USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 888 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 80 HIS : no HD1:sc= -1.06 X(o=-2.9,f=-2.7) USER MOD Set 1.2: A 86 ASN : amide:sc= -1.85 X(o=-2.9,f=-2.7) USER MOD Set 2.1: A 34 SER OG : rot -63:sc= 0.229 USER MOD Set 2.2: A 39 THR OG1 : rot 180:sc= 0.717 USER MOD Set 3.1: A 19 ASN : amide:sc= 0.0356 K(o=-2.6,f=-6.3!) USER MOD Set 3.2: A 22 GLN : amide:sc= -2.67 K(o=-2.6,f=-4.9!) USER MOD Single : A 1 ALA N :NH3+ -129:sc= 0.102 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= -0.524 USER MOD Single : A 3 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0262) USER MOD Single : A 6 CYS SG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 GLN : amide:sc= -0.0952 K(o=-0.095,f=-1.2) USER MOD Single : A 23 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.013) USER MOD Single : A 25 SER OG : rot 125:sc= 0.939 USER MOD Single : A 26 ASN : amide:sc= 0.317 X(o=0.32,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 161:sc= -0.0392 (180deg=-0.338) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 46 HIS : no HD1:sc= -0.015 K(o=-0.015,f=-0.64) USER MOD Single : A 48 HIS : no HE2:sc= 0.126 K(o=0.13,f=-3.5!) USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 54 THR OG1 : rot -37:sc= -0.606! USER MOD Single : A 57 CYS SG : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 115:sc= -0.188 USER MOD Single : A 59 SER OG : rot -170:sc= -1.5 USER MOD Single : A 63 HIS : no HE2:sc= -0.306 K(o=-0.31,f=-1.2) USER MOD Single : A 65 ASN : amide:sc= -0.305 K(o=-0.31,f=0.68) USER MOD Single : A 68 SER OG : rot 180:sc= -0.0768 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=-0.088) USER MOD Single : A 75 LYS NZ :NH3+ -115:sc= -0.493 (180deg=-1.16) USER MOD Single : A 88 THR OG1 : rot 39:sc= 1.04 USER MOD Single : A 91 LYS NZ :NH3+ 163:sc= -0.562 (180deg=-1.14) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= -0.484 USER MOD Single : A 107 SER OG : rot 180:sc=-0.00699 USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 111 CYS SG : rot 1:sc= 0.555 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 HIS : no HD1:sc= 0 X(o=0,f=-0.0079) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -17.108 8.692 -26.233 1.00 0.00 N ATOM 2 CA ALA A 1 -16.169 9.284 -27.176 1.00 0.00 C ATOM 3 C ALA A 1 -16.712 10.589 -27.748 1.00 0.00 C ATOM 4 O ALA A 1 -17.687 11.142 -27.240 1.00 0.00 O ATOM 5 CB ALA A 1 -15.857 8.303 -28.298 1.00 0.00 C ATOM 0 H1 ALA A 1 -16.614 8.468 -25.346 1.00 0.00 H new ATOM 0 H2 ALA A 1 -17.877 9.365 -26.041 1.00 0.00 H new ATOM 0 H3 ALA A 1 -17.504 7.820 -26.639 1.00 0.00 H new ATOM 0 HA ALA A 1 -15.248 9.509 -26.638 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -15.154 8.759 -28.995 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -15.417 7.398 -27.878 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -16.777 8.048 -28.825 1.00 0.00 H new ATOM 11 N THR A 2 -16.075 11.077 -28.808 1.00 0.00 N ATOM 12 CA THR A 2 -16.494 12.317 -29.447 1.00 0.00 C ATOM 13 C THR A 2 -15.603 12.650 -30.639 1.00 0.00 C ATOM 14 O THR A 2 -16.061 13.224 -31.627 1.00 0.00 O ATOM 15 CB THR A 2 -16.465 13.498 -28.455 1.00 0.00 C ATOM 16 OG1 THR A 2 -15.717 13.138 -27.288 1.00 0.00 O ATOM 17 CG2 THR A 2 -17.876 13.903 -28.056 1.00 0.00 C ATOM 0 H THR A 2 -15.266 10.631 -29.242 1.00 0.00 H new ATOM 0 HA THR A 2 -17.517 12.165 -29.792 1.00 0.00 H new ATOM 0 HB THR A 2 -15.986 14.346 -28.945 1.00 0.00 H new ATOM 0 HG1 THR A 2 -15.702 13.893 -26.663 1.00 0.00 H new ATOM 0 HG21 THR A 2 -17.831 14.737 -27.356 1.00 0.00 H new ATOM 0 HG22 THR A 2 -18.433 14.203 -28.943 1.00 0.00 H new ATOM 0 HG23 THR A 2 -18.377 13.059 -27.582 1.00 0.00 H new ATOM 25 N LYS A 3 -14.330 12.284 -30.542 1.00 0.00 N ATOM 26 CA LYS A 3 -13.375 12.540 -31.611 1.00 0.00 C ATOM 27 C LYS A 3 -11.990 12.018 -31.244 1.00 0.00 C ATOM 28 O LYS A 3 -10.975 12.580 -31.653 1.00 0.00 O ATOM 29 CB LYS A 3 -13.301 14.042 -31.910 1.00 0.00 C ATOM 30 CG LYS A 3 -13.202 14.904 -30.664 1.00 0.00 C ATOM 31 CD LYS A 3 -11.815 14.838 -30.048 1.00 0.00 C ATOM 32 CE LYS A 3 -11.587 15.973 -29.063 1.00 0.00 C ATOM 33 NZ LYS A 3 -12.559 15.933 -27.934 1.00 0.00 N1+ ATOM 0 H LYS A 3 -13.936 11.808 -29.731 1.00 0.00 H new ATOM 0 HA LYS A 3 -13.718 12.013 -32.501 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -12.437 14.236 -32.546 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -14.185 14.336 -32.476 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -13.440 15.937 -30.916 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -13.941 14.575 -29.934 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -11.687 13.883 -29.539 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -11.063 14.883 -30.836 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -10.572 15.914 -28.670 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -11.673 16.927 -29.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -12.288 16.637 -27.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -13.512 16.149 -28.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -12.556 14.985 -27.507 1.00 0.00 H new ATOM 47 N ALA A 4 -11.957 10.935 -30.473 1.00 0.00 N ATOM 48 CA ALA A 4 -10.699 10.334 -30.052 1.00 0.00 C ATOM 49 C ALA A 4 -10.238 9.275 -31.049 1.00 0.00 C ATOM 50 O ALA A 4 -9.041 9.101 -31.277 1.00 0.00 O ATOM 51 CB ALA A 4 -10.840 9.730 -28.664 1.00 0.00 C ATOM 0 H ALA A 4 -12.789 10.456 -30.128 1.00 0.00 H new ATOM 0 HA ALA A 4 -9.943 11.118 -30.018 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -9.892 9.285 -28.363 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -11.116 10.510 -27.954 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -11.613 8.962 -28.678 1.00 0.00 H new ATOM 57 N VAL A 5 -11.197 8.567 -31.640 1.00 0.00 N ATOM 58 CA VAL A 5 -10.890 7.524 -32.611 1.00 0.00 C ATOM 59 C VAL A 5 -11.611 7.772 -33.930 1.00 0.00 C ATOM 60 O VAL A 5 -11.080 7.489 -35.003 1.00 0.00 O ATOM 61 CB VAL A 5 -11.276 6.132 -32.080 1.00 0.00 C ATOM 62 CG1 VAL A 5 -10.669 5.041 -32.951 1.00 0.00 C ATOM 63 CG2 VAL A 5 -10.838 5.973 -30.632 1.00 0.00 C ATOM 0 H VAL A 5 -12.193 8.698 -31.463 1.00 0.00 H new ATOM 0 HA VAL A 5 -9.813 7.554 -32.778 1.00 0.00 H new ATOM 0 HB VAL A 5 -12.361 6.036 -32.120 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -10.953 4.064 -32.560 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -11.036 5.144 -33.972 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -9.583 5.133 -32.945 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -11.119 4.983 -30.273 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -9.756 6.090 -30.564 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -11.324 6.732 -30.019 1.00 0.00 H new ATOM 73 N CYS A 6 -12.827 8.302 -33.843 1.00 0.00 N ATOM 74 CA CYS A 6 -13.623 8.589 -35.030 1.00 0.00 C ATOM 75 C CYS A 6 -12.974 9.683 -35.870 1.00 0.00 C ATOM 76 O CYS A 6 -11.851 9.526 -36.352 1.00 0.00 O ATOM 77 CB CYS A 6 -15.039 9.008 -34.630 1.00 0.00 C ATOM 78 SG CYS A 6 -15.948 7.751 -33.702 1.00 0.00 S ATOM 0 H CYS A 6 -13.282 8.541 -32.962 1.00 0.00 H new ATOM 0 HA CYS A 6 -13.676 7.680 -35.630 1.00 0.00 H new ATOM 0 HB2 CYS A 6 -14.981 9.916 -34.030 1.00 0.00 H new ATOM 0 HB3 CYS A 6 -15.601 9.256 -35.531 1.00 0.00 H new ATOM 0 HG CYS A 6 -17.132 8.200 -33.408 1.00 0.00 H new ATOM 84 N VAL A 7 -13.686 10.792 -36.042 1.00 0.00 N ATOM 85 CA VAL A 7 -13.179 11.912 -36.825 1.00 0.00 C ATOM 86 C VAL A 7 -12.216 12.765 -36.006 1.00 0.00 C ATOM 87 O VAL A 7 -12.353 13.986 -35.940 1.00 0.00 O ATOM 88 CB VAL A 7 -14.325 12.803 -37.339 1.00 0.00 C ATOM 89 CG1 VAL A 7 -13.821 13.760 -38.407 1.00 0.00 C ATOM 90 CG2 VAL A 7 -15.465 11.949 -37.873 1.00 0.00 C ATOM 0 H VAL A 7 -14.616 10.939 -35.649 1.00 0.00 H new ATOM 0 HA VAL A 7 -12.649 11.487 -37.677 1.00 0.00 H new ATOM 0 HB VAL A 7 -14.703 13.394 -36.505 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -14.645 14.381 -38.758 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -13.041 14.395 -37.987 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -13.415 13.191 -39.243 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -16.266 12.595 -38.232 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -15.102 11.330 -38.694 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -15.844 11.309 -37.076 1.00 0.00 H new ATOM 100 N LEU A 8 -11.242 12.111 -35.381 1.00 0.00 N ATOM 101 CA LEU A 8 -10.253 12.809 -34.566 1.00 0.00 C ATOM 102 C LEU A 8 -9.450 13.796 -35.407 1.00 0.00 C ATOM 103 O LEU A 8 -8.830 14.718 -34.878 1.00 0.00 O ATOM 104 CB LEU A 8 -9.311 11.804 -33.899 1.00 0.00 C ATOM 105 CG LEU A 8 -8.081 12.392 -33.212 1.00 0.00 C ATOM 106 CD1 LEU A 8 -7.693 11.558 -32.002 1.00 0.00 C ATOM 107 CD2 LEU A 8 -6.918 12.488 -34.188 1.00 0.00 C ATOM 0 H LEU A 8 -11.116 11.100 -35.423 1.00 0.00 H new ATOM 0 HA LEU A 8 -10.784 13.367 -33.795 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -9.879 11.239 -33.160 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -8.976 11.094 -34.655 1.00 0.00 H new ATOM 0 HG LEU A 8 -8.328 13.397 -32.871 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -6.814 11.994 -31.526 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -8.519 11.541 -31.291 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -7.467 10.540 -32.319 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -6.051 12.909 -33.680 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -6.673 11.493 -34.561 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -7.196 13.130 -35.024 1.00 0.00 H new ATOM 119 N LYS A 9 -9.468 13.596 -36.720 1.00 0.00 N ATOM 120 CA LYS A 9 -8.745 14.469 -37.636 1.00 0.00 C ATOM 121 C LYS A 9 -9.651 15.579 -38.161 1.00 0.00 C ATOM 122 O LYS A 9 -9.217 16.440 -38.924 1.00 0.00 O ATOM 123 CB LYS A 9 -8.182 13.659 -38.808 1.00 0.00 C ATOM 124 CG LYS A 9 -7.322 12.483 -38.377 1.00 0.00 C ATOM 125 CD LYS A 9 -7.799 11.185 -39.007 1.00 0.00 C ATOM 126 CE LYS A 9 -8.574 10.336 -38.010 1.00 0.00 C ATOM 127 NZ LYS A 9 -9.021 9.047 -38.610 1.00 0.00 N1+ ATOM 0 H LYS A 9 -9.976 12.837 -37.174 1.00 0.00 H new ATOM 0 HA LYS A 9 -7.921 14.926 -37.088 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -9.009 13.290 -39.415 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -7.590 14.318 -39.443 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -6.285 12.666 -38.659 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -7.346 12.392 -37.291 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -8.431 11.407 -39.867 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -6.942 10.622 -39.378 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -7.948 10.134 -37.141 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -9.442 10.892 -37.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -9.545 8.497 -37.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -9.639 9.239 -39.