USER MOD reduce.3.24.130724 H: found=0, std=0, add=959, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 955 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 44 GLN : amide:sc= -0.336 K(o=-0.38,f=-1) USER MOD Set 1.2: A 59 LYS NZ :NH3+ -145:sc= -0.0452 (180deg=-0.788) USER MOD Set 2.1: A 37 CYS SG : rot 180:sc= 0.0141 USER MOD Set 2.2: A 103 LYS NZ :NH3+ -113:sc= 0.0053 (180deg=-0.0551) USER MOD Set 2.3: A 106 CYS SG : rot 180:sc= -0.355 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 155:sc= -0.218 (180deg=-0.899) USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 HIS : no HD1:sc= -0.0243 X(o=-0.024,f=-0.005) USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.35 X(o=-0.35,f=-0.0018) USER MOD Single : A 16 ASN : amide:sc= -0.204 K(o=-0.2,f=-2.4!) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 22 ASN : amide:sc= 0.00141 X(o=0.0014,f=-0.49) USER MOD Single : A 23 ASN : amide:sc= -0.243 X(o=-0.24,f=-0.44) USER MOD Single : A 26 ASN : amide:sc= -2.26 K(o=-2.3,f=-5.2!) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 31 MET CE :methyl -106:sc= -1.06 (180deg=-5.83!) USER MOD Single : A 41 MET CE :methyl -157:sc= -0.876 (180deg=-1.04) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc= -0.63 K(o=-0.63,f=-4.3!) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 CYS SG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0.0199 USER MOD Single : A 70 SER OG : rot -160:sc= -3.67! USER MOD Single : A 71 SER OG : rot 76:sc= 1.14 USER MOD Single : A 74 THR OG1 : rot -83:sc= -0.0751 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 178:sc= -0.0259 (180deg=-0.0333) USER MOD Single : A 81 SER OG : rot -123:sc= 1.37 USER MOD Single : A 86 GLN : amide:sc= 0.831 K(o=0.83,f=0) USER MOD Single : A 89 LYS NZ :NH3+ 154:sc= -0.177 (180deg=-0.823) USER MOD Single : A 90 ASN : amide:sc= -1.47 X(o=-1.5,f=-1.3) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 107 SER OG : rot 88:sc= -0.915! USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 TYR OH : rot 88:sc= 0.0431 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 124 LYS NZ :NH3+ 177:sc= 0.347 (180deg=0.302) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.101 21.989 -51.905 1.00 0.00 N ATOM 2 CA MET A 1 6.514 21.875 -51.563 1.00 0.00 C ATOM 3 C MET A 1 6.933 22.987 -50.606 1.00 0.00 C ATOM 4 O MET A 1 6.850 24.169 -50.939 1.00 0.00 O ATOM 5 CB MET A 1 7.373 21.925 -52.828 1.00 0.00 C ATOM 6 CG MET A 1 7.159 23.180 -53.659 1.00 0.00 C ATOM 7 SD MET A 1 7.626 22.957 -55.386 1.00 0.00 S ATOM 8 CE MET A 1 7.682 24.658 -55.944 1.00 0.00 C ATOM 0 H1 MET A 1 4.929 21.538 -52.826 1.00 0.00 H new ATOM 0 H2 MET A 1 4.528 21.517 -51.176 1.00 0.00 H new ATOM 0 H3 MET A 1 4.836 22.993 -51.957 1.00 0.00 H new ATOM 0 HA MET A 1 6.666 20.916 -51.067 1.00 0.00 H new ATOM 0 HB2 MET A 1 8.424 21.861 -52.546 1.00 0.00 H new ATOM 0 HB3 MET A 1 7.153 21.051 -53.441 1.00 0.00 H new ATOM 0 HG2 MET A 1 6.110 23.472 -53.605 1.00 0.00 H new ATOM 0 HG3 MET A 1 7.740 23.997 -53.232 1.00 0.00 H new ATOM 0 HE1 MET A 1 7.958 24.686 -56.998 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.702 25.116 -55.813 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.420 25.208 -55.361 1.00 0.00 H new ATOM 18 N ALA A 2 7.382 22.600 -49.417 1.00 0.00 N ATOM 19 CA ALA A 2 7.815 23.565 -48.413 1.00 0.00 C ATOM 20 C ALA A 2 8.651 22.892 -47.330 1.00 0.00 C ATOM 21 O ALA A 2 8.797 21.669 -47.315 1.00 0.00 O ATOM 22 CB ALA A 2 6.611 24.261 -47.797 1.00 0.00 C ATOM 0 H ALA A 2 7.456 21.625 -49.125 1.00 0.00 H new ATOM 0 HA ALA A 2 8.439 24.311 -48.906 1.00 0.00 H new ATOM 0 HB1 ALA A 2 6.949 24.979 -47.049 1.00 0.00 H new ATOM 0 HB2 ALA A 2 6.055 24.783 -48.576 1.00 0.00 H new ATOM 0 HB3 ALA A 2 5.965 23.521 -47.324 1.00 0.00 H new ATOM 28 N TYR A 3 9.198 23.697 -46.426 1.00 0.00 N ATOM 29 CA TYR A 3 10.022 23.179 -45.340 1.00 0.00 C ATOM 30 C TYR A 3 9.390 23.481 -43.985 1.00 0.00 C ATOM 31 O TYR A 3 8.920 22.579 -43.291 1.00 0.00 O ATOM 32 CB TYR A 3 11.426 23.781 -45.406 1.00 0.00 C ATOM 33 CG TYR A 3 12.157 23.473 -46.694 1.00 0.00 C ATOM 34 CD1 TYR A 3 12.157 22.190 -47.226 1.00 0.00 C ATOM 35 CD2 TYR A 3 12.846 24.466 -47.379 1.00 0.00 C ATOM 36 CE1 TYR A 3 12.824 21.904 -48.401 1.00 0.00 C ATOM 37 CE2 TYR A 3 13.515 24.190 -48.556 1.00 0.00 C ATOM 38 CZ TYR A 3 13.501 22.907 -49.063 1.00 0.00 C ATOM 39 OH TYR A 3 14.165 22.627 -50.235 1.00 0.00 O ATOM 0 H TYR A 3 9.086 24.711 -46.424 1.00 0.00 H new ATOM 0 HA TYR A 3 10.092 22.097 -45.455 1.00 0.00 H new ATOM 0 HB2 TYR A 3 11.355 24.862 -45.288 1.00 0.00 H new ATOM 0 HB3 TYR A 3 12.012 23.407 -44.567 1.00 0.00 H new ATOM 0 HD1 TYR A 3 11.626 21.402 -46.712 1.00 0.00 H new ATOM 0 HD2 TYR A 3 12.859 25.471 -46.985 1.00 0.00 H new ATOM 0 HE1 TYR A 3 12.816 20.900 -48.799 1.00 0.00 H new ATOM 0 HE2 TYR A 3 14.046 24.974 -49.076 1.00 0.00 H new ATOM 0 HH TYR A 3 14.589 23.443 -50.574 1.00 0.00 H new ATOM 49 N SER A 4 9.383 24.758 -43.614 1.00 0.00 N ATOM 50 CA SER A 4 8.813 25.180 -42.340 1.00 0.00 C ATOM 51 C SER A 4 9.543 24.523 -41.173 1.00 0.00 C ATOM 52 O SER A 4 9.272 23.374 -40.826 1.00 0.00 O ATOM 53 CB SER A 4 7.323 24.835 -42.285 1.00 0.00 C ATOM 54 OG SER A 4 6.545 25.981 -41.984 1.00 0.00 O ATOM 0 H SER A 4 9.765 25.517 -44.177 1.00 0.00 H new ATOM 0 HA SER A 4 8.932 26.260 -42.257 1.00 0.00 H new ATOM 0 HB2 SER A 4 7.007 24.418 -43.241 1.00 0.00 H new ATOM 0 HB3 SER A 4 7.152 24.067 -41.531 1.00 0.00 H new ATOM 0 HG SER A 4 5.597 25.735 -41.956 1.00 0.00 H new ATOM 60 N GLU A 5 10.470 25.261 -40.571 1.00 0.00 N ATOM 61 CA GLU A 5 11.240 24.750 -39.444 1.00 0.00 C ATOM 62 C GLU A 5 10.997 25.590 -38.193 1.00 0.00 C ATOM 63 O GLU A 5 10.690 26.779 -38.280 1.00 0.00 O ATOM 64 CB GLU A 5 12.733 24.736 -39.781 1.00 0.00 C ATOM 65 CG GLU A 5 13.472 23.532 -39.222 1.00 0.00 C ATOM 66 CD GLU A 5 13.474 22.354 -40.177 1.00 0.00 C ATOM 67 OE1 GLU A 5 12.404 22.046 -40.742 1.00 0.00 O ATOM 68 OE2 GLU A 5 14.547 21.741 -40.359 1.00 0.00 O ATOM 0 H GLU A 5 10.706 26.215 -40.845 1.00 0.00 H new ATOM 0 HA GLU A 5 10.911 23.730 -39.245 1.00 0.00 H new ATOM 0 HB2 GLU A 5 12.852 24.754 -40.864 1.00 0.00 H new ATOM 0 HB3 GLU A 5 13.193 25.646 -39.394 1.00 0.00 H new ATOM 0 HG2 GLU A 5 14.500 23.814 -38.997 1.00 0.00 H new ATOM 0 HG3 GLU A 5 13.010 23.232 -38.281 1.00 0.00 H new ATOM 75 N LYS A 6 11.137 24.963 -37.030 1.00 0.00 N ATOM 76 CA LYS A 6 10.934 25.651 -35.760 1.00 0.00 C ATOM 77 C LYS A 6 12.006 25.256 -34.750 1.00 0.00 C ATOM 78 O LYS A 6 11.862 24.266 -34.032 1.00 0.00 O ATOM 79 CB LYS A 6 9.547 25.331 -35.199 1.00 0.00 C ATOM 80 CG LYS A 6 8.414 25.995 -35.962 1.00 0.00 C ATOM 81 CD LYS A 6 7.233 26.297 -35.055 1.00 0.00 C ATOM 82 CE LYS A 6 6.193 27.155 -35.760 1.00 0.00 C ATOM 83 NZ LYS A 6 5.154 27.654 -34.818 1.00 0.00 N ATOM 0 H LYS A 6 11.390 23.979 -36.940 1.00 0.00 H new ATOM 0 HA LYS A 6 11.007 26.723 -35.941 1.00 0.00 H new ATOM 0 HB2 LYS A 6 9.399 24.251 -35.213 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.505 25.645 -34.156 1.00 0.00 H new ATOM 0 HG2 LYS A 6 8.772 26.920 -36.415 1.00 0.00 H new ATOM 0 HG3 LYS A 6 8.092 25.345 -36.776 1.00 0.00 H new ATOM 0 HD2 LYS A 6 6.775 25.363 -34.729 1.00 0.00 H new ATOM 0 HD3 LYS A 6 7.583 26.810 -34.159 1.00 0.00 H new ATOM 0 HE2 LYS A 6 6.685 28.001 -36.239 1.00 0.00 H new ATOM 0 HE3 LYS A 6 5.718 26.574 -36.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 4.464 28.234 -35.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 4.667 26.847 -34.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 5.604 28.230 -34.078 1.00 0.00 H new ATOM 97 N VAL A 7 13.081 26.037 -34.699 1.00 0.00 N ATOM 98 CA VAL A 7 14.176 25.769 -33.774 1.00 0.00 C ATOM 99 C VAL A 7 14.478 26.990 -32.913 1.00 0.00 C ATOM 100 O VAL A 7 13.897 28.058 -33.107 1.00 0.00 O ATOM 101 CB VAL A 7 15.456 25.355 -34.525 1.00 0.00 C ATOM 102 CG1 VAL A 7 15.215 24.089 -35.333 1.00 0.00 C ATOM 103 CG2 VAL A 7 15.937 26.486 -35.422 1.00 0.00 C ATOM 0 H VAL A 7 13.217 26.859 -35.287 1.00 0.00 H new ATOM 0 HA VAL A 7 13.857 24.946 -33.134 1.00 0.00 H new ATOM 0 HB VAL A 7 16.235 25.147 -33.792 1.00 0.00 H new ATOM 0 HG11 VAL A 7 16.130 23.812 -35.857 1.00 0.00 H new ATOM 0 HG12 VAL A 7 14.921 23.281 -34.664 1.00 0.00 H new ATOM 0 HG13 VAL A 7 14.421 24.266 -36.059 1.00 0.00 H new ATOM 0 HG21 VAL A 7 16.842 26.176 -35.945 1.00 0.00 H new ATOM 0 HG22 VAL A 7 15.162 26.728 -36.150 1.00 0.00 H new ATOM 0 HG23 VAL A 7 16.152 27.366 -34.815 1.00 0.00 H new ATOM 113 N ILE A 8 15.391 26.825 -31.962 1.00 0.00 N ATOM 114 CA ILE A 8 15.772 27.914 -31.071 1.00 0.00 C ATOM 115 C ILE A 8 14.545 28.551 -30.426 1.00 0.00 C ATOM 116 O ILE A 8 14.109 29.630 -30.829 1.00 0.00 O ATOM 117 CB ILE A 8 16.567 29.001 -31.819 1.00 0.00 C ATOM 118 CG1 ILE A 8 17.721 28.371 -32.601 1.00 0.00 C ATOM 119 CG2 ILE A 8 17.089 30.042 -30.840 1.00 0.00 C ATOM 120 CD1 ILE A 8 18.480 29.359 -33.459 1.00 0.00 C ATOM 0 H ILE A 8 15.881 25.947 -31.789 1.00 0.00 H new ATOM 0 HA ILE A 8 16.404 27.481 -30.296 1.00 0.00 H new ATOM 0 HB ILE A 8 15.902 29.497 -32.526 1.00 0.00 H new ATOM 0 HG12 ILE A 8 18.413 27.905 -31.899 1.00 0.00 H new ATOM 0 HG13 ILE A 8 17.328 27.577 -33.236 1.00 0.00 H new ATOM 0 HG21 ILE A 8 17.649 30.804 -31.383 1.00 0.00 H new ATOM 0 HG22 ILE A 8 16.250 30.508 -30.323 1.00 0.00 H new ATOM 0 HG23 ILE A 8 17.743 29.561 -30.112 1.00 0.00 H new ATOM 0 HD11 ILE A 8 19.283 28.843 -33.984 1.00 0.00 H new ATOM 0 HD12 ILE A 8 17.801 29.807 -34.185 1.00 0.00 H new ATOM 0 HD13 ILE A 8 18.903 30.140 -32.827 1.00 0.00 H new ATOM 132 N ASP A 9 13.995 27.878 -29.422 1.00 0.00 N ATOM 133 CA ASP A 9 12.820 28.379 -28.719 1.00 0.00 C ATOM 134 C ASP A 9 12.850 27.968 -27.250 1.00 0.00 C ATOM 135 O ASP A 9 12.246 26.967 -26.862 1.00 0.00 O ATOM 136 CB ASP A 9 11.543 27.859 -29.381 1.00 0.00 C ATOM 137 CG ASP A 9 10.895 28.893 -30.281 1.00 0.00 C ATOM 138 OD1 ASP A 9 10.619 30.011 -29.797 1.00 0.00 O ATOM 139 OD2 ASP A 9 10.664 28.585 -31.469 1.00 0.00 O ATOM 0 H ASP A 9 14.344 26.984 -29.076 1.00 0.00 H new ATOM 0 HA ASP A 9 12.831 29.468 -28.774 1.00 0.00 H new ATOM 0 HB2 ASP A 9 11.777 26.969 -29.965 1.00 0.00 H new ATOM 0 HB3 ASP A 9 10.834 27.558 -28.610 1.00 0.00 H new ATOM 144 N HIS A 10 13.557 28.746 -26.437 1.00 0.00 N ATOM 145 CA HIS A 10 13.666 28.463 -25.010 1.00 0.00 C ATOM 146 C HIS A 10 14.498 27.206 -24.768 1.00 0.00 C ATOM 147 O HIS A 10 15.657 27.286 -24.363 1.00 0.00 O ATOM 148 CB HIS A 10 12.277 28.296 -24.394 1.00 0.00 C ATOM 149 CG HIS A 10 11.933 29.358 -23.396 1.00 0.00 C ATOM 150 ND1 HIS A 10 11.468 29.078 -22.129 1.00 0.00 N ATOM 151 CD2 HIS A 10 11.990 30.708 -23.484 1.00 0.00 C ATOM 152 CE1 HIS A 10 11.252 30.209 -21.481 1.00 0.00 C ATOM 153 NE2 HIS A 10 11.562 31.213 -22.282 1.00 0.00 N ATOM 0 H HIS A 10 14.063 29.577 -26.742 1.00 0.00 H new ATOM 0 HA HIS A 10 14.167 29.306 -24.534 1.00 0.00 H new ATOM 0 HB2 HIS A 10 11.532 28.302 -25.190 1.00 0.00 H new ATOM 0 HB3 HIS A 10 12.218 27.321 -23.910 1.00 0.00 H new ATOM 0 HD2 HIS A 10 12.312 31.281 -24.341 1.00 0.00 H new ATOM 0 HE1 HIS A 10 10.885 30.298 -20.469 1.00 0.00 H new ATOM 0 HE2 HIS A 10 11.494 32.203 -22.045 1.00 0.00 H new ATOM 161 N TYR A 11 13.897 26.048 -25.018 1.00 0.00 N ATOM 162 CA TYR A 11 14.580 24.775 -24.824 1.00 0.00 C ATOM 163 C TYR A 11 14.375 23.858 -26.026 1.00 0.00 C ATOM 164 O TYR A 11 13.342 23.914 -26.693 1.00 0.00 O ATOM 165 CB TYR A 11 14.076 24.090 -23.553 1.00 0.00 C ATOM 166 CG TYR A 11 15.173 23.763 -22.566 1.00 0.00 C ATOM 167 CD1 TYR A 11 15.718 24.747 -21.750 1.00 0.00 C ATOM 168 CD2 TYR A 11 15.665 22.468 -22.448 1.00 0.00 C ATOM 169 CE1 TYR A 11 16.721 24.452 -20.847 1.00 0.00 C ATOM 170 CE2 TYR A 11 16.667 22.164 -21.547 1.00 0.00 C ATOM 171 CZ TYR A 11 17.192 23.159 -20.749 1.00 0.00 C ATOM 172 OH TYR A 11 18.190 22.861 -19.850 1.00 0.00 O ATOM 0 H TYR A 11 12.938 25.965 -25.355 1.00 0.00 H new ATOM 0 HA TYR A 11 15.646 24.976 -24.721 1.00 0.00 H new ATOM 0 HB2 TYR A 11 13.343 24.736 -23.068 1.00 0.00 H new ATOM 0 HB3 TYR A 11 13.559 23.170 -23.827 1.00 0.00 H new ATOM 0 HD1 TYR A 11 15.351 25.760 -21.823 1.00 0.00 H new ATOM 0 HD2 TYR A 11 15.257 21.686 -23.071 1.00 0.00 H new ATOM 0 HE1 TYR A 11 17.134 25.229 -20.221 1.00 0.00 H new ATOM 0 HE2 TYR A 11 17.037 21.153 -21.468 1.00 0.00 H new ATOM 0 HH TYR A 11 18.406 21.907 -19.906 1.00 0.00 H new ATOM 182 N GLU A 12 15.366 23.013 -26.294 1.00 0.00 N ATOM 183 CA GLU A 12 15.294 22.083 -27.415 1.00 0.00 C ATOM 184 C GLU A 12 14.773 20.723 -26.961 1.00 0.00 C ATOM 185 O GLU A 12 14.160 19.991 -27.736 1.00 0.00 O ATOM 186 CB GLU A 12 16.671 21.924 -28.063 1.00 0.00 C ATOM 187 CG GLU A 12 17.754 21.485 -27.092 1.00 0.00 C ATOM 188 CD GLU A 12 18.930 22.441 -27.058 1.00 0.00 C ATOM 189 OE1 GLU A 12 19.499 22.719 -28.134 1.00 0.00 O ATOM 190 OE2 GLU A 12 19.281 22.911 -25.956 1.00 0.00 O ATOM 0 H GLU A 12 16.227 22.953 -25.751 1.00 0.00 H new ATOM 0 HA GLU A 12 14.600 22.492 -28.149 1.00 0.00 H new ATOM 0 HB2 GLU A 12 16.601 21.195 -28.870 1.00 0.00 H new ATOM 0 HB3 GLU A 12 16.962 22.872 -28.514 1.00 0.00 H new ATOM 0 HG2 GLU A 12 17.328 21.403 -26.092 1.00 0.00 H new ATOM 0 HG3 GLU A 12 18.106 20.492 -27.371 1.00 0.00 H new ATOM 197 N ASN A 13 15.024 20.391 -25.698 1.00 0.00 N ATOM 198 CA ASN A 13 14.582 19.119 -25.140 1.00 0.00 C ATOM 199 C ASN A 13 15.109 17.950 -25.966 1.00 0.00 C ATOM 200 O ASN A 13 14.365 17.273 -26.676 1.00 0.00 O ATOM 201 CB ASN A 13 13.054 19.067 -25.081 1.00 0.00 C ATOM 202 CG ASN A 13 12.456 20.318 -24.466 1.00 0.00 C ATOM 203 OD1 ASN A 13 11.529 20.912 -25.016 1.00 0.00 O ATOM 204 ND2 ASN A 13 12.987 20.725 -23.318 1.00 0.00 N ATOM 0 H ASN A 13 15.531 20.986 -25.043 1.00 0.00 H new ATOM 0 HA ASN A 13 14.981 19.037 -24.129 1.00 0.00 H new ATOM 0 HB2 ASN A 13 12.659 18.936 -26.088 1.00 0.00 H new ATOM 0 HB3 ASN A 13 12.745 18.197 -24.501 1.00 0.00 H new ATOM 0 HD21 ASN A 13 12.627 21.561 -22.857 1.00 0.00 H new ATOM 0 HD22 ASN A 13 13.755 20.202 -22.897 1.00 