10.547 4.833 1.257 1.00 0.00 C ATOM 489 CE LYS A 33 -10.448 6.346 1.142 1.00 0.00 C ATOM 490 NZ LYS A 33 -11.565 6.907 0.344 1.00 0.00 N ATOM 0 H LYS A 33 -6.957 5.325 3.788 1.00 0.00 H new ATOM 0 HA LYS A 33 -7.001 2.835 2.203 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -7.910 5.656 1.483 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -8.039 4.248 0.447 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -9.533 3.175 2.168 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -9.466 4.656 3.103 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -10.528 4.391 0.261 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -11.503 4.564 1.707 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -10.454 6.788 2.138 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -9.498 6.615 0.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -11.466 7.941 0.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -11.544 6.503 -0.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -12.470 6.671 0.799 1.00 0.00 H new ATOM 504 N LYS A 34 -4.702 5.000 2.245 1.00 0.00 N ATOM 505 CA LYS A 34 -3.421 5.388 1.668 1.00 0.00 C ATOM 506 C LYS A 34 -2.351 4.348 1.993 1.00 0.00 C ATOM 507 O LYS A 34 -1.195 4.463 1.579 1.00 0.00 O ATOM 508 CB LYS A 34 -2.992 6.771 2.173 1.00 0.00 C ATOM 509 CG LYS A 34 -1.864 7.388 1.361 1.00 0.00 C ATOM 510 CD LYS A 34 -1.348 8.670 1.989 1.00 0.00 C ATOM 511 CE LYS A 34 -0.256 9.293 1.134 1.00 0.00 C ATOM 512 NZ LYS A 34 0.413 10.436 1.813 1.00 0.00 N ATOM 0 H LYS A 34 -4.863 5.335 3.195 1.00 0.00 H new ATOM 0 HA LYS A 34 -3.538 5.440 0.586 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -3.852 7.440 2.152 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -2.677 6.688 3.213 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -1.047 6.672 1.274 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -2.216 7.595 0.350 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -2.169 9.377 2.109 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -0.960 8.461 2.986 1.00 0.00 H new ATOM 0 HE2 LYS A 34 0.487 8.534 0.889 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -0.686 9.634 0.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 1.149 10.827 1.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -0.289 11.173 2.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 0.847 10.107 2.699 1.00 0.00 H new ATOM 526 N ALA A 35 -2.755 3.321 2.717 1.00 0.00 N ATOM 527 CA ALA A 35 -1.838 2.273 3.139 1.00 0.00 C ATOM 528 C ALA A 35 -1.663 1.236 2.038 1.00 0.00 C ATOM 529 O ALA A 35 -2.580 0.995 1.255 1.00 0.00 O ATOM 530 CB ALA A 35 -2.338 1.612 4.416 1.00 0.00 C ATOM 0 H ALA A 35 -3.717 3.188 3.028 1.00 0.00 H new ATOM 0 HA ALA A 35 -0.868 2.727 3.339 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -1.641 0.830 4.718 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -2.412 2.358 5.207 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -3.320 1.173 4.238 1.00 0.00 H new ATOM 536 N VAL A 36 -0.480 0.631 1.978 1.00 0.00 N ATOM 537 CA VAL A 36 -0.200 -0.399 0.980 1.00 0.00 C ATOM 538 C VAL A 36 -0.831 -1.719 1.408 1.00 0.00 C ATOM 539 O VAL A 36 -1.024 -2.631 0.604 1.00 0.00 O ATOM 540 CB VAL A 36 1.324 -0.588 0.779 1.00 0.00 C ATOM 541 CG1 VAL A 36 1.614 -1.517 -0.390 1.00 0.00 C ATOM 542 CG2 VAL A 36 2.010 0.756 0.576 1.00 0.00 C ATOM 0 H VAL A 36 0.298 0.834 2.606 1.00 0.00 H new ATOM 0 HA VAL A 36 -0.630 -0.077 0.032 1.00 0.00 H new ATOM 0 HB VAL A 36 1.725 -1.049 1.682 1.00 0.00 H new ATOM 0 HG11 VAL A 36 2.692 -1.630 -0.506 1.00 0.00 H new ATOM 0 HG12 VAL A 36 1.165 -2.492 -0.200 1.00 0.00 H new ATOM 0 HG13 VAL A 36 1.193 -1.096 -1.303 1.00 0.00 H new ATOM 0 HG21 VAL A 36 3.080 0.601 0.437 1.00 0.00 H new ATOM 0 HG22 VAL A 36 1.596 1.246 -0.305 1.00 0.00 H new ATOM 0 HG23 VAL A 36 1.845 1.384 1.451 1.00 0.00 H new ATOM 552 N SER A 37 -1.176 -1.776 2.685 1.00 0.00 N ATOM 553 CA SER A 37 -1.854 -2.923 3.281 1.00 0.00 C ATOM 554 C SER A 37 -0.980 -4.185 3.239 1.00 0.00 C ATOM 555 O SER A 37 0.154 -4.173 2.746 1.00 0.00 O ATOM 556 CB SER A 37 -3.197 -3.169 2.570 1.00 0.00 C ATOM 557 OG SER A 37 -3.987 -4.138 3.249 1.00 0.00 O ATOM 0 H SER A 37 -0.993 -1.021 3.346 1.00 0.00 H new ATOM 0 HA SER A 37 -2.042 -2.694 4.330 1.00 0.00 H new ATOM 0 HB2 SER A 37 -3.750 -2.232 2.504 1.00 0.00 H new ATOM 0 HB3 SER A 37 -3.012 -3.503 1.549 1.00 0.00 H new ATOM 0 HG SER A 37 -3.923 -3.993 4.216 1.00 0.00 H new ATOM 563 N ASP A 38 -1.513 -5.258 3.803 1.00 0.00 N ATOM 564 CA ASP A 38 -0.879 -6.570 3.761 1.00 0.00 C ATOM 565 C ASP A 38 -1.866 -7.578 3.205 1.00 0.00 C ATOM 566 O ASP A 38 -1.545 -8.750 3.008 1.00 0.00 O ATOM 567 CB ASP A 38 -0.439 -7.003 5.163 1.00 0.00 C ATOM 568 CG ASP A 38 -1.608 -7.409 6.044 1.00 0.00 C ATOM 569 OD1 ASP A 38 -2.373 -6.521 6.482 1.00 0.00 O ATOM 570 OD2 ASP A 38 -1.766 -8.616 6.308 1.00 0.00 O ATOM 0 H ASP A 38 -2.401 -5.245 4.305 1.00 0.00 H new ATOM 0 HA ASP A 38 0.003 -6.518 3.123 1.00 0.00 H new ATOM 0 HB2 ASP A 38 0.256 -7.839 5.080 1.00 0.00 H new ATOM 0 HB3 ASP A 38 0.102 -6.185 5.638 1.00 0.00 H new ATOM 576 N ARG A 39 -3.064 -7.090 2.912 1.00 0.00 N ATOM 577 CA ARG A 39 -4.158 -7.941 2.464 1.00 0.00 C ATOM 578 C ARG A 39 -4.036 -8.234 0.974 1.00 0.00 C ATOM 579 O ARG A 39 -5.008 -8.589 0.313 1.00 0.00 O ATOM 580 CB ARG A 39 -5.498 -7.264 2.772 1.00 0.00 C ATOM 581 CG ARG A 39 -5.608 -6.788 4.213 1.00 0.00 C ATOM 582 CD ARG A 39 -5.460 -7.937 5.196 1.00 0.00 C ATOM 583 NE ARG A 39 -5.043 -7.476 6.520 1.00 0.00 N ATOM 584 CZ ARG A 39 -5.814 -7.521 7.606 1.00 0.00 C ATOM 585 NH1 ARG A 39 -7.062 -7.963 7.522 1.00 0.00 N ATOM 586 NH2 ARG A 39 -5.341 -7.107 8.775 1.00 0.00 N ATOM 0 H ARG A 39 -3.304 -6.101 2.977 1.00 0.00 H new ATOM 0 HA ARG A 39 -4.109 -8.890 2.998 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -5.631 -6.413 2.103 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -6.308 -7.963 2.564 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -4.840 -6.040 4.409 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -6.572 -6.302 4.363 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -6.409 -8.467 5.279 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -4.729 -8.649 4.813 1.00 0.00 H new ATOM 0 HE ARG A 39 -4.102 -7.096 6.618 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -7.435 -8.270 6.624 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -7.649 -7.996 8.356 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -4.386 -6.754 8.843 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -5.932 -7.142 9.606 1.00 0.00 H new ATOM 600 N LEU A 40 -2.830 -8.071 0.453 1.00 0.00 N ATOM 601 CA LEU A 40 -2.533 -8.399 -0.926 1.00 0.00 C ATOM 602 C LEU A 40 -1.819 -9.744 -0.986 1.00 0.00 C ATOM 603 O LEU A 40 -1.795 -10.411 -2.019 1.00 0.00 O ATOM 604 CB LEU A 40 -1.645 -7.318 -1.543 1.00 0.00 C ATOM 605 CG LEU A 40 -2.166 -5.884 -1.424 1.00 0.00 C ATOM 606 CD1 LEU A 40 -1.196 -4.913 -2.084 1.00 0.00 C ATOM 607 CD2 LEU A 40 -3.551 -5.755 -2.040 1.00 0.00 C ATOM 0 H LEU A 40 -2.033 -7.708 0.976 1.00 0.00 H new ATOM 0 HA LEU A 40 -3.465 -8.455 -1.488 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.663 -7.368 -1.073 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.505 -7.548 -2.599 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.243 -5.636 -0.365 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -1.579 -3.897 -1.992 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -0.224 -4.980 -1.594 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -1.089 -5.166 -3.139 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.898 -4.726 -1.942 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -3.506 -6.024 -3.095 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -4.242 -6.422 -1.524 1.00 0.00 H new ATOM 619 N ILE A 41 -1.245 -10.139 0.146 1.00 0.00 N ATOM 620 CA ILE A 41 -0.469 -11.372 0.236 1.00 0.00 C ATOM 621 C ILE A 41 -1.367 -12.602 0.207 1.00 0.00 C ATOM 622 O ILE A 41 -2.415 -12.639 0.861 1.00 0.00 O ATOM 623 CB ILE A 41 0.382 -11.397 1.526 1.00 0.00 C ATOM 624 CG1 ILE A 41 1.302 -10.174 1.583 1.00 0.00 C ATOM 625 CG2 ILE A 41 1.198 -12.679 1.617 1.00 0.00 C ATOM 626 CD1 ILE A 41 2.275 -10.076 0.426 1.00 0.00 C ATOM 0 H ILE A 41 -1.303 -9.618 1.021 1.00 0.00 H new ATOM 0 HA ILE A 41 0.189 -11.396 -0.633 1.00 0.00 H new ATOM 0 HB ILE A 41 -0.296 -11.365 2.379 1.00 0.00 H new ATOM 0 HG12 ILE A 41 0.689 -9.273 1.605 1.00 0.00 H new ATOM 0 HG13 ILE A 41 1.865 -10.200 2.516 1.00 0.00 H new ATOM 0 HG21 ILE A 41 1.787 -12.671 2.534 1.00 0.00 H new ATOM 0 HG22 ILE A 41 0.527 -13.538 1.625 1.00 0.00 H new ATOM 0 HG23 ILE A 41 1.865 -12.748 0.758 1.00 0.00 H new ATOM 0 HD11 ILE A 41 2.889 -9.183 0.542 1.00 0.00 H new ATOM 0 HD12 ILE A 41 2.915 -10.958 0.414 1.00 0.00 H new ATOM 0 HD13 ILE A 41 1.721 -10.016 -0.511 1.00 0.00 H new ATOM 638 N GLY A 42 -0.957 -13.593 -0.576 1.00 0.00 N ATOM 639 CA GLY A 42 -1.620 -14.878 -0.566 1.00 0.00 C ATOM 640 C GLY A 42 -2.930 -14.887 -1.325 1.00 0.00 C ATOM 641 O GLY A 42 -3.812 -15.694 -1.036 1.00 0.00 O ATOM 0 H GLY A 42 -0.170 -13.525 -1.222 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -0.954 -15.625 -0.998 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -1.805 -15.174 0.466 1.00 0.00 H new ATOM 645 N ARG A 43 -3.063 -14.005 -2.302 1.00 0.00 N ATOM 646 CA ARG A 43 -4.281 -13.925 -3.089 1.00 0.00 C ATOM 647 C ARG A 43 -3.964 -14.038 -4.575 1.00 0.00 C ATOM 648 O ARG A 43 -2.820 -13.828 -4.990 1.00 0.00 O ATOM 649 CB ARG A 43 -5.005 -12.618 -2.783 1.00 0.00 C ATOM 650 CG ARG A 43 -5.464 -12.533 -1.336 1.00 0.00 C ATOM 651 CD ARG A 43 -5.887 -11.128 -0.944 1.00 0.00 C ATOM 652 NE ARG A 43 -7.130 -10.709 -1.584 1.00 0.00 N ATOM 653 CZ ARG A 43 -8.267 -10.522 -0.920 1.00 0.00 C ATOM 654 NH1 ARG A 43 -8.344 -10.817 0.374 1.00 0.00 N ATOM 655 NH2 ARG A 43 -9.333 -10.046 -1.548 1.00 0.00 N ATOM 0 H ARG A 43 -2.342 -13.335 -2.569 1.00 0.00 H new ATOM 0 HA ARG A 43 -4.934 -14.756 -2.823 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -4.343 -11.780 -3.001 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -5.868 -12.522 -3.441 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -6.299 -13.217 -1.182 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -4.657 -12.862 -0.682 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -6.007 -11.079 0.138 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -5.094 -10.428 -1.209 1.00 0.00 H new ATOM 0 HE ARG A 43 -7.126 -10.552 -2.592 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -7.529 -11.188 0.862 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -9.218 -10.672 0.879 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -9.282 -9.823 -2.542 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -10.204 -9.903 -1.037 1.00 0.00 H new ATOM 669 N LYS A 44 -4.971 -14.383 -5.366 1.00 0.00 N ATOM 670 CA LYS A 44 -4.783 -14.597 -6.791 1.00 0.00 C ATOM 671 C LYS A 44 -5.127 -13.338 -7.585 1.00 0.00 C ATOM 672 O LYS A 44 -6.050 -12.600 -7.233 1.00 0.00 O ATOM 673 CB LYS A 44 -5.654 -15.762 -7.263 1.00 0.00 C ATOM 674 CG LYS A 44 -5.440 -16.118 -8.723 1.00 0.00 C ATOM 675 CD LYS A 44 -6.395 -17.199 -9.209 1.00 0.00 C ATOM 676 CE LYS A 44 -7.848 -16.758 -9.107 1.00 0.00 C ATOM 677 NZ LYS A 44 -8.722 -17.531 -10.026 1.00 0.00 N ATOM 0 H LYS A 44 -5.928 -14.520 -5.042 1.00 0.00 H new ATOM 0 HA LYS A 44 -3.733 -14.835 -6.964 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -5.443 -16.637 -6.648 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -6.703 -15.509 -7.108 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -5.568 -15.224 -9.333 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -4.413 -16.456 -8.864 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -6.163 -17.450 -10.244 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -6.248 -18.105 -8.621 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -8.196 -16.884 -8.082 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -7.923 -15.696 -9.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -9.702 -17.503 -9.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -8.680 -17.114 -10.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -8.397 -18.518 -10.066 1.00 0.00 H new ATOM 691 N GLY A 45 -4.388 -13.116 -8.661 1.00 0.00 N ATOM 692 CA GLY A 45 -4.636 -11.996 -9.531 1.00 0.00 C ATOM 693 C GLY A 45 -4.469 -12.397 -10.979 1.00 0.00 C ATOM 694 O GLY A 45 -4.144 -13.548 -11.271 1.00 0.00 O ATOM 0 H GLY A 45 -3.607 -13.707 -8.947 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -5.645 -11.618 -9.367 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -3.949 -11.184 -9.292 1.00 0.00 H new ATOM 698 N VAL A 46 -4.668 -11.459 -11.880 1.00 0.00 N ATOM 699 CA VAL A 46 -4.595 -11.739 -13.306 1.00 0.00 C ATOM 700 C VAL A 46 -3.522 -10.868 -13.955 1.00 0.00 C ATOM 701 O VAL A 46 -3.316 -9.720 -13.552 1.00 0.00 O ATOM 702 CB VAL A 46 -5.968 -11.515 -13.995 1.00 0.00 C ATOM 703 CG1 VAL A 46 -6.424 -10.071 -13.851 1.00 0.00 C ATOM 704 CG2 VAL A 46 -5.918 -11.922 -15.462 1.00 0.00 C ATOM 0 H VAL A 46 -4.883 -10.488 -11.652 1.00 0.00 H new ATOM 0 HA VAL A 46 -4.327 -12.788 -13.434 1.00 0.00 H new ATOM 0 HB VAL A 46 -6.698 -12.151 -13.493 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -7.388 -9.943 -14.343 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -6.520 -9.824 -12.794 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -5.691 -9.410 -14.313 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.893 -11.754 -15.920 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -5.167 -11.325 -15.980 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -5.658 -12.978 -15.538 1.00 0.00 H new ATOM 714 N VAL A 47 -2.833 -11.425 -14.940 1.00 0.00 N ATOM 715 CA VAL A 47 -1.754 -10.715 -15.617 1.00 0.00 C ATOM 716 C VAL A 47 -2.310 -9.811 -16.709 1.00 0.00 C ATOM 717 O VAL A 47 -2.913 -10.285 -17.675 1.00 0.00 O ATOM 718 CB VAL A 47 -0.735 -11.696 -16.231 1.00 0.00 C ATOM 719 CG1 VAL A 47 0.450 -10.951 -16.823 1.00 0.00 C ATOM 720 CG2 VAL A 47 -0.269 -12.704 -15.191 1.00 0.00 C ATOM 0 H VAL A 47 -3.001 -12.368 -15.290 1.00 0.00 H new ATOM 0 HA VAL A 47 -1.244 -10.107 -14.870 1.00 0.00 H new ATOM 0 HB VAL A 47 -1.230 -12.236 -17.038 1.00 0.00 H new ATOM 0 HG11 VAL A 47 1.153 -11.666 -17.249 1.00 0.00 H new ATOM 0 HG12 VAL A 47 0.102 -10.275 -17.604 1.00 0.00 H new ATOM 0 HG13 VAL A 47 0.946 -10.376 -16.041 1.00 0.00 H new ATOM 0 HG21 VAL A 47 0.450 -13.388 -15.643 1.00 0.00 H new ATOM 0 HG22 VAL A 47 0.203 -12.178 -14.361 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -1.125 -13.269 -14.823 1.00 0.00 H new ATOM 730 N MET A 48 -2.107 -8.510 -16.546 1.00 0.00 N ATOM 731 CA MET A 48 -2.630 -7.524 -17.478 1.00 0.00 C ATOM 732 C MET A 48 -1.563 -7.086 -18.476 1.00 0.00 C ATOM 733 O MET A 48 -1.880 -6.609 -19.567 1.00 0.00 O ATOM 734 CB MET A 48 -3.153 -6.312 -16.713 1.00 0.00 C ATOM 735 CG MET A 48 -4.256 -6.653 -15.723 1.00 0.00 C ATOM 736 SD MET A 48 -5.709 -7.364 -16.513 1.00 0.00 S ATOM 737 CE MET A 48 -6.171 -6.042 -17.632 1.00 0.00 C ATOM 0 H MET A 48 -1.579 -8.112 -15.769 1.00 0.00 H new ATOM 0 HA MET A 48 -3.447 -7.984 -18.034 1.00 0.00 H new ATOM 0 HB2 MET A 48 -2.326 -5.845 -16.178 1.00 0.00 H new ATOM 0 HB3 MET A 48 -3.528 -5.577 -17.425 1.00 0.00 H new ATOM 0 HG2 MET A 48 -3.870 -7.355 -14.984 1.00 0.00 H new ATOM 0 HG3 MET A 48 -4.546 -5.751 -15.185 1.00 0.00 H new ATOM 0 HE1 MET A 48 -7.214 -6.161 -17.924 1.00 0.00 H new ATOM 0 HE2 MET A 48 -6.040 -5.081 -17.134 1.00 0.00 H new ATOM 0 HE3 MET A 48 -5.539 -6.079 -18.520 1.00 0.00 H new ATOM 747 N GLU A 49 -0.302 -7.231 -18.091 1.00 0.00 N ATOM 748 CA GLU A 49 0.809 -6.927 -18.984 1.00 0.00 C ATOM 749 C GLU A 49 1.923 -7.948 -18.788 1.00 0.00 C ATOM 750 O GLU A 49 2.094 -8.475 -17.690 1.00 0.00 O ATOM 751 CB GLU A 49 1.329 -5.504 -18.744 1.00 0.00 C ATOM 752 CG GLU A 49 2.420 -5.072 -19.715 1.00 0.00 C ATOM 753 CD GLU A 49 2.021 -5.272 -21.165 1.00 0.00 C ATOM 754 OE1 GLU A 49 2.373 -6.324 -21.744 1.00 0.00 O ATOM 755 OE2 GLU A 49 1.359 -4.383 -21.735 1.00 0.00 O ATOM 0 H GLU A 49 -0.023 -7.557 -17.166 1.00 0.00 H new ATOM 0 HA GLU A 49 0.456 -6.983 -20.014 1.00 0.00 H new ATOM 0 HB2 GLU A 49 0.495 -4.806 -18.817 1.00 0.00 H new ATOM 0 HB3 GLU A 49 1.714 -5.436 -17.727 1.00 0.00 H new ATOM 0 HG2 GLU A 49 2.655 -4.021 -19.548 1.00 0.00 H new ATOM 0 HG3 GLU A 49 3.329 -5.638 -19.510 1.00 0.00 H new ATOM 763 N ALA A 50 2.666 -8.210 -19.859 1.00 0.00 N ATOM 764 CA ALA A 50 3.702 -9.233 -19.866 1.00 0.00 C ATOM 765 C ALA A 50 4.720 -9.002 -18.761 1.00 0.00 C ATOM 766 O ALA A 50 5.337 -7.934 -18.672 1.00 0.00 O ATOM 767 CB ALA A 50 4.394 -9.272 -21.220 1.00 0.00 C ATOM 0 H ALA A 50 2.565 -7.718 -20.747 1.00 0.00 H new ATOM 0 HA ALA A 50 3.223 -10.195 -19.682 1.00 0.00 H new ATOM 0 HB1 ALA A 50 5.166 -10.041 -21.212 1.00 0.00 H new ATOM 0 HB2 ALA A 50 3.663 -9.500 -21.996 1.00 0.00 H new ATOM 0 HB3 ALA A 50 4.849 -8.303 -21.424 1.00 0.00 H new ATOM 773 N ILE A 51 4.882 -10.006 -17.917 1.00 0.00 N ATOM 774 CA ILE A 51 5.825 -9.942 -16.816 1.00 0.00 C ATOM 775 C ILE A 51 7.044 -10.794 -17.126 1.00 0.00 C ATOM 776 O ILE A 51 6.927 -12.002 -17.332 1.00 0.00 O ATOM 777 CB ILE A 51 5.194 -10.444 -15.496 1.00 0.00 C ATOM 778 CG1 ILE A 51 3.934 -9.642 -15.160 1.00 0.00 C ATOM 779 CG2 ILE A 51 6.204 -10.354 -14.359 1.00 0.00 C ATOM 780 CD1 ILE A 51 3.192 -10.154 -13.948 1.00 0.00 C ATOM 0 H ILE A 51 4.366 -10.884 -17.975 1.00 0.00 H new ATOM 0 HA ILE A 51 6.112 -8.898 -16.693 1.00 0.00 H new ATOM 0 HB ILE A 51 4.909 -11.488 -15.625 1.00 0.00 H new ATOM 0 HG12 ILE A 51 4.211 -8.601 -14.992 1.00 0.00 H new ATOM 0 HG13 ILE A 51 3.264 -9.659 -16.019 1.00 0.00 H new ATOM 0 HG21 ILE A 51 5.746 -10.711 -13.436 1.00 0.00 H new ATOM 0 HG22 ILE A 51 7.073 -10.969 -14.594 1.00 0.00 H new ATOM 0 HG23 ILE A 51 6.517 -9.318 -14.232 1.00 0.00 H new ATOM 0 HD11 ILE A 51 2.311 -9.536 -13.773 1.00 0.00 H new ATOM 0 HD12 ILE A 51 2.883 -11.185 -14.119 1.00 0.00 H new ATOM 0 HD13 ILE A 51 3.845 -10.111 -13.076 1.00 0.00 H new ATOM 792 N SER A 52 8.207 -10.170 -17.176 1.00 0.00 N ATOM 793 CA SER A 52 9.436 -10.903 -17.368 1.00 0.00 C ATOM 794 C SER A 52 10.345 -10.671 -16.163 1.00 0.00 C ATOM 795 O SER A 52 10.089 -9.780 -15.351 1.00 0.00 O ATOM 796 CB SER A 52 10.133 -10.475 -18.662 1.00 0.00 C ATOM 797 OG SER A 52 9.200 -9.981 -19.613 1.00 0.00 O ATOM 0 H SER A 52 8.322 -9.160 -17.086 1.00 0.00 H new ATOM 0 HA SER A 52 9.210 -11.966 -17.455 1.00 0.00 H new ATOM 0 HB2 SER A 52 10.873 -9.705 -18.442 1.00 0.00 H new ATOM 0 HB3 SER A 52 10.672 -11.323 -19.085 1.00 0.00 H new ATOM 0 HG SER A 52 9.674 -9.714 -20.428 1.00 0.00 H new ATOM 803 N PRO A 53 11.401 -11.473 -16.018 1.00 0.00 N ATOM 804 CA PRO A 53 12.333 -11.355 -14.896 1.00 0.00 C ATOM 805 C PRO A 53 13.059 -10.015 -14.900 1.00 0.00 C ATOM 806 O PRO A 53 13.333 -9.438 -13.846 1.00 0.00 O ATOM 807 CB PRO A 53 13.327 -12.504 -15.120 1.00 0.00 C ATOM 808 CG PRO A 53 12.668 -13.416 -16.101 1.00 0.00 C ATOM 809 CD PRO A 53 11.781 -12.547 -16.940 1.00 0.00 C ATOM 0 HA PRO A 53 11.822 -11.408 -13.935 1.00 0.00 H new ATOM 0 HB2 PRO A 53 14.276 -12.132 -15.506 1.00 0.00 H new ATOM 0 HB3 PRO A 53 13.544 -13.023 -14.186 1.00 0.00 H new ATOM 0 HG2 PRO A 53 13.408 -13.928 -16.716 1.00 0.00 H new ATOM 0 HG3 PRO A 53 12.090 -14.186 -15.591 1.00 0.00 H new ATOM 0 HD2 PRO A 53 12.305 -12.161 -17.815 1.00 0.00 H new ATOM 0 HD3 PRO A 53 10.910 -13.092 -17.305 1.00 0.00 H new ATOM 817 N GLN A 54 13.349 -9.519 -16.099 1.00 0.00 N ATOM 818 CA GLN A 54 14.113 -8.292 -16.261 1.00 0.00 C ATOM 819 C GLN A 54 13.222 -7.059 -16.132 1.00 0.00 C ATOM 820 O GLN A 54 13.573 -6.105 -15.439 1.00 0.00 O ATOM 821 CB GLN A 54 14.831 -8.276 -17.617 1.00 0.00 C ATOM 822 CG GLN A 54 15.675 -9.518 -17.886 1.00 0.00 C ATOM 823 CD GLN A 54 14.907 -10.613 -18.611 1.00 0.00 C ATOM 824 OE1 GLN A 54 13.684 -10.703 -18.510 1.00 0.00 O ATOM 825 NE2 GLN A 54 15.623 -11.464 -19.328 1.00 0.00 N ATOM 0 H GLN A 54 13.063 -9.953 -16.977 1.00 0.00 H new ATOM 0 HA GLN A 54 14.856 -8.262 -15.464 1.00 0.00 H new ATOM 0 HB2 GLN A 54 14.089 -8.175 -18.409 1.00 0.00 H new ATOM 0 HB3 GLN A 54 15.472 -7.396 -17.667 1.00 0.00 H new ATOM 0 HG2 GLN A 54 16.545 -9.238 -18.480 1.00 0.00 H new ATOM 0 HG3 GLN A 54 16.048 -9.909 -16.939 1.00 0.00 H new ATOM 0 HE21 GLN A 54 16.636 -11.355 -19.387 1.00 0.00 H new ATOM 0 HE22 GLN A 54 15.162 -12.228 -19.822 1.00 0.00 H new ATOM 834 N ASN A 55 12.065 -7.079 -16.785 1.00 0.00 N ATOM 835 CA ASN A 55 11.156 -5.940 -16.740 1.00 0.00 C ATOM 836 C ASN A 55 9.818 -6.376 -16.164 1.00 0.00 C ATOM 837 O ASN A 55 9.191 -7.313 -16.663 1.00 0.00 O ATOM 838 CB ASN A 55 10.965 -5.333 -18.139 1.00 0.00 C ATOM 839 CG ASN A 55 10.364 -3.932 -18.106 1.00 0.00 C ATOM 840 OD1 ASN A 55 9.642 -3.562 -17.177 1.00 0.00 O ATOM 841 ND2 ASN A 55 10.659 -3.139 -19.125 1.00 0.00 N ATOM 0 H ASN A 55 11.737 -7.864 -17.347 1.00 0.00 H new ATOM 0 HA ASN A 55 11.590 -5.173 -16.099 1.00 0.00 H new ATOM 0 HB2 ASN A 55 11.928 -5.297 -18.647 1.00 0.00 H new ATOM 0 HB3 ASN A 55 10.319 -5.985 -18.726 1.00 0.00 H new ATOM 0 HD21 ASN A 55 10.286 -2.190 -19.158 1.00 0.00 H new ATOM 0 HD22 ASN A 55 11.259 -3.477 -19.877 1.00 0.00 H new ATOM 848 N SER A 56 9.392 -5.696 -15.111 1.00 0.00 N ATOM 849 CA SER A 56 8.172 -6.051 -14.406 1.00 0.00 C ATOM 850 C SER A 56 6.939 -5.791 -15.273 1.00 0.00 C ATOM 851 O SER A 56 6.980 -4.991 -16.214 1.00 0.00 O ATOM 852 CB SER A 56 8.080 -5.249 -13.109 1.00 0.00 C ATOM 853 OG SER A 56 9.322 -5.264 -12.419 1.00 0.00 O ATOM 0 H SER A 56 9.879 -4.888 -14.724 1.00 0.00 H new ATOM 0 HA SER A 56 8.202 -7.116 -14.176 1.00 0.00 H new ATOM 0 HB2 SER A 56 7.794 -4.221 -13.331 1.00 0.00 H new ATOM 0 HB3 SER A 56 7.300 -5.666 -12.472 1.00 0.00 H new ATOM 0 HG SER A 56 9.736 -4.377 -12.472 1.00 0.00 H new ATOM 859 N GLY A 57 5.848 -6.461 -14.950 1.00 0.00 N ATOM 860 CA GLY A 57 4.628 -6.297 -15.708 1.00 0.00 C ATOM 861 C GLY A 57 3.503 -5.770 -14.849 1.00 0.00 C ATOM 862 O GLY A 57 3.741 -5.264 -13.750 1.00 0.00 O ATOM 0 H GLY A 57 5.784 -7.119 -14.173 1.00 0.00 H new ATOM 0 HA2 GLY A 57 4.804 -5.612 -16.537 1.00 0.00 H new ATOM 0 HA3 GLY A 57 4.337 -7.254 -16.141 1.00 0.00 H new ATOM 866 N LEU A 58 2.279 -5.900 -15.333 1.00 0.00 N ATOM 867 CA LEU A 58 1.124 -5.372 -14.629 1.00 0.00 C ATOM 868 C LEU A 58 0.137 -6.480 -14.287 1.00 0.00 C ATOM 869 O LEU A 58 -0.137 -7.353 -15.111 1.00 0.00 O ATOM 870 CB LEU A 58 0.431 -4.313 -15.485 1.00 0.00 C ATOM 871 CG LEU A 58 1.229 -3.032 -15.720 1.00 0.00 C ATOM 872 CD1 LEU A 58 0.469 -2.089 -16.640 1.00 0.00 C ATOM 873 CD2 LEU A 58 1.538 -2.348 -14.395 1.00 0.00 C ATOM 0 H LEU A 58 2.060 -6.368 -16.213 1.00 0.00 H new ATOM 0 HA LEU A 58 1.471 -4.921 -13.699 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.191 -4.753 -16.453 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -0.515 -4.050 -15.011 1.00 0.00 H new ATOM 0 HG LEU A 58 2.170 -3.297 -16.202 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.054 -1.182 -16.795 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.295 -2.577 -17.599 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.488 -1.830 -16.186 1.00 0.00 H new ATOM 0 HD21 LEU A 58 2.107 -1.437 -14.580 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.606 -2.097 -13.889 1.00 0.00 H new ATOM 0 HD23 LEU A 58 2.123 -3.020 -13.766 1.00 0.00 H new ATOM 885 N VAL A 59 -0.392 -6.442 -13.072 1.00 0.00 N ATOM 886 CA VAL A 59 -1.414 -7.387 -12.640 1.00 0.00 C ATOM 887 C VAL A 59 -2.590 -6.643 -12.021 1.00 0.00 C ATOM 888 O VAL A 59 -2.429 -5.539 -11.501 1.00 0.00 O ATOM 889 CB VAL A 59 -0.871 -8.409 -11.613 1.00 0.00 C ATOM 890 CG1 VAL A 59 0.128 -9.350 -12.263 1.00 0.00 C ATOM 891 CG2 VAL A 59 -0.237 -7.702 -10.421 1.00 0.00 C ATOM 0 H VAL A 59 -0.127 -5.760 -12.361 1.00 0.00 H new ATOM 0 HA VAL A 59 -1.735 -7.933 -13.527 1.00 0.00 H new ATOM 0 HB VAL A 59 -1.714 -8.998 -11.252 1.00 0.00 H new ATOM 0 HG11 VAL A 59 0.496 -10.059 -11.521 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -0.358 -9.892 -13.074 1.00 0.00 H new ATOM 0 HG13 VAL A 59 0.964 -8.775 -12.661 1.00 0.00 H new ATOM 0 HG21 VAL A 59 0.136 -8.443 -9.715 1.00 0.00 H new ATOM 0 HG22 VAL A 59 0.589 -7.080 -10.764 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -0.983 -7.077 -9.930 1.00 0.00 H new ATOM 901 N LYS A 60 -3.769 -7.238 -12.092 1.00 0.00 N ATOM 902 CA LYS A 60 -4.953 -6.635 -11.500 1.00 0.00 C ATOM 903 C LYS A 60 -5.178 -7.183 -10.101 1.00 0.00 C ATOM 904 O LYS A 60 -5.286 -8.394 -9.912 1.00 0.00 O ATOM 905 CB LYS A 60 -6.190 -6.899 -12.355 1.00 0.00 C ATOM 906 CG LYS A 60 -7.440 -6.215 -11.824 1.00 0.00 C ATOM 907 CD LYS A 60 -8.700 -6.723 -12.496 1.00 0.00 C ATOM 908 CE LYS A 60 -8.691 -6.453 -13.992 1.00 0.00 C ATOM 909 NZ LYS A 60 -9.936 -6.938 -14.643 1.00 0.00 N ATOM 0 H LYS A 60 -3.932 -8.134 -12.551 1.00 0.00 H new ATOM 0 HA LYS A 60 -4.789 -5.559 -11.448 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -6.001 -6.557 -13.373 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -6.366 -7.974 -12.407 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -7.513 -6.378 -10.749 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -7.357 -5.139 -11.978 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -8.799 -7.794 -12.321 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -9.570 -6.245 -12.046 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -8.580 -5.383 -14.169 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -7.829 -6.942 -14.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -9.895 -6.737 -15.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -10.028 -7.963 -14.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -10.757 -6.453 -14.227 1.00 0.00 H new ATOM 923 N VAL A 61 -5.231 -6.288 -9.127 1.00 0.00 N ATOM 924 CA VAL A 61 -5.491 -6.667 -7.748 1.00 0.00 C ATOM 925 C VAL A 61 -6.683 -5.882 -7.219 1.00 0.00 C ATOM 926 O VAL A 61 -6.600 -4.661 -7.038 1.00 0.00 O ATOM 927 CB VAL A 61 -4.267 -6.420 -6.839 1.00 0.00 C ATOM 928 CG1 VAL A 61 -4.543 -6.894 -5.421 1.00 0.00 C ATOM 929 CG2 VAL A 61 -3.027 -7.107 -7.395 1.00 0.00 C ATOM 0 H VAL A 61 -5.096 -5.287 -9.268 1.00 0.00 H new ATOM 0 HA VAL A 61 -5.706 -7.736 -7.734 1.00 0.00 H new ATOM 0 HB VAL A 61 -4.081 -5.346 -6.815 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -3.667 -6.710 -4.799 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -5.397 -6.351 -5.016 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -4.763 -7.961 -5.431 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -2.180 -6.917 -6.736 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.204 -8.181 -7.459 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -2.809 -6.716 -8.389 1.00 0.00 H new ATOM 939 N ASP A 62 -7.787 -6.594 -7.006 1.00 0.00 N ATOM 940 CA ASP A 62 -9.044 -6.020 -6.519 1.00 0.00 C ATOM 941 C ASP A 62 -9.660 -5.080 -7.548 1.00 0.00 C ATOM 942 O ASP A 62 -10.564 -5.465 -8.291 1.00 0.00 O ATOM 943 CB ASP A 62 -8.850 -5.303 -5.180 1.00 0.00 C ATOM 944 CG ASP A 62 -10.143 -4.727 -4.631 1.00 0.00 C ATOM 945 OD1 ASP A 62 -10.131 -3.564 -4.175 1.00 0.00 O ATOM 946 OD2 ASP A 62 -11.178 -5.430 -4.656 1.00 0.00 O ATOM 0 H ASP A 62 -7.837 -7.600 -7.168 1.00 0.00 H new ATOM 0 HA ASP A 62 -9.736 -6.847 -6.360 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -8.432 -6.002 -4.456 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -8.123 -4.500 -5.304 1.00 0.00 H new ATOM 952 N GLY A 63 -9.154 -3.861 -7.601 1.00 0.00 N ATOM 953 CA GLY A 63 -9.665 -2.883 -8.541 1.00 0.00 C ATOM 954 C GLY A 63 -8.575 -2.000 -9.109 1.00 0.00 C ATOM 955 O GLY A 63 -8.854 -1.060 -9.856 1.00 0.00 O ATOM 0 H GLY A 63 -8.394 -3.527 -7.008 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -10.172 -3.398 -9.357 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -10.410 -2.261 -8.044 1.00 0.00 H new ATOM 959 N GLU A 64 -7.331 -2.303 -8.774 1.00 0.00 N ATOM 960 CA GLU A 64 -6.212 -1.512 -9.245 1.00 0.00 C ATOM 961 C GLU A 64 -5.249 -2.359 -10.058 1.00 0.00 C ATOM 962 O GLU A 64 -5.246 -3.586 -9.956 1.00 0.00 O ATOM 963 CB GLU A 64 -5.464 -0.895 -8.070 1.00 0.00 C ATOM 964 CG GLU A 64 -6.266 0.131 -7.297 1.00 0.00 C ATOM 965 CD GLU A 64 -5.432 0.847 -6.259 1.00 0.00 C ATOM 966 OE1 GLU A 64 -4.907 1.941 -6.563 1.00 0.00 O ATOM 967 OE2 GLU A 64 -5.290 0.321 -5.140 1.00 0.00 O ATOM 0 H GLU A 64 -7.074 -3.090 -8.179 1.00 0.00 H new ATOM 0 HA GLU A 64 -6.611 -0.721 -9.880 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -5.159 -1.690 -7.389 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -4.553 -0.425 -8.440 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -6.683 0.861 -7.991 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -7.107 -0.361 -6.808 1.00 0.00 H new ATOM 975 N THR A 65 -4.430 -1.697 -10.856 1.00 0.00 N ATOM 976 CA THR A 65 -3.387 -2.368 -11.601 1.00 0.00 C ATOM 977 C THR A 65 -2.052 -2.150 -10.903 1.00 0.00 C ATOM 978 O THR A 65 -1.552 -1.026 -10.834 1.00 0.00 O ATOM 979 CB THR A 65 -3.295 -1.840 -13.040 1.00 0.00 C ATOM 980 OG1 THR A 65 -4.611 -1.664 -13.581 1.00 0.00 O ATOM 981 CG2 THR A 65 -2.505 -2.801 -13.921 1.00 0.00 C ATOM 0 H THR A 65 -4.470 -0.688 -11.003 1.00 0.00 H new ATOM 0 HA THR A 65 -3.628 -3.430 -11.642 1.00 0.00 H new ATOM 0 HB THR A 65 -2.777 -0.881 -13.020 1.00 0.00 H new ATOM 0 HG1 THR A 65 -4.545 -1.325 -14.498 1.00 0.00 H new ATOM 0 HG21 THR A 65 -2.453 -2.406 -14.935 1.00 0.00 H new ATOM 0 HG22 THR A 65 -1.496 -2.913 -13.524 1.00 0.00 H new ATOM 0 HG23 THR A 65 -3.000 -3.772 -13.935 1.00 0.00 H new ATOM 989 N TRP A 66 -1.492 -3.218 -10.377 1.00 0.00 N ATOM 990 CA TRP A 66 -0.245 -3.135 -9.636 1.00 0.00 C ATOM 991 C TRP A 66 0.903 -3.666 -10.478 1.00 0.00 C ATOM 992 O TRP A 66 0.688 -4.360 -11.475 1.00 0.00 O ATOM 993 CB TRP A 66 -0.336 -3.926 -8.329 1.00 0.00 C ATOM 994 CG TRP A 66 -1.274 -3.324 -7.325 1.00 0.00 C ATOM 995 CD1 TRP A 66 -2.639 -3.385 -7.329 1.00 0.00 C ATOM 996 CD2 TRP A 66 -0.910 -2.575 -6.158 1.00 0.00 C ATOM 997 NE1 TRP A 66 -3.146 -2.718 -6.240 1.00 0.00 N ATOM 998 CE2 TRP A 66 -2.104 -2.216 -5.504 1.00 0.00 C ATOM 999 CE3 TRP A 66 0.308 -2.182 -5.600 1.00 0.00 C ATOM 1000 CZ2 TRP A 66 -2.116 -1.473 -4.327 1.00 0.00 C ATOM 1001 CZ3 TRP A 66 0.297 -1.441 -4.431 1.00 0.00 C ATOM 1002 CH2 TRP A 66 -0.908 -1.099 -3.803 1.00 0.00 C ATOM 0 H TRP A 66 -1.880 -4.159 -10.447 1.00 0.00 H new ATOM 0 HA TRP A 66 -0.061 -2.087 -9.398 1.00 0.00 H new ATOM 0 HB2 TRP A 66 -0.660 -4.943 -8.552 1.00 0.00 H new ATOM 0 HB3 TRP A 66 0.658 -3.997 -7.888 1.00 0.00 H new ATOM 0 HD1 TRP A 66 -3.233 -3.885 -8.079 1.00 0.00 H new ATOM 0 HE1 TRP A 66 -4.136 -2.613 -6.016 1.00 0.00 H new ATOM 0 HE3 TRP A 66 1.241 -2.451 -6.072 1.00 0.00 H new ATOM 0 HZ2 TRP A 66 -3.044 -1.202 -3.845 1.00 0.00 H new ATOM 0 HZ3 TRP A 66 1.232 -1.121 -3.996 1.00 0.00 H new ATOM 0 HH2 TRP A 66 -0.883 -0.528 -2.886 1.00 0.00 H new ATOM 1013 N ARG A 67 2.119 -3.343 -10.077 1.00 0.00 N ATOM 1014 CA ARG A 67 