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -8.191 8.504 -38.925 1.00 0.00 H new ATOM 141 N GLY A 10 -10.914 15.551 -37.746 1.00 0.00 N ATOM 142 CA GLY A 10 -11.862 16.560 -38.183 1.00 0.00 C ATOM 143 C GLY A 10 -12.773 17.022 -37.063 1.00 0.00 C ATOM 144 O GLY A 10 -13.992 17.055 -37.220 1.00 0.00 O ATOM 0 H GLY A 10 -11.298 14.848 -37.115 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -11.318 17.416 -38.582 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -12.466 16.159 -38.997 1.00 0.00 H new ATOM 148 N ASP A 11 -12.179 17.380 -35.930 1.00 0.00 N ATOM 149 CA ASP A 11 -12.945 17.844 -34.778 1.00 0.00 C ATOM 150 C ASP A 11 -12.264 19.038 -34.118 1.00 0.00 C ATOM 151 O ASP A 11 -12.499 19.329 -32.946 1.00 0.00 O ATOM 152 CB ASP A 11 -13.115 16.712 -33.764 1.00 0.00 C ATOM 153 CG ASP A 11 -14.487 16.716 -33.119 1.00 0.00 C ATOM 154 OD1 ASP A 11 -14.670 17.439 -32.118 1.00 0.00 O ATOM 155 OD2 ASP A 11 -15.379 15.993 -33.613 1.00 0.00 O1- ATOM 0 H ASP A 11 -11.170 17.358 -35.784 1.00 0.00 H new ATOM 0 HA ASP A 11 -13.928 18.158 -35.128 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -12.953 15.755 -34.261 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -12.352 16.803 -32.990 1.00 0.00 H new ATOM 160 N GLY A 12 -11.418 19.726 -34.879 1.00 0.00 N ATOM 161 CA GLY A 12 -10.715 20.882 -34.350 1.00 0.00 C ATOM 162 C GLY A 12 -9.799 20.523 -33.196 1.00 0.00 C ATOM 163 O GLY A 12 -9.794 21.178 -32.154 1.00 0.00 O ATOM 0 H GLY A 12 -11.207 19.504 -35.852 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -10.129 21.343 -35.145 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -11.441 21.624 -34.017 1.00 0.00 H new ATOM 167 N PRO A 13 -9.002 19.459 -33.376 1.00 0.00 N ATOM 168 CA PRO A 13 -8.064 18.991 -32.352 1.00 0.00 C ATOM 169 C PRO A 13 -6.899 19.952 -32.151 1.00 0.00 C ATOM 170 O PRO A 13 -6.653 20.421 -31.039 1.00 0.00 O ATOM 171 CB PRO A 13 -7.567 17.655 -32.912 1.00 0.00 C ATOM 172 CG PRO A 13 -7.738 17.775 -34.386 1.00 0.00 C ATOM 173 CD PRO A 13 -8.956 18.632 -34.593 1.00 0.00 C ATOM 0 HA PRO A 13 -8.536 18.909 -31.373 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -6.524 17.478 -32.648 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -8.143 16.820 -32.513 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -6.859 18.228 -34.845 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -7.868 16.795 -34.845 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -8.869 19.243 -35.491 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -9.857 18.029 -34.704 1.00 0.00 H new ATOM 181 N VAL A 14 -6.183 20.242 -33.232 1.00 0.00 N ATOM 182 CA VAL A 14 -5.043 21.149 -33.175 1.00 0.00 C ATOM 183 C VAL A 14 -5.470 22.586 -33.454 1.00 0.00 C ATOM 184 O VAL A 14 -4.742 23.530 -33.147 1.00 0.00 O ATOM 185 CB VAL A 14 -3.952 20.745 -34.184 1.00 0.00 C ATOM 186 CG1 VAL A 14 -3.352 19.398 -33.811 1.00 0.00 C ATOM 187 CG2 VAL A 14 -4.518 20.712 -35.595 1.00 0.00 C ATOM 0 H VAL A 14 -6.372 19.861 -34.159 1.00 0.00 H new ATOM 0 HA VAL A 14 -4.636 21.082 -32.166 1.00 0.00 H new ATOM 0 HB VAL A 14 -3.158 21.491 -34.152 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -2.583 19.129 -34.535 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -2.909 19.460 -32.817 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -4.134 18.638 -33.813 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -3.733 20.425 -36.295 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -5.331 19.988 -35.644 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -4.896 21.700 -35.859 1.00 0.00 H new ATOM 197 N GLN A 15 -6.654 22.742 -34.037 1.00 0.00 N ATOM 198 CA GLN A 15 -7.177 24.066 -34.357 1.00 0.00 C ATOM 199 C GLN A 15 -8.146 24.543 -33.281 1.00 0.00 C ATOM 200 O GLN A 15 -8.032 25.663 -32.781 1.00 0.00 O ATOM 201 CB GLN A 15 -7.877 24.044 -35.717 1.00 0.00 C ATOM 202 CG GLN A 15 -8.120 25.428 -36.298 1.00 0.00 C ATOM 203 CD GLN A 15 -6.837 26.113 -36.728 1.00 0.00 C ATOM 204 OE1 GLN A 15 -5.813 25.464 -36.940 1.00 0.00 O ATOM 205 NE2 GLN A 15 -6.886 27.434 -36.857 1.00 0.00 N ATOM 0 H GLN A 15 -7.268 21.970 -34.297 1.00 0.00 H new ATOM 0 HA GLN A 15 -6.338 24.761 -34.398 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -7.274 23.466 -36.417 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -8.832 23.528 -35.617 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -8.789 25.346 -37.155 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -8.626 26.046 -35.556 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -7.756 27.933 -36.671 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -6.053 27.950 -37.142 1.00 0.00 H new ATOM 214 N GLY A 16 -9.101 23.687 -32.927 1.00 0.00 N ATOM 215 CA GLY A 16 -10.075 24.041 -31.914 1.00 0.00 C ATOM 216 C GLY A 16 -9.451 24.208 -30.542 1.00 0.00 C ATOM 217 O GLY A 16 -9.877 25.054 -29.758 1.00 0.00 O ATOM 0 H GLY A 16 -9.216 22.755 -33.325 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -10.571 24.969 -32.200 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -10.844 23.270 -31.869 1.00 0.00 H new ATOM 221 N ILE A 17 -8.439 23.395 -30.252 1.00 0.00 N ATOM 222 CA ILE A 17 -7.757 23.456 -28.966 1.00 0.00 C ATOM 223 C ILE A 17 -6.699 24.553 -28.957 1.00 0.00 C ATOM 224 O ILE A 17 -6.295 25.031 -27.897 1.00 0.00 O ATOM 225 CB ILE A 17 -7.089 22.112 -28.619 1.00 0.00 C ATOM 226 CG1 ILE A 17 -8.121 20.983 -28.644 1.00 0.00 C ATOM 227 CG2 ILE A 17 -6.416 22.191 -27.257 1.00 0.00 C ATOM 228 CD1 ILE A 17 -7.531 19.618 -28.367 1.00 0.00 C ATOM 0 H ILE A 17 -8.075 22.688 -30.890 1.00 0.00 H new ATOM 0 HA ILE A 17 -8.516 23.680 -28.216 1.00 0.00 H new ATOM 0 HB ILE A 17 -6.326 21.898 -29.368 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -8.894 21.192 -27.905 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -8.608 20.968 -29.619 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -5.949 21.234 -27.026 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -5.656 22.972 -27.272 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -7.161 22.424 -26.496 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -8.320 18.867 -28.401 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -6.778 19.387 -29.121 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -7.069 19.615 -27.380 1.00 0.00 H new ATOM 240 N ILE A 18 -6.254 24.950 -30.146 1.00 0.00 N ATOM 241 CA ILE A 18 -5.247 25.994 -30.274 1.00 0.00 C ATOM 242 C ILE A 18 -5.772 27.331 -29.768 1.00 0.00 C ATOM 243 O ILE A 18 -5.028 28.125 -29.193 1.00 0.00 O ATOM 244 CB ILE A 18 -4.787 26.156 -31.735 1.00 0.00 C ATOM 245 CG1 ILE A 18 -3.340 25.686 -31.893 1.00 0.00 C ATOM 246 CG2 ILE A 18 -4.931 27.604 -32.178 1.00 0.00 C ATOM 247 CD1 ILE A 18 -2.349 26.504 -31.097 1.00 0.00 C ATOM 0 H ILE A 18 -6.576 24.563 -31.033 1.00 0.00 H new ATOM 0 HA ILE A 18 -4.397 25.687 -29.665 1.00 0.00 H new ATOM 0 HB ILE A 18 -5.421 25.537 -32.370 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -3.269 24.643 -31.584 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -3.067 25.725 -32.948 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -4.602 27.702 -33.212 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.975 27.907 -32.099 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -4.319 28.242 -31.540 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -1.344 26.114 -31.257 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -2.391 27.544 -31.422 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -2.597 26.445 -30.037 1.00 0.00 H new ATOM 259 N ASN A 19 -7.061 27.576 -29.984 1.00 0.00 N ATOM 260 CA ASN A 19 -7.688 28.818 -29.548 1.00 0.00 C ATOM 261 C ASN A 19 -8.348 28.644 -28.182 1.00 0.00 C ATOM 262 O ASN A 19 -8.547 29.613 -27.450 1.00 0.00 O ATOM 263 CB ASN A 19 -8.725 29.279 -30.573 1.00 0.00 C ATOM 264 CG ASN A 19 -8.206 30.395 -31.458 1.00 0.00 C ATOM 265 OD1 ASN A 19 -7.390 31.212 -31.031 1.00 0.00 O ATOM 266 ND2 ASN A 19 -8.680 30.436 -32.699 1.00 0.00 N ATOM 0 H ASN A 19 -7.692 26.930 -30.459 1.00 0.00 H new ATOM 0 HA ASN A 19 -6.911 29.577 -29.463 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -9.019 28.433 -31.194 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -9.621 29.618 -30.052 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -8.368 31.166 -33.340 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -9.355 29.738 -33.010 1.00 0.00 H new ATOM 273 N PHE A 20 -8.687 27.403 -27.849 1.00 0.00 N ATOM 274 CA PHE A 20 -9.326 27.102 -26.573 1.00 0.00 C ATOM 275 C PHE A 20 -8.288 26.973 -25.464 1.00 0.00 C ATOM 276 O PHE A 20 -8.548 27.322 -24.312 1.00 0.00 O ATOM 277 CB PHE A 20 -10.139 25.811 -26.679 1.00 0.00 C ATOM 278 CG PHE A 20 -11.612 26.043 -26.856 1.00 0.00 C ATOM 279 CD1 PHE A 20 -12.301 26.888 -25.999 1.00 0.00 C ATOM 280 CD2 PHE A 20 -12.308 25.416 -27.876 1.00 0.00 C ATOM 281 CE1 PHE A 20 -13.656 27.102 -26.159 1.00 0.00 C ATOM 282 CE2 PHE A 20 -13.665 25.628 -28.041 1.00 0.00 C ATOM 283 CZ PHE A 20 -14.339 26.473 -27.182 1.00 0.00 C ATOM 0 H PHE A 20 -8.530 26.590 -28.445 1.00 0.00 H new ATOM 0 HA PHE A 20 -9.996 27.926 -26.326 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -9.768 25.225 -27.520 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -9.979 25.215 -25.780 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -11.773 27.384 -25.198 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -11.785 24.754 -28.550 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -14.182 27.761 -25.484 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -14.196 25.133 -28.841 1.00 0.00 H new ATOM 0 HZ PHE A 20 -15.398 26.642 -27.310 1.00 0.00 H new ATOM 293 N GLU A 21 -7.109 26.469 -25.817 1.00 0.00 N ATOM 294 CA GLU A 21 -6.032 26.292 -24.849 1.00 0.00 C ATOM 295 C GLU A 21 -5.254 27.591 -24.659 1.00 0.00 C ATOM 296 O GLU A 21 -4.482 27.730 -23.710 1.00 0.00 O ATOM 297 CB GLU A 21 -5.086 25.180 -25.304 1.00 0.00 C ATOM 298 CG GLU A 21 -4.121 24.723 -24.225 1.00 0.00 C ATOM 299 CD GLU A 21 -2.697 24.596 -24.729 1.00 0.00 C ATOM 300 OE1 GLU A 21 -2.470 23.813 -25.675 1.00 0.00 O ATOM 301 OE2 GLU A 21 -1.808 25.281 -24.179 1.00 0.00 O1- ATOM 0 H GLU A 21 -6.876 26.176 -26.766 1.00 0.00 H new ATOM 0 HA GLU A 21 -6.477 26.012 -23.894 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -5.676 24.326 -25.637 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -4.516 25.529 -26.165 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -4.147 25.431 -23.397 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -4.450 23.761 -23.833 1.00 0.00 H new ATOM 308 N GLN A 22 -5.465 28.539 -25.566 1.00 0.00 N ATOM 309 CA GLN A 22 -4.783 29.826 -25.498 1.00 0.00 C ATOM 310 C GLN A 22 -5.696 30.895 -24.906 1.00 0.00 C ATOM 311 O GLN A 22 -5.237 31.804 -24.214 1.00 0.00 O ATOM 312 CB GLN A 22 -4.316 30.253 -26.890 1.00 0.00 C ATOM 313 CG GLN A 22 -5.433 30.789 -27.771 1.00 0.00 C ATOM 314 CD GLN A 22 -5.584 32.294 -27.670 1.00 0.00 C ATOM 315 OE1 GLN A 22 -5.097 32.916 -26.726 1.00 0.00 O ATOM 316 NE2 GLN A 22 -6.259 32.888 -28.647 1.00 0.00 N ATOM 0 H GLN A 22 -6.102 28.440 -26.356 1.00 0.00 H new ATOM 0 HA GLN A 22 -3.915 29.715 -24.849 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -3.547 31.019 -26.787 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -3.852 29.400 -27.385 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -5.236 30.516 -28.808 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -6.373 30.314 -27.490 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -6.646 32.333 -29.410 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -6.391 33.899 -28.634 1.00 0.00 H new ATOM 325 N LYS A 23 -6.991 30.781 -25.181 1.00 0.00 N ATOM 326 CA LYS A 23 -7.968 31.735 -24.675 1.00 0.00 C ATOM 327 C LYS A 23 -8.401 31.372 -23.258 1.00 0.00 C ATOM 328 O LYS A 23 -8.608 32.248 -22.419 1.00 0.00 O ATOM 329 CB LYS A 23 -9.190 31.782 -25.596 1.00 0.00 C ATOM 330 CG LYS A 23 -8.908 32.423 -26.945 1.00 0.00 C ATOM 331 CD LYS A 23 -10.144 32.424 -27.828 1.00 0.00 C ATOM 332 CE LYS A 23 -9.840 32.983 -29.210 1.00 0.00 C ATOM 333 NZ LYS A 23 -10.787 32.468 -30.238 1.00 0.00 N1+ ATOM 0 H LYS A 23 -7.388 30.035 -25.753 1.00 0.00 H new ATOM 0 HA LYS A 23 -7.499 32.719 -24.652 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -9.555 30.767 -25.754 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -9.988 32.334 -25.100 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -8.563 33.447 -26.798 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -8.103 31.884 -27.444 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -10.527 31.408 -27.921 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -10.928 33.018 -27.358 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -9.892 34.071 -29.181 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -8.820 32.720 -29.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -10.486 32.790 -31.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -10.794 31.428 -30.