0.00 H new ATOM 211 N PRO A 14 16.425 17.705 -25.872 1.00 0.00 N ATOM 212 CA PRO A 14 17.082 16.617 -26.603 1.00 0.00 C ATOM 213 C PRO A 14 16.689 15.243 -26.073 1.00 0.00 C ATOM 214 O PRO A 14 16.437 14.318 -26.845 1.00 0.00 O ATOM 215 CB PRO A 14 18.571 16.877 -26.363 1.00 0.00 C ATOM 216 CG PRO A 14 18.622 17.635 -25.081 1.00 0.00 C ATOM 217 CD PRO A 14 17.372 18.471 -25.045 1.00 0.00 C ATOM 0 HA PRO A 14 16.802 16.606 -27.656 1.00 0.00 H new ATOM 0 HB2 PRO A 14 19.130 15.944 -26.293 1.00 0.00 H new ATOM 0 HB3 PRO A 14 19.009 17.451 -27.180 1.00 0.00 H new ATOM 0 HG2 PRO A 14 18.663 16.957 -24.228 1.00 0.00 H new ATOM 0 HG3 PRO A 14 19.512 18.262 -25.033 1.00 0.00 H new ATOM 0 HD2 PRO A 14 17.004 18.599 -24.027 1.00 0.00 H new ATOM 0 HD3 PRO A 14 17.544 19.468 -25.450 1.00 0.00 H new ATOM 225 N ARG A 15 16.638 15.116 -24.751 1.00 0.00 N ATOM 226 CA ARG A 15 16.277 13.853 -24.117 1.00 0.00 C ATOM 227 C ARG A 15 16.281 13.987 -22.597 1.00 0.00 C ATOM 228 O ARG A 15 15.470 13.369 -21.908 1.00 0.00 O ATOM 229 CB ARG A 15 17.244 12.748 -24.546 1.00 0.00 C ATOM 230 CG ARG A 15 16.566 11.586 -25.253 1.00 0.00 C ATOM 231 CD ARG A 15 16.620 10.317 -24.417 1.00 0.00 C ATOM 232 NE ARG A 15 16.583 9.114 -25.244 1.00 0.00 N ATOM 233 CZ ARG A 15 15.494 8.692 -25.878 1.00 0.00 C ATOM 234 NH1 ARG A 15 14.360 9.372 -25.779 1.00 0.00 N ATOM 235 NH2 ARG A 15 15.539 7.588 -26.612 1.00 0.00 N ATOM 0 H ARG A 15 16.842 15.872 -24.098 1.00 0.00 H new ATOM 0 HA ARG A 15 15.269 13.589 -24.438 1.00 0.00 H new ATOM 0 HB2 ARG A 15 17.999 13.174 -25.207 1.00 0.00 H new ATOM 0 HB3 ARG A 15 17.766 12.372 -23.666 1.00 0.00 H new ATOM 0 HG2 ARG A 15 15.527 11.842 -25.461 1.00 0.00 H new ATOM 0 HG3 ARG A 15 17.050 11.411 -26.214 1.00 0.00 H new ATOM 0 HD2 ARG A 15 17.530 10.317 -23.817 1.00 0.00 H new ATOM 0 HD3 ARG A 15 15.780 10.305 -23.722 1.00 0.00 H new ATOM 0 HE ARG A 15 17.439 8.568 -25.340 1.00 0.00 H new ATOM 0 HH11 ARG A 15 14.322 10.221 -25.215 1.00 0.00 H new ATOM 0 HH12 ARG A 15 13.526 9.046 -26.267 1.00 0.00 H new ATOM 0 HH21 ARG A 15 16.410 7.063 -26.690 1.00 0.00 H new ATOM 0 HH22 ARG A 15 14.703 7.265 -27.098 1.00 0.00 H new ATOM 249 N ASN A 16 17.200 14.797 -22.082 1.00 0.00 N ATOM 250 CA ASN A 16 17.310 15.011 -20.643 1.00 0.00 C ATOM 251 C ASN A 16 16.086 15.746 -20.107 1.00 0.00 C ATOM 252 O ASN A 16 15.395 15.256 -19.214 1.00 0.00 O ATOM 253 CB ASN A 16 18.578 15.804 -20.321 1.00 0.00 C ATOM 254 CG ASN A 16 19.776 14.906 -20.077 1.00 0.00 C ATOM 255 OD1 ASN A 16 19.635 13.693 -19.924 1.00 0.00 O ATOM 256 ND2 ASN A 16 20.963 15.500 -20.041 1.00 0.00 N ATOM 0 H ASN A 16 17.879 15.316 -22.639 1.00 0.00 H new ATOM 0 HA ASN A 16 17.366 14.036 -20.158 1.00 0.00 H new ATOM 0 HB2 ASN A 16 18.798 16.482 -21.145 1.00 0.00 H new ATOM 0 HB3 ASN A 16 18.404 16.420 -19.439 1.00 0.00 H new ATOM 0 HD21 ASN A 16 21.805 14.947 -19.881 1.00 0.00 H new ATOM 0 HD22 ASN A 16 21.033 16.509 -20.173 1.00 0.00 H new ATOM 263 N VAL A 17 15.823 16.927 -20.660 1.00 0.00 N ATOM 264 CA VAL A 17 14.681 17.730 -20.239 1.00 0.00 C ATOM 265 C VAL A 17 14.662 17.906 -18.724 1.00 0.00 C ATOM 266 O VAL A 17 13.958 17.189 -18.014 1.00 0.00 O ATOM 267 CB VAL A 17 13.352 17.095 -20.688 1.00 0.00 C ATOM 268 CG1 VAL A 17 12.172 17.912 -20.184 1.00 0.00 C ATOM 269 CG2 VAL A 17 13.310 16.961 -22.202 1.00 0.00 C ATOM 0 H VAL A 17 16.385 17.348 -21.400 1.00 0.00 H new ATOM 0 HA VAL A 17 14.787 18.705 -20.714 1.00 0.00 H new ATOM 0 HB VAL A 17 13.283 16.097 -20.256 1.00 0.00 H new ATOM 0 HG11 VAL A 17 11.242 17.448 -20.511 1.00 0.00 H new ATOM 0 HG12 VAL A 17 12.195 17.951 -19.095 1.00 0.00 H new ATOM 0 HG13 VAL A 17 12.233 18.924 -20.584 1.00 0.00 H new ATOM 0 HG21 VAL A 17 12.364 16.510 -22.501 1.00 0.00 H new ATOM 0 HG22 VAL A 17 13.402 17.947 -22.657 1.00 0.00 H new ATOM 0 HG23 VAL A 17 14.134 16.329 -22.534 1.00 0.00 H new ATOM 279 N GLY A 18 15.439 18.868 -18.236 1.00 0.00 N ATOM 280 CA GLY A 18 15.497 19.122 -16.808 1.00 0.00 C ATOM 281 C GLY A 18 16.548 18.281 -16.111 1.00 0.00 C ATOM 282 O GLY A 18 17.338 18.795 -15.320 1.00 0.00 O ATOM 0 H GLY A 18 16.029 19.476 -18.804 1.00 0.00 H new ATOM 0 HA2 GLY A 18 15.710 20.177 -16.638 1.00 0.00 H new ATOM 0 HA3 GLY A 18 14.522 18.918 -16.366 1.00 0.00 H new ATOM 286 N SER A 19 16.557 16.985 -16.405 1.00 0.00 N ATOM 287 CA SER A 19 17.515 16.070 -15.796 1.00 0.00 C ATOM 288 C SER A 19 18.937 16.608 -15.926 1.00 0.00 C ATOM 289 O SER A 19 19.408 16.891 -17.028 1.00 0.00 O ATOM 290 CB SER A 19 17.419 14.689 -16.448 1.00 0.00 C ATOM 291 OG SER A 19 18.076 13.708 -15.664 1.00 0.00 O ATOM 0 H SER A 19 15.912 16.545 -17.061 1.00 0.00 H new ATOM 0 HA SER A 19 17.273 15.981 -14.737 1.00 0.00 H new ATOM 0 HB2 SER A 19 16.372 14.416 -16.575 1.00 0.00 H new ATOM 0 HB3 SER A 19 17.863 14.721 -17.443 1.00 0.00 H new ATOM 0 HG SER A 19 17.999 12.834 -16.101 1.00 0.00 H new ATOM 297 N PHE A 20 19.616 16.746 -14.792 1.00 0.00 N ATOM 298 CA PHE A 20 20.984 17.251 -14.777 1.00 0.00 C ATOM 299 C PHE A 20 21.876 16.380 -13.896 1.00 0.00 C ATOM 300 O PHE A 20 21.474 15.960 -12.811 1.00 0.00 O ATOM 301 CB PHE A 20 21.011 18.697 -14.278 1.00 0.00 C ATOM 302 CG PHE A 20 20.992 19.713 -15.384 1.00 0.00 C ATOM 303 CD1 PHE A 20 21.956 19.692 -16.378 1.00 0.00 C ATOM 304 CD2 PHE A 20 20.010 20.690 -15.428 1.00 0.00 C ATOM 305 CE1 PHE A 20 21.942 20.626 -17.398 1.00 0.00 C ATOM 306 CE2 PHE A 20 19.990 21.625 -16.445 1.00 0.00 C ATOM 307 CZ PHE A 20 20.958 21.594 -17.431 1.00 0.00 C ATOM 0 H PHE A 20 19.241 16.515 -13.872 1.00 0.00 H new ATOM 0 HA PHE A 20 21.368 17.219 -15.797 1.00 0.00 H new ATOM 0 HB2 PHE A 20 20.153 18.864 -13.627 1.00 0.00 H new ATOM 0 HB3 PHE A 20 21.905 18.847 -13.673 1.00 0.00 H new ATOM 0 HD1 PHE A 20 22.728 18.937 -16.356 1.00 0.00 H new ATOM 0 HD2 PHE A 20 19.252 20.721 -14.659 1.00 0.00 H new ATOM 0 HE1 PHE A 20 22.699 20.598 -18.167 1.00 0.00 H new ATOM 0 HE2 PHE A 20 19.218 22.380 -16.469 1.00 0.00 H new ATOM 0 HZ PHE A 20 20.945 22.325 -18.226 1.00 0.00 H new ATOM 317 N ASP A 21 23.087 16.113 -14.371 1.00 0.00 N ATOM 318 CA ASP A 21 24.036 15.293 -13.628 1.00 0.00 C ATOM 319 C ASP A 21 25.196 16.138 -13.111 1.00 0.00 C ATOM 320 O ASP A 21 26.288 15.627 -12.866 1.00 0.00 O ATOM 321 CB ASP A 21 24.567 14.162 -14.510 1.00 0.00 C ATOM 322 CG ASP A 21 24.393 12.799 -13.871 1.00 0.00 C ATOM 323 OD1 ASP A 21 23.255 12.468 -13.477 1.00 0.00 O ATOM 324 OD2 ASP A 21 25.395 12.061 -13.765 1.00 0.00 O ATOM 0 H ASP A 21 23.435 16.453 -15.268 1.00 0.00 H new ATOM 0 HA ASP A 21 23.514 14.862 -12.774 1.00 0.00 H new ATOM 0 HB2 ASP A 21 24.049 14.179 -15.469 1.00 0.00 H new ATOM 0 HB3 ASP A 21 25.624 14.331 -14.716 1.00 0.00 H new ATOM 329 N ASN A 22 24.951 17.434 -12.949 1.00 0.00 N ATOM 330 CA ASN A 22 25.976 18.351 -12.463 1.00 0.00 C ATOM 331 C ASN A 22 26.420 17.973 -11.053 1.00 0.00 C ATOM 332 O ASN A 22 26.068 16.909 -10.546 1.00 0.00 O ATOM 333 CB ASN A 22 25.452 19.789 -12.477 1.00 0.00 C ATOM 334 CG ASN A 22 26.414 20.748 -13.151 1.00 0.00 C ATOM 335 OD1 ASN A 22 27.192 21.434 -12.486 1.00 0.00 O ATOM 336 ND2 ASN A 22 26.365 20.801 -14.477 1.00 0.00 N ATOM 0 H ASN A 22 24.052 17.873 -13.147 1.00 0.00 H new ATOM 0 HA ASN A 22 26.837 18.279 -13.127 1.00 0.00 H new ATOM 0 HB2 ASN A 22 24.493 19.818 -12.993 1.00 0.00 H new ATOM 0 HB3 ASN A 22 25.273 20.118 -11.453 1.00 0.00 H new ATOM 0 HD21 ASN A 22 26.988 21.428 -14.986 1.00 0.00 H new ATOM 0 HD22 ASN A 22 25.704 20.214 -14.987 1.00 0.00 H new ATOM 343 N ASN A 23 27.194 18.853 -10.426 1.00 0.00 N ATOM 344 CA ASN A 23 27.686 18.612 -9.075 1.00 0.00 C ATOM 345 C ASN A 23 26.537 18.605 -8.071 1.00 0.00 C ATOM 346 O ASN A 23 26.072 19.659 -7.637 1.00 0.00 O ATOM 347 CB ASN A 23 28.711 19.679 -8.685 1.00 0.00 C ATOM 348 CG ASN A 23 29.638 20.036 -9.831 1.00 0.00 C ATOM 349 OD1 ASN A 23 30.088 19.164 -10.575 1.00 0.00 O ATOM 350 ND2 ASN A 23 29.927 21.323 -9.979 1.00 0.00 N ATOM 0 H ASN A 23 27.494 19.739 -10.832 1.00 0.00 H new ATOM 0 HA ASN A 23 28.166 17.633 -9.059 1.00 0.00 H new ATOM 0 HB2 ASN A 23 28.189 20.576 -8.351 1.00 0.00 H new ATOM 0 HB3 ASN A 23 29.301 19.321 -7.842 1.00 0.00 H new ATOM 0 HD21 ASN A 23 30.545 21.624 -10.733 1.00 0.00 H new ATOM 0 HD22 ASN A 23 29.531 22.011 -9.339 1.00 0.00 H new ATOM 357 N ASP A 24 26.085 17.410 -7.707 1.00 0.00 N ATOM 358 CA ASP A 24 24.991 17.265 -6.753 1.00 0.00 C ATOM 359 C ASP A 24 25.338 17.929 -5.424 1.00 0.00 C ATOM 360 O ASP A 24 24.454 18.239 -4.626 1.00 0.00 O ATOM 361 CB ASP A 24 24.673 15.785 -6.530 1.00 0.00 C ATOM 362 CG ASP A 24 25.828 15.034 -5.897 1.00 0.00 C ATOM 363 OD1 ASP A 24 26.169 15.340 -4.736 1.00 0.00 O ATOM 364 OD2 ASP A 24 26.391 14.140 -6.563 1.00 0.00 O ATOM 0 H ASP A 24 26.459 16.528 -8.058 1.00 0.00 H new ATOM 0 HA ASP A 24 24.112 17.759 -7.167 1.00 0.00 H new ATOM 0 HB2 ASP A 24 23.793 15.697 -5.892 1.00 0.00 H new ATOM 0 HB3 ASP A 24 24.422 15.322 -7.485 1.00 0.00 H new ATOM 369 N GLU A 25 26.629 18.142 -5.194 1.00 0.00 N ATOM 370 CA GLU A 25 27.092 18.768 -3.960 1.00 0.00 C ATOM 371 C GLU A 25 26.346 20.073 -3.699 1.00 0.00 C ATOM 372 O GLU A 25 26.180 20.487 -2.553 1.00 0.00 O ATOM 373 CB GLU A 25 28.597 19.033 -4.030 1.00 0.00 C ATOM 374 CG GLU A 25 29.000 19.960 -5.164 1.00 0.00 C ATOM 375 CD GLU A 25 30.488 19.917 -5.452 1.00 0.00 C ATOM 376 OE1 GLU A 25 31.035 18.803 -5.588 1.00 0.00 O ATOM 377 OE2 GLU A 25 31.106 20.999 -5.542 1.00 0.00 O ATOM 0 H GLU A 25 27.373 17.891 -5.845 1.00 0.00 H new ATOM 0 HA GLU A 25 26.889 18.083 -3.137 1.00 0.00 H new ATOM 0 HB2 GLU A 25 28.926 19.465 -3.085 1.00 0.00 H new ATOM 0 HB3 GLU A 25 29.120 18.083 -4.145 1.00 0.00 H new ATOM 0 HG2 GLU A 25 28.451 19.686 -6.065 1.00 0.00 H new ATOM 0 HG3 GLU A 25 28.712 20.981 -4.914 1.00 0.00 H new ATOM 384 N ASN A 26 25.898 20.717 -4.772 1.00 0.00 N ATOM 385 CA ASN A 26 25.171 21.976 -4.660 1.00 0.00 C ATOM 386 C ASN A 26 23.731 21.817 -5.139 1.00 0.00 C ATOM 387 O ASN A 26 22.876 22.658 -4.861 1.00 0.00 O ATOM 388 CB ASN A 26 25.872 23.068 -5.471 1.00 0.00 C ATOM 389 CG ASN A 26 26.514 22.528 -6.734 1.00 0.00 C ATOM 390 OD1 ASN A 26 27.710 22.234 -6.760 1.00 0.00 O ATOM 391 ND2 ASN A 26 25.721 22.395 -7.791 1.00 0.00 N ATOM 0 H ASN A 26 26.026 20.388 -5.729 1.00 0.00 H new ATOM 0 HA ASN A 26 25.156 22.266 -3.609 1.00 0.00 H new ATOM 0 HB2 ASN A 26 25.150 23.840 -5.735 1.00 0.00 H new ATOM 0 HB3 ASN A 26 26.635 23.543 -4.853 1.00 0.00 H new ATOM 0 HD21 ASN A 26 26.097 22.037 -8.669 1.00 0.00 H new ATOM 0 HD22 ASN A 26 24.736 22.651 -7.725 1.00 0.00 H new ATOM 398 N VAL A 27 23.470 20.731 -5.861 1.00 0.00 N ATOM 399 CA VAL A 27 22.133 20.460 -6.377 1.00 0.00 C ATOM 400 C VAL A 27 21.304 19.672 -5.369 1.00 0.00 C ATOM 401 O VAL A 27 21.760 18.667 -4.825 1.00 0.00 O ATOM 402 CB VAL A 27 22.192 19.677 -7.702 1.00 0.00 C ATOM 403 CG1 VAL A 27 20.815 19.609 -8.344 1.00 0.00 C ATOM 404 CG2 VAL A 27 23.200 20.308 -8.650 1.00 0.00 C ATOM 0 H VAL A 27 24.166 20.025 -6.101 1.00 0.00 H new ATOM 0 HA VAL A 27 21.660 21.426 -6.555 1.00 0.00 H new ATOM 0 HB VAL A 27 22.517 18.659 -7.487 1.00 0.00 H new ATOM 0 HG11 VAL A 27 20.877 19.052 -9.279 1.00 0.00 H new ATOM 0 HG12 VAL A 27 20.123 19.107 -7.668 1.00 0.00 H new ATOM 0 HG13 VAL A 27 20.457 20.619 -8.546 1.00 0.00 H new ATOM 0 HG21 VAL A 27 23.228 19.742 -9.581 1.00 0.00 H new ATOM 0 HG22 VAL A 27 22.907 21.337 -8.860 1.00 0.00 H new ATOM 0 HG23 VAL A 27 24.188 20.299 -8.190 1.00 0.00 H new ATOM 414 N GLY A 28 20.082 20.135 -5.126 1.00 0.00 N ATOM 415 CA GLY A 28 19.207 19.461 -4.184 1.00 0.00 C ATOM 416 C GLY A 28 18.039 18.776 -4.865 1.00 0.00 C ATOM 417 O GLY A 28 17.448 19.322 -5.797 1.00 0.00 O ATOM 0 H GLY A 28 19.682 20.965 -5.564 1.00 0.00 H new ATOM 0 HA2 GLY A 28 19.781 18.723 -3.624 1.00 0.00 H new ATOM 0 HA3 GLY A 28 18.829 20.185 -3.462 1.00 0.00 H new ATOM 421 N SER A 29 17.707 17.575 -4.402 1.00 0.00 N ATOM 422 CA SER A 29 16.605 16.812 -4.976 1.00 0.00 C ATOM 423 C SER A 29 15.631 16.364 -3.891 1.00 0.00 C ATOM 424 O SER A 29 16.027 16.088 -2.760 1.00 0.00 O ATOM 425 CB SER A 29 17.140 15.594 -5.732 1.00 0.00 C ATOM 426 OG SER A 29 18.458 15.823 -6.200 1.00 0.00 O ATOM 0 H SER A 29 18.186 17.109 -3.631 1.00 0.00 H new ATOM 0 HA SER A 29 16.072 17.459 -5.673 1.00 0.00 H new ATOM 0 HB2 SER A 29 17.129 14.722 -5.078 1.00 0.00 H new ATOM 0 HB3 SER A 29 16.486 15.368 -6.574 1.00 0.00 H new ATOM 0 HG SER A 29 18.778 15.030 -6.678 1.00 0.00 H new ATOM 432 N GLY A 30 14.351 16.295 -4.246 1.00 0.00 N ATOM 433 CA GLY A 30 13.338 15.880 -3.292 1.00 0.00 C ATOM 434 C GLY A 30 12.222 15.086 -3.941 1.00 0.00 C ATOM 435 O GLY A 30 11.682 15.488 -4.971 1.00 0.00 O ATOM 0 H GLY A 30 13.998 16.519 -5.176 1.00 0.00 H new ATOM 0 HA2 GLY A 30 13.803 15.277 -2.512 1.00 0.00 H new ATOM 0 HA3 GLY A 30 12.918 16.761 -2.806 1.00 0.00 H new ATOM 439 N MET A 31 11.876 13.953 -3.338 1.00 0.00 N ATOM 440 CA MET A 31 10.817 13.100 -3.864 1.00 0.00 C ATOM 441 C MET A 31 9.781 12.792 -2.787 1.00 0.00 C ATOM 442 O MET A 31 10.127 12.386 -1.677 1.00 0.00 O ATOM 443 CB MET A 31 11.405 11.797 -4.409 1.00 0.00 C ATOM 444 CG MET A 31 10.357 10.828 -4.931 1.00 0.00 C ATOM 445 SD MET A 31 10.130 9.403 -3.850 1.00 0.00 S ATOM 446 CE MET A 31 8.476 9.707 -3.231 1.00 0.00 C ATOM 0 H MET A 31 12.314 13.605 -2.485 1.00 0.00 H new ATOM 0 HA MET A 31 10.324 13.635 -4.675 1.00 0.00 H new ATOM 0 HB2 MET A 31 12.103 12.031 -5.212 1.00 0.00 H new ATOM 0 HB3 MET A 31 11.978 11.309 -3.621 1.00 0.00 H new ATOM 0 HG2 MET A 31 9.407 11.351 -5.041 1.00 0.00 H new ATOM 0 HG3 MET A 31 10.648 10.484 -5.923 1.00 0.00 H new ATOM 0 HE1 MET A 31 8.531 10.044 -2.196 1.00 0.00 H new ATOM 0 HE2 MET A 31 7.996 10.475 -3.838 1.00 0.00 H new ATOM 0 HE3 MET A 31 7.894 8.787 -3.282 1.00 0.00 H new ATOM 456 N VAL A 32 8.510 12.988 -3.121 1.00 0.00 N ATOM 457 CA VAL A 32 7.424 12.731 -2.182 1.00 0.00 C ATOM 458 C VAL A 32 6.188 12.203 -2.903 1.00 0.00 C ATOM 459 O VAL A 32 6.046 12.368 -4.114 1.00 0.00 O ATOM 460 CB VAL A 32 7.045 14.002 -1.400 1.00 0.00 