3.294 -3.807 -10.779 1.00 0.00 C ATOM 1015 C ARG A 67 3.737 -5.113 -10.166 1.00 0.00 C ATOM 1016 O ARG A 67 3.638 -5.297 -8.955 1.00 0.00 O ATOM 1017 CB ARG A 67 4.441 -2.796 -10.698 1.00 0.00 C ATOM 1018 CG ARG A 67 4.109 -1.416 -11.240 1.00 0.00 C ATOM 1019 CD ARG A 67 3.196 -0.658 -10.288 1.00 0.00 C ATOM 1020 NE ARG A 67 3.045 0.751 -10.643 1.00 0.00 N ATOM 1021 CZ ARG A 67 2.101 1.548 -10.134 1.00 0.00 C ATOM 1022 NH1 ARG A 67 1.223 1.065 -9.258 1.00 0.00 N ATOM 1023 NH2 ARG A 67 2.041 2.820 -10.496 1.00 0.00 N ATOM 0 H ARG A 67 2.315 -2.758 -9.265 1.00 0.00 H new ATOM 0 HA ARG A 67 3.038 -3.936 -11.831 1.00 0.00 H new ATOM 0 HB2 ARG A 67 4.749 -2.698 -9.657 1.00 0.00 H new ATOM 0 HB3 ARG A 67 5.296 -3.191 -11.247 1.00 0.00 H new ATOM 0 HG2 ARG A 67 5.029 -0.851 -11.393 1.00 0.00 H new ATOM 0 HG3 ARG A 67 3.627 -1.510 -12.213 1.00 0.00 H new ATOM 0 HD2 ARG A 67 2.215 -1.132 -10.280 1.00 0.00 H new ATOM 0 HD3 ARG A 67 3.594 -0.731 -9.276 1.00 0.00 H new ATOM 0 HE ARG A 67 3.698 1.149 -11.318 1.00 0.00 H new ATOM 0 HH11 ARG A 67 1.271 0.086 -8.975 1.00 0.00 H new ATOM 0 HH12 ARG A 67 0.503 1.674 -8.870 1.00 0.00 H new ATOM 0 HH21 ARG A 67 2.716 3.192 -11.164 1.00 0.00 H new ATOM 0 HH22 ARG A 67 1.320 3.428 -10.107 1.00 0.00 H new ATOM 1037 N ALA A 68 4.235 -6.005 -10.987 1.00 0.00 N ATOM 1038 CA ALA A 68 4.591 -7.335 -10.522 1.00 0.00 C ATOM 1039 C ALA A 68 5.832 -7.855 -11.224 1.00 0.00 C ATOM 1040 O ALA A 68 6.012 -7.659 -12.425 1.00 0.00 O ATOM 1041 CB ALA A 68 3.426 -8.291 -10.720 1.00 0.00 C ATOM 0 H ALA A 68 4.405 -5.841 -11.979 1.00 0.00 H new ATOM 0 HA ALA A 68 4.817 -7.269 -9.458 1.00 0.00 H new ATOM 0 HB1 ALA A 68 3.706 -9.284 -10.368 1.00 0.00 H new ATOM 0 HB2 ALA A 68 2.564 -7.936 -10.156 1.00 0.00 H new ATOM 0 HB3 ALA A 68 3.172 -8.340 -11.779 1.00 0.00 H new ATOM 1047 N THR A 69 6.679 -8.519 -10.462 1.00 0.00 N ATOM 1048 CA THR A 69 7.874 -9.137 -10.996 1.00 0.00 C ATOM 1049 C THR A 69 7.806 -10.645 -10.770 1.00 0.00 C ATOM 1050 O THR A 69 7.055 -11.109 -9.909 1.00 0.00 O ATOM 1051 CB THR A 69 9.133 -8.578 -10.313 1.00 0.00 C ATOM 1052 OG1 THR A 69 8.868 -7.270 -9.786 1.00 0.00 O ATOM 1053 CG2 THR A 69 10.287 -8.498 -11.295 1.00 0.00 C ATOM 0 H THR A 69 6.557 -8.644 -9.457 1.00 0.00 H new ATOM 0 HA THR A 69 7.931 -8.918 -12.062 1.00 0.00 H new ATOM 0 HB THR A 69 9.406 -9.252 -9.501 1.00 0.00 H new ATOM 0 HG1 THR A 69 8.877 -7.304 -8.807 1.00 0.00 H new ATOM 0 HG21 THR A 69 11.167 -8.100 -10.790 1.00 0.00 H new ATOM 0 HG22 THR A 69 10.508 -9.494 -11.679 1.00 0.00 H new ATOM 0 HG23 THR A 69 10.016 -7.843 -12.123 1.00 0.00 H new ATOM 1061 N SER A 70 8.579 -11.405 -11.532 1.00 0.00 N ATOM 1062 CA SER A 70 8.571 -12.850 -11.408 1.00 0.00 C ATOM 1063 C SER A 70 9.850 -13.435 -11.999 1.00 0.00 C ATOM 1064 O SER A 70 10.649 -12.712 -12.593 1.00 0.00 O ATOM 1065 CB SER A 70 7.343 -13.431 -12.114 1.00 0.00 C ATOM 1066 OG SER A 70 7.134 -14.786 -11.752 1.00 0.00 O ATOM 0 H SER A 70 9.217 -11.043 -12.240 1.00 0.00 H new ATOM 0 HA SER A 70 8.524 -13.114 -10.352 1.00 0.00 H new ATOM 0 HB2 SER A 70 6.461 -12.844 -11.857 1.00 0.00 H new ATOM 0 HB3 SER A 70 7.472 -13.357 -13.194 1.00 0.00 H new ATOM 0 HG SER A 70 6.567 -14.828 -10.954 1.00 0.00 H new ATOM 1072 N GLY A 71 10.041 -14.738 -11.819 1.00 0.00 N ATOM 1073 CA GLY A 71 11.204 -15.410 -12.367 1.00 0.00 C ATOM 1074 C GLY A 71 10.869 -16.146 -13.651 1.00 0.00 C ATOM 1075 O GLY A 71 11.740 -16.729 -14.297 1.00 0.00 O ATOM 0 H GLY A 71 9.406 -15.344 -11.299 1.00 0.00 H new ATOM 0 HA2 GLY A 71 11.990 -14.680 -12.560 1.00 0.00 H new ATOM 0 HA3 GLY A 71 11.597 -16.115 -11.634 1.00 0.00 H new ATOM 1079 N THR A 72 9.593 -16.127 -14.012 1.00 0.00 N ATOM 1080 CA THR A 72 9.125 -16.755 -15.236 1.00 0.00 C ATOM 1081 C THR A 72 8.408 -15.716 -16.094 1.00 0.00 C ATOM 1082 O THR A 72 8.094 -14.625 -15.615 1.00 0.00 O ATOM 1083 CB THR A 72 8.169 -17.924 -14.925 1.00 0.00 C ATOM 1084 OG1 THR A 72 8.555 -18.552 -13.694 1.00 0.00 O ATOM 1085 CG2 THR A 72 8.187 -18.960 -16.037 1.00 0.00 C ATOM 0 H THR A 72 8.858 -15.678 -13.466 1.00 0.00 H new ATOM 0 HA THR A 72 9.985 -17.152 -15.776 1.00 0.00 H new ATOM 0 HB THR A 72 7.160 -17.520 -14.841 1.00 0.00 H new ATOM 0 HG1 THR A 72 7.944 -19.293 -13.499 1.00 0.00 H new ATOM 0 HG21 THR A 72 7.503 -19.772 -15.789 1.00 0.00 H new ATOM 0 HG22 THR A 72 7.875 -18.495 -16.972 1.00 0.00 H new ATOM 0 HG23 THR A 72 9.196 -19.357 -16.148 1.00 0.00 H new ATOM 1093 N VAL A 73 8.158 -16.041 -17.351 1.00 0.00 N ATOM 1094 CA VAL A 73 7.488 -15.114 -18.253 1.00 0.00 C ATOM 1095 C VAL A 73 5.979 -15.300 -18.180 1.00 0.00 C ATOM 1096 O VAL A 73 5.453 -16.360 -18.518 1.00 0.00 O ATOM 1097 CB VAL A 73 7.964 -15.292 -19.707 1.00 0.00 C ATOM 1098 CG1 VAL A 73 7.263 -14.306 -20.627 1.00 0.00 C ATOM 1099 CG2 VAL A 73 9.472 -15.121 -19.795 1.00 0.00 C ATOM 0 H VAL A 73 8.407 -16.936 -17.771 1.00 0.00 H new ATOM 0 HA VAL A 73 7.745 -14.104 -17.933 1.00 0.00 H new ATOM 0 HB VAL A 73 7.709 -16.301 -20.030 1.00 0.00 H new ATOM 0 HG11 VAL A 73 7.614 -14.449 -21.649 1.00 0.00 H new ATOM 0 HG12 VAL A 73 6.187 -14.473 -20.586 1.00 0.00 H new ATOM 0 HG13 VAL A 73 7.485 -13.288 -20.306 1.00 0.00 H new ATOM 0 HG21 VAL A 73 9.793 -15.250 -20.829 1.00 0.00 H new ATOM 0 HG22 VAL A 73 9.746 -14.123 -19.452 1.00 0.00 H new ATOM 0 HG23 VAL A 73 9.960 -15.867 -19.168 1.00 0.00 H new ATOM 1109 N LEU A 74 5.295 -14.268 -17.715 1.00 0.00 N ATOM 1110 CA LEU A 74 3.852 -14.313 -17.547 1.00 0.00 C ATOM 1111 C LEU A 74 3.165 -13.502 -18.638 1.00 0.00 C ATOM 1112 O LEU A 74 3.477 -12.325 -18.838 1.00 0.00 O ATOM 1113 CB LEU A 74 3.471 -13.767 -16.170 1.00 0.00 C ATOM 1114 CG LEU A 74 4.212 -14.405 -14.994 1.00 0.00 C ATOM 1115 CD1 LEU A 74 3.859 -13.706 -13.691 1.00 0.00 C ATOM 1116 CD2 LEU A 74 3.898 -15.889 -14.907 1.00 0.00 C ATOM 0 H LEU A 74 5.721 -13.381 -17.445 1.00 0.00 H new ATOM 0 HA LEU A 74 3.523 -15.349 -17.624 1.00 0.00 H new ATOM 0 HB2 LEU A 74 3.657 -12.693 -16.157 1.00 0.00 H new ATOM 0 HB3 LEU A 74 2.400 -13.907 -16.024 1.00 0.00 H new ATOM 0 HG LEU A 74 5.283 -14.289 -15.163 1.00 0.00 H new ATOM 0 HD11 LEU A 74 4.397 -14.176 -12.868 1.00 0.00 H new ATOM 0 HD12 LEU A 74 4.140 -12.655 -13.754 1.00 0.00 H new ATOM 0 HD13 LEU A 74 2.786 -13.785 -13.515 1.00 0.00 H new ATOM 0 HD21 LEU A 74 4.434 -16.326 -14.064 1.00 0.00 H new ATOM 0 HD22 LEU A 74 2.826 -16.026 -14.765 1.00 0.00 H new ATOM 0 HD23 LEU A 74 4.208 -16.381 -15.829 1.00 0.00 H new ATOM 1128 N ASP A 75 2.235 -14.135 -19.336 1.00 0.00 N ATOM 1129 CA ASP A 75 1.536 -13.490 -20.442 1.00 0.00 C ATOM 1130 C ASP A 75 0.192 -12.936 -20.003 1.00 0.00 C ATOM 1131 O ASP A 75 -0.330 -13.298 -18.945 1.00 0.00 O ATOM 1132 CB ASP A 75 1.323 -14.469 -21.593 1.00 0.00 C ATOM 1133 CG ASP A 75 2.586 -14.735 -22.378 1.00 0.00 C ATOM 1134 OD1 ASP A 75 3.365 -15.622 -21.973 1.00 0.00 O ATOM 1135 OD2 ASP A 75 2.797 -14.065 -23.411 1.00 0.00 O ATOM 0 H ASP A 75 1.945 -15.096 -19.158 1.00 0.00 H new ATOM 0 HA ASP A 75 2.163 -12.664 -20.779 1.00 0.00 H new ATOM 0 HB2 ASP A 75 0.942 -15.410 -21.197 1.00 0.00 H new ATOM 0 HB3 ASP A 75 0.560 -14.073 -22.264 1.00 0.00 H new ATOM 1141 N VAL A 76 -0.374 -12.083 -20.844 1.00 0.00 N ATOM 1142 CA VAL A 76 -1.635 -11.424 -20.542 1.00 0.00 C ATOM 1143 C VAL A 76 -2.790 -12.407 -20.665 1.00 0.00 C ATOM 1144 O VAL A 76 -3.071 -12.922 -21.747 1.00 0.00 O ATOM 1145 CB VAL A 76 -1.887 -10.224 -21.477 1.00 0.00 C ATOM 1146 CG1 VAL A 76 -3.139 -9.467 -21.060 1.00 0.00 C ATOM 1147 CG2 VAL A 76 -0.680 -9.298 -21.503 1.00 0.00 C ATOM 0 H VAL A 76 0.025 -11.830 -21.748 1.00 0.00 H new ATOM 0 HA VAL A 76 -1.571 -11.057 -19.518 1.00 0.00 H new ATOM 0 HB VAL A 76 -2.043 -10.607 -22.485 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -3.296 -8.625 -21.734 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -4.000 -10.134 -21.106 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -3.019 -9.099 -20.041 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -0.880 -8.458 -22.169 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -0.486 -8.925 -20.497 1.00 0.00 H new ATOM 0 HG23 VAL A 76 0.191 -9.846 -21.862 1.00 0.00 H new ATOM 1157 N GLY A 77 -3.454 -12.664 -19.552 1.00 0.00 N ATOM 1158 CA GLY A 77 -4.539 -13.624 -19.542 1.00 0.00 C ATOM 1159 C GLY A 77 -4.325 -14.706 -18.507 1.00 0.00 C ATOM 1160 O GLY A 77 -5.266 -15.404 -18.119 1.00 0.00 O ATOM 0 H GLY A 77 -3.262 -12.225 -18.652 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -5.478 -13.109 -19.340 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -4.631 -14.078 -20.529 1.00 0.00 H new ATOM 1164 N GLU A 78 -3.079 -14.846 -18.063 1.00 0.00 N ATOM 1165 CA GLU A 78 -2.738 -15.807 -17.035 1.00 0.00 C ATOM 1166 C GLU A 78 -3.194 -15.343 -15.664 1.00 0.00 C ATOM 1167 O GLU A 78 -3.564 -14.182 -15.471 1.00 0.00 O ATOM 1168 CB GLU A 78 -1.237 -16.031 -16.997 1.00 0.00 C ATOM 1169 CG GLU A 78 -0.713 -16.889 -18.124 1.00 0.00 C ATOM 1170 CD GLU A 78 -1.342 -18.270 -18.162 1.00 0.00 C ATOM 1171 OE1 GLU A 78 -1.675 -18.741 -19.272 1.00 0.00 O ATOM 1172 OE2 GLU A 78 -1.493 -18.890 -17.092 1.00 0.00 O ATOM 0 H GLU A 78 -2.289 -14.299 -18.406 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.250 -16.737 -17.282 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -0.735 -15.064 -17.027 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.974 -16.497 -16.047 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -0.899 -16.385 -19.073 1.00 0.00 H new ATOM 0 HG3 GLU A 78 0.368 -16.991 -18.023 1.00 0.00 H new ATOM 1180 N GLU A 79 -3.126 -16.255 -14.713 1.00 0.00 N ATOM 1181 CA GLU A 79 -3.463 -15.954 -13.334 1.00 0.00 C ATOM 1182 C GLU A 79 -2.270 -16.242 -12.446 1.00 0.00 C ATOM 1183 O GLU A 79 -1.607 -17.272 -12.587 1.00 0.00 O ATOM 1184 CB GLU A 79 -4.677 -16.760 -12.869 1.00 0.00 C ATOM 1185 CG GLU A 79 -5.929 -16.485 -13.677 1.00 0.00 C ATOM 1186 CD GLU A 79 -7.171 -17.049 -13.020 1.00 0.00 C ATOM 1187 OE1 GLU A 79 -7.795 -16.334 -12.208 1.00 0.00 O ATOM 1188 OE2 GLU A 79 -7.523 -18.212 -13.302 1.00 0.00 O ATOM 0 H GLU A 79 -2.837 -17.220 -14.873 1.00 0.00 H new ATOM 0 HA GLU A 79 -3.721 -14.897 -13.265 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -4.442 -17.823 -12.928 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -4.873 -16.534 -11.821 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -6.046 -15.409 -13.807 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -5.819 -16.916 -14.672 1.00 0.00 H new ATOM 1196 N VAL A 80 -1.988 -15.326 -11.539 1.00 0.00 N ATOM 1197 CA VAL A 80 -0.838 -15.463 -10.662 1.00 0.00 C ATOM 1198 C VAL A 80 -1.238 -15.269 -9.211 1.00 0.00 C ATOM 1199 O VAL A 80 -2.258 -14.658 -8.916 1.00 0.00 O ATOM 1200 CB VAL A 80 0.270 -14.450 -11.022 1.00 0.00 C ATOM 1201 CG1 VAL A 80 0.843 -14.746 -12.397 1.00 0.00 C ATOM 1202 CG2 VAL A 80 -0.262 -13.024 -10.963 1.00 0.00 C ATOM 0 H VAL A 80 -2.538 -14.480 -11.389 1.00 0.00 H new ATOM 0 HA VAL A 80 -0.450 -16.472 -10.799 1.00 0.00 H new ATOM 0 HB VAL A 80 1.069 -14.549 -10.288 1.00 0.00 H new ATOM 0 HG11 VAL A 80 1.622 -14.020 -12.630 1.00 0.00 H new ATOM 0 HG12 VAL A 80 1.268 -15.750 -12.406 1.00 0.00 H new ATOM 0 HG13 VAL A 80 0.051 -14.681 -13.143 1.00 0.00 H new ATOM 0 HG21 VAL A 80 0.536 -12.327 -11.220 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -1.083 -12.913 -11.671 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -0.620 -12.810 -9.956 1.00 0.00 H new ATOM 1212 N SER A 81 -0.451 -15.821 -8.312 1.00 0.00 N ATOM 1213 CA SER A 81 -0.670 -15.617 -6.892 1.00 0.00 C ATOM 1214 C SER A 81 0.475 -14.805 -6.294 1.00 0.00 C ATOM 1215 O SER A 81 1.644 -15.025 -6.625 1.00 0.00 O ATOM 1216 CB SER A 81 -0.812 -16.959 -6.174 1.00 0.00 C ATOM 1217 OG SER A 81 -1.869 -17.724 -6.733 1.00 0.00 O ATOM 0 H SER A 81 0.347 -16.415 -8.537 1.00 0.00 H new ATOM 0 HA SER A 81 -1.597 -15.059 -6.758 1.00 0.00 H new ATOM 0 HB2 SER A 81 0.123 -17.515 -6.247 1.00 0.00 H new ATOM 0 HB3 SER A 81 -1.001 -16.790 -5.114 1.00 0.00 H new ATOM 0 HG SER A 81 -1.940 -18.579 -6.259 1.00 0.00 H new ATOM 1223 N VAL A 82 0.127 -13.857 -5.435 1.00 0.00 N ATOM 1224 CA VAL A 82 1.106 -12.962 -4.826 1.00 0.00 C ATOM 1225 C VAL A 82 1.818 -13.635 -3.658 1.00 0.00 C ATOM 1226 O VAL A 82 1.195 -13.955 -2.644 1.00 0.00 O ATOM 1227 CB VAL A 82 0.441 -11.658 -4.326 1.00 0.00 C ATOM 1228 CG1 VAL A 82 1.488 -10.681 -3.808 1.00 0.00 C ATOM 1229 CG2 VAL A 82 -0.392 -11.021 -5.430 1.00 0.00 C ATOM 0 H VAL A 82 -0.835 -13.686 -5.141 1.00 0.00 H new ATOM 0 HA VAL A 82 1.835 -12.719 -5.599 1.00 0.00 H new ATOM 0 HB VAL A 82 -0.224 -11.911 -3.500 1.00 0.00 H new ATOM 0 HG11 VAL A 82 0.997 -9.771 -3.462 1.00 0.00 H new ATOM 0 HG12 VAL A 82 2.033 -11.136 -2.981 1.00 0.00 H new ATOM 0 HG13 VAL A 82 2.184 -10.435 -4.610 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -0.851 -10.105 -5.057 1.00 0.00 H new ATOM 0 HG22 VAL A 82 0.249 -10.786 -6.280 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -1.171 -11.715 -5.744 1.00 0.00 H new ATOM 1239 N LYS A 83 3.122 -13.850 -3.813 1.00 0.00 N ATOM 1240 CA LYS A 83 3.941 -14.422 -2.762 1.00 0.00 C ATOM 1241 C LYS A 83 4.246 -13.379 -1.696 1.00 0.00 C ATOM 1242 O LYS A 83 3.990 -13.590 -0.511 1.00 0.00 O ATOM 1243 CB LYS A 83 5.257 -14.939 -3.344 1.00 0.00 C ATOM 1244 CG LYS A 83 5.164 -16.267 -4.057 1.00 0.00 C ATOM 1245 CD LYS A 83 4.493 -17.286 -3.178 1.00 0.00 C ATOM 1246 CE LYS A 83 4.717 -18.707 -3.677 1.00 0.00 C ATOM 1247 NZ LYS A 83 4.501 -18.831 -5.142 1.00 0.00 N ATOM 0 H LYS A 83 3.633 -13.632 -4.668 1.00 0.00 H new ATOM 0 HA LYS A 83 3.389 -15.247 -2.311 1.00 0.00 H new ATOM 0 HB2 LYS A 83 5.645 -14.196 -4.041 1.00 0.00 H new ATOM 0 HB3 LYS A 83 5.984 -15.028 -2.536 1.00 0.00 H new ATOM 0 HG2 LYS A 83 4.603 -16.151 -4.984 1.00 0.00 H new ATOM 0 HG3 LYS A 83 6.162 -16.612 -4.329 1.00 0.00 H new ATOM 0 HD2 LYS A 83 4.875 -17.195 -2.161 1.00 0.00 H new ATOM 0 HD3 LYS A 83 3.423 -17.081 -3.137 1.00 0.00 H new ATOM 0 HE2 LYS A 83 5.733 -19.019 -3.434 1.00 0.00 H new ATOM 0 HE3 LYS A 83 4.042 -19.384 -3.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 4.115 -19.772 -5.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 3.830 -18.101 -5.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 5.406 -18.706 -5.638 1.00 0.00 H new ATOM 1261 N ALA A 84 4.780 -12.249 -2.136 1.00 0.00 N ATOM 1262 CA ALA A 84 5.221 -11.204 -1.224 1.00 0.00 C ATOM 1263 C ALA A 84 5.295 -9.864 -1.938 1.00 0.00 C ATOM 1264 O ALA A 84 5.005 -9.769 -3.133 1.00 0.00 O ATOM 1265 CB ALA A 84 6.581 -11.562 -0.636 1.00 0.00 C ATOM 0 H ALA A 84 4.919 -12.032 -3.123 1.00 0.00 H new ATOM 0 HA ALA A 84 4.495 -11.123 -0.415 1.00 0.00 H new ATOM 0 HB1 ALA A 84 6.902 -10.774 0.045 1.00 0.00 H new ATOM 0 HB2 ALA A 84 6.506 -12.503 -0.092 1.00 0.00 H new ATOM 0 HB3 ALA A 84 7.309 -11.665 -1.440 1.00 0.00 H new ATOM 1271 N ILE A 85 5.685 -8.833 -1.204 1.00 0.00 N ATOM 1272 CA ILE A 85 5.829 -7.496 -1.762 1.00 0.00 C ATOM 1273 C ILE A 85 7.286 -7.056 -1.650 1.00 0.00 C ATOM 1274 O ILE A 85 7.898 -7.205 -0.593 1.00 0.00 O ATOM 1275 CB ILE A 85 4.918 -6.482 -1.027 1.00 0.00 C ATOM 1276 CG1 ILE A 85 3.468 -6.975 -1.016 1.00 0.00 C ATOM 1277 CG2 ILE A 85 4.999 -5.104 -1.672 1.00 0.00 C ATOM 1278 CD1 ILE A 85 2.522 -6.067 -0.264 1.00 0.00 C ATOM 0 H ILE A 85 5.909 -8.898 -0.211 1.00 0.00 H new ATOM 0 HA ILE A 85 5.528 -7.524 -2.809 1.00 0.00 H new ATOM 0 HB ILE A 85 5.270 -6.399 0.001 1.00 0.00 H new ATOM 0 HG12 ILE A 85 3.120 -7.076 -2.044 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.435 -7.969 -0.570 1.00 0.00 H new ATOM 0 HG21 ILE A 85 4.349 -4.412 -1.136 1.00 0.00 H new ATOM 0 HG22 ILE A 85 6.027 -4.743 -1.631 1.00 0.00 H new ATOM 0 HG23 ILE A 85 4.679 -5.170 -2.712 1.00 0.00 H new ATOM 0 HD11 ILE A 85 1.514 -6.481 -0.300 1.00 0.00 H new ATOM 0 HD12 ILE A 85 2.844 -5.985 0.774 1.00 0.00 H new ATOM 0 HD13 ILE A 85 2.524 -5.078 -0.723 1.00 0.00 H new ATOM 1290 N GLU A 86 7.846 -6.531 -2.732 1.00 0.00 N ATOM 1291 CA GLU A 86 9.251 -6.151 -2.749 1.00 0.00 C ATOM 1292 C GLU A 86 9.410 -4.633 -2.733 1.00 0.00 C ATOM 1293 O GLU A 86 10.495 -4.105 -2.972 1.00 0.00 O ATOM 1294 CB GLU A 86 9.939 -6.740 -3.977 1.00 0.00 C ATOM 1295 CG GLU A 86 9.360 -6.268 -5.297 1.00 0.00 C ATOM 1296 CD GLU A 86 10.139 -6.795 -6.481 1.00 0.00 C ATOM 1297 OE1 GLU A 86 9.573 -7.570 -7.277 1.00 0.00 O ATOM 1298 OE2 GLU A 86 11.332 -6.448 -6.614 1.00 0.00 O ATOM 0 H GLU A 86 7.350 -6.359 -3.607 1.00 0.00 H new ATOM 0 HA GLU A 86 9.722 -6.550 -1.851 1.00 0.00 H new ATOM 0 HB2 GLU A 86 10.998 -6.484 -3.945 1.00 0.00 H new ATOM 0 HB3 GLU A 86 9.872 -7.827 -3.931 1.00 0.00 H new ATOM 0 HG2 GLU A 86 8.322 -6.592 -5.373 1.00 0.00 H new ATOM 0 HG3 GLU A 86 9.357 -5.178 -5.322 1.00 0.00 H new ATOM 1306 N GLY A 87 8.319 -3.944 -2.444 1.00 0.00 N ATOM 1307 CA GLY A 87 8.330 -2.498 -2.410 1.00 0.00 C ATOM 1308 C GLY A 87 7.111 -1.922 -3.092 1.00 0.00 C ATOM 1309 O GLY A 87 5.986 -2.097 -2.624 1.00 0.00 O ATOM 0 H GLY A 87 7.416 -4.366 -2.230 1.00 0.00 H new ATOM 0 HA2 GLY A 87 8.365 -2.157 -1.375 1.00 0.00 H new ATOM 0 HA3 GLY A 87 9.231 -2.128 -2.899 1.00 0.00 H new ATOM 1313 N VAL A 88 7.333 -1.237 -4.200 1.00 0.00 N ATOM 1314 CA VAL A 88 6.241 -0.705 -5.004 1.00 0.00 C ATOM 1315 C VAL A 88 5.752 -1.771 -5.987 1.00 0.00 C ATOM 1316 O VAL A 88 4.740 -1.602 -6.670 1.00 0.00 O ATOM 1317 CB VAL A 88 6.677 0.573 -5.763 1.00 0.00 C ATOM 1318 CG1 VAL A 88 7.721 0.254 -6.825 1.00 0.00 C ATOM 1319 CG2 VAL A 88 5.478 1.286 -6.375 1.00 0.00 C ATOM 0 H VAL A 88 8.263 -1.034 -4.567 1.00 0.00 H new ATOM 0 HA VAL A 88 5.423 -0.433 -4.337 1.00 0.00 H new ATOM 0 HB VAL A 88 7.133 1.247 -5.038 1.00 0.00 H new ATOM 0 HG11 VAL A 88 8.007 1.171 -7.341 1.00 0.00 H new ATOM 0 HG12 VAL A 88 8.599 -0.185 -6.352 1.00 0.00 H new ATOM 0 HG13 VAL A 88 7.305 -0.452 -7.544 1.00 0.00 H new ATOM 0 HG21 VAL A 88 5.815 2.179 -6.901 1.00 0.00 H new ATOM 0 HG22 VAL A 88 4.977 0.619 -7.077 1.00 0.00 H new ATOM 0 HG23 VAL A 88 4.782 1.571 -5.586 1.00 0.00 H new ATOM 1329 N LYS A 89 6.474 -2.885 -6.034 1.00 0.00 N ATOM 1330 CA LYS A 89 6.128 -3.978 -6.922 1.00 0.00 C ATOM 1331 C LYS A 89 5.776 -5.221 -6.116 1.00 0.00 C ATOM 1332 O LYS A 89 6.151 -5.346 -4.943 1.00 0.00 O ATOM 1333 CB LYS A 89 7.284 -4.289 -7.871 1.00 0.00 C ATOM 1334 CG LYS A 89 7.749 -3.100 -8.691 1.00 0.00 C ATOM 1335 CD LYS A 89 8.751 -3.517 -9.754 1.00 0.00 C ATOM 1336 CE LYS A 89 9.949 -4.243 -9.156 1.00 0.00 C ATOM 1337 NZ LYS A 89 10.875 -4.737 -10.209 1.00 0.00 N ATOM 0 H LYS A 89 7.304 -3.051 -5.464 1.00 0.00 H new ATOM 0 HA LYS A 89 5.262 -3.676 -7.512 1.00 0.00 H new ATOM 0 HB2 LYS A 89 8.125 -4.667 -7.290 1.00 0.00 H new ATOM 0 HB3 LYS A 89 6.980 -5.087 -8.548 1.00 0.00 H new ATOM 0 HG2 LYS A 89 6.890 -2.625 -9.165 1.00 0.00 H new ATOM 0 HG3 LYS A 89 8.202 -2.358 -8.034 1.00 0.00 H new ATOM 0 HD2 LYS A 89 8.260 -4.165 -10.480 1.00 0.00 H new ATOM 0 HD3 LYS A 89 9.094 -2.635 -10.294 1.00 0.00 H new ATOM 0 HE2 LYS A 89 10.485 -3.570 -8.487 1.00 0.00 H new ATOM 0 HE3 LYS A 89 9.602 -5.083 -8.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 11.573 -5.380 -9.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 10.333 -5.246 -10.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 11.367 -3.931 -10.644 1.00 0.00 H new ATOM 1351 N LEU A 90 5.066 -6.138 -6.749 1.00 0.00 N ATOM 1352 CA LEU A 90 4.652 -7.369 -6.100 1.00 0.00 C ATOM 1353 C LEU A 90 5.450 -8.539 -6.647 1.00 0.00 C ATOM 1354 O LEU A 90 5.843 -8.546 -7.814 1.00 0.00 O ATOM 1355 CB LEU A 90 3.158 -7.621 -6.328 1.00 0.00 C ATOM 1356 CG LEU A 90 2.220 -6.473 -5.942 1.00 0.00 C ATOM 1357 CD1 LEU A 90 0.773 -6.873 -6.184 1.00 0.00 C ATOM 1358 CD2 LEU A 90 2.423 -6.070 -4.489 1.00 0.00 C ATOM 0 H LEU A 90 4.762 -6.052 -7.719 1.00 0.00 H new ATOM 0 HA LEU A 90 4.836 -7.271 -5.030 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.005 -7.851 -7.382 1.00 0.00 H new ATOM 0 HB3 LEU A 90 2.868 -8.507 -5.763 1.00 0.00 H new ATOM 0 HG LEU A 90 2.457 -5.613 -6.568 1.00 0.00 H new ATOM 0 HD11 LEU A 90 0.116 -6.049 -5.906 1.00 0.00 H new ATOM 0 HD12 LEU A 90 0.632 -7.109 -7.239 1.00 0.00 H new ATOM 0 HD13 LEU A 90 0.532 -7.748 -5.581 1.00 0.00 H new ATOM 0 HD21 LEU A 90 1.745 -5.253 -4.240 1.00 0.00 H new ATOM 0 HD22 LEU A 90 2.216 -6.923 -3.843 1.00 0.00 H new ATOM 0 HD23 LEU A 90 3.453 -5.745 -4.342 1.00 0.00 H new ATOM 1370 N VAL A 91 5.692 -9.521 -5.800 1.00 0.00 N ATOM 1371 CA VAL A 91 6.359 -10.740 -6.216 1.00 0.00 C ATOM 1372 C VAL A 91 5.315 -11.816 -6.465 1.00 0.00 C ATOM 1373 O VAL A 91 4.786 -12.412 -5.525 1.00 0.00 O ATOM 1374 CB VAL A 91 7.376 -11.231 -5.158 1.00 0.00 C ATOM 1375 CG1 VAL A 91 8.120 -12.461 -5.659 1.00 0.00 C ATOM 1376 CG2 VAL A 91 8.359 -10.125 -4.796 1.00 0.00 C ATOM 0 H VAL A 91 5.435 -9.498 -4.813 1.00 0.00 H new ATOM 0 HA VAL A 91 6.914 -10.530 -7.130 1.00 0.00 H new ATOM 0 HB VAL A 91 6.823 -11.504 -4.259 1.00 0.00 H new ATOM 0 HG11 VAL A 91 8.830 -12.791 -4.901 1.00 0.00 H new ATOM 0 HG12 VAL A 91 7.407 -13.261 -5.860 1.00 0.00 H new ATOM 0 HG13 VAL A 91 8.656 -12.214 -6.575 1.00 0.00 H new ATOM 0 HG21 VAL A 91 9.064 -10.494 -4.051 1.00 0.00 H new ATOM 0 HG22 VAL A 91 8.903 -9.816 -5.688 1.00 0.00 H new ATOM 0 HG23 VAL A 91 7.814 -9.273 -4.390 1.00 0.00 H new ATOM 1386 N VAL A 92 4.987 -12.038 -7.725 1.00 0.00 N ATOM 1387 CA VAL A 92 3.938 -12.982 -8.078 1.00 0.00 C ATOM 1388 C VAL A 92 4.495 -14.123 -8.909 1.00 0.00 C ATOM 1389 O VAL A 92 5.534 -13.988 -9.554 1.00 0.00 O ATOM 1390 CB VAL A 92 2.792 -12.300 -8.859 1.00 0.00 C ATOM 1391 CG1 VAL A 92 2.177 -11.175 -8.041 1.00 0.00 C ATOM 1392 CG2 VAL A 92 3.292 -11.782 -10.200 1.00 0.00 C ATOM 0 H VAL A 92 5.430 -11.579 -8.521 1.00 0.00 H new ATOM 0 HA VAL A 92 3.538 -13.373 -7.142 1.00 0.00 H new ATOM 0 HB VAL A 92 2.017 -13.043 -9.048 1.00 0.00 H new ATOM 0 HG11 VAL A 92 1.373 -10.709 -8.610 1.00 0.00 H new ATOM 0 HG12 VAL A 92 1.777 -11.578 -7.111 1.00 0.00 H new ATOM 0 HG13 VAL A 92 2.940 -10.430 -7.815 1.00 0.00 H new ATOM 0 HG21 VAL A 92 2.471 -11.305 -10.735 1.00 0.00 H new ATOM 0 HG22 VAL A 92 4.088 -11.056 -10.036 1.00 0.00 H new ATOM 0 HG23 VAL A 92 3.676 -12.614 -10.791 1.00 0.00 H new ATOM 1402 N GLU A 93 3.805 -15.247 -8.882 1.00 0.00 N ATOM 1403 CA GLU A 93 4.184 -16.391 -9.684 1.00 0.00 C ATOM 1404 C GLU A 93 2.942 -17.024 -10.266 1.00 0.00 C ATOM 1405 O GLU A 93 1.841 -16.865 -9.726 1.00 0.00 O ATOM 1406 CB GLU A 93 4.963 -17.420 -8.865 1.00 0.00 C ATOM 1407 CG GLU A 93 6.250 -16.875 -8.271 1.00 0.00 C ATOM 1408 CD GLU A 93 7.008 -17.916 -7.485 1.00 0.00 C ATOM 1409 OE1 GLU A 93 6.765 -18.035 -6.270 1.00 0.00 O ATOM 1410 OE2 GLU A 93 7.861 -18.611 -8.076 1.00 0.00 O ATOM 0 H GLU A 93 2.974 -15.391 -8.309 1.00 0.00 H new ATOM 0 HA GLU A 93 4.838 -16.047 -10.486 1.00 0.00 H new ATOM 0 HB2 GLU A 93 4.328 -17.787 -8.059 1.00 0.00 H new ATOM 0 HB3 GLU A 93 5.199 -18.274 -9.500 1.00 0.00 H new ATOM 0 HG2 GLU A 93 6.884 -16.496 -9.072 1.00 0.00 H new ATOM 0 HG3 GLU A 93 6.018 -16.031 -7.621 1.00 0.00 H new ATOM 1418 N LYS A 94 3.122 -17.746 -11.353 1.00 0.00 N ATOM 1419 CA LYS A 94 2.005 -18.320 -12.077 1.00 0.00 C ATOM 1420 C LYS A 94 1.370 -19.435 -11.267 1.00 0.00 C ATOM 1421 O LYS A 94 2.066 -20.161 -10.555 1.00 0.00 O ATOM 1422 CB LYS A 94 2.472 -18.863 -13.430 1.00 0.00 C ATOM 1423 CG LYS A 94 1.334 -19.221 -14.372 1.00 0.00 C ATOM 1424 CD LYS A 94 1.846 -19.861 -15.652 1.00 0.00 C ATOM 1425 CE LYS A 94 2.368 -21.270 -15.412 1.00 0.00 C ATOM 1426 NZ LYS A 94 1.295 -22.188 -14.936 1.00 0.00 N ATOM 0 H LYS A 94 4.036 -17.950 -11.757 1.00 0.00 H new ATOM 0 HA LYS A 94 1.264 -17.538 -12.245 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.108 -18.119 -13.910 1.00 0.00 H new ATOM 0 HB3 LYS A 94 3.086 -19.748 -13.264 1.00 0.00 H new ATOM 0 HG2 LYS A 94 0.649 -19.905 -13.872 1.00 0.00 H new ATOM 0 HG3 LYS A 94 0.767 -18.323 -14.616 1.00 0.00 H new ATOM 0 HD2 LYS A 94 1.043 -19.892 -16.389 1.00 0.00 H new ATOM 0 HD3 LYS A 94 2.641 -19.246 -16.073 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.796 -21.660 -16.335 1.00 0.00 H new ATOM 0 HE3 LYS A 94 3.172 -21.239 -14.