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -11.743 32.825 -30.039 1.00 0.00 H new ATOM 347 N GLU A 24 -8.533 30.075 -22.999 1.00 0.00 N ATOM 348 CA GLU A 24 -8.942 29.597 -21.683 1.00 0.00 C ATOM 349 C GLU A 24 -7.736 29.456 -20.758 1.00 0.00 C ATOM 350 O GLU A 24 -7.840 28.897 -19.667 1.00 0.00 O ATOM 351 CB GLU A 24 -9.666 28.254 -21.804 1.00 0.00 C ATOM 352 CG GLU A 24 -10.826 28.099 -20.837 1.00 0.00 C ATOM 353 CD GLU A 24 -11.876 27.125 -21.338 1.00 0.00 C ATOM 354 OE1 GLU A 24 -12.012 26.981 -22.570 1.00 0.00 O ATOM 355 OE2 GLU A 24 -12.560 26.508 -20.495 1.00 0.00 O1- ATOM 0 H GLU A 24 -8.363 29.337 -23.682 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.625 30.331 -21.254 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -10.036 28.141 -22.823 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -8.951 27.449 -21.633 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -10.448 27.757 -19.874 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -11.288 29.072 -20.670 1.00 0.00 H new ATOM 362 N SER A 25 -6.592 29.968 -21.203 1.00 0.00 N ATOM 363 CA SER A 25 -5.365 29.895 -20.419 1.00 0.00 C ATOM 364 C SER A 25 -4.858 31.292 -20.076 1.00 0.00 C ATOM 365 O SER A 25 -3.723 31.460 -19.632 1.00 0.00 O ATOM 366 CB SER A 25 -4.291 29.123 -21.185 1.00 0.00 C ATOM 367 OG SER A 25 -4.450 27.724 -21.018 1.00 0.00 O ATOM 0 H SER A 25 -6.490 30.438 -22.103 1.00 0.00 H new ATOM 0 HA SER A 25 -5.586 29.369 -19.490 1.00 0.00 H new ATOM 0 HB2 SER A 25 -4.344 29.374 -22.244 1.00 0.00 H new ATOM 0 HB3 SER A 25 -3.303 29.424 -20.835 1.00 0.00 H new ATOM 0 HG SER A 25 -4.512 27.295 -21.897 1.00 0.00 H new ATOM 373 N ASN A 26 -5.708 32.292 -20.284 1.00 0.00 N ATOM 374 CA ASN A 26 -5.345 33.676 -19.998 1.00 0.00 C ATOM 375 C ASN A 26 -6.546 34.599 -20.174 1.00 0.00 C ATOM 376 O ASN A 26 -6.710 35.570 -19.436 1.00 0.00 O ATOM 377 CB ASN A 26 -4.203 34.124 -20.911 1.00 0.00 C ATOM 378 CG ASN A 26 -3.096 34.829 -20.149 1.00 0.00 C ATOM 379 OD1 ASN A 26 -3.014 36.057 -20.145 1.00 0.00 O ATOM 380 ND2 ASN A 26 -2.239 34.050 -19.498 1.00 0.00 N ATOM 0 H ASN A 26 -6.653 32.170 -20.649 1.00 0.00 H new ATOM 0 HA ASN A 26 -5.014 33.733 -18.961 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -3.791 33.256 -21.425 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -4.595 34.792 -21.678 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -1.474 34.466 -18.967 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -2.346 33.036 -19.530 1.00 0.00 H new ATOM 387 N GLY A 27 -7.385 34.289 -21.159 1.00 0.00 N ATOM 388 CA GLY A 27 -8.560 35.102 -21.414 1.00 0.00 C ATOM 389 C GLY A 27 -9.556 35.057 -20.272 1.00 0.00 C ATOM 390 O GLY A 27 -9.249 35.425 -19.138 1.00 0.00 O ATOM 0 H GLY A 27 -7.272 33.491 -21.784 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -8.254 36.134 -21.584 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -9.044 34.758 -22.328 1.00 0.00 H new ATOM 394 N PRO A 28 -10.781 34.596 -20.568 1.00 0.00 N ATOM 395 CA PRO A 28 -11.850 34.496 -19.570 1.00 0.00 C ATOM 396 C PRO A 28 -11.582 33.402 -18.541 1.00 0.00 C ATOM 397 O PRO A 28 -12.466 32.608 -18.219 1.00 0.00 O ATOM 398 CB PRO A 28 -13.084 34.150 -20.408 1.00 0.00 C ATOM 399 CG PRO A 28 -12.543 33.486 -21.626 1.00 0.00 C ATOM 400 CD PRO A 28 -11.216 34.139 -21.899 1.00 0.00 C ATOM 0 HA PRO A 28 -11.954 35.413 -18.990 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -13.759 33.489 -19.864 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -13.652 35.045 -20.664 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -12.425 32.414 -21.466 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -13.220 33.610 -22.471 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -10.505 33.437 -22.335 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -11.313 34.970 -22.597 1.00 0.00 H new ATOM 408 N VAL A 29 -10.356 33.369 -18.027 1.00 0.00 N ATOM 409 CA VAL A 29 -9.972 32.373 -17.032 1.00 0.00 C ATOM 410 C VAL A 29 -9.024 32.970 -15.998 1.00 0.00 C ATOM 411 O VAL A 29 -9.149 32.705 -14.803 1.00 0.00 O ATOM 412 CB VAL A 29 -9.296 31.155 -17.691 1.00 0.00 C ATOM 413 CG1 VAL A 29 -8.773 30.197 -16.631 1.00 0.00 C ATOM 414 CG2 VAL A 29 -10.265 30.451 -18.628 1.00 0.00 C ATOM 0 H VAL A 29 -9.613 34.019 -18.282 1.00 0.00 H new ATOM 0 HA VAL A 29 -10.887 32.047 -16.537 1.00 0.00 H new ATOM 0 HB VAL A 29 -8.448 31.505 -18.280 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -8.299 29.343 -17.115 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -8.043 30.710 -16.005 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -9.601 29.850 -16.013 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -9.771 29.593 -19.085 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -11.134 30.112 -18.065 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -10.585 31.143 -19.407 1.00 0.00 H new ATOM 424 N LYS A 30 -8.076 33.774 -16.465 1.00 0.00 N ATOM 425 CA LYS A 30 -7.107 34.410 -15.580 1.00 0.00 C ATOM 426 C LYS A 30 -7.420 35.892 -15.408 1.00 0.00 C ATOM 427 O LYS A 30 -7.181 36.467 -14.346 1.00 0.00 O ATOM 428 CB LYS A 30 -5.690 34.236 -16.134 1.00 0.00 C ATOM 429 CG LYS A 30 -5.036 32.926 -15.733 1.00 0.00 C ATOM 430 CD LYS A 30 -4.465 32.196 -16.937 1.00 0.00 C ATOM 431 CE LYS A 30 -4.084 30.765 -16.592 1.00 0.00 C ATOM 432 NZ LYS A 30 -5.279 29.934 -16.278 1.00 0.00 N1+ ATOM 0 H LYS A 30 -7.957 34.001 -17.452 1.00 0.00 H new ATOM 0 HA LYS A 30 -7.170 33.928 -14.604 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -5.724 34.297 -17.222 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -5.070 35.063 -15.788 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -4.241 33.121 -15.014 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -5.768 32.290 -15.235 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -5.198 32.194 -17.744 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -3.588 32.729 -17.304 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -3.543 30.322 -17.428 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -3.407 30.765 -15.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -5.034 28.927 -16.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -5.594 30.132 -15.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -6.045 30.162 -16.943 1.00 0.00 H new ATOM 446 N VAL A 31 -7.953 36.507 -16.459 1.00 0.00 N ATOM 447 CA VAL A 31 -8.300 37.922 -16.422 1.00 0.00 C ATOM 448 C VAL A 31 -9.346 38.204 -15.349 1.00 0.00 C ATOM 449 O VAL A 31 -9.559 39.353 -14.963 1.00 0.00 O ATOM 450 CB VAL A 31 -8.836 38.404 -17.784 1.00 0.00 C ATOM 451 CG1 VAL A 31 -9.197 39.880 -17.723 1.00 0.00 C ATOM 452 CG2 VAL A 31 -7.815 38.142 -18.880 1.00 0.00 C ATOM 0 H VAL A 31 -8.154 36.047 -17.347 1.00 0.00 H new ATOM 0 HA VAL A 31 -7.385 38.466 -16.186 1.00 0.00 H new ATOM 0 HB VAL A 31 -9.740 37.843 -18.019 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -9.574 40.203 -18.694 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -9.965 40.036 -16.966 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -8.311 40.461 -17.466 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -8.210 38.488 -19.835 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -6.892 38.676 -18.653 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -7.610 37.073 -18.938 1.00 0.00 H new ATOM 462 N TRP A 32 -9.996 37.147 -14.872 1.00 0.00 N ATOM 463 CA TRP A 32 -11.019 37.282 -13.843 1.00 0.00 C ATOM 464 C TRP A 32 -10.418 37.788 -12.536 1.00 0.00 C ATOM 465 O TRP A 32 -10.823 38.826 -12.017 1.00 0.00 O ATOM 466 CB TRP A 32 -11.715 35.939 -13.608 1.00 0.00 C ATOM 467 CG TRP A 32 -13.200 35.999 -13.801 1.00 0.00 C ATOM 468 CD1 TRP A 32 -13.870 36.100 -14.988 1.00 0.00 C ATOM 469 CD2 TRP A 32 -14.200 35.961 -12.777 1.00 0.00 C ATOM 470 NE1 TRP A 32 -15.225 36.130 -14.763 1.00 0.00 N ATOM 471 CE2 TRP A 32 -15.454 36.045 -13.415 1.00 0.00 C ATOM 472 CE3 TRP A 32 -14.159 35.863 -11.384 1.00 0.00 C ATOM 473 CZ2 TRP A 32 -16.651 36.034 -12.705 1.00 0.00 C ATOM 474 CZ3 TRP A 32 -15.349 35.853 -10.681 1.00 0.00 C ATOM 475 CH2 TRP A 32 -16.581 35.938 -11.341 1.00 0.00 C ATOM 0 H TRP A 32 -9.832 36.189 -15.182 1.00 0.00 H new ATOM 0 HA TRP A 32 -11.751 38.011 -14.191 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -11.297 35.197 -14.288 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -11.501 35.599 -12.595 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -13.403 36.149 -15.960 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -15.944 36.204 -15.483 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -13.214 35.796 -10.865 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -17.602 36.099 -13.212 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -15.328 35.778 -9.604 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -17.493 35.928 -10.763 1.00 0.00 H new ATOM 486 N GLY A 33 -9.444 37.049 -12.012 1.00 0.00 N ATOM 487 CA GLY A 33 -8.801 37.442 -10.772 1.00 0.00 C ATOM 488 C GLY A 33 -7.433 36.812 -10.604 1.00 0.00 C ATOM 489 O GLY A 33 -6.877 36.799 -9.506 1.00 0.00 O ATOM 0 H GLY A 33 -9.089 36.186 -12.424 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -8.704 38.527 -10.745 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -9.434 37.158 -9.932 1.00 0.00 H new ATOM 493 N SER A 34 -6.886 36.286 -11.696 1.00 0.00 N ATOM 494 CA SER A 34 -5.576 35.646 -11.664 1.00 0.00 C ATOM 495 C SER A 34 -4.462 36.685 -11.762 1.00 0.00 C ATOM 496 O SER A 34 -3.665 36.843 -10.838 1.00 0.00 O ATOM 497 CB SER A 34 -5.449 34.637 -12.806 1.00 0.00 C ATOM 498 OG SER A 34 -4.255 33.884 -12.692 1.00 0.00 O ATOM 0 H SER A 34 -7.330 36.291 -12.614 1.00 0.00 H new ATOM 0 HA SER A 34 -5.478 35.121 -10.714 1.00 0.00 H new ATOM 0 HB2 SER A 34 -6.308 33.966 -12.799 1.00 0.00 H new ATOM 0 HB3 SER A 34 -5.462 35.161 -13.762 1.00 0.00 H new ATOM 0 HG SER A 34 -3.483 34.483 -12.764 1.00 0.00 H new ATOM 504 N ILE A 35 -4.416 37.388 -12.888 1.00 0.00 N ATOM 505 CA ILE A 35 -3.401 38.413 -13.107 1.00 0.00 C ATOM 506 C ILE A 35 -3.446 39.474 -12.012 1.00 0.00 C ATOM 507 O ILE A 35 -2.516 40.263 -11.860 1.00 0.00 O ATOM 508 CB ILE A 35 -3.576 39.095 -14.475 1.00 0.00 C ATOM 509 CG1 ILE A 35 -5.038 39.498 -14.687 1.00 0.00 C ATOM 510 CG2 ILE A 35 -3.109 38.172 -15.591 1.00 0.00 C ATOM 511 CD1 ILE A 35 -5.257 40.357 -15.911 1.00 0.00 C ATOM 0 H ILE A 35 -5.069 37.268 -13.663 1.00 0.00 H new ATOM 0 HA ILE A 35 -2.434 37.910 -13.083 1.00 0.00 H new ATOM 0 HB ILE A 35 -2.964 39.997 -14.495 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -5.646 38.597 -14.772 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -5.389 40.037 -13.807 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.239 38.669 -16.552 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.056 37.931 -15.447 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.697 37.254 -15.574 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -6.315 40.604 -15.998 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -4.676 41.275 -15.820 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -4.938 39.812 -16.800 1.00 0.00 H new ATOM 523 N LYS A 36 -4.535 39.486 -11.252 1.00 0.00 N ATOM 524 CA LYS A 36 -4.703 40.447 -10.169 1.00 0.00 C ATOM 525 C LYS A 36 -4.893 39.735 -8.834 1.00 0.00 C ATOM 526 O LYS A 36 -5.246 40.356 -7.832 1.00 0.00 O ATOM 527 CB LYS A 36 -5.900 41.357 -10.447 1.00 0.00 C ATOM 528 CG LYS A 36 -5.590 42.496 -11.403 1.00 0.00 C ATOM 529 CD LYS A 36 -6.288 42.310 -12.740 1.00 0.00 C ATOM 530 CE LYS A 36 -7.501 43.218 -12.866 1.00 0.00 C ATOM 531 NZ LYS A 36 -8.502 42.675 -13.825 1.00 0.00 N1+ ATOM 0 H LYS A 36 -5.316 38.840 -11.366 1.00 0.00 H new ATOM 0 HA LYS A 36 -3.799 41.053 -10.113 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -6.712 40.759 -10.860 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -6.257 41.772 -9.504 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -5.902 43.441 -10.958 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -4.513 42.557 -11.560 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -5.589 42.521 -13.549 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -6.597 41.270 -12.849 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -7.965 43.342 -11.888 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -7.182 44.207 -13.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -9.314 43.322 -13.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -8.067 42.580 -14.