C ATOM 461 CG1 VAL A 32 8.267 14.587 -0.708 1.00 0.00 C ATOM 462 CG2 VAL A 32 6.405 15.025 -2.325 1.00 0.00 C ATOM 0 H VAL A 32 8.206 13.324 -4.035 1.00 0.00 H new ATOM 0 HA VAL A 32 7.783 11.977 -1.482 1.00 0.00 H new ATOM 0 HB VAL A 32 6.317 13.734 -0.634 1.00 0.00 H new ATOM 0 HG11 VAL A 32 7.980 15.485 -0.160 1.00 0.00 H new ATOM 0 HG12 VAL A 32 8.678 13.854 -0.014 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.020 14.842 -1.454 1.00 0.00 H new ATOM 0 HG21 VAL A 32 6.143 15.917 -1.756 1.00 0.00 H new ATOM 0 HG22 VAL A 32 7.108 15.292 -3.114 1.00 0.00 H new ATOM 0 HG23 VAL A 32 5.504 14.601 -2.769 1.00 0.00 H new ATOM 472 N GLY A 33 5.296 11.569 -2.149 1.00 0.00 N ATOM 473 CA GLY A 33 4.083 11.027 -2.732 1.00 0.00 C ATOM 474 C GLY A 33 3.215 10.317 -1.712 1.00 0.00 C ATOM 475 O GLY A 33 3.412 10.469 -0.507 1.00 0.00 O ATOM 0 H GLY A 33 5.392 11.421 -1.144 1.00 0.00 H new ATOM 0 HA2 GLY A 33 3.512 11.834 -3.191 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.346 10.330 -3.528 1.00 0.00 H new ATOM 479 N ALA A 34 2.251 9.540 -2.195 1.00 0.00 N ATOM 480 CA ALA A 34 1.351 8.804 -1.317 1.00 0.00 C ATOM 481 C ALA A 34 1.092 7.399 -1.849 1.00 0.00 C ATOM 482 O ALA A 34 1.107 7.153 -3.055 1.00 0.00 O ATOM 483 CB ALA A 34 0.040 9.558 -1.153 1.00 0.00 C ATOM 0 H ALA A 34 2.074 9.404 -3.190 1.00 0.00 H new ATOM 0 HA ALA A 34 1.829 8.712 -0.342 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -0.623 8.996 -0.495 1.00 0.00 H new ATOM 0 HB2 ALA A 34 0.236 10.539 -0.720 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -0.434 9.680 -2.127 1.00 0.00 H new ATOM 489 N PRO A 35 0.850 6.452 -0.930 1.00 0.00 N ATOM 490 CA PRO A 35 0.583 5.055 -1.283 1.00 0.00 C ATOM 491 C PRO A 35 -0.769 4.877 -1.965 1.00 0.00 C ATOM 492 O PRO A 35 -0.867 4.240 -3.013 1.00 0.00 O ATOM 493 CB PRO A 35 0.599 4.338 0.069 1.00 0.00 C ATOM 494 CG PRO A 35 0.243 5.391 1.061 1.00 0.00 C ATOM 495 CD PRO A 35 0.817 6.674 0.526 1.00 0.00 C ATOM 0 HA PRO A 35 1.312 4.668 -1.995 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -0.117 3.516 0.090 1.00 0.00 H new ATOM 0 HB3 PRO A 35 1.580 3.911 0.279 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -0.838 5.466 1.179 1.00 0.00 H new ATOM 0 HG3 PRO A 35 0.656 5.158 2.043 1.00 0.00 H new ATOM 0 HD2 PRO A 35 0.197 7.532 0.788 1.00 0.00 H new ATOM 0 HD3 PRO A 35 1.813 6.866 0.926 1.00 0.00 H new ATOM 503 N ALA A 36 -1.809 5.445 -1.363 1.00 0.00 N ATOM 504 CA ALA A 36 -3.155 5.351 -1.914 1.00 0.00 C ATOM 505 C ALA A 36 -3.363 6.367 -3.032 1.00 0.00 C ATOM 506 O ALA A 36 -4.349 6.302 -3.768 1.00 0.00 O ATOM 507 CB ALA A 36 -4.190 5.553 -0.817 1.00 0.00 C ATOM 0 H ALA A 36 -1.745 5.975 -0.494 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.279 4.354 -2.336 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -5.191 5.480 -1.243 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -4.064 4.786 -0.053 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.057 6.538 -0.368 1.00 0.00 H new ATOM 513 N CYS A 37 -2.429 7.304 -3.155 1.00 0.00 N ATOM 514 CA CYS A 37 -2.511 8.335 -4.184 1.00 0.00 C ATOM 515 C CYS A 37 -1.787 7.896 -5.452 1.00 0.00 C ATOM 516 O CYS A 37 -2.229 8.184 -6.563 1.00 0.00 O ATOM 517 CB CYS A 37 -1.915 9.646 -3.669 1.00 0.00 C ATOM 518 SG CYS A 37 -2.587 11.124 -4.464 1.00 0.00 S ATOM 0 H CYS A 37 -1.607 7.371 -2.555 1.00 0.00 H new ATOM 0 HA CYS A 37 -3.563 8.492 -4.424 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -2.087 9.714 -2.595 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -0.835 9.625 -3.818 1.00 0.00 H new ATOM 0 HG CYS A 37 -2.023 12.182 -3.961 1.00 0.00 H new ATOM 524 N GLY A 38 -0.669 7.198 -5.277 1.00 0.00 N ATOM 525 CA GLY A 38 0.101 6.732 -6.417 1.00 0.00 C ATOM 526 C GLY A 38 0.798 7.863 -7.147 1.00 0.00 C ATOM 527 O GLY A 38 1.386 7.656 -8.208 1.00 0.00 O ATOM 0 H GLY A 38 -0.283 6.947 -4.367 1.00 0.00 H new ATOM 0 HA2 GLY A 38 0.844 6.010 -6.079 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -0.560 6.210 -7.109 1.00 0.00 H new ATOM 531 N ALA A 39 0.730 9.062 -6.579 1.00 0.00 N ATOM 532 CA ALA A 39 1.360 10.230 -7.183 1.00 0.00 C ATOM 533 C ALA A 39 2.765 10.444 -6.629 1.00 0.00 C ATOM 534 O ALA A 39 3.044 10.122 -5.474 1.00 0.00 O ATOM 535 CB ALA A 39 0.506 11.468 -6.953 1.00 0.00 C ATOM 0 H ALA A 39 0.245 9.250 -5.702 1.00 0.00 H new ATOM 0 HA ALA A 39 1.443 10.053 -8.255 1.00 0.00 H new ATOM 0 HB1 ALA A 39 0.988 12.333 -7.409 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -0.476 11.321 -7.402 1.00 0.00 H new ATOM 0 HB3 ALA A 39 0.393 11.638 -5.882 1.00 0.00 H new ATOM 541 N VAL A 40 3.647 10.988 -7.461 1.00 0.00 N ATOM 542 CA VAL A 40 5.024 11.245 -7.055 1.00 0.00 C ATOM 543 C VAL A 40 5.494 12.611 -7.541 1.00 0.00 C ATOM 544 O VAL A 40 5.570 12.861 -8.744 1.00 0.00 O ATOM 545 CB VAL A 40 5.979 10.163 -7.593 1.00 0.00 C ATOM 546 CG1 VAL A 40 7.365 10.325 -6.987 1.00 0.00 C ATOM 547 CG2 VAL A 40 5.424 8.775 -7.313 1.00 0.00 C ATOM 0 H VAL A 40 3.433 11.259 -8.421 1.00 0.00 H new ATOM 0 HA VAL A 40 5.042 11.225 -5.965 1.00 0.00 H new ATOM 0 HB VAL A 40 6.065 10.283 -8.673 1.00 0.00 H new ATOM 0 HG11 VAL A 40 8.026 9.552 -7.379 1.00 0.00 H new ATOM 0 HG12 VAL A 40 7.762 11.307 -7.245 1.00 0.00 H new ATOM 0 HG13 VAL A 40 7.301 10.233 -5.903 1.00 0.00 H new ATOM 0 HG21 VAL A 40 6.112 8.023 -7.700 1.00 0.00 H new ATOM 0 HG22 VAL A 40 5.307 8.640 -6.238 1.00 0.00 H new ATOM 0 HG23 VAL A 40 4.455 8.665 -7.800 1.00 0.00 H new ATOM 557 N MET A 41 5.810 13.492 -6.598 1.00 0.00 N ATOM 558 CA MET A 41 6.275 14.833 -6.930 1.00 0.00 C ATOM 559 C MET A 41 7.792 14.931 -6.799 1.00 0.00 C ATOM 560 O MET A 41 8.329 14.957 -5.691 1.00 0.00 O ATOM 561 CB MET A 41 5.605 15.868 -6.024 1.00 0.00 C ATOM 562 CG MET A 41 4.099 15.951 -6.207 1.00 0.00 C ATOM 563 SD MET A 41 3.616 17.160 -7.455 1.00 0.00 S ATOM 564 CE MET A 41 3.330 18.604 -6.435 1.00 0.00 C ATOM 0 H MET A 41 5.752 13.301 -5.598 1.00 0.00 H new ATOM 0 HA MET A 41 6.004 15.038 -7.966 1.00 0.00 H new ATOM 0 HB2 MET A 41 5.824 15.624 -4.984 1.00 0.00 H new ATOM 0 HB3 MET A 41 6.041 16.847 -6.220 1.00 0.00 H new ATOM 0 HG2 MET A 41 3.717 14.970 -6.490 1.00 0.00 H new ATOM 0 HG3 MET A 41 3.635 16.212 -5.256 1.00 0.00 H new ATOM 0 HE1 MET A 41 2.659 19.289 -6.954 1.00 0.00 H new ATOM 0 HE2 MET A 41 2.879 18.299 -5.491 1.00 0.00 H new ATOM 0 HE3 MET A 41 4.278 19.105 -6.239 1.00 0.00 H new ATOM 574 N LYS A 42 8.478 14.985 -7.935 1.00 0.00 N ATOM 575 CA LYS A 42 9.933 15.080 -7.948 1.00 0.00 C ATOM 576 C LYS A 42 10.384 16.426 -8.505 1.00 0.00 C ATOM 577 O LYS A 42 10.074 16.773 -9.646 1.00 0.00 O ATOM 578 CB LYS A 42 10.532 13.945 -8.781 1.00 0.00 C ATOM 579 CG LYS A 42 10.068 12.564 -8.349 1.00 0.00 C ATOM 580 CD LYS A 42 10.856 11.468 -9.046 1.00 0.00 C ATOM 581 CE LYS A 42 12.277 11.376 -8.509 1.00 0.00 C ATOM 582 NZ LYS A 42 13.289 11.532 -9.589 1.00 0.00 N ATOM 0 H LYS A 42 8.049 14.965 -8.860 1.00 0.00 H new ATOM 0 HA LYS A 42 10.287 14.994 -6.921 1.00 0.00 H new ATOM 0 HB2 LYS A 42 10.270 14.096 -9.828 1.00 0.00 H new ATOM 0 HB3 LYS A 42 11.619 13.991 -8.715 1.00 0.00 H new ATOM 0 HG2 LYS A 42 10.179 12.463 -7.269 1.00 0.00 H new ATOM 0 HG3 LYS A 42 9.007 12.449 -8.572 1.00 0.00 H new ATOM 0 HD2 LYS A 42 10.351 10.512 -8.909 1.00 0.00 H new ATOM 0 HD3 LYS A 42 10.883 11.663 -10.118 1.00 0.00 H new ATOM 0 HE2 LYS A 42 12.430 12.147 -7.754 1.00 0.00 H new ATOM 0 HE3 LYS A 42 12.417 10.414 -8.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 14.244 11.463 -9.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 13.159 10.782 -10.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 13.172 12.460 -10.043 1.00 0.00 H new ATOM 596 N LEU A 43 11.120 17.180 -7.696 1.00 0.00 N ATOM 597 CA LEU A 43 11.616 18.488 -8.109 1.00 0.00 C ATOM 598 C LEU A 43 13.101 18.633 -7.789 1.00 0.00 C ATOM 599 O LEU A 43 13.584 18.105 -6.788 1.00 0.00 O ATOM 600 CB LEU A 43 10.824 19.598 -7.416 1.00 0.00 C ATOM 601 CG LEU A 43 9.552 20.059 -8.129 1.00 0.00 C ATOM 602 CD1 LEU A 43 8.558 18.914 -8.241 1.00 0.00 C ATOM 603 CD2 LEU A 43 8.928 21.239 -7.398 1.00 0.00 C ATOM 0 H LEU A 43 11.387 16.908 -6.750 1.00 0.00 H new ATOM 0 HA LEU A 43 11.485 18.575 -9.188 1.00 0.00 H new ATOM 0 HB2 LEU A 43 10.553 19.255 -6.418 1.00 0.00 H new ATOM 0 HB3 LEU A 43 11.479 20.460 -7.290 1.00 0.00 H new ATOM 0 HG LEU A 43 9.820 20.381 -9.135 1.00 0.00 H new ATOM 0 HD11 LEU A 43 7.659 19.261 -8.751 1.00 0.00 H new ATOM 0 HD12 LEU A 43 9.005 18.098 -8.809 1.00 0.00 H new ATOM 0 HD13 LEU A 43 8.296 18.561 -7.244 1.00 0.00 H new ATOM 0 HD21 LEU A 43 8.024 21.553 -7.920 1.00 0.00 H new ATOM 0 HD22 LEU A 43 8.675 20.944 -6.380 1.00 0.00 H new ATOM 0 HD23 LEU A 43 9.637 22.066 -7.370 1.00 0.00 H new ATOM 615 N GLN A 44 13.818 19.353 -8.646 1.00 0.00 N ATOM 616 CA GLN A 44 15.247 19.568 -8.453 1.00 0.00 C ATOM 617 C GLN A 44 15.541 21.034 -8.151 1.00 0.00 C ATOM 618 O GLN A 44 14.729 21.912 -8.441 1.00 0.00 O ATOM 619 CB GLN A 44 16.022 19.126 -9.696 1.00 0.00 C ATOM 620 CG GLN A 44 16.873 17.886 -9.473 1.00 0.00 C ATOM 621 CD GLN A 44 18.059 17.815 -10.414 1.00 0.00 C ATOM 622 OE1 GLN A 44 19.179 17.518 -9.998 1.00 0.00 O ATOM 623 NE2 GLN A 44 17.819 18.088 -11.691 1.00 0.00 N ATOM 0 H GLN A 44 13.433 19.797 -9.480 1.00 0.00 H new ATOM 0 HA GLN A 44 15.568 18.969 -7.601 1.00 0.00 H new ATOM 0 HB2 GLN A 44 15.317 18.932 -10.504 1.00 0.00 H new ATOM 0 HB3 GLN A 44 16.664 19.943 -10.023 1.00 0.00 H new ATOM 0 HG2 GLN A 44 17.230 17.876 -8.443 1.00 0.00 H new ATOM 0 HG3 GLN A 44 16.255 16.998 -9.605 1.00 0.00 H new ATOM 0 HE21 GLN A 44 16.875 18.330 -11.992 1.00 0.00 H new ATOM 0 HE22 GLN A 44 18.579 18.056 -12.371 1.00 0.00 H new ATOM 632 N ILE A 45 16.706 21.289 -7.565 1.00 0.00 N ATOM 633 CA ILE A 45 17.106 22.649 -7.224 1.00 0.00 C ATOM 634 C ILE A 45 18.623 22.800 -7.259 1.00 0.00 C ATOM 635 O ILE A 45 19.359 21.816 -7.177 1.00 0.00 O ATOM 636 CB ILE A 45 16.594 23.053 -5.829 1.00 0.00 C ATOM 637 CG1 ILE A 45 17.131 22.093 -4.766 1.00 0.00 C ATOM 638 CG2 ILE A 45 15.073 23.075 -5.810 1.00 0.00 C ATOM 639 CD1 ILE A 45 17.069 22.651 -3.361 1.00 0.00 C ATOM 0 H ILE A 45 17.389 20.573 -7.317 1.00 0.00 H new ATOM 0 HA ILE A 45 16.660 23.306 -7.970 1.00 0.00 H new ATOM 0 HB ILE A 45 16.956 24.056 -5.602 1.00 0.00 H new ATOM 0 HG12 ILE A 45 16.561 21.165 -4.805 1.00 0.00 H new ATOM 0 HG13 ILE A 45 18.165 21.842 -5.003 1.00 0.00 H new ATOM 0 HG21 ILE A 45 14.726 23.362 -4.818 1.00 0.00 H new ATOM 0 HG22 ILE A 45 14.710 23.795 -6.544 1.00 0.00 H new ATOM 0 HG23 ILE A 45 14.692 22.084 -6.055 1.00 0.00 H new ATOM 0 HD11 ILE A 45 17.466 21.917 -2.660 1.00 0.00 H new ATOM 0 HD12 ILE A 45 17.663 23.564 -3.305 1.00 0.00 H new ATOM 0 HD13 ILE A 45 16.034 22.875 -3.104 1.00 0.00 H new ATOM 651 N LYS A 46 19.086 24.039 -7.379 1.00 0.00 N ATOM 652 CA LYS A 46 20.516 24.322 -7.422 1.00 0.00 C ATOM 653 C LYS A 46 20.866 25.498 -6.516 1.00 0.00 C ATOM 654 O LYS A 46 20.404 26.619 -6.730 1.00 0.00 O ATOM 655 CB LYS A 46 20.955 24.622 -8.857 1.00 0.00 C ATOM 656 CG LYS A 46 21.959 23.625 -9.408 1.00 0.00 C ATOM 657 CD LYS A 46 23.365 24.201 -9.428 1.00 0.00 C ATOM 658 CE LYS A 46 24.294 23.374 -10.302 1.00 0.00 C ATOM 659 NZ LYS A 46 24.170 23.735 -11.741 1.00 0.00 N ATOM 0 H LYS A 46 18.491 24.865 -7.448 1.00 0.00 H new ATOM 0 HA LYS A 46 21.046 23.440 -7.063 1.00 0.00 H new ATOM 0 HB2 LYS A 46 20.076 24.634 -9.502 1.00 0.00 H new ATOM 0 HB3 LYS A 46 21.390 25.621 -8.893 1.00 0.00 H new ATOM 0 HG2 LYS A 46 21.945 22.720 -8.801 1.00 0.00 H new ATOM 0 HG3 LYS A 46 21.669 23.336 -10.418 1.00 0.00 H new ATOM 0 HD2 LYS A 46 23.334 25.226 -9.797 1.00 0.00 H new ATOM 0 HD3 LYS A 46 23.758 24.239 -8.412 1.00 0.00 H new ATOM 0 HE2 LYS A 46 25.324 23.522 -9.978 1.00 0.00 H new ATOM 0 HE3 LYS A 46 24.068 22.316 -10.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 24.820 23.149 -12.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 23.193 23.570 -12.