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 1.551 -23.170 -15.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 1.186 -22.090 -13.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 0.398 -21.946 -15.403 1.00 0.00 H new ATOM 1440 N LEU A 95 0.050 -19.535 -11.344 1.00 0.00 N ATOM 1441 CA LEU A 95 -0.665 -20.664 -10.774 1.00 0.00 C ATOM 1442 C LEU A 95 -0.046 -21.976 -11.247 1.00 0.00 C ATOM 1443 O LEU A 95 0.460 -22.069 -12.371 1.00 0.00 O ATOM 1444 CB LEU A 95 -2.142 -20.605 -11.164 1.00 0.00 C ATOM 1445 CG LEU A 95 -3.088 -20.056 -10.094 1.00 0.00 C ATOM 1446 CD1 LEU A 95 -2.738 -18.618 -9.751 1.00 0.00 C ATOM 1447 CD2 LEU A 95 -4.530 -20.154 -10.563 1.00 0.00 C ATOM 0 H LEU A 95 -0.547 -18.844 -11.798 1.00 0.00 H new ATOM 0 HA LEU A 95 -0.587 -20.614 -9.688 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -2.239 -19.990 -12.059 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -2.469 -21.610 -11.431 1.00 0.00 H new ATOM 0 HG LEU A 95 -2.972 -20.659 -9.193 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -3.424 -18.249 -8.988 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -1.717 -18.572 -9.373 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -2.822 -18.000 -10.645 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -5.191 -19.760 -9.791 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -4.655 -19.575 -11.478 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -4.780 -21.197 -10.756 1.00 0.00 H new ATOM 1459 N GLU A 96 -0.093 -22.974 -10.383 1.00 0.00 N ATOM 1460 CA GLU A 96 0.598 -24.237 -10.611 1.00 0.00 C ATOM 1461 C GLU A 96 0.023 -25.005 -11.798 1.00 0.00 C ATOM 1462 O GLU A 96 -1.114 -24.777 -12.217 1.00 0.00 O ATOM 1463 CB GLU A 96 0.503 -25.099 -9.354 1.00 0.00 C ATOM 1464 CG GLU A 96 -0.918 -25.523 -9.024 1.00 0.00 C ATOM 1465 CD GLU A 96 -1.052 -26.092 -7.634 1.00 0.00 C ATOM 1466 OE1 GLU A 96 -1.376 -25.321 -6.705 1.00 0.00 O ATOM 1467 OE2 GLU A 96 -0.851 -27.309 -7.463 1.00 0.00 O ATOM 0 H GLU A 96 -0.609 -22.935 -9.504 1.00 0.00 H new ATOM 0 HA GLU A 96 1.639 -24.008 -10.841 1.00 0.00 H new ATOM 0 HB2 GLU A 96 1.120 -25.988 -9.484 1.00 0.00 H new ATOM 0 HB3 GLU A 96 0.915 -24.546 -8.510 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -1.581 -24.664 -9.125 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -1.248 -26.267 -9.749 1.00 0.00 H new ATOM 1475 N GLU A 97 0.831 -25.910 -12.339 1.00 0.00 N ATOM 1476 CA GLU A 97 0.369 -26.842 -13.357 1.00 0.00 C ATOM 1477 C GLU A 97 -0.704 -27.748 -12.765 1.00 0.00 C ATOM 1478 O GLU A 97 -0.499 -28.361 -11.717 1.00 0.00 O ATOM 1479 CB GLU A 97 1.535 -27.677 -13.894 1.00 0.00 C ATOM 1480 CG GLU A 97 2.341 -26.995 -14.993 1.00 0.00 C ATOM 1481 CD GLU A 97 2.845 -25.619 -14.606 1.00 0.00 C ATOM 1482 OE1 GLU A 97 2.304 -24.619 -15.129 1.00 0.00 O ATOM 1483 OE2 GLU A 97 3.779 -25.531 -13.780 1.00 0.00 O ATOM 0 H GLU A 97 1.814 -26.017 -12.087 1.00 0.00 H new ATOM 0 HA GLU A 97 -0.054 -26.279 -14.189 1.00 0.00 H new ATOM 0 HB2 GLU A 97 2.203 -27.921 -13.068 1.00 0.00 H new ATOM 0 HB3 GLU A 97 1.145 -28.620 -14.277 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.191 -27.625 -15.253 1.00 0.00 H new ATOM 0 HG3 GLU A 97 1.723 -26.909 -15.886 1.00 0.00 H new ATOM 1491 N GLN A 98 -1.837 -27.839 -13.445 1.00 0.00 N ATOM 1492 CA GLN A 98 -3.014 -28.507 -12.895 1.00 0.00 C ATOM 1493 C GLN A 98 -2.844 -30.025 -12.806 1.00 0.00 C ATOM 1494 O GLN A 98 -3.677 -30.710 -12.210 1.00 0.00 O ATOM 1495 CB GLN A 98 -4.247 -28.155 -13.727 1.00 0.00 C ATOM 1496 CG GLN A 98 -4.485 -26.655 -13.831 1.00 0.00 C ATOM 1497 CD GLN A 98 -5.805 -26.306 -14.487 1.00 0.00 C ATOM 1498 OE1 GLN A 98 -6.787 -27.039 -14.373 1.00 0.00 O ATOM 1499 NE2 GLN A 98 -5.838 -25.177 -15.179 1.00 0.00 N ATOM 0 H GLN A 98 -1.969 -27.458 -14.382 1.00 0.00 H new ATOM 0 HA GLN A 98 -3.144 -28.147 -11.875 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -4.133 -28.570 -14.729 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -5.124 -28.627 -13.284 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -4.456 -26.219 -12.833 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -3.673 -26.203 -14.400 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -5.002 -24.597 -15.249 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -6.700 -24.887 -15.642 1.00 0.00 H new ATOM 1508 N LYS A 99 -1.772 -30.549 -13.390 1.00 0.00 N ATOM 1509 CA LYS A 99 -1.480 -31.976 -13.304 1.00 0.00 C ATOM 1510 C LYS A 99 -0.018 -32.249 -13.667 1.00 0.00 C ATOM 1511 O LYS A 99 0.297 -33.247 -14.317 1.00 0.00 O ATOM 1512 CB LYS A 99 -2.419 -32.770 -14.224 1.00 0.00 C ATOM 1513 CG LYS A 99 -2.428 -34.266 -13.937 1.00 0.00 C ATOM 1514 CD LYS A 99 -3.244 -35.053 -14.954 1.00 0.00 C ATOM 1515 CE LYS A 99 -4.742 -34.829 -14.802 1.00 0.00 C ATOM 1516 NZ LYS A 99 -5.188 -33.524 -15.359 1.00 0.00 N ATOM 0 H LYS A 99 -1.093 -30.010 -13.926 1.00 0.00 H new ATOM 0 HA LYS A 99 -1.645 -32.300 -12.277 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -3.432 -32.382 -14.119 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -2.122 -32.609 -15.260 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -1.403 -34.638 -13.933 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -2.833 -34.438 -12.940 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -2.938 -34.766 -15.960 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -3.026 -36.115 -14.845 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -5.278 -35.635 -15.303 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -5.007 -34.878 -13.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -5.417 -32.874 -14.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -4.427 -33.116 -15.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -6.033 -33.669 -15.948 1.00 0.00 H new ATOM 1530 N GLY A 100 0.874 -31.363 -13.228 1.00 0.00 N ATOM 1531 CA GLY A 100 2.292 -31.516 -13.517 1.00 0.00 C ATOM 1532 C GLY A 100 2.576 -31.579 -15.003 1.00 0.00 C ATOM 1533 O GLY A 100 2.481 -30.571 -15.703 1.00 0.00 O ATOM 0 H GLY A 100 0.639 -30.539 -12.675 1.00 0.00 H new ATOM 0 HA2 GLY A 100 2.841 -30.682 -13.080 1.00 0.00 H new ATOM 0 HA3 GLY A 100 2.661 -32.424 -13.041 1.00 0.00 H new ATOM 1537 N SER A 101 2.922 -32.761 -15.482 1.00 0.00 N ATOM 1538 CA SER A 101 3.156 -32.987 -16.898 1.00 0.00 C ATOM 1539 C SER A 101 2.565 -34.333 -17.309 1.00 0.00 C ATOM 1540 O SER A 101 1.617 -34.345 -18.127 1.00 0.00 O ATOM 1541 CB SER A 101 4.654 -32.933 -17.208 1.00 0.00 C ATOM 1542 OG SER A 101 5.189 -31.651 -16.909 1.00 0.00 O ATOM 1543 OXT SER A 101 3.006 -35.366 -16.770 1.00 0.00 O ATOM 0 H SER A 101 3.049 -33.590 -14.902 1.00 0.00 H new ATOM 0 HA SER A 101 2.666 -32.200 -17.471 1.00 0.00 H new ATOM 0 HB2 SER A 101 5.177 -33.694 -16.628 1.00 0.00 H new ATOM 0 HB3 SER A 101 4.820 -33.164 -18.260 1.00 0.00 H new ATOM 0 HG SER A 101 6.147 -31.641 -17.113 1.00 0.00 H new TER 1549 SER A 101