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -8.826 41.742 -13.498 1.00 0.00 H new ATOM 545 N GLY A 37 -4.654 38.426 -8.826 1.00 0.00 N ATOM 546 CA GLY A 37 -4.802 37.653 -7.607 1.00 0.00 C ATOM 547 C GLY A 37 -3.836 36.485 -7.539 1.00 0.00 C ATOM 548 O GLY A 37 -2.974 36.434 -6.663 1.00 0.00 O ATOM 0 H GLY A 37 -4.361 37.888 -9.642 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -4.642 38.303 -6.747 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -5.824 37.280 -7.539 1.00 0.00 H new ATOM 552 N LEU A 38 -3.982 35.547 -8.469 1.00 0.00 N ATOM 553 CA LEU A 38 -3.117 34.373 -8.510 1.00 0.00 C ATOM 554 C LEU A 38 -1.731 34.736 -9.035 1.00 0.00 C ATOM 555 O LEU A 38 -0.721 34.500 -8.372 1.00 0.00 O ATOM 556 CB LEU A 38 -3.738 33.287 -9.390 1.00 0.00 C ATOM 557 CG LEU A 38 -4.991 32.607 -8.834 1.00 0.00 C ATOM 558 CD1 LEU A 38 -5.529 31.587 -9.823 1.00 0.00 C ATOM 559 CD2 LEU A 38 -4.689 31.948 -7.495 1.00 0.00 C ATOM 0 H LEU A 38 -4.690 35.576 -9.203 1.00 0.00 H new ATOM 0 HA LEU A 38 -3.014 33.994 -7.493 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -3.986 33.728 -10.356 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -2.984 32.521 -9.574 1.00 0.00 H new ATOM 0 HG LEU A 38 -5.756 33.368 -8.678 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.420 31.114 -9.410 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -5.784 32.086 -10.758 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.770 30.828 -10.012 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -5.591 31.469 -7.114 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -3.908 31.199 -7.626 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.352 32.704 -6.785 1.00 0.00 H new ATOM 571 N THR A 39 -1.691 35.314 -10.231 1.00 0.00 N ATOM 572 CA THR A 39 -0.429 35.714 -10.844 1.00 0.00 C ATOM 573 C THR A 39 0.095 37.006 -10.233 1.00 0.00 C ATOM 574 O THR A 39 1.275 37.332 -10.366 1.00 0.00 O ATOM 575 CB THR A 39 -0.581 35.902 -12.366 1.00 0.00 C ATOM 576 OG1 THR A 39 -1.884 35.485 -12.785 1.00 0.00 O ATOM 577 CG2 THR A 39 0.476 35.107 -13.117 1.00 0.00 C ATOM 0 H THR A 39 -2.517 35.516 -10.795 1.00 0.00 H new ATOM 0 HA THR A 39 0.284 34.912 -10.653 1.00 0.00 H new ATOM 0 HB THR A 39 -0.449 36.960 -12.593 1.00 0.00 H new ATOM 0 HG1 THR A 39 -1.972 35.610 -13.753 1.00 0.00 H new ATOM 0 HG21 THR A 39 0.349 35.255 -14.189 1.00 0.00 H new ATOM 0 HG22 THR A 39 1.468 35.447 -12.819 1.00 0.00 H new ATOM 0 HG23 THR A 39 0.370 34.048 -12.882 1.00 0.00 H new ATOM 585 N GLU A 40 -0.787 37.740 -9.562 1.00 0.00 N ATOM 586 CA GLU A 40 -0.411 38.999 -8.930 1.00 0.00 C ATOM 587 C GLU A 40 -0.055 38.785 -7.461 1.00 0.00 C ATOM 588 O GLU A 40 0.706 39.555 -6.877 1.00 0.00 O ATOM 589 CB GLU A 40 -1.548 40.015 -9.049 1.00 0.00 C ATOM 590 CG GLU A 40 -1.535 41.072 -7.957 1.00 0.00 C ATOM 591 CD GLU A 40 -2.262 40.624 -6.703 1.00 0.00 C ATOM 592 OE1 GLU A 40 -2.700 39.455 -6.657 1.00 0.00 O ATOM 593 OE2 GLU A 40 -2.394 41.442 -5.769 1.00 0.00 O1- ATOM 0 H GLU A 40 -1.767 37.484 -9.442 1.00 0.00 H new ATOM 0 HA GLU A 40 0.467 39.387 -9.446 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -1.485 40.507 -10.020 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -2.501 39.487 -9.021 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -0.503 41.317 -7.706 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -1.997 41.984 -8.334 1.00 0.00 H new ATOM 600 N GLY A 41 -0.613 37.733 -6.869 1.00 0.00 N ATOM 601 CA GLY A 41 -0.345 37.437 -5.475 1.00 0.00 C ATOM 602 C GLY A 41 0.663 36.318 -5.303 1.00 0.00 C ATOM 603 O GLY A 41 1.527 36.380 -4.428 1.00 0.00 O ATOM 0 H GLY A 41 -1.246 37.080 -7.331 1.00 0.00 H new ATOM 0 HA2 GLY A 41 0.026 38.335 -4.981 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -1.276 37.162 -4.980 1.00 0.00 H new ATOM 607 N LEU A 42 0.554 35.293 -6.139 1.00 0.00 N ATOM 608 CA LEU A 42 1.464 34.153 -6.076 1.00 0.00 C ATOM 609 C LEU A 42 2.676 34.374 -6.976 1.00 0.00 C ATOM 610 O LEU A 42 3.754 33.831 -6.726 1.00 0.00 O ATOM 611 CB LEU A 42 0.737 32.872 -6.486 1.00 0.00 C ATOM 612 CG LEU A 42 -0.733 32.772 -6.073 1.00 0.00 C ATOM 613 CD1 LEU A 42 -1.415 31.620 -6.796 1.00 0.00 C ATOM 614 CD2 LEU A 42 -0.854 32.605 -4.566 1.00 0.00 C ATOM 0 H LEU A 42 -0.155 35.226 -6.869 1.00 0.00 H new ATOM 0 HA LEU A 42 1.811 34.053 -5.048 1.00 0.00 H new ATOM 0 HB2 LEU A 42 0.796 32.776 -7.570 1.00 0.00 H new ATOM 0 HB3 LEU A 42 1.272 32.023 -6.061 1.00 0.00 H new ATOM 0 HG LEU A 42 -1.233 33.698 -6.357 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -2.459 31.565 -6.489 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -1.361 31.783 -7.872 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -0.914 30.685 -6.545 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -1.906 32.536 -4.291 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -0.338 31.696 -4.258 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -0.405 33.464 -4.068 1.00 0.00 H new ATOM 626 N HIS A 43 2.493 35.172 -8.022 1.00 0.00 N ATOM 627 CA HIS A 43 3.573 35.466 -8.958 1.00 0.00 C ATOM 628 C HIS A 43 3.859 36.964 -9.002 1.00 0.00 C ATOM 629 O HIS A 43 4.860 37.398 -9.570 1.00 0.00 O ATOM 630 CB HIS A 43 3.217 34.961 -10.356 1.00 0.00 C ATOM 631 CG HIS A 43 4.306 34.159 -10.999 1.00 0.00 C ATOM 632 ND1 HIS A 43 4.259 32.787 -11.122 1.00 0.00 N ATOM 633 CD2 HIS A 43 5.478 34.546 -11.557 1.00 0.00 C ATOM 634 CE1 HIS A 43 5.353 32.363 -11.728 1.00 0.00 C ATOM 635 NE2 HIS A 43 6.109 33.410 -12.001 1.00 0.00 N ATOM 0 H HIS A 43 1.607 35.627 -8.244 1.00 0.00 H new ATOM 0 HA HIS A 43 4.470 34.952 -8.613 1.00 0.00 H new ATOM 0 HB2 HIS A 43 2.316 34.351 -10.294 1.00 0.00 H new ATOM 0 HB3 HIS A 43 2.981 35.814 -10.992 1.00 0.00 H new ATOM 0 HD2 HIS A 43 5.847 35.558 -11.638 1.00 0.00 H new ATOM 0 HE1 HIS A 43 5.589 31.335 -11.961 1.00 0.00 H new ATOM 0 HE2 HIS A 43 7.016 33.380 -12.467 1.00 0.00 H new ATOM 643 N GLY A 44 2.970 37.751 -8.402 1.00 0.00 N ATOM 644 CA GLY A 44 3.145 39.191 -8.386 1.00 0.00 C ATOM 645 C GLY A 44 3.573 39.708 -7.029 1.00 0.00 C ATOM 646 O GLY A 44 4.179 40.776 -6.924 1.00 0.00 O ATOM 0 H GLY A 44 2.132 37.416 -7.927 1.00 0.00 H new ATOM 0 HA2 GLY A 44 3.891 39.471 -9.130 1.00 0.00 H new ATOM 0 HA3 GLY A 44 2.210 39.671 -8.676 1.00 0.00 H new ATOM 650 N PHE A 45 3.260 38.951 -5.983 1.00 0.00 N ATOM 651 CA PHE A 45 3.615 39.341 -4.623 1.00 0.00 C ATOM 652 C PHE A 45 4.465 38.266 -3.953 1.00 0.00 C ATOM 653 O PHE A 45 5.096 38.508 -2.923 1.00 0.00 O ATOM 654 CB PHE A 45 2.352 39.595 -3.796 1.00 0.00 C ATOM 655 CG PHE A 45 2.602 39.644 -2.316 1.00 0.00 C ATOM 656 CD1 PHE A 45 2.571 38.484 -1.557 1.00 0.00 C ATOM 657 CD2 PHE A 45 2.873 40.847 -1.686 1.00 0.00 C ATOM 658 CE1 PHE A 45 2.800 38.527 -0.194 1.00 0.00 C ATOM 659 CE2 PHE A 45 3.105 40.894 -0.323 1.00 0.00 C ATOM 660 CZ PHE A 45 3.069 39.733 0.422 1.00 0.00 C ATOM 0 H PHE A 45 2.761 38.064 -6.051 1.00 0.00 H new ATOM 0 HA PHE A 45 4.198 40.260 -4.677 1.00 0.00 H new ATOM 0 HB2 PHE A 45 1.905 40.537 -4.112 1.00 0.00 H new ATOM 0 HB3 PHE A 45 1.625 38.810 -4.007 1.00 0.00 H new ATOM 0 HD1 PHE A 45 2.366 37.538 -2.035 1.00 0.00 H new ATOM 0 HD2 PHE A 45 2.904 41.758 -2.265 1.00 0.00 H new ATOM 0 HE1 PHE A 45 2.768 37.618 0.388 1.00 0.00 H new ATOM 0 HE2 PHE A 45 3.314 41.838 0.158 1.00 0.00 H new ATOM 0 HZ PHE A 45 3.251 39.768 1.486 1.00 0.00 H new ATOM 670 N HIS A 46 4.477 37.075 -4.545 1.00 0.00 N ATOM 671 CA HIS A 46 5.251 35.961 -4.006 1.00 0.00 C ATOM 672 C HIS A 46 6.530 35.748 -4.811 1.00 0.00 C ATOM 673 O HIS A 46 7.621 35.665 -4.250 1.00 0.00 O ATOM 674 CB HIS A 46 4.412 34.682 -4.010 1.00 0.00 C ATOM 675 CG HIS A 46 3.850 34.331 -2.666 1.00 0.00 C ATOM 676 ND1 HIS A 46 2.498 34.207 -2.426 1.00 0.00 N ATOM 677 CD2 HIS A 46 4.466 34.074 -1.489 1.00 0.00 C ATOM 678 CE1 HIS A 46 2.307 33.893 -1.157 1.00 0.00 C ATOM 679 NE2 HIS A 46 3.484 33.804 -0.567 1.00 0.00 N ATOM 0 H HIS A 46 3.960 36.857 -5.397 1.00 0.00 H new ATOM 0 HA HIS A 46 5.526 36.204 -2.979 1.00 0.00 H new ATOM 0 HB2 HIS A 46 3.592 34.797 -4.719 1.00 0.00 H new ATOM 0 HB3 HIS A 46 5.027 33.855 -4.365 1.00 0.00 H new ATOM 0 HD2 HIS A 46 5.531 34.080 -1.308 1.00 0.00 H new ATOM 0 HE1 HIS A 46 1.350 33.736 -0.683 1.00 0.00 H new ATOM 0 HE2 HIS A 46 3.639 33.572 0.414 1.00 0.00 H new ATOM 687 N VAL A 47 6.386 35.659 -6.130 1.00 0.00 N ATOM 688 CA VAL A 47 7.527 35.456 -7.012 1.00 0.00 C ATOM 689 C VAL A 47 8.213 36.778 -7.338 1.00 0.00 C ATOM 690 O VAL A 47 9.384 36.981 -7.015 1.00 0.00 O ATOM 691 CB VAL A 47 7.107 34.772 -8.326 1.00 0.00 C ATOM 692 CG1 VAL A 47 8.303 34.617 -9.254 1.00 0.00 C ATOM 693 CG2 VAL A 47 6.466 33.422 -8.041 1.00 0.00 C ATOM 0 H VAL A 47 5.489 35.725 -6.610 1.00 0.00 H new ATOM 0 HA VAL A 47 8.225 34.809 -6.481 1.00 0.00 H new ATOM 0 HB VAL A 47 6.370 35.402 -8.824 1.00 0.00 H new ATOM 0 HG11 VAL A 47 7.987 34.132 -10.177 1.00 0.00 H new ATOM 0 HG12 VAL A 47 8.715 35.600 -9.483 1.00 0.00 H new ATOM 0 HG13 VAL A 47 9.065 34.009 -8.767 1.00 0.00 H new ATOM 0 HG21 VAL A 47 6.175 32.952 -8.980 1.00 0.00 H new ATOM 0 HG22 VAL A 47 7.180 32.783 -7.521 1.00 0.00 H new ATOM 0 HG23 VAL A 47 5.583 33.563 -7.417 1.00 0.00 H new ATOM 703 N HIS A 48 7.475 37.679 -7.980 1.00 0.00 N ATOM 704 CA HIS A 48 8.011 38.984 -8.349 1.00 0.00 C ATOM 705 C HIS A 48 8.142 39.884 -7.124 1.00 0.00 C ATOM 706 O HIS A 48 9.222 40.400 -6.837 1.00 0.00 O ATOM 707 CB HIS A 48 7.114 39.651 -9.393 1.00 0.00 C ATOM 708 CG HIS A 48 7.416 39.233 -10.799 1.00 0.00 C ATOM 709 ND1 HIS A 48 6.643 38.333 -11.499 1.00 0.00 N ATOM 710 CD2 HIS A 48 8.414 39.600 -11.636 1.00 0.00 C ATOM 711 CE1 HIS A 48 7.153 38.162 -12.706 1.00 0.00 C ATOM 712 NE2 HIS A 48 8.230 38.921 -12.814 1.00 0.00 N ATOM 0 H HIS A 48 6.504 37.529 -8.255 1.00 0.00 H new ATOM 0 HA HIS A 48 9.003 38.834 -8.776 1.00 0.00 H new ATOM 0 HB2 HIS A 48 6.073 39.416 -9.169 1.00 0.00 H new ATOM 0 HB3 HIS A 48 7.221 40.733 -9.314 1.00 0.00 H new ATOM 0 HD1 HIS A 48 5.807 37.871 -11.141 1.00 0.00 H new ATOM 0 HD2 HIS A 48 9.208 40.298 -11.417 1.00 0.00 H new ATOM 0 HE1 HIS A 48 6.757 37.513 -13.473 1.00 0.00 H new ATOM 720 N GLU A 49 7.036 40.067 -6.409 1.00 0.00 N ATOM 721 CA GLU A 49 7.029 40.906 -5.216 1.00 0.00 C ATOM 722 C GLU A 49 7.151 42.380 -5.589 1.00 0.00 C ATOM 723 O GLU A 49 6.195 43.146 -5.459 1.00 0.00 O ATOM 724 CB GLU A 49 8.172 40.509 -4.280 1.00 0.00 C ATOM 725 CG GLU A 49 7.708 40.087 -2.896 1.00 0.00 C ATOM 726 CD GLU A 49 8.534 40.711 -1.788 1.00 0.00 C ATOM 727 OE1 GLU A 49 8.176 41.818 -1.332 1.00 0.00 O ATOM 728 OE2 GLU A 49 9.537 40.094 -1.377 1.00 0.00 O1- ATOM 0 H GLU A 49 6.135 39.646 -6.635 1.00 0.00 H new ATOM 0 HA GLU A 49 6.080 40.756 -4.702 1.00 0.00 H new ATOM 0 HB2 GLU A 49 8.732 39.690 -4.731 1.00 0.00 H new ATOM 0 HB3 GLU A 49 8.859 41.350 -4.183 1.00 0.00 H new ATOM 0 HG2 GLU A 49 6.663 40.367 -2.766 1.00 0.00 H new ATOM 0 HG3 GLU A 49 7.760 39.001 -2.815 1.00 0.00 H new ATOM 735 N PHE A 50 8.333 42.774 -6.051 1.00 0.00 N ATOM 736 CA PHE A 50 8.581 44.157 -6.440 1.00 0.00 C ATOM 737 C PHE A 50 8.797 44.267 -7.946 1.00 0.00 C ATOM 738 O PHE A 50 8.784 45.363 -8.507 1.00 0.00 O ATOM 739 CB PHE A 50 9.800 44.708 -5.697 1.00 0.00 C ATOM 740 CG PHE A 50 9.555 46.038 -5.046 1.00 0.00 C ATOM 741 CD1 PHE A 50 9.397 47.181 -5.813 1.00 0.00 C ATOM 742 CD2 PHE A 50 9.480 46.146 -3.666 1.00 0.00 C ATOM 743 CE1 PHE A 50 9.172 48.406 -5.215 1.00 0.00 C ATOM 744 CE2 PHE A 50 9.255 47.369 -3.064 1.00 0.00 C ATOM 745 CZ PHE A 50 9.100 48.500 -3.839 1.00 0.00 C ATOM 0 H PHE A 50 9.135 42.154 -6.165 1.00 0.00 H new ATOM 0 HA PHE A 50 7.704 44.746 -6.172 1.00 0.00 H new ATOM 0 HB2 PHE A 50 10.106 43.991 -4.935 1.00 0.00 H new ATOM 0 HB3 PHE A 50 10.630 44.803 -6.397 1.00 0.00 H new ATOM 0 HD1 PHE A 50 9.450 47.114 -6.890 1.00 0.00 H new ATOM 0 HD2 PHE A 50 9.599 45.264 -3.054 1.00 0.00 H new ATOM 0 HE1 PHE A 50 9.052 49.290 -5.824 1.00 0.00 H new ATOM 0 HE2 PHE A 50 9.200 47.440 -1.988 1.00 0.00 H new ATOM 0 HZ PHE A 50 8.923 49.457 -3.371 1.00 0.00 H new ATOM 755 N GLY A 51 8.994 43.124 -8.596 1.00 0.00 N ATOM 756 CA GLY A 51 9.212 43.114 -10.031 1.00 0.00 C ATOM 757 C GLY A 51 8.096 43.808 -10.789 1.00 0.00 C ATOM 758 O GLY A 51 8.302 44.873 -11.372 1.00 0.00 O ATOM 0 H GLY A 51 9.007 42.205 -8.154 1.00 0.00 H new ATOM 0 HA2 GLY A 51 10.160 43.604 -10.255 1.00 0.00 H new ATOM 0 HA3 GLY A 51 9.296 42.083 -10.376 1.00 0.00 H new ATOM 762 N ASP A 52 6.915 43.201 -10.786 1.00 0.00 N ATOM 763 CA ASP A 52 5.764 43.766 -11.479 1.00 0.00 C ATOM 764 C ASP A 52 4.635 44.073 -10.499 1.00 0.00 C ATOM 765 O ASP A 52 3.680 44.770 -10.839 1.00 0.00 O ATOM 766 CB ASP A 52 5.269 42.803 -12.561 1.00 0.00 C ATOM 767 CG ASP A 52 6.394 41.992 -13.171 1.00 0.00 C ATOM 768 OD1 ASP A 52 7.485 42.560 -13.393 1.00 0.00 O ATOM 769 OD2 ASP A 52 6.186 40.787 -13.424 1.00 0.00 O1- ATOM 0 H ASP A 52 6.730 42.317 -10.311 1.00 0.00 H new ATOM 0 HA ASP A 52 6.077 44.699 -11.949 1.00 0.00 H new ATOM 0 HB2 ASP A 52 4.529 42.127 -12.131 1.00 0.00 H new ATOM 0 HB3 ASP A 52 4.766 43.369 -13.345 1.00 0.00 H new ATOM 774 N ASN A 53 4.752 43.546 -9.286 1.00 0.00 N ATOM 775 CA ASN A 53 3.741 43.763 -8.257 1.00 0.00 C ATOM 776 C ASN A 53 2.487 42.946 -8.549 1.00 0.00 C ATOM 777 O ASN A 53 2.095 42.085 -7.759 1.00 0.00 O ATOM 778 CB ASN A 53 3.388 45.249 -8.167 1.00 0.00 C ATOM 779 CG ASN A 53 3.041 45.674 -6.753 1.00 0.00 C ATOM 780 OD1 ASN A 53 2.343 44.961 -6.032 1.00 0.00 O ATOM 781 ND2 ASN A 53 3.525 46.843 -6.352 1.00 0.00 N ATOM 0 H ASN A 53 5.537 42.965 -8.990 1.00 0.00 H new ATOM 0 HA ASN A 53 4.151 43.436 -7.302 1.00 0.00 H new ATOM 0 HB2 ASN A 53 4.229 45.842 -8.526 1.00 0.00 H new ATOM 0 HB3 ASN A 53 2.545 45.460 -8.825 1.00 0.00 H new ATOM 0 HD21 ASN A 53 3.323 47.183 -5.412 1.00 0.00 H new ATOM 0 HD22 ASN A 53 4.099 47.401 -6.984 1.00 0.00 H new ATOM 788 N THR A 54 