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 24.411 24.739 -11.869 1.00 0.00 H new ATOM 673 N VAL A 47 21.685 25.236 -5.503 1.00 0.00 N ATOM 674 CA VAL A 47 22.099 26.273 -4.566 1.00 0.00 C ATOM 675 C VAL A 47 23.532 26.718 -4.835 1.00 0.00 C ATOM 676 O VAL A 47 24.370 25.923 -5.259 1.00 0.00 O ATOM 677 CB VAL A 47 21.989 25.788 -3.108 1.00 0.00 C ATOM 678 CG1 VAL A 47 22.219 26.941 -2.143 1.00 0.00 C ATOM 679 CG2 VAL A 47 20.635 25.140 -2.863 1.00 0.00 C ATOM 0 H VAL A 47 22.075 24.314 -5.310 1.00 0.00 H new ATOM 0 HA VAL A 47 21.426 27.118 -4.712 1.00 0.00 H new ATOM 0 HB VAL A 47 22.762 25.039 -2.933 1.00 0.00 H new ATOM 0 HG11 VAL A 47 22.137 26.579 -1.118 1.00 0.00 H new ATOM 0 HG12 VAL A 47 23.214 27.357 -2.303 1.00 0.00 H new ATOM 0 HG13 VAL A 47 21.471 27.715 -2.315 1.00 0.00 H new ATOM 0 HG21 VAL A 47 20.575 24.803 -1.828 1.00 0.00 H new ATOM 0 HG22 VAL A 47 19.844 25.865 -3.055 1.00 0.00 H new ATOM 0 HG23 VAL A 47 20.514 24.286 -3.530 1.00 0.00 H new ATOM 689 N ASN A 48 23.807 27.994 -4.586 1.00 0.00 N ATOM 690 CA ASN A 48 25.139 28.545 -4.802 1.00 0.00 C ATOM 691 C ASN A 48 25.934 28.573 -3.500 1.00 0.00 C ATOM 692 O ASN A 48 25.522 27.991 -2.496 1.00 0.00 O ATOM 693 CB ASN A 48 25.042 29.957 -5.383 1.00 0.00 C ATOM 694 CG ASN A 48 23.841 30.125 -6.294 1.00 0.00 C ATOM 695 OD1 ASN A 48 23.677 29.387 -7.266 1.00 0.00 O ATOM 696 ND2 ASN A 48 22.995 31.101 -5.984 1.00 0.00 N ATOM 0 H ASN A 48 23.125 28.666 -4.234 1.00 0.00 H new ATOM 0 HA ASN A 48 25.660 27.902 -5.512 1.00 0.00 H new ATOM 0 HB2 ASN A 48 24.981 30.679 -4.569 1.00 0.00 H new ATOM 0 HB3 ASN A 48 25.952 30.181 -5.940 1.00 0.00 H new ATOM 0 HD21 ASN A 48 22.170 31.263 -6.561 1.00 0.00 H new ATOM 0 HD22 ASN A 48 23.171 31.688 -5.169 1.00 0.00 H new ATOM 703 N ASP A 49 27.074 29.254 -3.523 1.00 0.00 N ATOM 704 CA ASP A 49 27.927 29.360 -2.345 1.00 0.00 C ATOM 705 C ASP A 49 27.237 30.162 -1.246 1.00 0.00 C ATOM 706 O ASP A 49 27.251 29.773 -0.079 1.00 0.00 O ATOM 707 CB ASP A 49 29.260 30.014 -2.710 1.00 0.00 C ATOM 708 CG ASP A 49 30.404 29.019 -2.739 1.00 0.00 C ATOM 709 OD1 ASP A 49 30.786 28.523 -1.658 1.00 0.00 O ATOM 710 OD2 ASP A 49 30.916 28.736 -3.842 1.00 0.00 O ATOM 0 H ASP A 49 27.429 29.742 -4.345 1.00 0.00 H new ATOM 0 HA ASP A 49 28.116 28.353 -1.972 1.00 0.00 H new ATOM 0 HB2 ASP A 49 29.172 30.491 -3.686 1.00 0.00 H new ATOM 0 HB3 ASP A 49 29.485 30.801 -1.990 1.00 0.00 H new ATOM 715 N GLU A 50 26.636 31.285 -1.628 1.00 0.00 N ATOM 716 CA GLU A 50 25.943 32.143 -0.674 1.00 0.00 C ATOM 717 C GLU A 50 24.772 31.406 -0.031 1.00 0.00 C ATOM 718 O GLU A 50 24.342 31.743 1.072 1.00 0.00 O ATOM 719 CB GLU A 50 25.442 33.412 -1.366 1.00 0.00 C ATOM 720 CG GLU A 50 24.695 33.145 -2.661 1.00 0.00 C ATOM 721 CD GLU A 50 23.854 34.327 -3.104 1.00 0.00 C ATOM 722 OE1 GLU A 50 23.776 35.316 -2.345 1.00 0.00 O ATOM 723 OE2 GLU A 50 23.275 34.264 -4.209 1.00 0.00 O ATOM 0 H GLU A 50 26.615 31.621 -2.591 1.00 0.00 H new ATOM 0 HA GLU A 50 26.650 32.419 0.108 1.00 0.00 H new ATOM 0 HB2 GLU A 50 24.787 33.953 -0.683 1.00 0.00 H new ATOM 0 HB3 GLU A 50 26.292 34.062 -1.574 1.00 0.00 H new ATOM 0 HG2 GLU A 50 25.411 32.899 -3.445 1.00 0.00 H new ATOM 0 HG3 GLU A 50 24.052 32.274 -2.532 1.00 0.00 H new ATOM 730 N GLY A 51 24.260 30.396 -0.728 1.00 0.00 N ATOM 731 CA GLY A 51 23.143 29.627 -0.211 1.00 0.00 C ATOM 732 C GLY A 51 21.814 30.076 -0.785 1.00 0.00 C ATOM 733 O GLY A 51 20.793 30.050 -0.098 1.00 0.00 O ATOM 0 H GLY A 51 24.599 30.097 -1.642 1.00 0.00 H new ATOM 0 HA2 GLY A 51 23.296 28.572 -0.439 1.00 0.00 H new ATOM 0 HA3 GLY A 51 23.115 29.718 0.875 1.00 0.00 H new ATOM 737 N ILE A 52 21.827 30.491 -2.047 1.00 0.00 N ATOM 738 CA ILE A 52 20.613 30.948 -2.713 1.00 0.00 C ATOM 739 C ILE A 52 20.283 30.072 -3.916 1.00 0.00 C ATOM 740 O ILE A 52 21.179 29.572 -4.598 1.00 0.00 O ATOM 741 CB ILE A 52 20.743 32.411 -3.177 1.00 0.00 C ATOM 742 CG1 ILE A 52 21.128 33.310 -2.000 1.00 0.00 C ATOM 743 CG2 ILE A 52 19.442 32.883 -3.808 1.00 0.00 C ATOM 744 CD1 ILE A 52 20.193 33.190 -0.817 1.00 0.00 C ATOM 0 H ILE A 52 22.664 30.520 -2.629 1.00 0.00 H new ATOM 0 HA ILE A 52 19.806 30.877 -1.983 1.00 0.00 H new ATOM 0 HB ILE A 52 21.531 32.471 -3.928 1.00 0.00 H new ATOM 0 HG12 ILE A 52 22.140 33.062 -1.680 1.00 0.00 H new ATOM 0 HG13 ILE A 52 21.145 34.347 -2.336 1.00 0.00 H new ATOM 0 HG21 ILE A 52 19.549 33.919 -4.131 1.00 0.00 H new ATOM 0 HG22 ILE A 52 19.207 32.257 -4.669 1.00 0.00 H new ATOM 0 HG23 ILE A 52 18.636 32.812 -3.077 1.00 0.00 H new ATOM 0 HD11 ILE A 52 20.527 33.855 -0.021 1.00 0.00 H new ATOM 0 HD12 ILE A 52 19.184 33.467 -1.122 1.00 0.00 H new ATOM 0 HD13 ILE A 52 20.194 32.162 -0.455 1.00 0.00 H new ATOM 756 N ILE A 53 18.992 29.891 -4.173 1.00 0.00 N ATOM 757 CA ILE A 53 18.543 29.078 -5.296 1.00 0.00 C ATOM 758 C ILE A 53 18.663 29.842 -6.611 1.00 0.00 C ATOM 759 O ILE A 53 18.007 30.864 -6.807 1.00 0.00 O ATOM 760 CB ILE A 53 17.084 28.620 -5.113 1.00 0.00 C ATOM 761 CG1 ILE A 53 16.947 27.778 -3.843 1.00 0.00 C ATOM 762 CG2 ILE A 53 16.619 27.833 -6.329 1.00 0.00 C ATOM 763 CD1 ILE A 53 17.705 26.471 -3.899 1.00 0.00 C ATOM 0 H ILE A 53 18.238 30.297 -3.618 1.00 0.00 H new ATOM 0 HA ILE A 53 19.189 28.201 -5.328 1.00 0.00 H new ATOM 0 HB ILE A 53 16.452 29.502 -5.012 1.00 0.00 H new ATOM 0 HG12 ILE A 53 17.303 28.359 -2.992 1.00 0.00 H new ATOM 0 HG13 ILE A 53 15.892 27.569 -3.668 1.00 0.00 H new ATOM 0 HG21 ILE A 53 15.586 27.516 -6.184 1.00 0.00 H new ATOM 0 HG22 ILE A 53 16.685 28.462 -7.217 1.00 0.00 H new ATOM 0 HG23 ILE A 53 17.253 26.956 -6.459 1.00 0.00 H new ATOM 0 HD11 ILE A 53 17.562 25.927 -2.965 1.00 0.00 H new ATOM 0 HD12 ILE A 53 17.334 25.870 -4.729 1.00 0.00 H new ATOM 0 HD13 ILE A 53 18.767 26.672 -4.043 1.00 0.00 H new ATOM 775 N GLU A 54 19.505 29.337 -7.508 1.00 0.00 N ATOM 776 CA GLU A 54 19.709 29.972 -8.804 1.00 0.00 C ATOM 777 C GLU A 54 19.045 29.165 -9.916 1.00 0.00 C ATOM 778 O GLU A 54 18.729 29.698 -10.980 1.00 0.00 O ATOM 779 CB GLU A 54 21.204 30.124 -9.092 1.00 0.00 C ATOM 780 CG GLU A 54 21.516 30.426 -10.549 1.00 0.00 C ATOM 781 CD GLU A 54 22.945 30.889 -10.755 1.00 0.00 C ATOM 782 OE1 GLU A 54 23.829 30.026 -10.936 1.00 0.00 O ATOM 783 OE2 GLU A 54 23.179 32.116 -10.736 1.00 0.00 O ATOM 0 H GLU A 54 20.056 28.491 -7.361 1.00 0.00 H new ATOM 0 HA GLU A 54 19.250 30.960 -8.772 1.00 0.00 H new ATOM 0 HB2 GLU A 54 21.606 30.924 -8.470 1.00 0.00 H new ATOM 0 HB3 GLU A 54 21.716 29.207 -8.802 1.00 0.00 H new ATOM 0 HG2 GLU A 54 21.337 29.533 -11.148 1.00 0.00 H new ATOM 0 HG3 GLU A 54 20.833 31.194 -10.911 1.00 0.00 H new ATOM 790 N ASP A 55 18.837 27.878 -9.662 1.00 0.00 N ATOM 791 CA ASP A 55 18.210 26.997 -10.640 1.00 0.00 C ATOM 792 C ASP A 55 17.219 26.054 -9.965 1.00 0.00 C ATOM 793 O ASP A 55 17.410 25.655 -8.817 1.00 0.00 O ATOM 794 CB ASP A 55 19.274 26.190 -11.386 1.00 0.00 C ATOM 795 CG ASP A 55 19.576 26.761 -12.758 1.00 0.00 C ATOM 796 OD1 ASP A 55 18.694 26.687 -13.639 1.00 0.00 O ATOM 797 OD2 ASP A 55 20.695 27.281 -12.950 1.00 0.00 O ATOM 0 H ASP A 55 19.094 27.421 -8.787 1.00 0.00 H new ATOM 0 HA ASP A 55 17.666 27.615 -11.354 1.00 0.00 H new ATOM 0 HB2 ASP A 55 20.190 26.168 -10.795 1.00 0.00 H new ATOM 0 HB3 ASP A 55 18.937 25.159 -11.491 1.00 0.00 H new ATOM 802 N ALA A 56 16.159 25.703 -10.686 1.00 0.00 N ATOM 803 CA ALA A 56 15.138 24.807 -10.158 1.00 0.00 C ATOM 804 C ALA A 56 14.527 23.956 -11.266 1.00 0.00 C ATOM 805 O ALA A 56 14.045 24.482 -12.270 1.00 0.00 O ATOM 806 CB ALA A 56 14.056 25.602 -9.443 1.00 0.00 C ATOM 0 H ALA A 56 15.985 26.026 -11.638 1.00 0.00 H new ATOM 0 HA ALA A 56 15.614 24.137 -9.442 1.00 0.00 H new ATOM 0 HB1 ALA A 56 13.300 24.920 -9.054 1.00 0.00 H new ATOM 0 HB2 ALA A 56 14.500 26.160 -8.619 1.00 0.00 H new ATOM 0 HB3 ALA A 56 13.592 26.296 -10.143 1.00 0.00 H new ATOM 812 N ARG A 57 14.552 22.641 -11.079 1.00 0.00 N ATOM 813 CA ARG A 57 14.001 21.718 -12.064 1.00 0.00 C ATOM 814 C ARG A 57 12.743 21.039 -11.530 1.00 0.00 C ATOM 815 O ARG A 57 12.388 21.198 -10.362 1.00 0.00 O ATOM 816 CB ARG A 57 15.042 20.663 -12.442 1.00 0.00 C ATOM 817 CG ARG A 57 15.416 20.676 -13.915 1.00 0.00 C ATOM 818 CD ARG A 57 16.745 21.378 -14.147 1.00 0.00 C ATOM 819 NE ARG A 57 16.686 22.793 -13.790 1.00 0.00 N ATOM 820 CZ ARG A 57 16.179 23.730 -14.584 1.00 0.00 C ATOM 821 NH1 ARG A 57 15.691 23.404 -15.773 1.00 0.00 N ATOM 822 NH2 ARG A 57 16.160 24.997 -14.189 1.00 0.00 N ATOM 0 H ARG A 57 14.948 22.190 -10.254 1.00 0.00 H new ATOM 0 HA ARG A 57 13.734 22.290 -12.952 1.00 0.00 H new ATOM 0 HB2 ARG A 57 15.941 20.822 -11.846 1.00 0.00 H new ATOM 0 HB3 ARG A 57 14.658 19.677 -12.182 1.00 0.00 H new ATOM 0 HG2 ARG A 57 15.474 19.653 -14.286 1.00 0.00 H new ATOM 0 HG3 ARG A 57 14.634 21.177 -14.485 1.00 0.00 H new ATOM 0 HD2 ARG A 57 17.521 20.888 -13.559 1.00 0.00 H new ATOM 0 HD3 ARG A 57 17.029 21.280 -15.195 1.00 0.00 H new ATOM 0 HE ARG A 57 17.054 23.077 -12.882 1.00 0.00 H new ATOM 0 HH11 ARG A 57 15.704 22.432 -16.080 1.00 0.00 H new ATOM 0 HH12 ARG A 57 15.302 24.126 -16.380 1.00 0.00 H new ATOM 0 HH21 ARG A 57 16.535 25.252 -13.275 1.00 0.00 H new ATOM 0 HH22 ARG A 57 15.771 25.716 -14.799 1.00 0.00 H new ATOM 836 N PHE A 58 12.074 20.283 -12.394 1.00 0.00 N ATOM 837 CA PHE A 58 10.854 19.581 -12.010 1.00 0.00 C ATOM 838 C PHE A 58 10.601 18.390 -12.929 1.00 0.00 C ATOM 839 O PHE A 58 10.818 18.466 -14.138 1.00 0.00 O ATOM 840 CB PHE A 58 9.658 20.534 -12.050 1.00 0.00 C ATOM 841 CG PHE A 58 9.363 21.069 -13.422 1.00 0.00 C ATOM 842 CD1 PHE A 58 10.013 22.198 -13.894 1.00 0.00 C ATOM 843 CD2 PHE A 58 8.437 20.442 -14.241 1.00 0.00 C ATOM 844 CE1 PHE A 58 9.742 22.693 -15.156 1.00 0.00 C ATOM 845 CE2 PHE A 58 8.163 20.932 -15.504 1.00 0.00 C ATOM 846 CZ PHE A 58 8.818 22.058 -15.963 1.00 0.00 C ATOM 0 H PHE A 58 12.355 20.141 -13.364 1.00 0.00 H new ATOM 0 HA PHE A 58 10.981 19.212 -10.992 1.00 0.00 H new ATOM 0 HB2 PHE A 58 8.777 20.014 -11.674 1.00 0.00 H new ATOM 0 HB3 PHE A 58 9.847 21.369 -11.376 1.00 0.00 H new ATOM 0 HD1 PHE A 58 10.739 22.697 -13.269 1.00 0.00 H new ATOM 0 HD2 PHE A 58 7.923 19.560 -13.888 1.00 0.00 H new ATOM 0 HE1 PHE A 58 10.253 23.576 -15.511 1.00 0.00 H new ATOM 0 HE2 PHE A 58 7.438 20.435 -16.131 1.00 0.00 H new ATOM 0 HZ PHE A 58 8.608 22.441 -16.951 1.00 0.00 H new ATOM 856 N LYS A 59 10.141 17.288 -12.346 1.00 0.00 N ATOM 857 CA LYS A 59 9.856 16.079 -13.109 1.00 0.00 C ATOM 858 C LYS A 59 8.580 15.408 -12.611 1.00 0.00 C ATOM 859 O LYS A 59 8.560 14.812 -11.533 1.00 0.00 O ATOM 860 CB LYS A 59 11.030 15.102 -13.013 1.00 0.00 C ATOM 861 CG LYS A 59 12.310 15.626 -13.642 1.00 0.00 C ATOM 862 CD LYS A 59 13.540 15.010 -12.996 1.00 0.00 C ATOM 863 CE LYS A 59 14.491 16.078 -12.479 1.00 0.00 C ATOM 864 NZ LYS A 59 14.888 17.034 -13.550 1.00 0.00 N ATOM 0 H LYS A 59 9.957 17.208 -11.346 1.00 0.00 H new ATOM 0 HA LYS A 59 9.712 16.363 -14.151 1.00 0.00 H new ATOM 0 HB2 LYS A 59 11.217 14.874 -11.964 1.00 0.00 H new ATOM 0 HB3 LYS A 59 10.753 14.166 -13.498 1.00 0.00 H new ATOM 0 HG2 LYS A 59 12.309 15.405 -14.709 1.00 0.00 H new ATOM 0 HG3 LYS A 59 12.349 16.711 -13.541 1.00 0.00 H new ATOM 0 HD2 LYS A 59 13.235 14.363 -12.173 1.00 0.00 H new ATOM 0 HD3 LYS A 59 14.057 14.381 -13.721 1.00 0.00 H new ATOM 0 HE2 LYS A 59 14.016 16.623 -11.664 1.00 0.00 H new ATOM 0 HE3 LYS A 59 15.382 15.603 -12.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 15.874 17.330 -13.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 14.800 16.572 -14.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 14.268 17.868 -13.518 1.00 0.00 H new ATOM 878 N THR A 60 7.516 15.508 -13.401 1.00 0.00 N ATOM 879 CA THR A 60 6.237 14.910 -13.040 1.00 0.00 C ATOM 880 C THR A 60 6.242 13.406 -13.289 1.00 0.00 C ATOM 881 O THR A 60 6.861 12.927 -14.239 1.00 0.00 O ATOM 882 CB THR A 60 5.077 15.546 -13.830 1.00 0.00 C ATOM 883 OG1 THR A 60 5.290 16.955 -13.965 1.00 0.00 O ATOM 884 CG2 THR A 60 3.747 15.292 -13.137 1.00 0.00 C ATOM 0 H THR A 60 7.515 15.998 -14.296 1.00 0.00 H new ATOM 0 HA THR A 60 6.090 15.098 -11.977 1.00 0.00 H new ATOM 0 HB THR A 60 5.046 15.088 -14.819 1.00 0.00 H new ATOM 0 HG1 THR A 60 4.549 17.351 -14.470 1.00 0.00 H new ATOM 0 HG21 THR A 60 2.943 15.750 -13.713 1.00 0.00 H new ATOM 0 HG22 THR A 60 3.574 14.218 -13.064 1.00 0.00 H new ATOM 0 HG23 THR A 60 3.769 15.725 -12.137 1.00 0.00 H new ATOM 892 N TYR A 61 5.549 12.667 -12.430 1.00 0.00 N ATOM 893 CA TYR A 61 5.476 11.216 -12.556 1.00 0.00 C ATOM 894 C TYR A 61 4.219 10.674 -11.883 1.00 0.00 C ATOM 895 O TYR A 61 4.236 10.318 -10.705 1.00 0.00 O ATOM 896 CB TYR A 61 6.718 10.567 -11.942 1.00 0.00 C ATOM 897 CG TYR A 61 6.943 9.142 -12.396 1.00 0.00 C ATOM 898 CD1 TYR A 61 7.500 8.868 -13.639 1.00 0.00 C ATOM 899 CD2 TYR A 61 6.597 8.070 -11.582 1.00 0.00 C ATOM 900 CE1 TYR A 61 7.707 7.568 -14.058 1.00 0.00 C ATOM 901 CE2 TYR A 61 6.802 6.767 -11.992 1.00 0.00 C ATOM 902 CZ TYR A 61 7.357 6.521 -13.231 1.00 0.00 C ATOM 903 OH TYR A 61 7.561 5.224 -13.644 1.00 0.00 O ATOM 0 H TYR A 61 5.030 13.048 -11.639 1.00 0.00 H new ATOM 0 HA TYR A 61 5.433 10.970 -13.617 1.00 0.00 H new ATOM 0 HB2 TYR A 61 7.594 11.164 -12.198 1.00 0.00 H new ATOM 0 HB3 TYR A 61 6.627 10.584 -10.856 1.00 0.00 H new ATOM 0 HD1 TYR A 61 7.776 9.685 -14.289 1.00 0.00 H new ATOM 0 HD2 TYR A 61 6.160 8.259 -10.612 1.00 0.00 H new ATOM 0 HE1 TYR A 61 8.140 7.373 -15.028 1.00 0.00 H new ATOM 0 HE2 TYR A 61 6.529 5.945 -11.346 1.00 0.00 H new ATOM 0 HH TYR A 61 7.262 4.607 -12.944 1.00 0.00 H new ATOM 913 N GLY A 62 3.129 10.613 -12.642 1.00 0.00 N ATOM 914 CA GLY A 62 1.877 10.113 -12.103 1.00 0.00 C ATOM 915 C GLY A 62 0.769 10.091 -13.136 1.00 0.00 C ATOM 916 O GLY A 62 1.026 10.204 -14.336 1.00 0.00 O ATOM 0 H GLY A 62 3.090 10.901 -13.620 1.00 0.00 H new ATOM 0 HA2 GLY A 62 2.028 9.105 -11.716 1.00 0.00 H new ATOM 0 HA3 GLY A 62 1.573 10.736 -11.262 1.00 0.00 H new ATOM 920 N CYS A 63 -0.467 9.945 -12.673 1.00 0.00 N ATOM 921 CA CYS A 63 -1.620 9.906 -13.566 1.00 0.00 C ATOM 922 C CYS A 63 -2.794 10.676 -12.971 1.00 0.00 C ATOM 923 O CYS A 63 -3.743 10.083 -12.460 1.00 0.00 O ATOM 924 CB CYS A 63 -2.030 8.459 -13.841 1.00 0.00 C ATOM 925 SG CYS A 63 -1.201 7.715 -15.266 1.00 0.00 S ATOM 0 H CYS A 63 -0.697 9.852 -11.684 1.00 0.00 H new ATOM 0 HA CYS A 63 -1.337 10.380 -14.506 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -1.818 7.858 -12.956 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -3.108 8.422 -14.001 1.00 0.00 H new ATOM 0 HG CYS A 63 -1.611 6.491 -15.416 1.00 0.00 H new ATOM 931 N GLY A 64 -2.722 12.002 -13.041 1.00 0.00 N ATOM 932 CA GLY A 64 -3.785 12.832 -12.504 1.00 0.00 C ATOM 933 C GLY A 64 -3.788 14.226 -13.098 1.00 0.00 C ATOM 934 O GLY A 64 -3.815 14.389 -14.318 1.00 0.00 O ATOM 0 H GLY A 64 -1.947 12.516 -13.460 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -4.746 12.356 -12.697 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -3.676 12.902 -11.422 1.00 0.00 H new ATOM 938 N SER A 65 -3.762 15.236 -12.233 1.00 0.00 N ATOM 939 CA SER A 65 -3.768 16.624 -12.679 1.00 0.00 C ATOM 940 C SER A 65 -3.024 17.516 -11.689 1.00 0.00 C ATOM 941 O SER A 65 -3.360 18.687 -11.518 1.00 0.00 O ATOM 942 CB SER A 65 -5.204 17.121 -12.851 1.00 0.00 C ATOM 943 OG SER A 65 -5.316 17.979 -13.974 1.00 0.00 O ATOM 0 H SER A 65 -3.737 15.118 -11.220 1.00 0.00 H new ATOM 0 HA SER A 65 -3.257 16.673 -13.641 1.00 0.00 H new ATOM 0 HB2 SER A 65 -5.875 16.270 -12.971 1.00 0.00 H new ATOM 0 HB3 SER A 65 -5.519 17.651 -11.952 1.00 0.00 H new ATOM 0 HG SER A 65 -6.244 18.282 -14.063 1.00 0.00 H new ATOM 949 N ALA A 66 -2.011 16.951 -11.040 1.00 0.00 N ATOM 950 CA ALA A 66 -1.218 17.694 -10.068 1.00 0.00 C ATOM 951 C ALA A 66 0.115 18.131 -10.666 1.00 0.00 C ATOM 952 O ALA A 66 1.172 17.628 -10.283 1.00 0.00 O ATOM 953 CB ALA A 66 -0.990 16.854 -8.820 1.00 0.00 C ATOM 0 H ALA A 66 -1.720 15.982 -11.170 1.00 0.00 H new ATOM 0 HA ALA A 66 -1.773 18.590 -9.792 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -0.397 17.421 -8.103 