1.859 43.221 -9.687 1.00 0.00 N ATOM 789 CA THR A 54 0.648 42.513 -10.083 1.00 0.00 C ATOM 790 C THR A 54 0.744 42.023 -11.524 1.00 0.00 C ATOM 791 O THR A 54 -0.175 41.383 -12.033 1.00 0.00 O ATOM 792 CB THR A 54 -0.598 43.406 -9.938 1.00 0.00 C ATOM 793 OG1 THR A 54 -1.744 42.740 -10.478 1.00 0.00 O ATOM 794 CG2 THR A 54 -0.397 44.736 -10.648 1.00 0.00 C ATOM 0 H THR A 54 2.169 43.930 -10.352 1.00 0.00 H new ATOM 0 HA THR A 54 0.551 41.656 -9.416 1.00 0.00 H new ATOM 0 HB THR A 54 -0.757 43.599 -8.877 1.00 0.00 H new ATOM 0 HG1 THR A 54 -1.482 42.233 -11.275 1.00 0.00 H new ATOM 0 HG21 THR A 54 -1.290 45.349 -10.531 1.00 0.00 H new ATOM 0 HG22 THR A 54 0.458 45.254 -10.214 1.00 0.00 H new ATOM 0 HG23 THR A 54 -0.214 44.559 -11.708 1.00 0.00 H new ATOM 802 N ALA A 55 1.860 42.327 -12.175 1.00 0.00 N ATOM 803 CA ALA A 55 2.078 41.915 -13.556 1.00 0.00 C ATOM 804 C ALA A 55 1.017 42.507 -14.477 1.00 0.00 C ATOM 805 O ALA A 55 0.841 42.056 -15.608 1.00 0.00 O ATOM 806 CB ALA A 55 2.081 40.396 -13.660 1.00 0.00 C ATOM 0 H ALA A 55 2.630 42.858 -11.768 1.00 0.00 H new ATOM 0 HA ALA A 55 3.050 42.292 -13.873 1.00 0.00 H new ATOM 0 HB1 ALA A 55 2.245 40.103 -14.697 1.00 0.00 H new ATOM 0 HB2 ALA A 55 2.879 39.990 -13.038 1.00 0.00 H new ATOM 0 HB3 ALA A 55 1.122 40.006 -13.320 1.00 0.00 H new ATOM 812 N GLY A 56 0.310 43.521 -13.985 1.00 0.00 N ATOM 813 CA GLY A 56 -0.723 44.158 -14.779 1.00 0.00 C ATOM 814 C GLY A 56 -0.559 45.663 -14.847 1.00 0.00 C ATOM 815 O GLY A 56 -0.909 46.288 -15.849 1.00 0.00 O ATOM 0 H GLY A 56 0.435 43.912 -13.051 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -0.705 43.748 -15.789 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -1.699 43.921 -14.356 1.00 0.00 H new ATOM 819 N CYS A 57 -0.026 46.246 -13.780 1.00 0.00 N ATOM 820 CA CYS A 57 0.183 47.689 -13.722 1.00 0.00 C ATOM 821 C CYS A 57 1.671 48.023 -13.679 1.00 0.00 C ATOM 822 O CYS A 57 2.060 49.134 -13.321 1.00 0.00 O ATOM 823 CB CYS A 57 -0.520 48.279 -12.497 1.00 0.00 C ATOM 824 SG CYS A 57 -2.312 48.439 -12.681 1.00 0.00 S ATOM 0 H CYS A 57 0.269 45.743 -12.943 1.00 0.00 H new ATOM 0 HA CYS A 57 -0.243 48.129 -14.624 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -0.309 47.650 -11.632 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -0.098 49.262 -12.287 1.00 0.00 H new ATOM 0 HG CYS A 57 -2.816 48.944 -11.595 1.00 0.00 H new ATOM 830 N THR A 58 2.500 47.049 -14.043 1.00 0.00 N ATOM 831 CA THR A 58 3.945 47.237 -14.043 1.00 0.00 C ATOM 832 C THR A 58 4.631 46.228 -14.956 1.00 0.00 C ATOM 833 O THR A 58 5.849 46.054 -14.901 1.00 0.00 O ATOM 834 CB THR A 58 4.529 47.108 -12.624 1.00 0.00 C ATOM 835 OG1 THR A 58 3.569 47.550 -11.657 1.00 0.00 O ATOM 836 CG2 THR A 58 5.806 47.924 -12.487 1.00 0.00 C ATOM 0 H THR A 58 2.195 46.123 -14.341 1.00 0.00 H new ATOM 0 HA THR A 58 4.132 48.245 -14.414 1.00 0.00 H new ATOM 0 HB THR A 58 4.766 46.059 -12.447 1.00 0.00 H new ATOM 0 HG1 THR A 58 3.302 46.795 -11.092 1.00 0.00 H new ATOM 0 HG21 THR A 58 6.200 47.817 -11.476 1.00 0.00 H new ATOM 0 HG22 THR A 58 6.545 47.566 -13.204 1.00 0.00 H new ATOM 0 HG23 THR A 58 5.589 48.974 -12.683 1.00 0.00 H new ATOM 844 N SER A 59 3.841 45.564 -15.796 1.00 0.00 N ATOM 845 CA SER A 59 4.373 44.570 -16.719 1.00 0.00 C ATOM 846 C SER A 59 3.848 44.802 -18.132 1.00 0.00 C ATOM 847 O SER A 59 4.567 44.616 -19.114 1.00 0.00 O ATOM 848 CB SER A 59 4.004 43.160 -16.252 1.00 0.00 C ATOM 849 OG SER A 59 5.079 42.556 -15.554 1.00 0.00 O ATOM 0 H SER A 59 2.831 45.697 -15.855 1.00 0.00 H new ATOM 0 HA SER A 59 5.458 44.669 -16.733 1.00 0.00 H new ATOM 0 HB2 SER A 59 3.127 43.205 -15.606 1.00 0.00 H new ATOM 0 HB3 SER A 59 3.735 42.547 -17.112 1.00 0.00 H new ATOM 0 HG SER A 59 4.881 41.608 -15.405 1.00 0.00 H new ATOM 855 N ALA A 60 2.587 45.213 -18.226 1.00 0.00 N ATOM 856 CA ALA A 60 1.964 45.474 -19.517 1.00 0.00 C ATOM 857 C ALA A 60 0.564 46.052 -19.345 1.00 0.00 C ATOM 858 O ALA A 60 -0.411 45.511 -19.866 1.00 0.00 O ATOM 859 CB ALA A 60 1.913 44.200 -20.347 1.00 0.00 C ATOM 0 H ALA A 60 1.978 45.372 -17.423 1.00 0.00 H new ATOM 0 HA ALA A 60 2.571 46.212 -20.042 1.00 0.00 H new ATOM 0 HB1 ALA A 60 1.445 44.411 -21.309 1.00 0.00 H new ATOM 0 HB2 ALA A 60 2.926 43.831 -20.509 1.00 0.00 H new ATOM 0 HB3 ALA A 60 1.332 43.444 -19.818 1.00 0.00 H new ATOM 865 N GLY A 61 0.469 47.153 -18.607 1.00 0.00 N ATOM 866 CA GLY A 61 -0.818 47.785 -18.378 1.00 0.00 C ATOM 867 C GLY A 61 -0.990 49.059 -19.182 1.00 0.00 C ATOM 868 O GLY A 61 -0.031 49.613 -19.719 1.00 0.00 O ATOM 0 H GLY A 61 1.260 47.619 -18.163 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -1.614 47.086 -18.636 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -0.924 48.011 -17.317 1.00 0.00 H new ATOM 872 N PRO A 62 -2.238 49.541 -19.273 1.00 0.00 N ATOM 873 CA PRO A 62 -2.563 50.761 -20.018 1.00 0.00 C ATOM 874 C PRO A 62 -2.023 52.015 -19.336 1.00 0.00 C ATOM 875 O PRO A 62 -1.401 52.862 -19.978 1.00 0.00 O ATOM 876 CB PRO A 62 -4.094 50.774 -20.027 1.00 0.00 C ATOM 877 CG PRO A 62 -4.487 49.987 -18.825 1.00 0.00 C ATOM 878 CD PRO A 62 -3.428 48.932 -18.658 1.00 0.00 C ATOM 0 HA PRO A 62 -2.118 50.763 -21.013 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -4.481 51.792 -19.978 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -4.488 50.327 -20.939 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -4.546 50.625 -17.943 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -5.470 49.536 -18.958 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -3.260 48.694 -17.608 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -3.705 48.002 -19.155 1.00 0.00 H new ATOM 886 N HIS A 63 -2.266 52.126 -18.035 1.00 0.00 N ATOM 887 CA HIS A 63 -1.803 53.279 -17.267 1.00 0.00 C ATOM 888 C HIS A 63 -2.200 53.147 -15.799 1.00 0.00 C ATOM 889 O HIS A 63 -3.384 53.075 -15.470 1.00 0.00 O ATOM 890 CB HIS A 63 -2.377 54.569 -17.849 1.00 0.00 C ATOM 891 CG HIS A 63 -1.330 55.544 -18.296 1.00 0.00 C ATOM 892 ND1 HIS A 63 -1.300 56.087 -19.562 1.00 0.00 N ATOM 893 CD2 HIS A 63 -0.271 56.070 -17.636 1.00 0.00 C ATOM 894 CE1 HIS A 63 -0.268 56.907 -19.662 1.00 0.00 C ATOM 895 NE2 HIS A 63 0.372 56.914 -18.506 1.00 0.00 N ATOM 0 H HIS A 63 -2.780 51.434 -17.490 1.00 0.00 H new ATOM 0 HA HIS A 63 -0.715 53.315 -17.330 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -3.017 54.322 -18.696 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -3.009 55.046 -17.100 1.00 0.00 H new ATOM 0 HD1 HIS A 63 -1.969 55.888 -20.305 1.00 0.00 H new ATOM 0 HD2 HIS A 63 0.014 55.864 -16.615 1.00 0.00 H new ATOM 0 HE1 HIS A 63 0.005 57.475 -20.539 1.00 0.00 H new ATOM 903 N PHE A 64 -1.203 53.117 -14.922 1.00 0.00 N ATOM 904 CA PHE A 64 -1.446 52.992 -13.490 1.00 0.00 C ATOM 905 C PHE A 64 -1.056 54.273 -12.758 1.00 0.00 C ATOM 906 O PHE A 64 -1.185 54.369 -11.539 1.00 0.00 O ATOM 907 CB PHE A 64 -0.666 51.808 -12.919 1.00 0.00 C ATOM 908 CG PHE A 64 0.810 52.061 -12.805 1.00 0.00 C ATOM 909 CD1 PHE A 64 1.614 52.081 -13.935 1.00 0.00 C ATOM 910 CD2 PHE A 64 1.396 52.281 -11.568 1.00 0.00 C ATOM 911 CE1 PHE A 64 2.972 52.314 -13.831 1.00 0.00 C ATOM 912 CE2 PHE A 64 2.753 52.515 -11.459 1.00 0.00 C ATOM 913 CZ PHE A 64 3.542 52.532 -12.593 1.00 0.00 C ATOM 0 H PHE A 64 -0.218 53.178 -15.178 1.00 0.00 H new ATOM 0 HA PHE A 64 -2.512 52.820 -13.342 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.062 51.564 -11.933 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -0.829 50.936 -13.553 1.00 0.00 H new ATOM 0 HD1 PHE A 64 1.174 51.913 -14.907 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.784 52.269 -10.678 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.587 52.326 -14.718 1.00 0.00 H new ATOM 0 HE2 PHE A 64 3.196 52.684 -10.489 1.00 0.00 H new ATOM 0 HZ PHE A 64 4.603 52.716 -12.511 1.00 0.00 H new ATOM 923 N ASN A 65 -0.578 55.256 -13.514 1.00 0.00 N ATOM 924 CA ASN A 65 -0.167 56.532 -12.939 1.00 0.00 C ATOM 925 C ASN A 65 -0.032 57.600 -14.022 1.00 0.00 C ATOM 926 O ASN A 65 1.062 57.904 -14.494 1.00 0.00 O ATOM 927 CB ASN A 65 1.160 56.376 -12.195 1.00 0.00 C ATOM 928 CG ASN A 65 0.968 56.230 -10.696 1.00 0.00 C ATOM 929 OD1 ASN A 65 1.354 55.222 -10.104 1.00 0.00 O ATOM 930 ND2 ASN A 65 0.372 57.242 -10.077 1.00 0.00 N ATOM 0 H ASN A 65 -0.466 55.194 -14.526 1.00 0.00 H new ATOM 0 HA ASN A 65 -0.937 56.849 -12.235 1.00 0.00 H new ATOM 0 HB2 ASN A 65 1.688 55.503 -12.578 1.00 0.00 H new ATOM 0 HB3 ASN A 65 1.790 57.243 -12.395 1.00 0.00 H new ATOM 0 HD21 ASN A 65 0.217 57.204 -9.070 1.00 0.00 H new ATOM 0 HD22 ASN A 65 0.069 58.058 -10.609 1.00 0.00 H new ATOM 937 N PRO A 66 -1.173 58.182 -14.423 1.00 0.00 N ATOM 938 CA PRO A 66 -1.207 59.224 -15.453 1.00 0.00 C ATOM 939 C PRO A 66 -0.591 60.534 -14.973 1.00 0.00 C ATOM 940 O PRO A 66 -1.280 61.550 -14.859 1.00 0.00 O ATOM 941 CB PRO A 66 -2.703 59.404 -15.723 1.00 0.00 C ATOM 942 CG PRO A 66 -3.372 58.966 -14.466 1.00 0.00 C ATOM 943 CD PRO A 66 -2.513 57.867 -13.902 1.00 0.00 C ATOM 0 HA PRO A 66 -0.630 58.946 -16.335 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -2.941 60.442 -15.957 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -3.027 58.804 -16.573 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -3.460 59.793 -13.762 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -4.382 58.609 -14.665 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -2.530 57.863 -12.812 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -2.851 56.884 -14.230 1.00 0.00 H new ATOM 951 N LEU A 67 0.707 60.505 -14.693 1.00 0.00 N ATOM 952 CA LEU A 67 1.415 61.691 -14.225 1.00 0.00 C ATOM 953 C LEU A 67 2.876 61.371 -13.928 1.00 0.00 C ATOM 954 O LEU A 67 3.749 62.227 -14.061 1.00 0.00 O ATOM 955 CB LEU A 67 0.739 62.253 -12.973 1.00 0.00 C ATOM 956 CG LEU A 67 0.370 61.232 -11.895 1.00 0.00 C ATOM 957 CD1 LEU A 67 1.578 60.908 -11.030 1.00 0.00 C ATOM 958 CD2 LEU A 67 -0.777 61.753 -11.039 1.00 0.00 C ATOM 0 H LEU A 67 1.291 59.673 -14.782 1.00 0.00 H new ATOM 0 HA LEU A 67 1.380 62.440 -15.016 1.00 0.00 H new ATOM 0 HB2 LEU A 67 1.401 62.997 -12.530 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.168 62.775 -13.277 1.00 0.00 H new ATOM 0 HG LEU A 67 0.045 60.315 -12.386 1.00 0.00 H new ATOM 0 HD11 LEU A 67 1.296 60.180 -10.269 1.00 0.00 H new ATOM 0 HD12 LEU A 67 2.371 60.493 -11.653 1.00 0.00 H new ATOM 0 HD13 LEU A 67 1.934 61.818 -10.547 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.027 61.015 -10.277 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -0.478 62.684 -10.558 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -1.648 61.934 -11.669 1.00 0.00 H new ATOM 970 N SER A 68 3.134 60.129 -13.527 1.00 0.00 N ATOM 971 CA SER A 68 4.490 59.696 -13.210 1.00 0.00 C ATOM 972 C SER A 68 5.346 59.621 -14.471 1.00 0.00 C ATOM 973 O SER A 68 6.552 59.390 -14.401 1.00 0.00 O ATOM 974 CB SER A 68 4.463 58.334 -12.515 1.00 0.00 C ATOM 975 OG SER A 68 4.138 57.301 -13.430 1.00 0.00 O ATOM 0 H SER A 68 2.423 59.407 -13.414 1.00 0.00 H new ATOM 0 HA SER A 68 4.932 60.431 -12.537 1.00 0.00 H new ATOM 0 HB2 SER A 68 5.435 58.133 -12.065 1.00 0.00 H new ATOM 0 HB3 SER A 68 3.734 58.350 -11.705 1.00 0.00 H new ATOM 0 HG SER A 68 4.129 56.440 -12.962 1.00 0.00 H new ATOM 981 N ARG A 69 4.711 59.817 -15.621 1.00 0.00 N ATOM 982 CA ARG A 69 5.412 59.769 -16.899 1.00 0.00 C ATOM 983 C ARG A 69 4.637 60.527 -17.972 1.00 0.00 C ATOM 984 O ARG A 69 4.981 61.656 -18.321 1.00 0.00 O ATOM 985 CB ARG A 69 5.622 58.318 -17.336 1.00 0.00 C ATOM 986 CG ARG A 69 4.611 57.351 -16.742 1.00 0.00 C ATOM 987 CD ARG A 69 4.415 56.134 -17.632 1.00 0.00 C ATOM 988 NE ARG A 69 3.523 56.417 -18.756 1.00 0.00 N ATOM 989 CZ ARG A 69 3.477 55.678 -19.860 1.00 0.00 C ATOM 990 NH1 ARG A 69 4.266 54.619 -19.987 1.00 0.00 N1+ ATOM 991 NH2 ARG A 69 2.640 55.999 -20.837 1.00 0.00 N ATOM 0 H ARG A 69 3.712 60.011 -15.695 1.00 0.00 H new ATOM 0 HA ARG A 69 6.383 60.247 -16.770 1.00 0.00 H new ATOM 0 HB2 ARG A 69 5.569 58.264 -18.423 1.00 0.00 H new ATOM 0 HB3 ARG A 69 6.625 58.003 -17.050 1.00 0.00 H new ATOM 0 HG2 ARG A 69 4.947 57.031 -15.756 1.00 0.00 H new ATOM 0 HG3 ARG A 69 3.657 57.860 -16.604 1.00 0.00 H new ATOM 0 HD2 ARG A 69 5.382 55.802 -18.011 1.00 0.00 H new ATOM 0 HD3 ARG A 69 4.006 55.315 -17.041 1.00 0.00 H new ATOM 0 HE ARG A 69 2.903 57.224 -18.689 1.00 0.00 H new ATOM 0 HH11 ARG A 69 4.910 54.370 -19.236 1.00 0.00 H new ATOM 0 HH12 ARG A 69 4.228 54.054 -20.835 1.00 0.00 H new ATOM 0 HH21 ARG A 69 2.032 56.812 -20.741 1.00 0.00 H new ATOM 0 HH22 ARG A 69 2.604 55.433 -21.684 1.00 0.00 H new ATOM 1005 N LYS A 70 3.589 59.899 -18.495 1.00 0.00 N ATOM 1006 CA LYS A 70 2.764 60.514 -19.527 1.00 0.00 C ATOM 1007 C LYS A 70 3.614 60.937 -20.721 1.00 0.00 C ATOM 1008 O LYS A 70 3.814 60.163 -21.658 1.00 0.00 O ATOM 1009 CB LYS A 70 2.021 61.726 -18.962 1.00 0.00 C ATOM 1010 CG LYS A 70 0.904 61.360 -17.999 1.00 0.00 C ATOM 1011 CD LYS A 70 -0.123 60.453 -18.656 1.00 0.00 C ATOM 1012 CE LYS A 70 -1.525 61.036 -18.560 1.00 0.00 C ATOM 1013 NZ LYS A 70 -2.540 60.147 -19.188 1.00 0.00 N1+ ATOM 0 H LYS A 70 3.291 58.963 -18.220 1.00 0.00 H new ATOM 0 HA LYS A 70 2.037 59.775 -19.863 1.00 0.00 H new ATOM 0 HB2 LYS A 70 2.734 62.372 -18.450 1.00 0.00 H new ATOM 0 HB3 LYS A 70 1.604 62.303 -19.787 1.00 0.00 H new ATOM 0 HG2 LYS A 70 1.324 60.862 -17.125 1.00 0.00 H new ATOM 0 HG3 LYS A 70 0.416 62.268 -17.645 1.00 0.00 H new ATOM 0 HD2 LYS A 70 0.139 60.304 -19.703 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -0.102 59.473 -18.179 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -1.781 61.196 -17.513 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -1.547 62.012 -19.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -3.482 60.580 -19.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -2.311 60.015 -20.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -2.538 59.224 -18.708 1.00 0.00 H new ATOM 1027 N HIS A 71 4.111 62.168 -20.681 1.00 0.00 N ATOM 1028 CA HIS A 71 4.942 62.694 -21.759 1.00 0.00 C ATOM 1029 C HIS A 71 6.077 61.729 -22.087 1.00 0.00 C ATOM 1030 O HIS A 71 6.415 61.528 -23.254 1.00 0.00 O ATOM 1031 CB HIS A 71 5.513 64.059 -21.374 1.00 0.00 C ATOM 1032 CG HIS A 71 4.537 65.183 -21.540 1.00 0.00 C ATOM 1033 ND1 HIS A 71 3.306 65.209 -20.921 1.00 0.00 N ATOM 1034 CD2 HIS A 71 4.620 66.328 -22.258 1.00 0.00 C ATOM 1035 CE1 HIS A 71 2.673 66.320 -21.253 1.00 0.00 C ATOM 1036 NE2 HIS A 71 3.449 67.016 -22.064 1.00 0.00 N ATOM 0 H HIS A 71 3.953 62.821 -19.914 1.00 0.00 H new ATOM 0 HA HIS A 71 4.316 62.808 -22.644 1.00 0.00 H new ATOM 0 HB2 HIS A 71 5.844 64.026 -20.336 1.00 0.00 H new ATOM 0 HB3 HIS A 71 6.394 64.260 -21.983 1.00 0.00 H new ATOM 0 HD2 HIS A 71 5.453 66.641 -22.870 1.00 0.00 H new ATOM 0 HE1 HIS A 71 1.688 66.610 -20.918 1.00 0.00 H new ATOM 0 HE2 HIS A 71 3.216 67.918 -22.479 1.00 0.00 H new ATOM 1044 N GLY A 72 6.664 61.136 -21.052 1.00 0.00 N ATOM 1045 CA GLY A 72 7.754 60.201 -21.254 1.00 0.00 C ATOM 1046 C GLY A 72 7.754 59.079 -20.235 1.00 0.00 C ATOM 1047 O GLY A 72 7.740 59.326 -19.029 1.00 0.00 O ATOM 0 H GLY A 72 6.404 61.287 -20.077 1.00 0.00 H new ATOM 0 HA2 GLY A 72 7.684 59.777 -22.256 1.00 0.00 H new ATOM 0 HA3 GLY A 72 8.702 60.736 -21.200 1.00 0.00 H new ATOM 1051 N GLY A 73 7.763 57.841 -20.719 1.00 0.00 N ATOM 1052 CA GLY A 73 7.759 56.695 -19.828 1.00 0.00 C ATOM 1053 C GLY A 73 9.016 56.613 -18.987 1.00 0.00 C ATOM 1054 O GLY A 73 9.776 57.575 -18.868 1.00 0.00 O ATOM 0 H GLY A 73 7.773 57.611 -21.713 1.00 0.00 H new ATOM 0 HA2 GLY A 73 6.890 56.751 -19.173 1.00 0.00 H new ATOM 0 HA3 GLY A 73 7.658 55.782 -20.415 1.00 0.00 H new ATOM 1058 N PRO A 74 9.252 55.440 -18.380 1.00 0.00 N ATOM 1059 CA PRO A 74 10.425 55.207 -17.534 1.00 0.00 C ATOM 1060 C PRO A 74 11.721 55.163 -18.337 1.00 0.00 C ATOM 1061 O PRO A 74 11.738 55.481 -19.526 1.00 0.00 O ATOM 1062 CB PRO A 74 10.142 53.842 -16.901 1.00 0.00 C ATOM 1063 CG PRO A 74 9.229 53.162 -17.864 1.00 0.00 C ATOM 1064 CD PRO A 74 8.391 54.249 -18.477 1.00 0.00 C ATOM 0 HA PRO A 74 10.568 56.007 -16.808 1.00 0.00 H new ATOM 0 HB2 PRO A 74 11.061 53.274 -16.757 1.00 0.00 H new ATOM 0 HB3 PRO A 74 9.676 53.948 -15.921 1.00 0.00 H new ATOM 0 HG2 PRO A 74 9.795 52.628 -18.627 1.00 0.00 H new ATOM 0 HG3 PRO A 74 8.604 52.427 -17.357 1.00 0.00 H new ATOM 0 HD2 PRO A 74 8.134 54.023 -19.512 1.00 0.00 H new ATOM 0 HD3 PRO A 74 7.454 54.386 -17.938 1.00 0.00 H new ATOM 1072 N LYS A 75 12.805 54.767 -17.680 1.00 0.00 N ATOM 1073 CA LYS A 75 14.106 54.679 -18.332 1.00 0.00 C ATOM 1074 C LYS A 75 15.178 54.213 -17.351 1.00 0.00 C ATOM 1075 O LYS A 75 15.038 54.379 -16.139 1.00 0.00 O ATOM 1076 CB LYS A 75 14.496 56.037 -18.922 1.00 0.00 C ATOM 1077 CG LYS A 75 15.125 55.942 -20.302 1.00 0.00 C ATOM 1078 CD LYS A 75 14.119 56.258 -21.395 1.00 0.00 C ATOM 1079 CE LYS A 75 13.703 57.720 -21.364 1.00 0.00 C ATOM 1080 NZ LYS A 75 14.219 58.469 -22.543 1.00 0.00 N1+ ATOM 0 H LYS A 75 12.809 54.502 -16.695 1.00 0.00 H new ATOM 0 HA LYS A 75 14.032 53.947 -19.136 1.00 0.00 H new ATOM 0 HB2 LYS A 75 13.609 56.668 -18.979 1.00 0.00 H new ATOM 0 HB3 LYS A 75 15.195 56.530 -18.246 1.00 0.00 H new ATOM 0 HG2 LYS A 75 15.965 56.633 -20.368 1.00 0.00 H new ATOM 0 HG3 LYS A 75 15.525 54.939 -20.453 1.00 0.00 H new ATOM 0 HD2 LYS A 75 14.551 56.022 -22.368 1.00 0.00 H new ATOM 0 HD3 LYS A 75 13.239 55.626 -21.275 1.00 0.00 H new ATOM 0 HE2 LYS A 75 12.615 57.788 -21.339 1.00 0.00 H new ATOM 0 HE3 LYS A 75 14.073 58.183 -20.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 14.898 59.190 -22.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 14.692 57.810 -23.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 13.427 58.931 -23.034 1.00 0.00 H new ATOM 1094 N ASP A 76 16.246 53.631 -17.881 1.00 0.00 N ATOM 1095 CA ASP A 76 17.341 53.143 -17.053 1.00 0.00 C ATOM 1096 C ASP A 76 16.874 52.009 -16.144 1.00 0.00 C ATOM 1097 O ASP A 76 17.429 51.795 -15.069 1.00 0.00 O ATOM 1098 CB ASP A 76 17.920 54.282 -16.211 1.00 0.00 C ATOM 1099 CG ASP A 76 19.433 54.241 -16.139 1.00 0.00 C ATOM 1100 OD1 ASP A 76 19.993 53.126 -16.082 1.00 0.00 O ATOM 1101 OD2 ASP A 76 20.058 55.322 -16.137 1.00 0.00 O1- ATOM 0 H ASP A 76 16.377 53.485 -18.882 1.00 0.00 H new ATOM 0 HA ASP A 76 18.118 52.758 -17.714 1.00 0.00 H new ATOM 0 HB2 ASP A 76 17.606 55.237 -16.632 1.00 0.00 H new ATOM 0 HB3 ASP A 76 17.510 54.228 -15.202 1.00 0.00 H new ATOM 1106 N GLU A 77 15.849 51.288 -16.588 1.00 0.00 N ATOM 1107 CA GLU A 77 15.306 50.178 -15.814 1.00 0.00 C ATOM 1108 C GLU A 77 14.172 49.491 -16.570 1.00 0.00 C ATOM 1109 O GLU A 77 14.145 48.267 -16.689 1.00 0.00 O ATOM 1110 CB GLU A 77 14.804 50.672 -14.457 1.00 0.00 C ATOM 1111 CG GLU A 77 13.793 51.803 -14.555 1.00 0.00 C ATOM 1112 CD GLU A 77 13.732 52.643 -13.294 1.00 0.00 C ATOM 1113 OE1 GLU A 77 12.947 52.294 -12.386 1.00 0.00 O ATOM 1114 OE2 GLU A 77 14.467 53.647 -13.214 1.00 0.00 O1- ATOM 0 H GLU A 77 15.379 51.452 -17.478 1.00 0.00 H new ATOM 0 HA GLU A 77 16.105 49.453 -15.656 1.00 0.00 H new ATOM 0 HB2 GLU A 77 14.352 49.838 -13.921 1.00 0.00 H new ATOM 0 HB3 GLU A 77 15.655 51.008 -13.865 1.00 0.00 H new ATOM 0 HG2 GLU A 77 14.049 52.442 -15.400 1.00 0.00 H new ATOM 0 HG3 GLU A 77 12.806 51.387 -14.758 1.00 0.00 H new ATOM 1121 N GLU A 78 13.239 50.290 -17.077 1.00 0.00 N ATOM 1122 CA GLU A 78 12.101 49.759 -17.819 1.00 0.00 C ATOM 1123 C GLU A 78 12.280 49.978 -19.320 1.00 0.00 C ATOM 1124 O GLU A 78 12.271 49.028 -20.102 1.00 0.00 O ATOM 1125 CB GLU A 78 10.804 50.418 -17.348 1.00 0.00 C ATOM 1126 CG GLU A 78 9.947 49.520 -16.471 1.00 0.00 C ATOM 1127 CD GLU A 78 9.079 48.572 -17.278 1.00 0.00 C ATOM 1128 OE1 GLU A 78 9.605 47.543 -17.750 1.00 0.00 O ATOM 1129 OE2 GLU A 78 7.876 48.862 -17.438 1.00 0.00 O1- ATOM 0 H GLU A 78 13.248 51.306 -16.988 1.00 0.00 H new ATOM 0 HA GLU A 78 12.045 48.687 -17.629 1.00 0.00 H new ATOM 0 HB2 GLU A 78 11.048 51.325 -16.795 1.00 0.00 H new ATOM 0 HB3 GLU A 78 10.224 50.721 -18.219 1.00 0.00 H new ATOM 0 HG2 GLU A 78 10.592 48.942 -15.809 1.00 0.00 H new ATOM 0 HG3 GLU A 78 9.311 50.138 -15.837 1.00 0.00 H new ATOM 1136 N ARG A 79 12.443 51.239 -19.712 1.00 0.00 N ATOM 1137 CA ARG A 79 12.622 51.583 -21.117 1.00 0.00 C ATOM 1138 C ARG A 79 14.057 51.316 -21.564 1.00 0.00 C ATOM 1139 O ARG A 79 14.398 51.499 -22.731 1.00 0.00 O ATOM 1140 CB ARG A 79 12.268 53.052 -21.352 1.00 0.00 C ATOM 1141 CG ARG A 79 11.421 53.283 -22.593 1.00 0.00 C ATOM 1142 CD ARG A 79 10.011 53.724 -22.227 1.00 0.00 C ATOM 1143 NE ARG A 79 9.091 52.594 -22.141 1.00 0.00 N ATOM 1144 CZ ARG A 79 7.768 52.717 -22.187 1.00 0.00 C ATOM 1145 NH1 ARG A 79 7.216 53.915 -22.322 1.00 0.00 N1+ ATOM 1146 NH2 ARG A 79 6.996 51.641 -22.100 1.00 0.00 N ATOM 0 H ARG A 79 12.455 52.037 -19.077 1.00 0.00 H new ATOM 0 HA ARG A 79 11.954 50.956 -21.707 1.00 0.00 H new ATOM 0 HB2 ARG A 79 11.733 53.432 -20.481 1.00 0.00 H new ATOM 0 HB3 ARG A 79 13.188 53.630 -21.438 1.00 0.00 H new ATOM 0 HG2 ARG A 79 11.890 54.041 -23.220 1.00 0.00 H new ATOM 0 HG3 ARG A 79 11.376 52.366 -23.181 1.00 0.00 H new ATOM 0 HD2 ARG A 79 10.031 54.249 -21.272 1.00 0.00 H new ATOM 0 HD3 ARG A 79 9.647 54.432 -22.972 1.00 0.00 H new ATOM 0 HE ARG A 79 9.485 51.659 -22.040 1.00 0.00 H new ATOM 0 HH11 ARG A 79 7.807 54.744 -22.391 1.00 0.00 H new ATOM 0 HH12 ARG A 79 6.201 54.008 -22.357 1.00 0.00 H new ATOM 0 HH21 ARG A 79 7.418 50.718 -21.998 1.00 0.00 H new ATOM 0 HH22 ARG A 79 5.981 51.737 -22.135 1.00 0.00 H new ATOM 1160 N HIS A 80 14.893 50.883 -20.624 1.00 0.00 N ATOM 1161 CA HIS A 80 16.291 50.591 -20.921 1.00 0.00 C ATOM 1162 C HIS A 80 16.444 49.179 -21.480 1.00 0.00 C ATOM 1163 O HIS A 80 17.404 48.882 -22.191 1.00 0.00 O ATOM 1164 CB HIS A 80 17.144 50.749 -19.662 1.00 0.00 C ATOM 1165 CG HIS A 80 18.575 51.086 -19.948 1.00 0.00 C ATOM 1166 ND1 HIS A 80 19.053 51.320 -21.222 1.00 0.00 N ATOM 1167 CD2 HIS A 80 19.635 51.231 -19.118 1.00 0.00 C ATOM 1168 CE1 HIS A 80 20.345 51.593 -21.160 1.00 0.00 C ATOM 1169 NE2 HIS A 80 20.722 51.546 -19.895 1.00 0.00 N ATOM 0 H HIS A 80 14.627 50.727 -19.652 1.00 0.00 H new ATOM 0 HA HIS A 80 16.633 51.300 -21.675 1.00 0.00 H new ATOM 0 HB2 HIS A 80 16.713 51.531 -19.037 1.00 0.00 H new ATOM 0 HB3 HIS A 80 17.105 49.823 -19.088 1.00 0.00 H new ATOM 0 HD2 HIS A 80 19.627 51.119 -18.044 1.00 0.00 H new ATOM 0 HE1 HIS A 80 20.984 51.817 -22.001 1.00 0.00 H new ATOM 0 HE2 HIS A 80 21.667 51.716 -19.551 1.00 0.00 H new ATOM 1177 N VAL A 81 15.491 48.310 -21.154 1.00 0.00 N ATOM 1178 CA VAL A 81 15.520 46.933 -21.623 1.00 0.00 C ATOM 1179 C VAL A 81 14.117 46.339 -21.676 1.00 0.00 C ATOM 1180 O VAL A 81 13.933 45.135 -21.507 1.00 0.00 O ATOM 1181 CB VAL A 81 16.403 46.050 -20.722 1.00 0.00 C ATOM 1182 CG1 VAL A 81 17.878 46.307 -21.003 1.00 0.00 C ATOM 1183 CG2 VAL A 81 16.083 46.296 -19.255 1.00 0.00 C ATOM 0 H VAL A 81 14.689 48.538 -20.566 1.00 0.00 H new ATOM 0 HA VAL A 81 15.942 46.952 -22.628 1.00 0.00 H new ATOM 0 HB VAL A 81 16.190 45.005 -20.947 1.00 0.00 H new ATOM 0 HG11 VAL A 81 18.487 45.674 -20.357 1.00 0.00 H new ATOM 0 HG12 VAL A 81 18.095 46.077 -22.046 1.00 0.00 H new ATOM 0 HG13 VAL A 81 18.109 47.354 -20.807 1.00 0.00 H new ATOM 0 HG21 VAL A 81 16.717 45.663 -18.633 1.00 0.00 H new ATOM 0 HG22 VAL A 81 16.267 47.343 -19.013 1.00 0.00 H new ATOM 0 HG23 VAL A 81 15.036 46.058 -19.066 1.00 0.00 H new ATOM 1193 N GLY A 82 13.127 47.195 -21.911 1.00 0.00 N ATOM 1194 CA GLY A 82 11.751 46.738 -21.980 1.00 0.00 C ATOM 1195 C GLY A 82 11.512 45.794 -23.141 1.00 0.00 C ATOM 1196 O GLY A 82 10.475 45.135 -23.211 1.00 0.00 O ATOM 0 H GLY A 82 13.253 48.197 -22.055 1.00 0.00 H new ATOM 0 HA2 GLY A 82 11.491 46.236 -21.048 1.00 0.00 H new ATOM 0 HA3 GLY A 82 11.089 47.599 -22.074 1.00 0.00 H new ATOM 1200 N ASP A 83 12.475 45.727 -24.054 1.00 0.00 N ATOM 1201 CA ASP A 83 12.365 44.855 -25.219 1.00 0.00 C ATOM 1202 C ASP A 83 11.358 45.411 -26.221 1.00 0.00 C ATOM 1203 O ASP A 83 10.655 44.658 -26.895 1.00 0.00 O ATOM 1204 CB ASP A 83 11.951 43.447 -24.791 1.00 0.00 C ATOM 1205 CG ASP A 83 12.597 43.026 -23.485 1.00 0.00 C ATOM 1206 OD1 ASP A 83 13.824 42.798 -23.477 1.00 0.00 O ATOM 1207 OD2 ASP A 83 11.874 42.925 -22.473 1.00 0.00 O1- ATOM 0 H ASP A 83 13.340 46.266 -24.010 1.00 0.00 H new ATOM 0 HA ASP A 83 13.342 44.808 -25.700 1.00 0.00 H new ATOM 0 HB2 ASP A 83 10.867 43.406 -24.687 1.00 0.00 H new ATOM 0 HB3 ASP A 83 12.223 42.738 -25.573 1.00 0.00 H new ATOM 1212 N LEU A 84 11.292 46.735 -26.313 1.00 0.00 N ATOM 1213 CA LEU A 84 10.370 47.394 -27.232 1.00 0.00 C ATOM 1214 C LEU A 84 10.911 48.753 -27.666 1.00 0.00 C ATOM 1215 O LEU A 84 11.415 48.903 -28.778 1.00 0.00 O ATOM 1216 CB LEU A 84 8.999 47.565 -26.576 1.00 0.00 C ATOM 1217 CG LEU A 84 9.000 47.741 -25.056 1.00 0.00 C ATOM 1218 CD1 LEU A 84 8.309 49.039 -24.668 1.00 0.00 C ATOM 1219 CD2 LEU A 84 8.326 46.555 -24.381 1.00 0.00 C ATOM 0 H LEU A 84 11.866 47.373 -25.762 1.00 0.00 H new ATOM 0 HA LEU A 84 10.267 46.765 -28.116 