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -1.951 16.597 -8.374 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -0.459 15.941 -9.088 1.00 0.00 H new ATOM 959 N ILE A 67 0.058 19.068 -11.606 1.00 0.00 N ATOM 960 CA ILE A 67 1.261 19.571 -12.256 1.00 0.00 C ATOM 961 C ILE A 67 1.483 21.045 -11.936 1.00 0.00 C ATOM 962 O ILE A 67 2.616 21.527 -11.935 1.00 0.00 O ATOM 963 CB ILE A 67 1.191 19.395 -13.785 1.00 0.00 C ATOM 964 CG1 ILE A 67 0.925 17.930 -14.139 1.00 0.00 C ATOM 965 CG2 ILE A 67 2.480 19.877 -14.433 1.00 0.00 C ATOM 966 CD1 ILE A 67 -0.494 17.666 -14.590 1.00 0.00 C ATOM 0 H ILE A 67 -0.809 19.494 -11.934 1.00 0.00 H new ATOM 0 HA ILE A 67 2.096 18.987 -11.869 1.00 0.00 H new ATOM 0 HB ILE A 67 0.368 19.997 -14.169 1.00 0.00 H new ATOM 0 HG12 ILE A 67 1.611 17.625 -14.929 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.143 17.309 -13.270 1.00 0.00 H new ATOM 0 HG21 ILE A 67 2.415 19.746 -15.513 1.00 0.00 H new ATOM 0 HG22 ILE A 67 2.630 20.932 -14.204 1.00 0.00 H new ATOM 0 HG23 ILE A 67 3.320 19.299 -14.047 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -0.610 16.608 -14.824 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -1.186 17.939 -13.793 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -0.710 18.260 -15.478 1.00 0.00 H new ATOM 978 N ALA A 68 0.395 21.756 -11.661 1.00 0.00 N ATOM 979 CA ALA A 68 0.471 23.175 -11.334 1.00 0.00 C ATOM 980 C ALA A 68 1.125 23.390 -9.974 1.00 0.00 C ATOM 981 O ALA A 68 1.998 24.245 -9.823 1.00 0.00 O ATOM 982 CB ALA A 68 -0.917 23.797 -11.360 1.00 0.00 C ATOM 0 H ALA A 68 -0.550 21.373 -11.658 1.00 0.00 H new ATOM 0 HA ALA A 68 1.090 23.664 -12.086 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -0.846 24.856 -11.114 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -1.348 23.684 -12.355 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -1.553 23.297 -10.630 1.00 0.00 H new ATOM 988 N SER A 69 0.696 22.611 -8.986 1.00 0.00 N ATOM 989 CA SER A 69 1.237 22.721 -7.636 1.00 0.00 C ATOM 990 C SER A 69 2.757 22.592 -7.648 1.00 0.00 C ATOM 991 O SER A 69 3.446 23.171 -6.809 1.00 0.00 O ATOM 992 CB SER A 69 0.629 21.646 -6.732 1.00 0.00 C ATOM 993 OG SER A 69 -0.760 21.502 -6.973 1.00 0.00 O ATOM 0 H SER A 69 -0.024 21.897 -9.095 1.00 0.00 H new ATOM 0 HA SER A 69 0.977 23.705 -7.245 1.00 0.00 H new ATOM 0 HB2 SER A 69 1.132 20.694 -6.905 1.00 0.00 H new ATOM 0 HB3 SER A 69 0.795 21.909 -5.687 1.00 0.00 H new ATOM 0 HG SER A 69 -1.124 20.808 -6.384 1.00 0.00 H new ATOM 999 N SER A 70 3.272 21.828 -8.606 1.00 0.00 N ATOM 1000 CA SER A 70 4.710 21.619 -8.726 1.00 0.00 C ATOM 1001 C SER A 70 5.357 22.744 -9.529 1.00 0.00 C ATOM 1002 O SER A 70 6.393 23.283 -9.139 1.00 0.00 O ATOM 1003 CB SER A 70 4.997 20.272 -9.392 1.00 0.00 C ATOM 1004 OG SER A 70 6.360 20.169 -9.768 1.00 0.00 O ATOM 0 H SER A 70 2.715 21.344 -9.310 1.00 0.00 H new ATOM 0 HA SER A 70 5.137 21.619 -7.723 1.00 0.00 H new ATOM 0 HB2 SER A 70 4.743 19.463 -8.707 1.00 0.00 H new ATOM 0 HB3 SER A 70 4.364 20.155 -10.272 1.00 0.00 H new ATOM 0 HG SER A 70 6.459 19.474 -10.452 1.00 0.00 H new ATOM 1010 N SER A 71 4.739 23.092 -10.652 1.00 0.00 N ATOM 1011 CA SER A 71 5.255 24.150 -11.513 1.00 0.00 C ATOM 1012 C SER A 71 5.238 25.494 -10.792 1.00 0.00 C ATOM 1013 O SER A 71 5.981 26.411 -11.145 1.00 0.00 O ATOM 1014 CB SER A 71 4.431 24.238 -12.799 1.00 0.00 C ATOM 1015 OG SER A 71 4.402 22.991 -13.472 1.00 0.00 O ATOM 0 H SER A 71 3.880 22.657 -10.988 1.00 0.00 H new ATOM 0 HA SER A 71 6.287 23.907 -11.767 1.00 0.00 H new ATOM 0 HB2 SER A 71 3.414 24.551 -12.562 1.00 0.00 H new ATOM 0 HB3 SER A 71 4.854 24.999 -13.455 1.00 0.00 H new ATOM 0 HG SER A 71 3.792 22.382 -13.006 1.00 0.00 H new ATOM 1021 N LEU A 72 4.385 25.604 -9.779 1.00 0.00 N ATOM 1022 CA LEU A 72 4.270 26.836 -9.006 1.00 0.00 C ATOM 1023 C LEU A 72 5.377 26.929 -7.961 1.00 0.00 C ATOM 1024 O LEU A 72 6.076 27.938 -7.869 1.00 0.00 O ATOM 1025 CB LEU A 72 2.902 26.908 -8.325 1.00 0.00 C ATOM 1026 CG LEU A 72 2.707 28.053 -7.331 1.00 0.00 C ATOM 1027 CD1 LEU A 72 2.375 29.345 -8.063 1.00 0.00 C ATOM 1028 CD2 LEU A 72 1.613 27.710 -6.330 1.00 0.00 C ATOM 0 H LEU A 72 3.763 24.855 -9.474 1.00 0.00 H new ATOM 0 HA LEU A 72 4.372 27.677 -9.692 1.00 0.00 H new ATOM 0 HB2 LEU A 72 2.138 26.990 -9.098 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.728 25.967 -7.803 1.00 0.00 H new ATOM 0 HG LEU A 72 3.640 28.197 -6.785 1.00 0.00 H new ATOM 0 HD11 LEU A 72 2.240 30.149 -7.339 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.191 29.600 -8.740 1.00 0.00 H new ATOM 0 HD13 LEU A 72 1.457 29.213 -8.635 1.00 0.00 H new ATOM 0 HD21 LEU A 72 1.488 28.536 -5.630 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.676 27.538 -6.860 1.00 0.00 H new ATOM 0 HD23 LEU A 72 1.890 26.809 -5.782 1.00 0.00 H new ATOM 1040 N VAL A 73 5.532 25.868 -7.175 1.00 0.00 N ATOM 1041 CA VAL A 73 6.556 25.828 -6.138 1.00 0.00 C ATOM 1042 C VAL A 73 7.951 25.964 -6.738 1.00 0.00 C ATOM 1043 O VAL A 73 8.875 26.450 -6.085 1.00 0.00 O ATOM 1044 CB VAL A 73 6.483 24.520 -5.328 1.00 0.00 C ATOM 1045 CG1 VAL A 73 5.217 24.483 -4.486 1.00 0.00 C ATOM 1046 CG2 VAL A 73 6.553 23.315 -6.254 1.00 0.00 C ATOM 0 H VAL A 73 4.961 25.025 -7.237 1.00 0.00 H new ATOM 0 HA VAL A 73 6.366 26.670 -5.473 1.00 0.00 H new ATOM 0 HB VAL A 73 7.339 24.482 -4.655 1.00 0.00 H new ATOM 0 HG11 VAL A 73 5.183 23.552 -3.921 1.00 0.00 H new ATOM 0 HG12 VAL A 73 5.214 25.327 -3.796 1.00 0.00 H new ATOM 0 HG13 VAL A 73 4.345 24.544 -5.137 1.00 0.00 H new ATOM 0 HG21 VAL A 73 6.500 22.400 -5.665 1.00 0.00 H new ATOM 0 HG22 VAL A 73 5.718 23.345 -6.954 1.00 0.00 H new ATOM 0 HG23 VAL A 73 7.491 23.336 -6.808 1.00 0.00 H new ATOM 1056 N THR A 74 8.098 25.532 -7.987 1.00 0.00 N ATOM 1057 CA THR A 74 9.380 25.605 -8.675 1.00 0.00 C ATOM 1058 C THR A 74 9.744 27.048 -9.007 1.00 0.00 C ATOM 1059 O THR A 74 10.850 27.500 -8.715 1.00 0.00 O ATOM 1060 CB THR A 74 9.367 24.779 -9.975 1.00 0.00 C ATOM 1061 OG1 THR A 74 8.079 24.859 -10.595 1.00 0.00 O ATOM 1062 CG2 THR A 74 9.711 23.323 -9.694 1.00 0.00 C ATOM 0 H THR A 74 7.344 25.128 -8.542 1.00 0.00 H new ATOM 0 HA THR A 74 10.127 25.191 -7.997 1.00 0.00 H new ATOM 0 HB THR A 74 10.119 25.191 -10.648 1.00 0.00 H new ATOM 0 HG1 THR A 74 7.475 24.208 -10.181 1.00 0.00 H new ATOM 0 HG21 THR A 74 9.696 22.759 -10.627 1.00 0.00 H new ATOM 0 HG22 THR A 74 10.705 23.263 -9.250 1.00 0.00 H new ATOM 0 HG23 THR A 74 8.979 22.903 -9.004 1.00 0.00 H new ATOM 1070 N GLU A 75 8.807 27.764 -9.619 1.00 0.00 N ATOM 1071 CA GLU A 75 9.031 29.156 -9.991 1.00 0.00 C ATOM 1072 C GLU A 75 9.236 30.024 -8.752 1.00 0.00 C ATOM 1073 O GLU A 75 9.809 31.111 -8.831 1.00 0.00 O ATOM 1074 CB GLU A 75 7.851 29.686 -10.808 1.00 0.00 C ATOM 1075 CG GLU A 75 7.685 29.000 -12.154 1.00 0.00 C ATOM 1076 CD GLU A 75 8.830 29.295 -13.104 1.00 0.00 C ATOM 1077 OE1 GLU A 75 9.547 30.292 -12.876 1.00 0.00 O ATOM 1078 OE2 GLU A 75 9.008 28.530 -14.074 1.00 0.00 O ATOM 0 H GLU A 75 7.886 27.404 -9.868 1.00 0.00 H new ATOM 0 HA GLU A 75 9.934 29.201 -10.600 1.00 0.00 H new ATOM 0 HB2 GLU A 75 6.935 29.561 -10.231 1.00 0.00 H new ATOM 0 HB3 GLU A 75 7.983 30.756 -10.969 1.00 0.00 H new ATOM 0 HG2 GLU A 75 7.612 27.923 -12.002 1.00 0.00 H new ATOM 0 HG3 GLU A 75 6.748 29.322 -12.609 1.00 0.00 H new ATOM 1085 N TRP A 76 8.764 29.535 -7.611 1.00 0.00 N ATOM 1086 CA TRP A 76 8.895 30.266 -6.355 1.00 0.00 C ATOM 1087 C TRP A 76 10.286 30.079 -5.759 1.00 0.00 C ATOM 1088 O TRP A 76 10.921 31.041 -5.328 1.00 0.00 O ATOM 1089 CB TRP A 76 7.832 29.801 -5.358 1.00 0.00 C ATOM 1090 CG TRP A 76 6.717 30.785 -5.176 1.00 0.00 C ATOM 1091 CD1 TRP A 76 5.378 30.517 -5.187 1.00 0.00 C ATOM 1092 CD2 TRP A 76 6.845 32.194 -4.959 1.00 0.00 C ATOM 1093 NE1 TRP A 76 4.665 31.675 -4.989 1.00 0.00 N ATOM 1094 CE2 TRP A 76 5.542 32.718 -4.846 1.00 0.00 C ATOM 1095 CE3 TRP A 76 7.932 33.064 -4.846 1.00 0.00 C ATOM 1096 CZ2 TRP A 76 5.301 34.072 -4.627 1.00 0.00 C ATOM 1097 CZ3 TRP A 76 7.691 34.408 -4.629 1.00 0.00 C ATOM 1098 CH2 TRP A 76 6.384 34.901 -4.521 1.00 0.00 C ATOM 0 H TRP A 76 8.288 28.637 -7.529 1.00 0.00 H new ATOM 0 HA TRP A 76 8.749 31.326 -6.563 1.00 0.00 H new ATOM 0 HB2 TRP A 76 7.417 28.852 -5.697 1.00 0.00 H new ATOM 0 HB3 TRP A 76 8.305 29.616 -4.393 1.00 0.00 H new ATOM 0 HD1 TRP A 76 4.943 29.539 -5.330 1.00 0.00 H new ATOM 0 HE1 TRP A 76 3.648 31.746 -4.954 1.00 0.00 H new ATOM 0 HE3 TRP A 76 8.943 32.693 -4.927 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 4.294 34.454 -4.544 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 8.524 35.089 -4.541 1.00 0.00 H new ATOM 0 HH2 TRP A 76 6.228 35.956 -4.351 1.00 0.00 H new ATOM 1109 N VAL A 77 10.754 28.835 -5.737 1.00 0.00 N ATOM 1110 CA VAL A 77 12.071 28.523 -5.195 1.00 0.00 C ATOM 1111 C VAL A 77 13.177 29.095 -6.074 1.00 0.00 C ATOM 1112 O VAL A 77 14.269 29.403 -5.596 1.00 0.00 O ATOM 1113 CB VAL A 77 12.274 27.003 -5.056 1.00 0.00 C ATOM 1114 CG1 VAL A 77 11.304 26.424 -4.038 1.00 0.00 C ATOM 1115 CG2 VAL A 77 12.115 26.319 -6.406 1.00 0.00 C ATOM 0 H VAL A 77 10.240 28.027 -6.088 1.00 0.00 H new ATOM 0 HA VAL A 77 12.124 28.981 -4.207 1.00 0.00 H new ATOM 0 HB VAL A 77 13.288 26.821 -4.699 1.00 0.00 H new ATOM 0 HG11 VAL A 77 11.463 25.349 -3.954 1.00 0.00 H new ATOM 0 HG12 VAL A 77 11.472 26.892 -3.068 1.00 0.00 H new ATOM 0 HG13 VAL A 77 10.281 26.615 -4.361 1.00 0.00 H new ATOM 0 HG21 VAL A 77 12.262 25.245 -6.289 1.00 0.00 H new ATOM 0 HG22 VAL A 77 11.114 26.508 -6.794 1.00 0.00 H new ATOM 0 HG23 VAL A 77 12.855 26.713 -7.103 1.00 0.00 H new ATOM 1125 N LYS A 78 12.887 29.236 -7.364 1.00 0.00 N ATOM 1126 CA LYS A 78 13.856 29.773 -8.312 1.00 0.00 C ATOM 1127 C LYS A 78 14.230 31.207 -7.954 1.00 0.00 C ATOM 1128 O LYS A 78 13.548 32.153 -8.346 1.00 0.00 O ATOM 1129 CB LYS A 78 13.291 29.721 -9.733 1.00 0.00 C ATOM 1130 CG LYS A 78 13.855 28.586 -10.571 1.00 0.00 C ATOM 1131 CD LYS A 78 14.269 29.065 -11.952 1.00 0.00 C ATOM 1132 CE LYS A 78 15.434 30.041 -11.877 1.00 0.00 C ATOM 1133 NZ LYS A 78 16.272 30.000 -13.108 1.00 0.00 N ATOM 0 H LYS A 78 11.988 28.986 -7.776 1.00 0.00 H new ATOM 0 HA LYS A 78 14.755 29.159 -8.262 1.00 0.00 H new ATOM 0 HB2 LYS A 78 12.207 29.619 -9.680 1.00 0.00 H new ATOM 0 HB3 LYS A 78 13.498 30.668 -10.232 1.00 0.00 H new ATOM 0 HG2 LYS A 78 14.715 28.150 -10.063 1.00 0.00 H new ATOM 0 HG3 LYS A 78 13.108 27.798 -10.667 1.00 0.00 H new ATOM 0 HD2 LYS A 78 14.549 28.209 -12.566 1.00 0.00 H new ATOM 0 HD3 LYS A 78 13.421 29.545 -12.441 1.00 0.00 H new ATOM 0 HE2 LYS A 78 15.052 31.052 -11.731 1.00 0.00 H new ATOM 0 HE3 LYS A 78 16.051 29.805 -11.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 17.055 30.679 -13.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 16.657 29.042 -13.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 15.690 30.250 -13.933 1.00 0.00 H new ATOM 1147 N GLY A 79 15.319 31.361 -7.207 1.00 0.00 N ATOM 1148 CA GLY A 79 15.766 32.684 -6.811 1.00 0.00 C ATOM 1149 C GLY A 79 15.623 32.921 -5.320 1.00 0.00 C ATOM 1150 O GLY A 79 16.078 33.940 -4.799 1.00 0.00 O ATOM 0 H GLY A 79 15.900 30.593 -6.869 1.00 0.00 H new ATOM 0 HA2 GLY A 79 16.810 32.813 -7.098 1.00 0.00 H new ATOM 0 HA3 GLY A 79 15.191 33.436 -7.352 1.00 0.00 H new ATOM 1154 N LYS A 80 14.989 31.979 -4.631 1.00 0.00 N ATOM 1155 CA LYS A 80 14.787 32.089 -3.191 1.00 0.00 C ATOM 1156 C LYS A 80 15.892 31.365 -2.429 1.00 0.00 C ATOM 1157 O LYS A 80 16.597 30.525 -2.989 1.00 0.00 O ATOM 1158 CB LYS A 80 13.423 31.514 -2.801 1.00 0.00 C ATOM 1159 CG LYS A 80 12.511 32.520 -2.121 1.00 0.00 C ATOM 1160 CD LYS A 80 11.799 33.401 -3.133 1.00 0.00 C ATOM 1161 CE LYS A 80 10.520 33.990 -2.558 1.00 0.00 C ATOM 1162 NZ LYS A 80 10.372 35.433 -2.898 1.00 0.00 N ATOM 0 H LYS A 80 14.606 31.130 -5.047 1.00 0.00 H new ATOM 0 HA LYS A 80 14.819 33.146 -2.925 1.00 0.00 H new ATOM 0 HB2 LYS A 80 12.929 31.135 -3.695 1.00 0.00 H new ATOM 0 HB3 LYS A 80 13.573 30.664 -2.135 1.00 0.00 H new ATOM 0 HG2 LYS A 80 11.775 31.993 -1.515 1.00 0.00 H new ATOM 0 HG3 LYS A 80 13.095 33.142 -1.443 1.00 0.00 H new ATOM 0 HD2 LYS A 80 12.463 34.207 -3.446 1.00 0.00 H new ATOM 0 HD3 LYS A 80 11.564 32.817 -4.023 1.00 0.00 H new ATOM 0 HE2 LYS A 80 9.662 33.437 -2.940 1.00 0.00 H new ATOM 0 HE3 LYS A 80 10.520 33.870 -1.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 9.472 35.789 -2.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 11.160 35.970 -2.