1.00 0.00 H new ATOM 0 HB2 LEU A 84 8.510 48.431 -27.022 1.00 0.00 H new ATOM 0 HB3 LEU A 84 8.390 46.695 -26.821 1.00 0.00 H new ATOM 0 HG LEU A 84 10.035 47.788 -24.716 1.00 0.00 H new ATOM 0 HD11 LEU A 84 8.320 49.147 -23.583 1.00 0.00 H new ATOM 0 HD12 LEU A 84 8.834 49.880 -25.121 1.00 0.00 H new ATOM 0 HD13 LEU A 84 7.278 49.022 -25.021 1.00 0.00 H new ATOM 0 HD21 LEU A 84 8.336 46.697 -23.300 1.00 0.00 H new ATOM 0 HD22 LEU A 84 7.295 46.477 -24.727 1.00 0.00 H new ATOM 0 HD23 LEU A 84 8.863 45.640 -24.631 1.00 0.00 H new ATOM 1231 N GLY A 85 10.807 49.737 -26.778 1.00 0.00 N ATOM 1232 CA GLY A 85 11.291 51.069 -27.088 1.00 0.00 C ATOM 1233 C GLY A 85 12.803 51.126 -27.197 1.00 0.00 C ATOM 1234 O GLY A 85 13.344 51.815 -28.058 1.00 0.00 O ATOM 0 H GLY A 85 10.396 49.635 -25.850 1.00 0.00 H new ATOM 0 HA2 GLY A 85 10.849 51.403 -28.027 1.00 0.00 H new ATOM 0 HA3 GLY A 85 10.959 51.762 -26.315 1.00 0.00 H new ATOM 1238 N ASN A 86 13.485 50.396 -26.319 1.00 0.00 N ATOM 1239 CA ASN A 86 14.944 50.369 -26.319 1.00 0.00 C ATOM 1240 C ASN A 86 15.474 49.740 -27.602 1.00 0.00 C ATOM 1241 O ASN A 86 16.528 50.130 -28.108 1.00 0.00 O ATOM 1242 CB ASN A 86 15.458 49.593 -25.106 1.00 0.00 C ATOM 1243 CG ASN A 86 16.803 50.103 -24.621 1.00 0.00 C ATOM 1244 OD1 ASN A 86 17.811 49.402 -24.705 1.00 0.00 O ATOM 1245 ND2 ASN A 86 16.821 51.328 -24.111 1.00 0.00 N ATOM 0 H ASN A 86 13.052 49.817 -25.600 1.00 0.00 H new ATOM 0 HA ASN A 86 15.304 51.396 -26.264 1.00 0.00 H new ATOM 0 HB2 ASN A 86 14.731 49.666 -24.297 1.00 0.00 H new ATOM 0 HB3 ASN A 86 15.544 48.537 -25.363 1.00 0.00 H new ATOM 0 HD21 ASN A 86 17.696 51.725 -23.768 1.00 0.00 H new ATOM 0 HD22 ASN A 86 15.960 51.873 -24.062 1.00 0.00 H new ATOM 1252 N VAL A 87 14.740 48.762 -28.125 1.00 0.00 N ATOM 1253 CA VAL A 87 15.136 48.081 -29.351 1.00 0.00 C ATOM 1254 C VAL A 87 14.380 48.631 -30.557 1.00 0.00 C ATOM 1255 O VAL A 87 14.589 48.195 -31.688 1.00 0.00 O ATOM 1256 CB VAL A 87 14.889 46.564 -29.254 1.00 0.00 C ATOM 1257 CG1 VAL A 87 13.399 46.262 -29.279 1.00 0.00 C ATOM 1258 CG2 VAL A 87 15.607 45.834 -30.379 1.00 0.00 C ATOM 0 H VAL A 87 13.868 48.424 -27.718 1.00 0.00 H new ATOM 0 HA VAL A 87 16.203 48.262 -29.482 1.00 0.00 H new ATOM 0 HB VAL A 87 15.292 46.209 -28.305 1.00 0.00 H new ATOM 0 HG11 VAL A 87 13.245 45.185 -29.210 1.00 0.00 H new ATOM 0 HG12 VAL A 87 12.914 46.753 -28.435 1.00 0.00 H new ATOM 0 HG13 VAL A 87 12.969 46.631 -30.210 1.00 0.00 H new ATOM 0 HG21 VAL A 87 15.421 44.763 -30.295 1.00 0.00 H new ATOM 0 HG22 VAL A 87 15.237 46.192 -31.340 1.00 0.00 H new ATOM 0 HG23 VAL A 87 16.678 46.023 -30.310 1.00 0.00 H new ATOM 1268 N THR A 88 13.499 49.594 -30.305 1.00 0.00 N ATOM 1269 CA THR A 88 12.711 50.205 -31.368 1.00 0.00 C ATOM 1270 C THR A 88 13.595 51.000 -32.322 1.00 0.00 C ATOM 1271 O THR A 88 13.389 50.983 -33.535 1.00 0.00 O ATOM 1272 CB THR A 88 11.624 51.135 -30.798 1.00 0.00 C ATOM 1273 OG1 THR A 88 10.460 50.375 -30.453 1.00 0.00 O ATOM 1274 CG2 THR A 88 11.251 52.212 -31.804 1.00 0.00 C ATOM 0 H THR A 88 13.313 49.967 -29.374 1.00 0.00 H new ATOM 0 HA THR A 88 12.233 49.391 -31.914 1.00 0.00 H new ATOM 0 HB THR A 88 12.022 51.616 -29.905 1.00 0.00 H new ATOM 0 HG1 THR A 88 10.732 49.521 -30.057 1.00 0.00 H new ATOM 0 HG21 THR A 88 10.482 52.856 -31.379 1.00 0.00 H new ATOM 0 HG22 THR A 88 12.132 52.808 -32.043 1.00 0.00 H new ATOM 0 HG23 THR A 88 10.871 51.745 -32.713 1.00 0.00 H new ATOM 1282 N ALA A 89 14.582 51.695 -31.764 1.00 0.00 N ATOM 1283 CA ALA A 89 15.498 52.496 -32.566 1.00 0.00 C ATOM 1284 C ALA A 89 16.423 53.324 -31.680 1.00 0.00 C ATOM 1285 O ALA A 89 17.545 53.646 -32.068 1.00 0.00 O ATOM 1286 CB ALA A 89 14.723 53.397 -33.514 1.00 0.00 C ATOM 0 H ALA A 89 14.767 51.719 -30.761 1.00 0.00 H new ATOM 0 HA ALA A 89 16.115 51.817 -33.155 1.00 0.00 H new ATOM 0 HB1 ALA A 89 15.421 53.989 -34.106 1.00 0.00 H new ATOM 0 HB2 ALA A 89 14.111 52.786 -34.178 1.00 0.00 H new ATOM 0 HB3 ALA A 89 14.080 54.063 -32.939 1.00 0.00 H new ATOM 1292 N ASP A 90 15.942 53.667 -30.490 1.00 0.00 N ATOM 1293 CA ASP A 90 16.724 54.458 -29.548 1.00 0.00 C ATOM 1294 C ASP A 90 15.955 54.676 -28.249 1.00 0.00 C ATOM 1295 O ASP A 90 16.540 54.716 -27.168 1.00 0.00 O ATOM 1296 CB ASP A 90 17.095 55.808 -30.168 1.00 0.00 C ATOM 1297 CG ASP A 90 18.592 56.038 -30.199 1.00 0.00 C ATOM 1298 OD1 ASP A 90 19.202 56.127 -29.113 1.00 0.00 O ATOM 1299 OD2 ASP A 90 19.155 56.131 -31.310 1.00 0.00 O1- ATOM 0 H ASP A 90 15.014 53.409 -30.155 1.00 0.00 H new ATOM 0 HA ASP A 90 17.637 53.907 -29.320 1.00 0.00 H new ATOM 0 HB2 ASP A 90 16.701 55.859 -31.183 1.00 0.00 H new ATOM 0 HB3 ASP A 90 16.619 56.608 -29.601 1.00 0.00 H new ATOM 1304 N LYS A 91 14.639 54.816 -28.364 1.00 0.00 N ATOM 1305 CA LYS A 91 13.788 55.028 -27.200 1.00 0.00 C ATOM 1306 C LYS A 91 12.389 54.468 -27.438 1.00 0.00 C ATOM 1307 O LYS A 91 11.788 53.870 -26.545 1.00 0.00 O ATOM 1308 CB LYS A 91 13.701 56.520 -26.870 1.00 0.00 C ATOM 1309 CG LYS A 91 12.571 56.868 -25.917 1.00 0.00 C ATOM 1310 CD LYS A 91 12.722 56.151 -24.587 1.00 0.00 C ATOM 1311 CE LYS A 91 11.673 56.610 -23.584 1.00 0.00 C ATOM 1312 NZ LYS A 91 10.297 56.524 -24.143 1.00 0.00 N1+ ATOM 0 H LYS A 91 14.139 54.786 -29.252 1.00 0.00 H new ATOM 0 HA LYS A 91 14.233 54.500 -26.356 1.00 0.00 H new ATOM 0 HB2 LYS A 91 14.646 56.842 -26.433 1.00 0.00 H new ATOM 0 HB3 LYS A 91 13.570 57.081 -27.795 1.00 0.00 H new ATOM 0 HG2 LYS A 91 12.553 57.945 -25.751 1.00 0.00 H new ATOM 0 HG3 LYS A 91 11.617 56.599 -26.370 1.00 0.00 H new ATOM 0 HD2 LYS A 91 12.634 55.075 -24.740 1.00 0.00 H new ATOM 0 HD3 LYS A 91 13.718 56.335 -24.184 1.00 0.00 H new ATOM 0 HE2 LYS A 91 11.738 55.998 -22.684 1.00 0.00 H new ATOM 0 HE3 LYS A 91 11.880 57.638 -23.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 9.604 56.562 -23.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 10.135 57.321 -24.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 10.188 55.629 -24.661 1.00 0.00 H new ATOM 1326 N ASP A 92 11.876 54.664 -28.649 1.00 0.00 N ATOM 1327 CA ASP A 92 10.550 54.177 -29.005 1.00 0.00 C ATOM 1328 C ASP A 92 10.065 54.818 -30.302 1.00 0.00 C ATOM 1329 O ASP A 92 8.872 55.062 -30.479 1.00 0.00 O ATOM 1330 CB ASP A 92 9.557 54.463 -27.879 1.00 0.00 C ATOM 1331 CG ASP A 92 9.127 53.204 -27.150 1.00 0.00 C ATOM 1332 OD1 ASP A 92 8.700 52.245 -27.826 1.00 0.00 O ATOM 1333 OD2 ASP A 92 9.220 53.178 -25.905 1.00 0.00 O1- ATOM 0 H ASP A 92 12.360 55.157 -29.400 1.00 0.00 H new ATOM 0 HA ASP A 92 10.616 53.099 -29.155 1.00 0.00 H new ATOM 0 HB2 ASP A 92 10.009 55.155 -27.168 1.00 0.00 H new ATOM 0 HB3 ASP A 92 8.678 54.958 -28.291 1.00 0.00 H new ATOM 1338 N GLY A 93 10.999 55.091 -31.208 1.00 0.00 N ATOM 1339 CA GLY A 93 10.649 55.702 -32.476 1.00 0.00 C ATOM 1340 C GLY A 93 10.051 57.085 -32.305 1.00 0.00 C ATOM 1341 O GLY A 93 9.269 57.537 -33.142 1.00 0.00 O ATOM 0 H GLY A 93 11.993 54.899 -31.086 1.00 0.00 H new ATOM 0 HA2 GLY A 93 11.539 55.769 -33.102 1.00 0.00 H new ATOM 0 HA3 GLY A 93 9.938 55.064 -33.000 1.00 0.00 H new ATOM 1345 N VAL A 94 10.416 57.757 -31.218 1.00 0.00 N ATOM 1346 CA VAL A 94 9.909 59.096 -30.941 1.00 0.00 C ATOM 1347 C VAL A 94 11.041 60.046 -30.567 1.00 0.00 C ATOM 1348 O VAL A 94 11.035 61.215 -30.948 1.00 0.00 O ATOM 1349 CB VAL A 94 8.871 59.078 -29.803 1.00 0.00 C ATOM 1350 CG1 VAL A 94 8.494 60.496 -29.403 1.00 0.00 C ATOM 1351 CG2 VAL A 94 7.640 58.287 -30.216 1.00 0.00 C ATOM 0 H VAL A 94 11.061 57.396 -30.515 1.00 0.00 H new ATOM 0 HA VAL A 94 9.430 59.449 -31.854 1.00 0.00 H new ATOM 0 HB VAL A 94 9.315 58.587 -28.937 1.00 0.00 H new ATOM 0 HG11 VAL A 94 7.760 60.464 -28.598 1.00 0.00 H new ATOM 0 HG12 VAL A 94 9.383 61.027 -29.062 1.00 0.00 H new ATOM 0 HG13 VAL A 94 8.068 61.015 -30.262 1.00 0.00 H new ATOM 0 HG21 VAL A 94 6.918 58.285 -29.400 1.00 0.00 H new ATOM 0 HG22 VAL A 94 7.191 58.746 -31.097 1.00 0.00 H new ATOM 0 HG23 VAL A 94 7.927 57.262 -30.448 1.00 0.00 H new ATOM 1361 N ALA A 95 12.013 59.534 -29.819 1.00 0.00 N ATOM 1362 CA ALA A 95 13.154 60.335 -29.394 1.00 0.00 C ATOM 1363 C ALA A 95 14.382 60.037 -30.249 1.00 0.00 C ATOM 1364 O ALA A 95 15.511 60.068 -29.760 1.00 0.00 O ATOM 1365 CB ALA A 95 13.457 60.087 -27.925 1.00 0.00 C ATOM 0 H ALA A 95 12.033 58.567 -29.495 1.00 0.00 H new ATOM 0 HA ALA A 95 12.898 61.386 -29.526 1.00 0.00 H new ATOM 0 HB1 ALA A 95 14.312 60.692 -27.623 1.00 0.00 H new ATOM 0 HB2 ALA A 95 12.589 60.358 -27.324 1.00 0.00 H new ATOM 0 HB3 ALA A 95 13.688 59.032 -27.774 1.00 0.00 H new ATOM 1371 N ASP A 96 14.154 59.746 -31.524 1.00 0.00 N ATOM 1372 CA ASP A 96 15.243 59.442 -32.446 1.00 0.00 C ATOM 1373 C ASP A 96 14.709 59.201 -33.855 1.00 0.00 C ATOM 1374 O ASP A 96 15.398 59.458 -34.843 1.00 0.00 O ATOM 1375 CB ASP A 96 16.018 58.216 -31.965 1.00 0.00 C ATOM 1376 CG ASP A 96 17.415 58.565 -31.487 1.00 0.00 C ATOM 1377 OD1 ASP A 96 18.306 58.749 -32.342 1.00 0.00 O ATOM 1378 OD2 ASP A 96 17.615 58.655 -30.258 1.00 0.00 O1- ATOM 0 H ASP A 96 13.225 59.714 -31.944 1.00 0.00 H new ATOM 0 HA ASP A 96 15.915 60.300 -32.473 1.00 0.00 H new ATOM 0 HB2 ASP A 96 15.469 57.737 -31.154 1.00 0.00 H new ATOM 0 HB3 ASP A 96 16.085 57.491 -32.776 1.00 0.00 H new ATOM 1383 N VAL A 97 13.478 58.706 -33.941 1.00 0.00 N ATOM 1384 CA VAL A 97 12.853 58.429 -35.228 1.00 0.00 C ATOM 1385 C VAL A 97 11.655 59.342 -35.463 1.00 0.00 C ATOM 1386 O VAL A 97 10.795 59.052 -36.297 1.00 0.00 O ATOM 1387 CB VAL A 97 12.395 56.962 -35.329 1.00 0.00 C ATOM 1388 CG1 VAL A 97 12.088 56.595 -36.771 1.00 0.00 C ATOM 1389 CG2 VAL A 97 13.452 56.034 -34.746 1.00 0.00 C ATOM 0 H VAL A 97 12.894 58.489 -33.134 1.00 0.00 H new ATOM 0 HA VAL A 97 13.607 58.617 -35.992 1.00 0.00 H new ATOM 0 HB VAL A 97 11.480 56.844 -34.749 1.00 0.00 H new ATOM 0 HG11 VAL A 97 11.766 55.555 -36.821 1.00 0.00 H new ATOM 0 HG12 VAL A 97 11.294 57.239 -37.149 1.00 0.00 H new ATOM 0 HG13 VAL A 97 12.983 56.727 -37.379 1.00 0.00 H new ATOM 0 HG21 VAL A 97 13.113 55.001 -34.825 1.00 0.00 H new ATOM 0 HG22 VAL A 97 14.385 56.153 -35.297 1.00 0.00 H new ATOM 0 HG23 VAL A 97 13.616 56.283 -33.698 1.00 0.00 H new ATOM 1399 N SER A 98 11.605 60.446 -34.725 1.00 0.00 N ATOM 1400 CA SER A 98 10.508 61.400 -34.852 1.00 0.00 C ATOM 1401 C SER A 98 11.017 62.832 -34.707 1.00 0.00 C ATOM 1402 O SER A 98 10.602 63.724 -35.448 1.00 0.00 O ATOM 1403 CB SER A 98 9.437 61.119 -33.797 1.00 0.00 C ATOM 1404 OG SER A 98 8.216 61.757 -34.129 1.00 0.00 O ATOM 0 H SER A 98 12.310 60.702 -34.034 1.00 0.00 H new ATOM 0 HA SER A 98 10.070 61.286 -35.844 1.00 0.00 H new ATOM 0 HB2 SER A 98 9.278 60.044 -33.712 1.00 0.00 H new ATOM 0 HB3 SER A 98 9.781 61.468 -32.823 1.00 0.00 H new ATOM 0 HG SER A 98 7.547 61.561 -33.440 1.00 0.00 H new ATOM 1410 N ILE A 99 11.915 63.042 -33.752 1.00 0.00 N ATOM 1411 CA ILE A 99 12.481 64.363 -33.513 1.00 0.00 C ATOM 1412 C ILE A 99 13.033 64.967 -34.800 1.00 0.00 C ATOM 1413 O ILE A 99 12.835 66.149 -35.078 1.00 0.00 O ATOM 1414 CB ILE A 99 13.603 64.313 -32.459 1.00 0.00 C ATOM 1415 CG1 ILE A 99 13.093 63.672 -31.167 1.00 0.00 C ATOM 1416 CG2 ILE A 99 14.138 65.712 -32.188 1.00 0.00 C ATOM 1417 CD1 ILE A 99 14.134 63.601 -30.074 1.00 0.00 C ATOM 0 H ILE A 99 12.267 62.314 -33.130 1.00 0.00 H new ATOM 0 HA ILE A 99 11.671 64.990 -33.140 1.00 0.00 H new ATOM 0 HB ILE A 99 14.418 63.702 -32.847 1.00 0.00 H new ATOM 0 HG12 ILE A 99 12.236 64.239 -30.804 1.00 0.00 H new ATOM 0 HG13 ILE A 99 12.739 62.665 -31.386 1.00 0.00 H new ATOM 0 HG21 ILE A 99 14.930 65.660 -31.441 1.00 0.00 H new ATOM 0 HG22 ILE A 99 14.536 66.134 -33.111 1.00 0.00 H new ATOM 0 HG23 ILE A 99 13.331 66.345 -31.818 1.00 0.00 H new ATOM 0 HD11 ILE A 99 13.701 63.135 -29.189 1.00 0.00 H new ATOM 0 HD12 ILE A 99 14.982 63.009 -30.417 1.00 0.00 H new ATOM 0 HD13 ILE A 99 14.471 64.608 -29.826 1.00 0.00 H new ATOM 1429 N GLU A 100 13.724 64.145 -35.583 1.00 0.00 N ATOM 1430 CA GLU A 100 14.305 64.598 -36.841 1.00 0.00 C ATOM 1431 C GLU A 100 13.214 64.914 -37.862 1.00 0.00 C ATOM 1432 O GLU A 100 13.340 65.850 -38.650 1.00 0.00 O ATOM 1433 CB GLU A 100 15.252 63.535 -37.405 1.00 0.00 C ATOM 1434 CG GLU A 100 16.187 62.941 -36.365 1.00 0.00 C ATOM 1435 CD GLU A 100 17.529 62.547 -36.947 1.00 0.00 C ATOM 1436 OE1 GLU A 100 17.552 61.990 -38.064 1.00 0.00 O ATOM 1437 OE2 GLU A 100 18.559 62.793 -36.283 1.00 0.00 O1- ATOM 0 H GLU A 100 13.895 63.163 -35.369 1.00 0.00 H new ATOM 0 HA GLU A 100 14.869 65.509 -36.642 1.00 0.00 H new