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 10.380 35.549 -3.932 1.00 0.00 H new ATOM 1176 N SER A 81 16.037 31.694 -1.150 1.00 0.00 N ATOM 1177 CA SER A 81 17.058 31.077 -0.312 1.00 0.00 C ATOM 1178 C SER A 81 16.588 29.722 0.208 1.00 0.00 C ATOM 1179 O SER A 81 15.565 29.195 -0.233 1.00 0.00 O ATOM 1180 CB SER A 81 17.408 31.993 0.862 1.00 0.00 C ATOM 1181 OG SER A 81 16.316 32.113 1.758 1.00 0.00 O ATOM 0 H SER A 81 15.460 32.385 -0.671 1.00 0.00 H new ATOM 0 HA SER A 81 17.949 30.924 -0.922 1.00 0.00 H new ATOM 0 HB2 SER A 81 18.275 31.597 1.391 1.00 0.00 H new ATOM 0 HB3 SER A 81 17.686 32.978 0.488 1.00 0.00 H new ATOM 0 HG SER A 81 16.076 33.058 1.857 1.00 0.00 H new ATOM 1187 N LEU A 82 17.341 29.162 1.148 1.00 0.00 N ATOM 1188 CA LEU A 82 17.003 27.867 1.729 1.00 0.00 C ATOM 1189 C LEU A 82 15.889 28.009 2.761 1.00 0.00 C ATOM 1190 O LEU A 82 14.961 27.201 2.802 1.00 0.00 O ATOM 1191 CB LEU A 82 18.238 27.239 2.378 1.00 0.00 C ATOM 1192 CG LEU A 82 19.499 27.194 1.515 1.00 0.00 C ATOM 1193 CD1 LEU A 82 20.742 27.357 2.377 1.00 0.00 C ATOM 1194 CD2 LEU A 82 19.561 25.892 0.729 1.00 0.00 C ATOM 0 H LEU A 82 18.190 29.584 1.524 1.00 0.00 H new ATOM 0 HA LEU A 82 16.651 27.217 0.928 1.00 0.00 H new ATOM 0 HB2 LEU A 82 18.465 27.791 3.290 1.00 0.00 H new ATOM 0 HB3 LEU A 82 17.989 26.220 2.676 1.00 0.00 H new ATOM 0 HG LEU A 82 19.461 28.022 0.807 1.00 0.00 H new ATOM 0 HD11 LEU A 82 21.630 27.322 1.746 1.00 0.00 H new ATOM 0 HD12 LEU A 82 20.702 28.315 2.895 1.00 0.00 H new ATOM 0 HD13 LEU A 82 20.786 26.550 3.109 1.00 0.00 H new ATOM 0 HD21 LEU A 82 20.465 25.877 0.120 1.00 0.00 H new ATOM 0 HD22 LEU A 82 19.575 25.050 1.421 1.00 0.00 H new ATOM 0 HD23 LEU A 82 18.687 25.815 0.082 1.00 0.00 H new ATOM 1206 N ASP A 83 15.986 29.041 3.592 1.00 0.00 N ATOM 1207 CA ASP A 83 14.985 29.291 4.622 1.00 0.00 C ATOM 1208 C ASP A 83 13.675 29.768 4.003 1.00 0.00 C ATOM 1209 O ASP A 83 12.594 29.350 4.415 1.00 0.00 O ATOM 1210 CB ASP A 83 15.498 30.328 5.622 1.00 0.00 C ATOM 1211 CG ASP A 83 16.173 29.691 6.821 1.00 0.00 C ATOM 1212 OD1 ASP A 83 15.673 28.653 7.301 1.00 0.00 O ATOM 1213 OD2 ASP A 83 17.202 30.231 7.280 1.00 0.00 O ATOM 0 H ASP A 83 16.748 29.718 3.572 1.00 0.00 H new ATOM 0 HA ASP A 83 14.798 28.354 5.146 1.00 0.00 H new ATOM 0 HB2 ASP A 83 16.203 30.993 5.122 1.00 0.00 H new ATOM 0 HB3 ASP A 83 14.665 30.944 5.962 1.00 0.00 H new ATOM 1218 N GLU A 84 13.781 30.648 3.011 1.00 0.00 N ATOM 1219 CA GLU A 84 12.605 31.183 2.337 1.00 0.00 C ATOM 1220 C GLU A 84 11.726 30.058 1.799 1.00 0.00 C ATOM 1221 O GLU A 84 10.544 29.967 2.128 1.00 0.00 O ATOM 1222 CB GLU A 84 13.022 32.110 1.193 1.00 0.00 C ATOM 1223 CG GLU A 84 13.176 33.563 1.612 1.00 0.00 C ATOM 1224 CD GLU A 84 13.885 33.714 2.944 1.00 0.00 C ATOM 1225 OE1 GLU A 84 13.241 33.478 3.988 1.00 0.00 O ATOM 1226 OE2 GLU A 84 15.082 34.067 2.943 1.00 0.00 O ATOM 0 H GLU A 84 14.669 31.004 2.657 1.00 0.00 H new ATOM 0 HA GLU A 84 12.029 31.753 3.066 1.00 0.00 H new ATOM 0 HB2 GLU A 84 13.966 31.758 0.778 1.00 0.00 H new ATOM 0 HB3 GLU A 84 12.280 32.047 0.397 1.00 0.00 H new ATOM 0 HG2 GLU A 84 13.733 34.101 0.845 1.00 0.00 H new ATOM 0 HG3 GLU A 84 12.191 34.026 1.674 1.00 0.00 H new ATOM 1233 N ALA A 85 12.314 29.202 0.969 1.00 0.00 N ATOM 1234 CA ALA A 85 11.586 28.081 0.386 1.00 0.00 C ATOM 1235 C ALA A 85 11.069 27.140 1.469 1.00 0.00 C ATOM 1236 O ALA A 85 9.932 26.672 1.405 1.00 0.00 O ATOM 1237 CB ALA A 85 12.475 27.327 -0.592 1.00 0.00 C ATOM 0 H ALA A 85 13.292 29.263 0.685 1.00 0.00 H new ATOM 0 HA ALA A 85 10.726 28.478 -0.154 1.00 0.00 H new ATOM 0 HB1 ALA A 85 11.919 26.493 -1.020 1.00 0.00 H new ATOM 0 HB2 ALA A 85 12.791 28.000 -1.389 1.00 0.00 H new ATOM 0 HB3 ALA A 85 13.352 26.948 -0.068 1.00 0.00 H new ATOM 1243 N GLN A 86 11.910 26.867 2.460 1.00 0.00 N ATOM 1244 CA GLN A 86 11.537 25.980 3.556 1.00 0.00 C ATOM 1245 C GLN A 86 10.439 26.603 4.411 1.00 0.00 C ATOM 1246 O GLN A 86 9.754 25.909 5.161 1.00 0.00 O ATOM 1247 CB GLN A 86 12.757 25.663 4.422 1.00 0.00 C ATOM 1248 CG GLN A 86 12.620 24.376 5.219 1.00 0.00 C ATOM 1249 CD GLN A 86 12.602 24.614 6.716 1.00 0.00 C ATOM 1250 OE1 GLN A 86 13.619 24.460 7.393 1.00 0.00 O ATOM 1251 NE2 GLN A 86 11.443 24.994 7.241 1.00 0.00 N ATOM 0 H GLN A 86 12.854 27.247 2.527 1.00 0.00 H new ATOM 0 HA GLN A 86 11.156 25.054 3.126 1.00 0.00 H new ATOM 0 HB2 GLN A 86 13.637 25.593 3.783 1.00 0.00 H new ATOM 0 HB3 GLN A 86 12.928 26.490 5.111 1.00 0.00 H new ATOM 0 HG2 GLN A 86 11.702 23.867 4.925 1.00 0.00 H new ATOM 0 HG3 GLN A 86 13.447 23.710 4.971 1.00 0.00 H new ATOM 0 HE21 GLN A 86 10.625 25.109 6.642 1.00 0.00 H new ATOM 0 HE22 GLN A 86 11.370 25.171 8.243 1.00 0.00 H new ATOM 1260 N ALA A 87 10.277 27.917 4.292 1.00 0.00 N ATOM 1261 CA ALA A 87 9.262 28.634 5.053 1.00 0.00 C ATOM 1262 C ALA A 87 7.895 28.520 4.387 1.00 0.00 C ATOM 1263 O ALA A 87 6.862 28.707 5.032 1.00 0.00 O ATOM 1264 CB ALA A 87 9.654 30.095 5.211 1.00 0.00 C ATOM 0 H ALA A 87 10.836 28.506 3.675 1.00 0.00 H new ATOM 0 HA ALA A 87 9.195 28.179 6.041 1.00 0.00 H new ATOM 0 HB1 ALA A 87 8.886 30.618 5.781 1.00 0.00 H new ATOM 0 HB2 ALA A 87 10.606 30.161 5.738 1.00 0.00 H new ATOM 0 HB3 ALA A 87 9.751 30.554 4.227 1.00 0.00 H new ATOM 1270 N ILE A 88 7.895 28.214 3.094 1.00 0.00 N ATOM 1271 CA ILE A 88 6.655 28.075 2.342 1.00 0.00 C ATOM 1272 C ILE A 88 5.684 27.137 3.051 1.00 0.00 C ATOM 1273 O ILE A 88 6.080 26.097 3.578 1.00 0.00 O ATOM 1274 CB ILE A 88 6.915 27.546 0.919 1.00 0.00 C ATOM 1275 CG1 ILE A 88 7.827 28.508 0.153 1.00 0.00 C ATOM 1276 CG2 ILE A 88 5.601 27.350 0.178 1.00 0.00 C ATOM 1277 CD1 ILE A 88 8.259 27.983 -1.198 1.00 0.00 C ATOM 0 H ILE A 88 8.741 28.058 2.545 1.00 0.00 H new ATOM 0 HA ILE A 88 6.214 29.069 2.276 1.00 0.00 H new ATOM 0 HB ILE A 88 7.415 26.580 0.992 1.00 0.00 H new ATOM 0 HG12 ILE A 88 7.308 29.457 0.016 1.00 0.00 H new ATOM 0 HG13 ILE A 88 8.713 28.713 0.754 1.00 0.00 H new ATOM 0 HG21 ILE A 88 5.802 26.976 -0.826 1.00 0.00 H new ATOM 0 HG22 ILE A 88 4.983 26.631 0.716 1.00 0.00 H new ATOM 0 HG23 ILE A 88 5.075 28.302 0.112 1.00 0.00 H new ATOM 0 HD11 ILE A 88 8.903 28.716 -1.684 1.00 0.00 H new ATOM 0 HD12 ILE A 88 8.806 27.049 -1.068 1.00 0.00 H new ATOM 0 HD13 ILE A 88 7.380 27.805 -1.817 1.00 0.00 H new ATOM 1289 N LYS A 89 4.408 27.509 3.058 1.00 0.00 N ATOM 1290 CA LYS A 89 3.378 26.701 3.699 1.00 0.00 C ATOM 1291 C LYS A 89 2.413 26.130 2.665 1.00 0.00 C ATOM 1292 O LYS A 89 2.042 26.808 1.707 1.00 0.00 O ATOM 1293 CB LYS A 89 2.608 27.537 4.723 1.00 0.00 C ATOM 1294 CG LYS A 89 3.460 28.002 5.892 1.00 0.00 C ATOM 1295 CD LYS A 89 4.076 29.365 5.625 1.00 0.00 C ATOM 1296 CE LYS A 89 3.125 30.490 6.002 1.00 0.00 C ATOM 1297 NZ LYS A 89 2.790 30.472 7.453 1.00 0.00 N ATOM 0 H LYS A 89 4.063 28.366 2.626 1.00 0.00 H new ATOM 0 HA LYS A 89 3.868 25.872 4.210 1.00 0.00 H new ATOM 0 HB2 LYS A 89 2.184 28.408 4.224 1.00 0.00 H new ATOM 0 HB3 LYS A 89 1.772 26.950 5.104 1.00 0.00 H new ATOM 0 HG2 LYS A 89 2.849 28.048 6.793 1.00 0.00 H new ATOM 0 HG3 LYS A 89 4.250 27.275 6.080 1.00 0.00 H new ATOM 0 HD2 LYS A 89 5.002 29.464 6.192 1.00 0.00 H new ATOM 0 HD3 LYS A 89 4.338 29.447 4.570 1.00 0.00 H new ATOM 0 HE2 LYS A 89 3.577 31.448 5.746 1.00 0.00 H new ATOM 0 HE3 LYS A 89 2.209 30.403 5.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 2.533 31.431 7.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 1.989 29.829 7.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 3.614 30.143 7.995 1.00 0.00 H new ATOM 1311 N ASN A 90 2.009 24.880 2.865 1.00 0.00 N ATOM 1312 CA ASN A 90 1.086 24.218 1.950 1.00 0.00 C ATOM 1313 C ASN A 90 -0.119 25.108 1.656 1.00 0.00 C ATOM 1314 O ASN A 90 -0.552 25.227 0.509 1.00 0.00 O ATOM 1315 CB ASN A 90 0.618 22.886 2.539 1.00 0.00 C ATOM 1316 CG ASN A 90 -0.085 23.058 3.872 1.00 0.00 C ATOM 1317 OD1 ASN A 90 0.556 23.116 4.921 1.00 0.00 O ATOM 1318 ND2 ASN A 90 -1.410 23.139 3.835 1.00 0.00 N ATOM 0 H ASN A 90 2.306 24.305 3.653 1.00 0.00 H new ATOM 0 HA ASN A 90 1.613 24.029 1.015 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -0.057 22.398 1.836 1.00 0.00 H new ATOM 0 HB3 ASN A 90 1.477 22.227 2.667 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -1.938 23.254 4.700 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -1.899 23.086 2.942 1.00 0.00 H new ATOM 1325 N THR A 91 -0.656 25.732 2.700 1.00 0.00 N ATOM 1326 CA THR A 91 -1.810 26.610 2.554 1.00 0.00 C ATOM 1327 C THR A 91 -1.593 27.622 1.435 1.00 0.00 C ATOM 1328 O THR A 91 -2.530 27.986 0.724 1.00 0.00 O ATOM 1329 CB THR A 91 -2.110 27.365 3.863 1.00 0.00 C ATOM 1330 OG1 THR A 91 -3.164 28.311 3.652 1.00 0.00 O ATOM 1331 CG2 THR A 91 -0.869 28.085 4.369 1.00 0.00 C ATOM 0 H THR A 91 -0.310 25.645 3.656 1.00 0.00 H new ATOM 0 HA THR A 91 -2.661 25.975 2.306 1.00 0.00 H new ATOM 0 HB THR A 91 -2.420 26.638 4.613 1.00 0.00 H new ATOM 0 HG1 THR A 91 -3.350 28.786 4.489 1.00 0.00 H new ATOM 0 HG21 THR A 91 -1.105 28.611 5.294 1.00 0.00 H new ATOM 0 HG22 THR A 91 -0.078 27.359 4.556 1.00 0.00 H new ATOM 0 HG23 THR A 91 -0.533 28.802 3.620 1.00 0.00 H new ATOM 1339 N ASP A 92 -0.353 28.072 1.283 1.00 0.00 N ATOM 1340 CA ASP A 92 -0.013 29.042 0.248 1.00 0.00 C ATOM 1341 C ASP A 92 -0.135 28.421 -1.140 1.00 0.00 C ATOM 1342 O ASP A 92 -0.579 29.072 -2.085 1.00 0.00 O ATOM 1343 CB ASP A 92 1.407 29.570 0.461 1.00 0.00 C ATOM 1344 CG ASP A 92 1.579 30.989 -0.046 1.00 0.00 C ATOM 1345 OD1 ASP A 92 0.756 31.853 0.322 1.00 0.00 O ATOM 1346 OD2 ASP A 92 2.535 31.234 -0.810 1.00 0.00 O ATOM 0 H ASP A 92 0.434 27.781 1.863 1.00 0.00 H new ATOM 0 HA ASP A 92 -0.716 29.872 0.318 1.00 0.00 H new ATOM 0 HB2 ASP A 92 1.649 29.535 1.523 1.00 0.00 H new ATOM 0 HB3 ASP A 92 2.115 28.917 -0.049 1.00 0.00 H new ATOM 1351 N ILE A 93 0.264 27.158 -1.254 1.00 0.00 N ATOM 1352 CA ILE A 93 0.199 26.450 -2.526 1.00 0.00 C ATOM 1353 C ILE A 93 -1.223 25.988 -2.827 1.00 0.00 C ATOM 1354 O ILE A 93 -1.595 25.805 -3.985 1.00 0.00 O ATOM 1355 CB ILE A 93 1.137 25.228 -2.539 1.00 0.00 C ATOM 1356 CG1 ILE A 93 2.592 25.673 -2.378 1.00 0.00 C ATOM 1357 CG2 ILE A 93 0.959 24.437 -3.826 1.00 0.00 C ATOM 1358 CD1 ILE A 93 3.002 25.890 -0.938 1.00 0.00 C ATOM 0 H ILE A 93 0.635 26.605 -0.481 1.00 0.00 H new ATOM 0 HA ILE A 93 0.520 27.153 -3.295 1.00 0.00 H new ATOM 0 HB ILE A 93 0.879 24.582 -1.700 1.00 0.00 H new ATOM 0 HG12 ILE A 93 3.244 24.922 -2.824 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.744 26.598 -2.934 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.629 23.577 -3.820 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.073 24.093 -3.902 1.00 0.00 H new ATOM 0 HG23 ILE A 93 1.193 25.073 -4.679 1.00 0.00 H new ATOM 0 HD11 ILE A 93 4.045 26.204 -0.900 1.00 0.00 H new ATOM 0 HD12 ILE A 93 2.374 26.662 -0.493 1.00 0.00 H new ATOM 0 HD13 ILE A 93 2.882 24.960 -0.382 1.00 0.00 H new ATOM 1370 N ALA A 94 -2.014 25.804 -1.775 1.00 0.00 N ATOM 1371 CA ALA A 94 -3.396 25.367 -1.925 1.00 0.00 C ATOM 1372 C ALA A 94 -4.259 26.474 -2.522 1.00 0.00 C ATOM 1373 O ALA A 94 -4.953 26.264 -3.516 1.00 0.00 O ATOM 1374 CB ALA A 94 -3.959 24.922 -0.583 1.00 0.00 C ATOM 0 H ALA A 94 -1.721 25.951 -0.809 1.00 0.00 H new ATOM 0 HA ALA A 94 -3.411 24.520 -2.611 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.992 24.598 -0.711 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -3.365 24.094 -0.196 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -3.924 25.754 0.120 1.00 0.00 H new ATOM 1380 N GLU A 95 -4.211 27.652 -1.908 1.00 0.00 N ATOM 1381 CA GLU A 95 -4.990 28.791 -2.379 1.00 0.00 C ATOM 1382 C GLU A 95 -4.386 29.374 -3.654 1.00 0.00 C ATOM 1383 O GLU A 95 -5.091 29.962 -4.473 1.00 0.00 O ATOM 1384 CB GLU A 95 -5.064 29.870 -1.297 1.00 0.00 C ATOM 1385 CG GLU A 95 -5.456 29.335 0.070 1.00 0.00 C ATOM 1386 CD GLU A 95 -6.845 28.726 0.082 1.00 0.00 C ATOM 1387 OE1 GLU A 95 -7.774 29.355 -0.466 1.00 0.00 O ATOM 1388 OE2 GLU A 95 -7.002 27.619 0.639 1.00 0.00 O ATOM 0 H GLU A 95 -3.641 27.842 -1.084 1.00 0.00 H new ATOM 0 HA GLU A 95 -5.998 28.441 -2.602 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -4.095 30.363 -1.221 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -5.785 30.629 -1.601 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -4.731 28.584 0.383 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -5.412 30.144 0.799 1.00 0.00 H new ATOM 1395 N GLU A 96 -3.077 29.205 -3.812 1.00 0.00 N ATOM 1396 CA GLU A 96 -2.379 29.715 -4.986 1.00 0.00 C ATOM 1397 C GLU A 96 -3.067 29.261 -6.269 1.00 0.00 C ATOM 1398 O GLU A 96 -3.287 30.055 -7.185 1.00 0.00 O ATOM 1399 CB GLU A 96 -0.921 29.248 -4.982 1.00 0.00 C ATOM 1400 CG GLU A 96 0.066 30.339 -4.603 1.00 0.00 C ATOM 1401 CD GLU A 96 0.458 31.207 -5.782 1.00 0.00 C ATOM 1402 OE1 GLU A 96 -0.275 31.199 -6.794 1.00 0.00 O ATOM 1403 OE2 GLU A 96 1.497 31.895 -5.694 1.00 0.00 O ATOM 0 H GLU A 96 -2.479 28.720 -3.143 1.00 0.00 H new ATOM 0 HA GLU A 96 -2.405 30.804 -4.948 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -0.816 28.417 -4.285 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -0.667 28.868 -5.972 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -0.371 30.965 -3.825 1.00 0.00 H new ATOM 0 HG3 GLU A 96 0.961 29.883 -4.179 1.00 0.00 H new ATOM 1410 N LEU A 97 -3.405 27.977 -6.330 1.00 0.00 N ATOM 1411 CA LEU A 97 -4.068 27.415 -7.501 1.00 0.00 C ATOM 1412 C LEU A 97 -5.502 27.011 -7.173 1.00 0.00 C ATOM 1413 O LEU A 97 -6.240 26.548 -8.042 1.00 0.00 O ATOM 1414 CB LEU A 97 -3.290 26.204 -8.020 1.00 0.00 C ATOM 1415 CG LEU A 97 -1.821 26.447 -8.364 1.00 0.00 C ATOM 1416 CD1 LEU A 97 -1.029 25.152 -8.272 1.00 0.00 C ATOM 1417 CD2 LEU A 97 -1.691 27.056 -9.752 1.00 0.00 C ATOM 0 H LEU A 97 -3.231 27.306 -5.582 1.00 0.00 H new ATOM 0 HA LEU A 97 -4.094 28.181 -8.276 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -3.341 25.416 -7.269 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -3.794 25.828 -8.911 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.411 27.152 -7.640 1.00 0.00 H new ATOM 0 HD11 LEU A 97 0.015 25.345 -8.520 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -1.094 24.757 -7.258 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -1.440 24.424 -8.972 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -0.638 27.222 -9.979 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -2.119 26.376 -10.489 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -2.223 28.007 -9.783 1.00 0.00 H new ATOM 1429 N GLU A 98 -5.889 27.191 -5.914 1.00 0.00 N ATOM 1430 CA GLU A 98 -7.235 26.846 -5.473 1.00 0.00 C ATOM 1431 C GLU A 98 -7.589 25.416 -5.871 1.00 0.00 C ATOM 1432 O GLU A 98 -8.542 25.184 -6.615 1.00 0.00 O ATOM 1433 CB GLU A 98 -8.256 27.819 -6.067 1.00 0.00 C ATOM 1434 CG GLU A 98 -8.050 29.260 -5.629 1.00 0.00 C ATOM 1435 CD GLU A 98 -9.353 30.028 -5.519 1.00 0.00 C ATOM 1436 OE1 GLU A 98 -10.053 30.159 -6.545 1.00 0.00 O ATOM 1437 OE2 GLU A 98 -9.672 30.498 -4.407 1.00 0.00 O ATOM 0 H GLU A 98 -5.290 27.573 -5.182 1.00 0.00 H new ATOM 0 HA GLU A 98 -7.263 26.920 -4.386 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -8.204 27.768 -7.155 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -9.258 27.501 -5.780 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -7.542 29.274 -4.665 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -7.395 29.762 -6.341 1.00 0.00 H new ATOM 1444 N LEU A 99 -6.813 24.461 -5.371 1.00 0.00 N ATOM 1445 CA LEU A 99 -7.042 23.052 -5.674 1.00 0.00 C ATOM 1446 C LEU A 99 -8.429 22.615 -5.213 1.00 0.00 C ATOM 1447 O LEU A 99 -9.006 23.177 -4.283 1.00 0.00 O ATOM 1448 CB LEU A 99 -5.973 22.186 -5.006 1.00 0.00 C ATOM 1449 CG LEU A 99 -4.924 21.576 -5.936 1.00 0.00 C ATOM 1450 CD1 LEU A 99 -4.006 22.657 -6.486 1.00 0.00 C ATOM 1451 CD2 LEU A 99 -4.119 20.510 -5.208 1.00 0.00 C ATOM 0 H LEU A 99 -6.020 24.636 -4.754 1.00 0.00 H new ATOM 0 HA LEU A 99 -6.981 22.923 -6.755 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -5.459 22.791 -4.259 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -6.471 21.376 -4.473 1.00 0.00 H new ATOM 0 HG LEU A 99 -5.439 21.104 -6.773 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -3.266 22.205 -7.146 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -4.595 23.384 -7.045 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -3.499 23.158 -5.661 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -3.378 20.087 -5.886 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -3.614 20.957 -4.351 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -4.788 19.721 -4.864 1.00 0.00 H new ATOM 1463 N PRO A 100 -8.976 21.586 -5.878 1.00 0.00 N ATOM 1464 CA PRO A 100 -10.301 21.048 -5.552 1.00 0.00 C ATOM 1465 C PRO A 100 -10.317 20.319 -4.213 1.00 0.00 C ATOM 1466 O PRO A 100 -9.291 19.843 -3.725 1.00 0.00 O ATOM 1467 CB PRO A 100 -10.578 20.070 -6.696 1.00 0.00 C ATOM 1468 CG PRO A 100 -9.229 19.667 -7.185 1.00 0.00 C ATOM 1469 CD PRO A 100 -8.345 20.868 -6.997 1.00 0.00 C ATOM 0 HA PRO A 100 -11.048 21.836 -5.456 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -11.148 19.207 -6.350 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -11.161 20.541 -7.487 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -8.850 18.812 -6.625 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -9.266 19.370 -8.233 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -7.320 20.580 -6.762 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -8.305 21.482 -7.897 1.00 0.00 H new ATOM 1477 N PRO A 101 -11.508 20.228 -3.602 1.00 0.00 N ATOM 1478 CA PRO A 101 -11.686 19.558 -2.311 1.00 0.00 C ATOM 1479 C PRO A 101 -11.513 18.046 -2.414 1.00 0.00 C ATOM 1480 O PRO A 101 -11.392 17.354 -1.403 1.00 0.00 O ATOM 1481 CB PRO A 101 -13.126 19.906 -1.926 1.00 0.00 C ATOM 1482 CG PRO A 101 -13.811 20.169 -3.222 1.00 0.00 C ATOM 1483 CD PRO A 101 -12.772 20.773 -4.125 1.00 0.00 C ATOM 0 HA PRO A 101 -10.945 19.880 -1.579 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -13.601 19.086 -1.386 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -13.162 20.779 -1.275 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -14.209 19.248 -3.647 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -14.653 20.848 -3.087 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -12.931 20.491 -5.166 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -12.788 21.862 -4.084 1.00 0.00 H new ATOM 1491 N VAL A 102 -11.502 17.539 -3.643 1.00 0.00 N ATOM 1492 CA VAL A 102 -11.343 16.109 -3.878 1.00 0.00 C ATOM 1493 C VAL A 102 -10.135 15.560 -3.128 1.00 0.00 C ATOM 1494 O VAL A 102 -10.202 14.494 -2.515 1.00 0.00 O ATOM 1495 CB VAL A 102 -11.185 15.801 -5.379 1.00 0.00 C ATOM 1496 CG1 VAL A 102 -12.491 16.053 -6.117 1.00 0.00 C ATOM 1497 CG2 VAL A 102 -10.058 16.630 -5.977 1.00 0.00 C ATOM 0 H VAL A 102 -11.601 18.097 -4.491 1.00 0.00 H new ATOM 0 HA VAL A 102 -12.247 15.625 -3.509 1.00 0.00 H new ATOM 0 HB VAL A 102 -10.930 14.747 -5.490 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -12.360 15.830 -7.176 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -13.271 15.412 -5.705 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -12.780 17.097 -5.999 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -9.960 16.400 -7.038 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -10.282 17.690 -5.855 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -9.124 16.395 -5.467 1.00 0.00 H new ATOM 1507 N LYS A 103 -9.029 16.295 -3.180 1.00 0.00 N ATOM 1508 CA LYS A 103 -7.804 15.884 -2.504 1.00 0.00 C ATOM 1509 C LYS A 103 -6.881 17.077 -2.277 1.00 0.00 C ATOM 1510 O LYS A 103 -5.815 17.173 -2.886 1.00 0.00 O ATOM 1511 CB LYS A 103 -7.080 14.813 -3.323 1.00 0.00 C ATOM 1512 CG LYS A 103 -6.830 15.217 -4.765 1.00 0.00 C ATOM 1513 CD LYS A 103 -7.453 14.229 -5.737 1.00 0.00 C ATOM 1514 CE LYS A 103 -6.807 12.856 -5.628 1.00 0.00 C ATOM 1515 NZ LYS A 103 -5.414 12.856 -6.153 1.00 0.00 N ATOM 0 H LYS A 103 -8.956 17.179 -3.684 1.00 0.00 H new ATOM 0 HA LYS A 103 -8.076 15.468 -1.534 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -6.126 14.587 -2.847 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -7.669 13.896 -3.308 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -7.241 16.211 -4.942 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -5.757 15.279 -4.946 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -8.522 14.146 -5.538 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -7.346 14.603 -6.755 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -6.802 12.539 -4.585 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -7.403 12.129 -6.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -5.367 12.273 -7.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -5.128 13.830 -6.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -4.772 12.465 -5.434 1.00 0.00 H new ATOM 1529 N ILE A 104 -7.297 17.983 -1.398 1.00 0.00 N ATOM 1530 CA ILE A 104 -6.506 19.167 -1.091 1.00 0.00 C ATOM 1531 C ILE A 104 -5.068 18.794 -0.745 1.00 0.00 C ATOM 1532 O ILE A 104 -4.150 19.598 -0.909 1.00 0.00 O ATOM 1533 CB ILE A 104 -7.113 19.961 0.081 1.00 0.00 C ATOM 1534 CG1 ILE A 104 -8.538 20.404 -0.259 1.00 0.00 C ATOM 1535 CG2 ILE A 104 -6.244 21.165 0.412 1.00 0.00 C ATOM 1536 CD1 ILE A 104 -8.606 21.410 -1.386 1.00 0.00 C ATOM 0 H ILE A 104 -8.177 17.919 -0.886 1.00 0.00 H new ATOM 0 HA ILE A 104 -6.512 19.791 -1.985 1.00 0.00 H new ATOM 0 HB ILE A 104 -7.152 19.314 0.957 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -9.127 19.528 -0.529 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -8.997 20.835 0.630 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -6.686 21.716 1.242 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -5.246 20.828 0.691 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -6.176 21.816 -0.460 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -9.646 21.678 -1.572 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -8.045 22.303 -1.111 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -8.177 20.975 -2.288 1.00 0.00 H new ATOM 1548 N HIS A 105 -4.879 17.567 -0.269 1.00 0.00 N ATOM 1549 CA HIS A 105 -3.552 17.085 0.097 1.00 0.00 C ATOM 1550 C HIS A 105 -2.578 17.241 -1.066 1.00 0.00 C ATOM 1551 O HIS A 105 -1.365 17.323 -0.866 1.00 0.00 O ATOM 1552 CB HIS A 105 -3.620 15.620 0.529 1.00 0.00 C ATOM 1553 CG HIS A 105 -3.724 15.436 2.012 1.00 0.00 C ATOM 1554 ND1 HIS A 105 -4.746 15.972 2.767 1.00 0.00 N ATOM 1555 CD2 HIS A 105 -2.926 14.771 2.879 1.00 0.00 C ATOM 1556 CE1 HIS A 105 -4.572 15.644 4.035 1.00 0.00 C ATOM 1557 NE2 HIS A 105 -3.475 14.915 4.130 1.00 0.00 N ATOM 0 H HIS A 105 -5.628 16.889 -0.128 1.00 0.00 H new ATOM 0 HA HIS A 105 -3.191 17.685 0.932 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -4.479 15.149 0.052 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -2.731 15.102 0.169 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -2.025 14.228 2.633 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -5.217 15.924 4.854 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -3.097 14.523 4.992 1.00 0.00 H new ATOM 1565 N CYS A 106 -3.115 17.280 -2.280 1.00 0.00 N ATOM 1566 CA CYS A 106 -2.292 17.424 -3.476 1.00 0.00 C ATOM 1567 C CYS A 106 -1.478 18.712 -3.424 1.00 0.00 C ATOM 1568 O CYS A 106 -0.478 18.855 -4.128 1.00 0.00 O ATOM 1569 CB CYS A 106 -3.170 17.411 -4.729 1.00 0.00 C ATOM 1570 SG CYS A 106 -3.126 15.853 -5.645 1.00 0.00 S ATOM 0 H CYS A 106 -4.116 17.214 -2.463 1.00 0.00 H new ATOM 0 HA CYS A 106 -1.602 16.581 -3.516 1.00 0.00 H new ATOM 0 HB2 CYS A 106 -4.200 17.621 -4.440 1.00 0.00 H new ATOM 0 HB3 CYS A 106 -2.853 18.218 -5.390 1.00 0.00 H new ATOM 0 HG CYS A 106 -3.901 15.939 -6.685 1.00 0.00 H new ATOM 1576 N SER A 107 -1.913 19.648 -2.586 1.00 0.00 N ATOM 1577 CA SER A 107 -1.228 20.927 -2.446 1.00 0.00 C ATOM 1578 C SER A 107 -0.145 20.849 -1.374 1.00 0.00 C ATOM 1579 O SER A 107 0.871 21.539 -1.451 1.00 0.00 O ATOM 1580 CB SER A 107 -2.229 22.030 -2.097 1.00 0.00 C ATOM 1581 OG SER A 107 -3.553 21.635 -2.409 1.00 0.00 O ATOM 0 H SER A 107 -2.737 19.544 -1.994 1.00 0.00 H new ATOM 0 HA SER A 107 -0.755 21.164 -3.399 1.00 0.00 H new ATOM 0 HB2 SER A 107 -2.158 22.267 -1.036 1.00 0.00 H new ATOM 0 HB3 SER A 107 -1.979 22.939 -2.644 1.00 0.00 H new ATOM 0 HG SER A 107 -3.940 21.156 -1.646 1.00 0.00 H new ATOM 1587 N ILE A 108 -0.371 20.003 -0.374 1.00 0.00 N ATOM 1588 CA ILE A 108 0.584 19.833 0.713 1.00 0.00 C ATOM 1589 C ILE A 108 1.815 19.061 0.248 1.00 0.00 C ATOM 1590 O ILE A 108 2.886 19.158 0.849 1.00 0.00 O ATOM 1591 CB ILE A 108 -0.048 19.096 1.908 1.00 0.00 C ATOM 1592 CG1 ILE A 108 -1.256 19.874 2.434 1.00 0.00 C ATOM 1593 CG2 ILE A 108 0.980 18.896 3.011 1.00 0.00 C ATOM 1594 CD1 ILE A 108 -2.007 19.155 3.532 1.00 0.00 C ATOM 0 H ILE A 108 -1.208 19.425 -0.295 1.00 0.00 H new ATOM 0 HA ILE A 108 0.882 20.832 1.029 1.00 0.00 H new ATOM 0 HB ILE A 108 -0.388 18.116 1.573 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -0.920 20.841 2.808 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -1.939 20.072 1.607 1.00 0.00 H new ATOM 0 HG21 ILE A 108 0.518 18.374 3.849 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.813 18.305 2.630 1.00 0.00 H new ATOM 0 HG23 ILE A 108 1.347 19.866 3.346 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -2.850 19.765 3.856 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -2.374 18.200 3.157 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -1.339 18.981 4.376 1.00 0.00 H new ATOM 1606 N LEU A 109 1.655 18.297 -0.827 1.00 0.00 N ATOM 1607 CA LEU A 109 2.754 17.509 -1.375 1.00 0.00 C ATOM 1608 C LEU A 109 3.709 18.390 -2.175 1.00 0.00 C ATOM 1609 O LEU A 109 4.885 18.064 -2.332 1.00 0.00 O ATOM 1610 CB LEU A 109 2.211 16.389 -2.264 1.00 0.00 C ATOM 1611 CG LEU A 109 1.654 15.165 -1.535 1.00 0.00 C ATOM 1612 CD1 LEU A 109 0.329 14.737 -2.146 1.00 0.00 C ATOM 1613 CD2 LEU A 109 2.656 14.020 -1.575 1.00 0.00 C ATOM 0 H LEU A 109 0.776 18.206 -1.336 1.00 0.00 H new ATOM 0 HA LEU A 109 3.304 17.070 -0.543 1.00 0.00 H new ATOM 0 HB2 LEU A 109 1.423 16.802 -2.894 1.00 0.00 H new ATOM 0 HB3 LEU A 109 3.010 16.059 -2.928 1.00 0.00 H new ATOM 0 HG LEU A 109 1.480 15.434 -0.493 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -0.052 13.865 -1.614 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -0.389 15.553 -2.066 1.00 0.00 H new ATOM 0 HD13 LEU A 109 0.477 14.486 -3.196 1.00 0.00 H new ATOM 0 HD21 LEU A 109 2.244 13.157 -1.052 1.00 0.00 H new ATOM 0 HD22 LEU A 109 2.861 13.752 -2.611 1.00 0.00 H new ATOM 0 HD23 LEU A 109 3.582 14.330 -1.090 1.00 0.00 H new ATOM 1625 N ALA A 110 3.195 19.508 -2.676 1.00 0.00 N ATOM 1626 CA ALA A 110 4.003 20.438 -3.456 1.00 0.00 C ATOM 1627 C ALA A 110 5.038 21.135 -2.579 1.00 0.00 C ATOM 1628 O ALA A 110 6.184 21.322 -2.985 1.00 0.00 O ATOM 1629 CB ALA A 110 3.113 21.463 -4.142 1.00 0.00 C ATOM 0 H ALA A 110 2.223 19.792 -2.556 1.00 0.00 H new ATOM 0 HA ALA A 110 4.535 19.868 -4.217 1.00 0.00 H new ATOM 0 HB1 ALA A 110 3.729 22.151 -4.721 1.00 0.00 H new ATOM 0 HB2 ALA A 110 2.416 20.953 -4.807 1.00 0.00 H new ATOM 0 HB3 ALA A 110 2.555 22.021 -3.390 1.00 0.00 H new ATOM 1635 N GLU A 111 4.625 21.516 -1.374 1.00 0.00 N ATOM 1636 CA GLU A 111 5.517 22.194 -0.441 1.00 0.00 C ATOM 1637 C GLU A 111 6.405 21.191 0.289 1.00 0.00 C ATOM 1638 O GLU A 111 7.473 21.541 0.792 1.00 0.00 O ATOM 1639 CB GLU A 111 4.709 23.008 0.572 1.00 0.00 C ATOM 1640 CG GLU A 111 3.776 22.165 1.425 1.00 0.00 C ATOM 1641 CD GLU A 111 3.954 22.419 2.909 1.00 0.00 C ATOM 1642 OE1 GLU A 111 4.369 23.538 3.275 1.00 0.00 O ATOM 1643 OE2 GLU A 111 3.677 21.497 3.706 1.00 0.00 O ATOM 0 H GLU A 111 3.680 21.367 -1.022 1.00 0.00 H new ATOM 0 HA GLU A 111 6.154 22.869 -1.013 1.00 0.00 H new ATOM 0 HB2 GLU A 111 5.397 23.546 1.224 1.00 0.00 H new ATOM 0 HB3 GLU A 111 4.123 23.757 0.039 1.00 0.00 H new ATOM 0 HG2 GLU A 111 2.744 22.376 1.145 1.00 0.00 H new ATOM 0 HG3 GLU A 111 3.953 21.110 1.217 1.00 0.00 H new ATOM 1650 N ASP A 112 5.956 19.942 0.343 1.00 0.00 N ATOM 1651 CA ASP A 112 6.709 18.886 1.011 1.00 0.00 C ATOM 1652 C ASP A 112 7.849 18.390 0.127 1.00 0.00 C ATOM 1653 O ASP A 112 8.856 17.886 0.622 1.00 0.00 O ATOM 1654 CB ASP A 112 5.785 17.723 1.374 1.00 0.00 C ATOM 1655 CG ASP A 112 4.883 18.045 2.550 1.00 0.00 C ATOM 1656 OD1 ASP A 112 4.744 19.241 2.880 1.00 0.00 O ATOM 1657 OD2 ASP A 112 4.318 17.100 3.140 1.00 0.00 O ATOM 0 H ASP A 112 5.074 19.636 -0.068 1.00 0.00 H new ATOM 0 HA ASP A 112 7.135 19.299 1.925 1.00 0.00 H new ATOM 0 HB2 ASP A 112 5.172 17.466 0.510 1.00 0.00 H new ATOM 0 HB3 ASP A 112 6.386 16.845 1.611 1.00 0.00 H new ATOM 1662 N ALA A 113 7.682 18.536 -1.183 1.00 0.00 N ATOM 1663 CA ALA A 113 8.697 18.104 -2.135 1.00 0.00 C ATOM 1664 C ALA A 113 9.867 19.082 -2.173 1.00 0.00 C ATOM 1665 O ALA A 113 11.028 18.678 -2.103 1.00 0.00 O ATOM 1666 CB ALA A 113 8.089 17.952 -3.522 1.00 0.00 C ATOM 0 H ALA A 113 6.853 18.950 -1.609 1.00 0.00 H new ATOM 0 HA ALA A 113 9.077 17.136 -1.808 1.00 0.00 H new ATOM 0 HB1 ALA A 113 8.858 17.629 -4.223 1.00 0.00 H new ATOM 0 HB2 ALA A 113 7.292 17.209 -3.490 1.00 0.00 H new ATOM 0 HB3 ALA A 113 7.681 18.909 -3.847 1.00 0.00 H new ATOM 1672 N ILE A 114 9.553 20.368 -2.284 1.00 0.00 N ATOM 1673 CA ILE A 114 10.579 21.403 -2.330 1.00 0.00 C ATOM 1674 C ILE A 114 11.501 21.317 -1.119 1.00 0.00 C ATOM 1675 O ILE A 114 12.713 21.506 -1.233 1.00 0.00 O ATOM 1676 CB ILE A 114 9.956 22.810 -2.388 1.00 0.00 C ATOM 1677 CG1 ILE A 114 8.986 23.011 -1.223 1.00 0.00 C ATOM 1678 CG2 ILE A 114 9.247 23.021 -3.717 1.00 0.00 C ATOM 1679 CD1 ILE A 114 8.263 24.340 -1.259 1.00 0.00 C ATOM 0 H ILE A 114 8.597 20.718 -2.344 1.00 0.00 H new ATOM 0 HA ILE A 114 11.159 21.233 -3.237 1.00 0.00 H new ATOM 0 HB ILE A 114 10.754 23.548 -2.303 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.251 22.206 -1.231 1.00 0.00 H new ATOM 0 HG13 ILE A 114 9.536 22.931 -0.285 1.00 0.00 H new ATOM 0 HG21 ILE A 114 8.812 24.020 -3.743 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.963 22.916 -4.532 1.00 0.00 H new ATOM 0 HG23 ILE A 114 8.457 22.278 -3.830 1.00 0.00 H new ATOM 0 HD11 ILE A 114 7.592 24.413 -0.403 1.00 0.00 H new ATOM 0 HD12 ILE A 114 8.990 25.151 -1.220 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.685 24.415 -2.180 1.00 0.00 H new ATOM 1691 N LYS A 115 10.921 21.029 0.041 1.00 0.00 N ATOM 1692 CA LYS A 115 11.690 20.914 1.274 1.00 0.00 C ATOM 1693 C LYS A 115 12.666 19.744 1.200 1.00 0.00 C ATOM 1694 O LYS A 115 13.806 19.845 1.652 1.00 0.00 O ATOM 1695 CB LYS A 115 10.752 20.734 2.470 1.00 0.00 C ATOM 1696 CG LYS A 115 11.464 20.314 3.744 1.00 0.00 C ATOM 1697 CD LYS A 115 12.477 21.357 4.186 1.00 0.00 C ATOM 1698 CE LYS A 115 13.837 20.732 4.459 1.00 0.00 C ATOM 1699 NZ LYS A 115 14.064 20.513 5.914 1.00 0.00 N ATOM 0 H LYS A 115 9.920 20.871 0.153 1.00 0.00 H new ATOM 0 HA LYS A 115 12.261 21.833 1.403 1.00 0.00 H new ATOM 0 HB2 LYS A 115 10.224 21.670 2.651 1.00 0.00 H new ATOM 0 HB3 LYS A 115 9.999 19.986 2.221 1.00 0.00 H new ATOM 0 HG2 LYS A 115 10.732 20.158 4.536 1.00 0.00 H new ATOM 0 HG3 LYS A 115 11.968 19.361 3.583 1.00 0.00 H new ATOM 0 HD2 LYS A 115 12.575 22.121 3.415 1.00 0.00 H new ATOM 0 HD3 LYS A 115 12.118 21.857 5.086 1.00 0.00 H new ATOM 0 HE2 LYS A 115 13.912 19.781 3.932 1.00 0.00 H new ATOM 0 HE3 LYS A 115 14.620 21.378 4.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 15.001 20.086 6.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 14.018 21.424 6.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 13.332 19.876 6.288 1.00 0.00 H new ATOM 1713 N ALA A 116 12.211 18.635 0.625 1.00 0.00 N ATOM 1714 CA ALA A 116 13.046 17.448 0.488 1.00 0.00 C ATOM 1715 C ALA A 116 14.314 17.756 -0.301 1.00 0.00 C ATOM 1716 O ALA A 116 15.319 17.058 -0.175 1.00 0.00 O ATOM 1717 CB ALA A 116 12.264 16.328 -0.182 1.00 0.00 C ATOM 0 H ALA A 116 11.269 18.534 0.247 1.00 0.00 H new ATOM 0 HA ALA A 116 13.341 17.124 1.486 1.00 0.00 H new ATOM 0 HB1 ALA A 116 12.899 15.448 -0.278 1.00 0.00 H new ATOM 0 HB2 ALA A 116 11.391 16.081 0.423 1.00 0.00 H new ATOM 0 HB3 ALA A 116 11.940 16.652 -1.171 1.00 0.00 H new ATOM 1723 N ALA A 117 14.259 18.806 -1.115 1.00 0.00 N ATOM 1724 CA ALA A 117 15.403 19.207 -1.923 1.00 0.00 C ATOM 1725 C ALA A 117 16.373 20.062 -1.115 1.00 0.00 C ATOM 1726 O ALA A 117 17.590 19.938 -1.255 1.00 0.00 O ATOM 1727 CB ALA A 117 14.938 19.959 -3.161 1.00 0.00 C ATOM 0 H ALA A 117 13.434 19.394 -1.232 1.00 0.00 H new ATOM 0 HA ALA A 117 15.929 18.305 -2.236 1.00 0.00 H new ATOM 0 HB1 ALA A 117 15.804 20.252 -3.755 1.00 0.00 H new ATOM 0 HB2 ALA A 117 14.291 19.315 -3.756 1.00 0.00 H new ATOM 0 HB3 ALA A 117 14.386 20.849 -2.860 1.00 0.00 H new ATOM 1733 N ILE A 118 15.827 20.931 -0.271 1.00 0.00 N ATOM 1734 CA ILE A 118 16.644 21.807 0.558 1.00 0.00 C ATOM 1735 C ILE A 118 17.442 21.007 1.582 1.00 0.00 C ATOM 1736 O ILE A 118 18.573 21.358 1.915 1.00 0.00 O ATOM 1737 CB ILE A 118 15.783 22.849 1.296 1.00 0.00 C ATOM 1738 CG1 ILE A 118 15.051 23.741 0.292 1.00 0.00 C ATOM 1739 CG2 ILE A 118 16.647 23.687 2.227 1.00 0.00 C ATOM 1740 CD1 ILE A 118 14.193 24.804 0.941 1.00 0.00 C ATOM 0 H ILE A 118 14.822 21.047 -0.144 1.00 0.00 H new ATOM 0 HA ILE A 118 17.331 22.324 -0.112 1.00 0.00 H new ATOM 0 HB ILE A 118 15.040 22.325 1.897 1.00 0.00 H new ATOM 0 HG12 ILE A 118 15.784 24.222 -0.356 1.00 0.00 H new ATOM 0 HG13 ILE A 118 14.423 23.118 -0.345 1.00 0.00 H new ATOM 0 HG21 ILE A 118 16.024 24.419 2.741 1.00 0.00 H new ATOM 0 HG22 ILE A 118 17.126 23.039 2.961 1.00 0.00 H new ATOM 0 HG23 ILE A 118 17.411 24.205 1.647 1.00 0.00 H new ATOM 0 HD11 ILE A 118 13.704 25.399 0.169 1.00 0.00 H new ATOM 0 HD12 ILE A 118 13.437 24.329 1.567 1.00 0.00 H new ATOM 0 HD13 ILE A 118 14.819 25.451 1.556 1.00 0.00 H new ATOM 1752 N ALA A 119 16.845 19.927 2.077 1.00 0.00 N ATOM 1753 CA ALA A 119 17.501 19.074 3.060 1.00 0.00 C ATOM 1754 C ALA A 119 18.704 18.361 2.452 1.00 0.00 C ATOM 1755 O ALA A 119 19.724 18.170 3.114 1.00 0.00 O ATOM 1756 CB ALA A 119 16.514 18.062 3.623 1.00 0.00 C ATOM 0 H ALA A 119 15.908 19.623 1.813 1.00 0.00 H new ATOM 0 HA ALA A 119 17.859 19.706 3.872 1.00 0.00 H new ATOM 0 HB1 ALA A 119 17.018 17.432 4.356 1.00 0.00 H new ATOM 0 HB2 ALA A 119 15.688 18.587 4.103 1.00 0.00 H new ATOM 0 HB3 ALA A 119 16.128 17.441 2.814 1.00 0.00 H new ATOM 1762 N ASP A 120 18.577 17.969 1.189 1.00 0.00 N ATOM 1763 CA ASP A 120 19.655 17.276 0.492 1.00 0.00 C ATOM 1764 C ASP A 120 20.924 18.123 0.476 1.00 0.00 C ATOM 1765 O ASP A 120 21.992 17.665 0.882 1.00 0.00 O ATOM 1766 CB ASP A 120 19.232 16.941 -0.939 1.00 0.00 C ATOM 1767 CG ASP A 120 20.292 16.158 -1.687 1.00 0.00 C ATOM 1768 OD1 ASP A 120 20.622 15.036 -1.248 1.00 0.00 O ATOM 1769 OD2 ASP A 120 20.792 16.666 -2.713 1.00 0.00 O ATOM 0 H ASP A 120 17.739 18.119 0.627 1.00 0.00 H new ATOM 0 HA ASP A 120 19.865 16.350 1.027 1.00 0.00 H new ATOM 0 HB2 ASP A 120 18.307 16.365 -0.916 1.00 0.00 H new ATOM 0 HB3 ASP A 120 19.019 17.864 -1.477 1.00 0.00 H new ATOM 1774 N TYR A 121 20.799 19.358 0.004 1.00 0.00 N ATOM 1775 CA TYR A 121 21.936 20.267 -0.068 1.00 0.00 C ATOM 1776 C TYR A 121 22.672 20.326 1.267 1.00 0.00 C ATOM 1777 O TYR A 121 23.892 20.168 1.325 1.00 0.00 O ATOM 1778 CB TYR A 121 21.471 21.668 -0.469 1.00 0.00 C ATOM 1779 CG TYR A 121 22.572 22.704 -0.437 1.00 0.00 C ATOM 1780 CD1 TYR A 121 23.714 22.557 -1.215 1.00 0.00 C ATOM 1781 CD2 TYR A 121 22.471 23.829 0.372 1.00 0.00 C ATOM 1782 CE1 TYR A 121 24.723 23.500 -1.188 1.00 0.00 C ATOM 1783 CE2 TYR A 121 23.474 24.779 0.404 1.00 0.00 C ATOM 1784 CZ TYR A 121 24.598 24.609 -0.378 1.00 0.00 C ATOM 1785 OH TYR A 121 25.601 25.552 -0.348 1.00 0.00 O ATOM 0 H TYR A 121 19.921 19.753 -0.335 1.00 0.00 H new ATOM 0 HA TYR A 121 22.623 19.889 -0.825 1.00 0.00 H new ATOM 0 HB2 TYR A 121 21.050 21.628 -1.474 1.00 0.00 H new ATOM 0 HB3 TYR A 121 20.670 21.981 0.200 1.00 0.00 H new ATOM 0 HD1 TYR A 121 23.814 21.690 -1.852 1.00 0.00 H new ATOM 0 HD2 TYR A 121 21.593 23.963 0.987 1.00 0.00 H new ATOM 0 HE1 TYR A 121 25.605 23.369 -1.798 1.00 0.00 H new ATOM 0 HE2 TYR A 121 23.379 25.649 1.037 1.00 0.00 H new ATOM 0 HH TYR A 121 25.444 26.219 -1.049 1.00 0.00 H new ATOM 1795 N LYS A 122 21.922 20.554 2.339 1.00 0.00 N ATOM 1796 CA LYS A 122 22.500 20.632 3.676 1.00 0.00 C ATOM 1797 C LYS A 122 23.314 19.382 3.990 1.00 0.00 C ATOM 1798 O LYS A 122 24.336 19.450 4.674 1.00 0.00 O ATOM 1799 CB LYS A 122 21.396 20.812 4.721 1.00 0.00 C ATOM 1800 CG LYS A 122 20.568 22.069 4.521 1.00 0.00 C ATOM 1801 CD LYS A 122 19.622 22.305 5.687 1.00 0.00 C ATOM 1802 CE LYS A 122 18.826 23.588 5.508 1.00 0.00 C ATOM 1803 NZ LYS A 122 19.435 24.727 6.250 1.00 0.00 N ATOM 0 H LYS A 122 20.911 20.688 2.309 1.00 0.00 H new ATOM 0 HA LYS A 122 23.166 21.494 3.708 1.00 0.00 H new ATOM 0 HB2 LYS A 122 20.737 19.945 4.694 1.00 0.00 H new ATOM 0 HB3 LYS A 122 21.847 20.838 5.713 1.00 0.00 H new ATOM 0 HG2 LYS A 122 21.230 22.928 4.409 1.00 0.00 H new ATOM 0 HG3 LYS A 122 19.995 21.985 3.598 1.00 0.00 H new ATOM 0 HD2 LYS A 122 18.938 21.461 5.779 1.00 0.00 H new ATOM 0 HD3 LYS A 122 20.192 22.356 6.615 1.00 0.00 H new ATOM 0 HE2 LYS A 122 18.768 23.835 4.448 1.00 0.00 H new ATOM 0 HE3 LYS A 122 17.804 23.433 5.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 18.863 25.583 6.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 19.467 24.503 7.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 20.401 24.892 5.901 1.00 0.00 H new ATOM 1817 N SER A 123 22.856 18.240 3.486 1.00 0.00 N ATOM 1818 CA SER A 123 23.541 16.974 3.716 1.00 0.00 C ATOM 1819 C SER A 123 24.693 16.793 2.731 1.00 0.00 C ATOM 1820 O SER A 123 25.598 15.989 2.956 1.00 0.00 O ATOM 1821 CB SER A 123 22.559 15.808 3.589 1.00 0.00 C ATOM 1822 OG SER A 123 22.767 14.852 4.614 1.00 0.00 O ATOM 0 H SER A 123 22.013 18.166 2.916 1.00 0.00 H new ATOM 0 HA SER A 123 23.948 16.988 4.727 1.00 0.00 H new ATOM 0 HB2 SER A 123 21.537 16.183 3.639 1.00 0.00 H new ATOM 0 HB3 SER A 123 22.677 15.333 2.615 1.00 0.00 H new ATOM 0 HG SER A 123 22.126 14.118 4.512 1.00 0.00 H new ATOM 1828 N LYS A 124 24.652 17.547 1.638 1.00 0.00 N ATOM 1829 CA LYS A 124 25.691 17.473 0.618 1.00 0.00 C ATOM 1830 C LYS A 124 26.953 18.200 1.072 1.00 0.00 C ATOM 1831 O LYS A 124 28.057 17.881 0.632 1.00 0.00 O ATOM 1832 CB LYS A 124 25.188 18.075 -0.696 1.00 0.00 C ATOM 1833 CG LYS A 124 24.190 17.193 -1.426 1.00 0.00 C ATOM 1834 CD LYS A 124 24.856 15.957 -2.005 1.00 0.00 C ATOM 1835 CE LYS A 124 23.902 15.173 -2.893 1.00 0.00 C ATOM 1836 NZ LYS A 124 24.386 13.786 -3.139 1.00 0.00 N ATOM 0 H LYS A 124 23.910 18.217 1.436 1.00 0.00 H new ATOM 0 HA LYS A 124 25.935 16.423 0.460 1.00 0.00 H new ATOM 0 HB2 LYS A 124 24.725 19.040 -0.490 1.00 0.00 H new ATOM 0 HB3 LYS A 124 26.040 18.263 -1.349 1.00 0.00 H new ATOM 0 HG2 LYS A 124 23.398 16.893 -0.739 1.00 0.00 H new ATOM 0 HG3 LYS A 124 23.718 17.762 -2.227 1.00 0.00 H new ATOM 0 HD2 LYS A 124 25.733 16.252 -2.582 1.00 0.00 H new ATOM 0 HD3 LYS A 124 25.208 15.319 -1.194 1.00 0.00 H new ATOM 0 HE2 LYS A 124 22.918 15.137 -2.426 1.00 0.00 H new ATOM 0 HE3 LYS A 124 23.784 15.691 -3.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 23.684 13.269 -3.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 25.289 13.820 -3.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 24.523 13.300 -2.230 1.00 0.00 H new ATOM 1850 N ARG A 125 26.781 19.178 1.956 1.00 0.00 N ATOM 1851 CA ARG A 125 27.906 19.950 2.470 1.00 0.00 C ATOM 1852 C ARG A 125 28.238 19.540 3.902 1.00 0.00 C ATOM 1853 O ARG A 125 29.245 19.970 4.463 1.00 0.00 O ATOM 1854 CB ARG A 125 27.592 21.446 2.416 1.00 0.00 C ATOM 1855 CG ARG A 125 26.381 21.845 3.244 1.00 0.00 C ATOM 1856 CD ARG A 125 26.686 23.036 4.138 1.00 0.00 C ATOM 1857 NE ARG A 125 26.636 24.298 3.404 1.00 0.00 N ATOM 1858 CZ ARG A 125 26.672 25.490 3.989 1.00 0.00 C ATOM 1859 NH1 ARG A 125 26.760 25.583 5.309 1.00 0.00 N ATOM 1860 NH2 ARG A 125 26.623 26.593 3.253 1.00 0.00 N ATOM 0 H ARG A 125 25.874 19.454 2.331 1.00 0.00 H new ATOM 0 HA ARG A 125 28.773 19.745 1.842 1.00 0.00 H new ATOM 0 HB2 ARG A 125 28.461 22.004 2.766 1.00 0.00 H new ATOM 0 HB3 ARG A 125 27.424 21.736 1.379 1.00 0.00 H new ATOM 0 HG2 ARG A 125 25.550 22.089 2.582 1.00 0.00 H new ATOM 0 HG3 ARG A 125 26.063 21.001 3.856 1.00 0.00 H new ATOM 0 HD2 ARG A 125 25.970 23.066 4.959 1.00 0.00 H new ATOM 0 HD3 ARG A 125 27.674 22.913 4.581 1.00 0.00 H new ATOM 0 HE ARG A 125 26.570 24.262 2.387 1.00 0.00 H new ATOM 0 HH11 ARG A 125 26.800 24.738 5.878 1.00 0.00 H new ATOM 0 HH12 ARG A 125 26.787 26.500 5.755 1.00 0.00 H new ATOM 0 HH21 ARG A 125 26.558 26.526 2.237 1.00 0.00 H new ATOM 0 HH22 ARG A 125 26.651 27.508 3.703 1.00 0.00 H new ATOM 1874 N GLU A 126 27.383 18.706 4.487 1.00 0.00 N ATOM 1875 CA GLU A 126 27.585 18.240 5.853 1.00 0.00 C ATOM 1876 C GLU A 126 28.576 17.080 5.891 1.00 0.00 C ATOM 1877 O GLU A 126 29.479 17.049 6.727 1.00 0.00 O ATOM 1878 CB GLU A 126 26.253 17.808 6.471 1.00 0.00 C ATOM 1879 CG GLU A 126 25.748 18.751 7.549 1.00 0.00 C ATOM 1880 CD GLU A 126 25.215 18.017 8.764 1.00 0.00 C ATOM 1881 OE1 GLU A 126 24.029 17.627 8.748 1.00 0.00 O ATOM 1882 OE2 GLU A 126 25.984 17.832 9.730 1.00 0.00 O ATOM 0 H GLU A 126 26.545 18.340 4.036 1.00 0.00 H new ATOM 0 HA GLU A 126 27.996 19.066 6.434 1.00 0.00 H new ATOM 0 HB2 GLU A 126 25.503 17.736 5.683 1.00 0.00 H new ATOM 0 HB3 GLU A 126 26.366 16.811 6.896 1.00 0.00 H new ATOM 0 HG2 GLU A 126 26.558 19.413 7.856 1.00 0.00 H new ATOM 0 HG3 GLU A 126 24.960 19.381 7.135 1.00 0.00 H new ATOM 1889 N ALA A 127 28.399 16.129 4.981 1.00 0.00 N ATOM 1890 CA ALA A 127 29.278 14.968 4.909 1.00 0.00 C ATOM 1891 C ALA A 127 29.844 14.795 3.503 1.00 0.00 C ATOM 1892 O ALA A 127 29.160 14.309 2.602 1.00 0.00 O ATOM 1893 CB ALA A 127 28.531 13.713 5.337 1.00 0.00 C ATOM 0 H ALA A 127 27.655 16.139 4.283 1.00 0.00 H new ATOM 0 HA ALA A 127 30.112 15.132 5.591 1.00 0.00 H new ATOM 0 HB1 ALA A 127 29.199 12.854 5.278 1.00 0.00 H new ATOM 0 HB2 ALA A 127 28.180 13.830 6.362 1.00 0.00 H new ATOM 0 HB3 ALA A 127 27.678 13.555 4.677 1.00 0.00 H new ATOM 1899 N LYS A 128 31.098 15.195 3.323 1.00 0.00 N ATOM 1900 CA LYS A 128 31.758 15.084 2.027 1.00 0.00 C ATOM 1901 C LYS A 128 33.269 14.957 2.195 1.00 0.00 C ATOM 1902 O LYS A 128 33.751 13.866 2.496 1.00 0.00 O ATOM 1903 CB LYS A 128 31.431 16.301 1.159 1.00 0.00 C ATOM 1904 CG LYS A 128 32.131 16.292 -0.189 1.00 0.00 C ATOM 1905 CD LYS A 128 32.908 17.577 -0.423 1.00 0.00 C ATOM 1906 CE LYS A 128 33.292 17.738 -1.886 1.00 0.00 C ATOM 1907 NZ LYS A 128 33.632 19.150 -2.218 1.00 0.00 N ATOM 0 H LYS A 128 31.678 15.599 4.058 1.00 0.00 H new ATOM 0 HA LYS A 128 31.388 14.185 1.535 1.00 0.00 H new ATOM 0 HB2 LYS A 128 30.354 16.344 0.999 1.00 0.00 H new ATOM 0 HB3 LYS A 128 31.710 17.207 1.698 1.00 0.00 H new ATOM 0 HG2 LYS A 128 32.810 15.441 -0.242 1.00 0.00 H new ATOM 0 HG3 LYS A 128 31.394 16.162 -0.982 1.00 0.00 H new ATOM 0 HD2 LYS A 128 32.307 18.430 -0.108 1.00 0.00 H new ATOM 0 HD3 LYS A 128 33.808 17.577 0.192 1.00 0.00 H new ATOM 0 HE2 LYS A 128 34.144 17.097 -2.110 1.00 0.00 H new ATOM 0 HE3 LYS A 128 32.468 17.405 -2.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 33.888 19.218 -3.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 32.811 19.759 -2.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 34.435 19.460 -1.634 1.00 0.00 H new TER 1921 LYS A 128