ATOM 0 HB2 GLU A 100 14.662 62.734 -37.851 1.00 0.00 H new ATOM 0 HB3 GLU A 100 15.846 63.977 -38.205 1.00 0.00 H new ATOM 0 HG2 GLU A 100 16.340 63.664 -35.564 1.00 0.00 H new ATOM 0 HG3 GLU A 100 15.718 62.065 -35.918 1.00 0.00 H new ATOM 1444 N ASP A 101 12.143 64.128 -37.836 1.00 0.00 N ATOM 1445 CA ASP A 101 11.030 64.324 -38.756 1.00 0.00 C ATOM 1446 C ASP A 101 10.165 65.499 -38.319 1.00 0.00 C ATOM 1447 O ASP A 101 9.364 66.018 -39.099 1.00 0.00 O ATOM 1448 CB ASP A 101 10.182 63.053 -38.842 1.00 0.00 C ATOM 1449 CG ASP A 101 8.832 63.299 -39.485 1.00 0.00 C ATOM 1450 OD1 ASP A 101 8.769 63.353 -40.732 1.00 0.00 O ATOM 1451 OD2 ASP A 101 7.839 63.439 -38.743 1.00 0.00 O1- ATOM 0 H ASP A 101 12.023 63.350 -37.188 1.00 0.00 H new ATOM 0 HA ASP A 101 11.440 64.545 -39.742 1.00 0.00 H new ATOM 0 HB2 ASP A 101 10.721 62.298 -39.414 1.00 0.00 H new ATOM 0 HB3 ASP A 101 10.036 62.649 -37.840 1.00 0.00 H new ATOM 1456 N SER A 102 10.326 65.915 -37.068 1.00 0.00 N ATOM 1457 CA SER A 102 9.557 67.027 -36.525 1.00 0.00 C ATOM 1458 C SER A 102 10.357 68.325 -36.586 1.00 0.00 C ATOM 1459 O SER A 102 9.805 69.398 -36.827 1.00 0.00 O ATOM 1460 CB SER A 102 9.147 66.734 -35.079 1.00 0.00 C ATOM 1461 OG SER A 102 7.781 67.045 -34.864 1.00 0.00 O ATOM 0 H SER A 102 10.984 65.497 -36.410 1.00 0.00 H new ATOM 0 HA SER A 102 8.660 67.146 -37.133 1.00 0.00 H new ATOM 0 HB2 SER A 102 9.324 65.682 -34.853 1.00 0.00 H new ATOM 0 HB3 SER A 102 9.767 67.315 -34.397 1.00 0.00 H new ATOM 0 HG SER A 102 7.543 66.848 -33.934 1.00 0.00 H new ATOM 1467 N VAL A 103 11.664 68.216 -36.365 1.00 0.00 N ATOM 1468 CA VAL A 103 12.542 69.378 -36.395 1.00 0.00 C ATOM 1469 C VAL A 103 12.696 69.916 -37.813 1.00 0.00 C ATOM 1470 O VAL A 103 12.999 71.092 -38.013 1.00 0.00 O ATOM 1471 CB VAL A 103 13.937 69.044 -35.830 1.00 0.00 C ATOM 1472 CG1 VAL A 103 14.721 68.193 -36.817 1.00 0.00 C ATOM 1473 CG2 VAL A 103 14.694 70.320 -35.493 1.00 0.00 C ATOM 0 H VAL A 103 12.137 67.335 -36.163 1.00 0.00 H new ATOM 0 HA VAL A 103 12.077 70.140 -35.769 1.00 0.00 H new ATOM 0 HB VAL A 103 13.812 68.470 -34.912 1.00 0.00 H new ATOM 0 HG11 VAL A 103 15.703 67.967 -36.402 1.00 0.00 H new ATOM 0 HG12 VAL A 103 14.183 67.264 -37.004 1.00 0.00 H new ATOM 0 HG13 VAL A 103 14.840 68.738 -37.753 1.00 0.00 H new ATOM 0 HG21 VAL A 103 15.677 70.066 -35.095 1.00 0.00 H new ATOM 0 HG22 VAL A 103 14.812 70.922 -36.394 1.00 0.00 H new ATOM 0 HG23 VAL A 103 14.137 70.888 -34.748 1.00 0.00 H new ATOM 1483 N ILE A 104 12.484 69.045 -38.795 1.00 0.00 N ATOM 1484 CA ILE A 104 12.597 69.432 -40.195 1.00 0.00 C ATOM 1485 C ILE A 104 11.235 69.800 -40.776 1.00 0.00 C ATOM 1486 O ILE A 104 11.143 70.579 -41.727 1.00 0.00 O ATOM 1487 CB ILE A 104 13.216 68.305 -41.043 1.00 0.00 C ATOM 1488 CG1 ILE A 104 14.633 67.994 -40.558 1.00 0.00 C ATOM 1489 CG2 ILE A 104 13.226 68.693 -42.514 1.00 0.00 C ATOM 1490 CD1 ILE A 104 15.582 69.167 -40.671 1.00 0.00 C ATOM 0 H ILE A 104 12.233 68.068 -38.646 1.00 0.00 H new ATOM 0 HA ILE A 104 13.252 70.303 -40.229 1.00 0.00 H new ATOM 0 HB ILE A 104 12.608 67.408 -40.929 1.00 0.00 H new ATOM 0 HG12 ILE A 104 14.590 67.671 -39.518 1.00 0.00 H new ATOM 0 HG13 ILE A 104 15.030 67.159 -41.135 1.00 0.00 H new ATOM 0 HG21 ILE A 104 13.666 67.886 -43.100 1.00 0.00 H new ATOM 0 HG22 ILE A 104 12.204 68.870 -42.851 1.00 0.00 H new ATOM 0 HG23 ILE A 104 13.814 69.601 -42.647 1.00 0.00 H new ATOM 0 HD11 ILE A 104 16.568 68.874 -40.309 1.00 0.00 H new ATOM 0 HD12 ILE A 104 15.655 69.477 -41.714 1.00 0.00 H new ATOM 0 HD13 ILE A 104 15.208 69.997 -40.072 1.00 0.00 H new ATOM 1502 N SER A 105 10.180 69.238 -40.197 1.00 0.00 N ATOM 1503 CA SER A 105 8.822 69.504 -40.657 1.00 0.00 C ATOM 1504 C SER A 105 8.253 70.746 -39.979 1.00 0.00 C ATOM 1505 O SER A 105 7.335 71.385 -40.494 1.00 0.00 O ATOM 1506 CB SER A 105 7.921 68.300 -40.382 1.00 0.00 C ATOM 1507 OG SER A 105 7.660 68.165 -38.995 1.00 0.00 O ATOM 0 H SER A 105 10.239 68.595 -39.408 1.00 0.00 H new ATOM 0 HA SER A 105 8.858 69.682 -41.732 1.00 0.00 H new ATOM 0 HB2 SER A 105 6.981 68.414 -40.923 1.00 0.00 H new ATOM 0 HB3 SER A 105 8.396 67.393 -40.756 1.00 0.00 H new ATOM 0 HG SER A 105 7.081 67.389 -38.845 1.00 0.00 H new ATOM 1513 N LEU A 106 8.803 71.082 -38.816 1.00 0.00 N ATOM 1514 CA LEU A 106 8.350 72.247 -38.065 1.00 0.00 C ATOM 1515 C LEU A 106 9.058 73.512 -38.539 1.00 0.00 C ATOM 1516 O LEU A 106 8.457 74.582 -38.613 1.00 0.00 O ATOM 1517 CB LEU A 106 8.597 72.041 -36.569 1.00 0.00 C ATOM 1518 CG LEU A 106 7.873 73.006 -35.629 1.00 0.00 C ATOM 1519 CD1 LEU A 106 6.992 72.242 -34.655 1.00 0.00 C ATOM 1520 CD2 LEU A 106 8.876 73.872 -34.879 1.00 0.00 C ATOM 0 H LEU A 106 9.562 70.564 -38.374 1.00 0.00 H new ATOM 0 HA LEU A 106 7.280 72.366 -38.238 1.00 0.00 H new ATOM 0 HB2 LEU A 106 8.303 71.024 -36.310 1.00 0.00 H new ATOM 0 HB3 LEU A 106 9.668 72.120 -36.384 1.00 0.00 H new ATOM 0 HG LEU A 106 7.236 73.658 -36.227 1.00 0.00 H new ATOM 0 HD11 LEU A 106 6.485 72.945 -33.994 1.00 0.00 H new ATOM 0 HD12 LEU A 106 6.251 71.666 -35.209 1.00 0.00 H new ATOM 0 HD13 LEU A 106 7.607 71.566 -34.062 1.00 0.00 H new ATOM 0 HD21 LEU A 106 8.344 74.553 -34.215 1.00 0.00 H new ATOM 0 HD22 LEU A 106 9.538 73.236 -34.292 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.465 74.448 -35.593 1.00 0.00 H new ATOM 1532 N SER A 107 10.342 73.377 -38.862 1.00 0.00 N ATOM 1533 CA SER A 107 11.134 74.509 -39.329 1.00 0.00 C ATOM 1534 C SER A 107 11.228 74.516 -40.852 1.00 0.00 C ATOM 1535 O SER A 107 11.208 75.573 -41.481 1.00 0.00 O ATOM 1536 CB SER A 107 12.538 74.462 -38.721 1.00 0.00 C ATOM 1537 OG SER A 107 13.489 74.008 -39.669 1.00 0.00 O ATOM 0 H SER A 107 10.854 72.497 -38.809 1.00 0.00 H new ATOM 0 HA SER A 107 10.637 75.425 -39.009 1.00 0.00 H new ATOM 0 HB2 SER A 107 12.818 75.454 -38.367 1.00 0.00 H new ATOM 0 HB3 SER A 107 12.540 73.802 -37.854 1.00 0.00 H new ATOM 0 HG SER A 107 14.378 73.988 -39.257 1.00 0.00 H new ATOM 1543 N GLY A 108 11.329 73.326 -41.438 1.00 0.00 N ATOM 1544 CA GLY A 108 11.424 73.218 -42.882 1.00 0.00 C ATOM 1545 C GLY A 108 10.083 73.385 -43.565 1.00 0.00 C ATOM 1546 O GLY A 108 9.988 73.310 -44.790 1.00 0.00 O ATOM 0 H GLY A 108 11.347 72.437 -40.939 1.00 0.00 H new ATOM 0 HA2 GLY A 108 12.115 73.974 -43.255 1.00 0.00 H new ATOM 0 HA3 GLY A 108 11.843 72.246 -43.144 1.00 0.00 H new ATOM 1550 N ASP A 109 9.040 73.608 -42.772 1.00 0.00 N ATOM 1551 CA ASP A 109 7.696 73.786 -43.307 1.00 0.00 C ATOM 1552 C ASP A 109 7.006 74.983 -42.661 1.00 0.00 C ATOM 1553 O ASP A 109 5.782 75.107 -42.705 1.00 0.00 O ATOM 1554 CB ASP A 109 6.865 72.521 -43.085 1.00 0.00 C ATOM 1555 CG ASP A 109 6.142 72.074 -44.341 1.00 0.00 C ATOM 1556 OD1 ASP A 109 5.013 72.553 -44.578 1.00 0.00 O ATOM 1557 OD2 ASP A 109 6.706 71.247 -45.087 1.00 0.00 O1- ATOM 0 H ASP A 109 9.100 73.670 -41.756 1.00 0.00 H new ATOM 0 HA ASP A 109 7.780 73.974 -44.377 1.00 0.00 H new ATOM 0 HB2 ASP A 109 7.516 71.718 -42.739 1.00 0.00 H new ATOM 0 HB3 ASP A 109 6.136 72.703 -42.295 1.00 0.00 H new ATOM 1562 N HIS A 110 7.801 75.863 -42.057 1.00 0.00 N ATOM 1563 CA HIS A 110 7.267 77.050 -41.400 1.00 0.00 C ATOM 1564 C HIS A 110 7.825 78.321 -42.037 1.00 0.00 C ATOM 1565 O HIS A 110 7.107 79.306 -42.209 1.00 0.00 O ATOM 1566 CB HIS A 110 7.596 77.025 -39.908 1.00 0.00 C ATOM 1567 CG HIS A 110 7.236 78.291 -39.193 1.00 0.00 C ATOM 1568 ND1 HIS A 110 6.041 78.952 -39.391 1.00 0.00 N ATOM 1569 CD2 HIS A 110 7.917 79.016 -38.277 1.00 0.00 C ATOM 1570 CE1 HIS A 110 6.005 80.030 -38.629 1.00 0.00 C ATOM 1571 NE2 HIS A 110 7.133 80.091 -37.941 1.00 0.00 N ATOM 0 H HIS A 110 8.816 75.775 -42.010 1.00 0.00 H new ATOM 0 HA HIS A 110 6.184 77.048 -41.524 1.00 0.00 H new ATOM 0 HB2 HIS A 110 7.069 76.192 -39.442 1.00 0.00 H new ATOM 0 HB3 HIS A 110 8.662 76.838 -39.783 1.00 0.00 H new ATOM 0 HD2 HIS A 110 8.897 78.791 -37.883 1.00 0.00 H new ATOM 0 HE1 HIS A 110 5.193 80.740 -38.577 1.00 0.00 H new ATOM 0 HE2 HIS A 110 7.380 80.819 -37.270 1.00 0.00 H new ATOM 1579 N CYS A 111 9.106 78.289 -42.382 1.00 0.00 N ATOM 1580 CA CYS A 111 9.762 79.438 -42.997 1.00 0.00 C ATOM 1581 C CYS A 111 10.268 79.092 -44.394 1.00 0.00 C ATOM 1582 O CYS A 111 9.987 79.801 -45.359 1.00 0.00 O ATOM 1583 CB CYS A 111 10.925 79.916 -42.124 1.00 0.00 C ATOM 1584 SG CYS A 111 11.880 78.579 -41.371 1.00 0.00 S ATOM 0 H CYS A 111 9.712 77.480 -42.247 1.00 0.00 H new ATOM 0 HA CYS A 111 9.029 80.240 -43.084 1.00 0.00 H new ATOM 0 HB2 CYS A 111 11.593 80.528 -42.730 1.00 0.00 H new ATOM 0 HB3 CYS A 111 10.533 80.557 -41.335 1.00 0.00 H new ATOM 0 HG CYS A 111 11.388 77.433 -41.739 1.00 0.00 H new ATOM 1590 N ILE A 112 11.014 77.997 -44.491 1.00 0.00 N ATOM 1591 CA ILE A 112 11.560 77.558 -45.771 1.00 0.00 C ATOM 1592 C ILE A 112 10.494 77.585 -46.861 1.00 0.00 C ATOM 1593 O ILE A 112 10.807 77.718 -48.045 1.00 0.00 O ATOM 1594 CB ILE A 112 12.146 76.138 -45.674 1.00 0.00 C ATOM 1595 CG1 ILE A 112 13.220 76.077 -44.588 1.00 0.00 C ATOM 1596 CG2 ILE A 112 12.717 75.707 -47.017 1.00 0.00 C ATOM 1597 CD1 ILE A 112 14.354 77.054 -44.806 1.00 0.00 C ATOM 0 H ILE A 112 11.254 77.398 -43.701 1.00 0.00 H new ATOM 0 HA ILE A 112 12.358 78.254 -46.031 1.00 0.00 H new ATOM 0 HB ILE A 112 11.345 75.450 -45.404 1.00 0.00 H new ATOM 0 HG12 ILE A 112 12.759 76.277 -43.621 1.00 0.00 H new ATOM 0 HG13 ILE A 112 13.625 75.066 -44.545 1.00 0.00 H new ATOM 0 HG21 ILE A 112 13.128 74.701 -46.932 1.00 0.00 H new ATOM 0 HG22 ILE A 112 11.927 75.714 -47.768 1.00 0.00 H new ATOM 0 HG23 ILE A 112 13.506 76.397 -47.315 1.00 0.00 H new ATOM 0 HD11 ILE A 112 15.079 76.956 -43.998 1.00 0.00 H new ATOM 0 HD12 ILE A 112 14.840 76.841 -45.758 1.00 0.00 H new ATOM 0 HD13 ILE A 112 13.961 78.071 -44.819 1.00 0.00 H new ATOM 1609 N ILE A 113 9.236 77.461 -46.453 1.00 0.00 N ATOM 1610 CA ILE A 113 8.124 77.473 -47.395 1.00 0.00 C ATOM 1611 C ILE A 113 7.437 78.833 -47.416 1.00 0.00 C ATOM 1612 O ILE A 113 7.203 79.406 -48.478 1.00 0.00 O ATOM 1613 CB ILE A 113 7.083 76.388 -47.053 1.00 0.00 C ATOM 1614 CG1 ILE A 113 7.730 75.003 -47.084 1.00 0.00 C ATOM 1615 CG2 ILE A 113 5.912 76.455 -48.021 1.00 0.00 C ATOM 1616 CD1 ILE A 113 6.769 73.881 -46.758 1.00 0.00 C ATOM 0 H ILE A 113 8.961 77.351 -45.477 1.00 0.00 H new ATOM 0 HA ILE A 113 8.542 77.265 -48.380 1.00 0.00 H new ATOM 0 HB ILE A 113 6.707 76.569 -46.046 1.00 0.00 H new ATOM 0 HG12 ILE A 113 8.155 74.831 -48.073 1.00 0.00 H new ATOM 0 HG13 ILE A 113 8.557 74.981 -46.374 1.00 0.00 H new ATOM 0 HG21 ILE A 113 5.185 75.683 -47.767 1.00 0.00 H new ATOM 0 HG22 ILE A 113 5.439 77.435 -47.953 1.00 0.00 H new ATOM 0 HG23 ILE A 113 6.271 76.295 -49.038 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.296 72.928 -46.799 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.363 74.029 -45.757 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.955 73.877 -47.483 1.00 0.00 H new ATOM 1628 N GLY A 114 7.115 79.346 -46.232 1.00 0.00 N ATOM 1629 CA GLY A 114 6.459 80.638 -46.136 1.00 0.00 C ATOM 1630 C GLY A 114 7.437 81.791 -46.223 1.00 0.00 C ATOM 1631 O GLY A 114 7.209 82.752 -46.959 1.00 0.00 O ATOM 0 H GLY A 114 7.297 78.890 -45.338 1.00 0.00 H new ATOM 0 HA2 GLY A 114 5.723 80.729 -46.935 1.00 0.00 H new ATOM 0 HA3 GLY A 114 5.915 80.697 -45.193 1.00 0.00 H new ATOM 1635 N ARG A 115 8.528 81.701 -45.471 1.00 0.00 N ATOM 1636 CA ARG A 115 9.542 82.748 -45.463 1.00 0.00 C ATOM 1637 C ARG A 115 9.954 83.113 -46.885 1.00 0.00 C ATOM 1638 O ARG A 115 10.414 84.226 -47.144 1.00 0.00 O ATOM 1639 CB ARG A 115 10.767 82.296 -44.666 1.00 0.00 C ATOM 1640 CG ARG A 115 11.678 83.439 -44.251 1.00 0.00 C ATOM 1641 CD ARG A 115 12.939 83.482 -45.102 1.00 0.00 C ATOM 1642 NE ARG A 115 13.949 82.539 -44.628 1.00 0.00 N ATOM 1643 CZ ARG A 115 14.625 82.693 -43.494 1.00 0.00 C ATOM 1644 NH1 ARG A 115 14.397 83.746 -42.721 1.00 0.00 N1+ ATOM 1645 NH2 ARG A 115 15.530 81.793 -43.132 1.00 0.00 N ATOM 0 H ARG A 115 8.733 80.912 -44.858 1.00 0.00 H new ATOM 0 HA ARG A 115 9.114 83.631 -44.988 1.00 0.00 H new ATOM 0 HB2 ARG A 115 10.434 81.765 -43.774 1.00 0.00 H new ATOM 0 HB3 ARG A 115 11.338 81.586 -45.265 1.00 0.00 H new ATOM 0 HG2 ARG A 115 11.143 84.384 -44.343 1.00 0.00 H new ATOM 0 HG3 ARG A 115 11.949 83.327 -43.201 1.00 0.00 H new ATOM 0 HD2 ARG A 115 12.686 83.253 -46.137 1.00 0.00 H new ATOM 0 HD3 ARG A 115 13.351 84.491 -45.090 1.00 0.00 H new ATOM 0 HE ARG A 115 14.146 81.717 -45.199 1.00 0.00 H new ATOM 0 HH11 ARG A 115 13.702 84.440 -42.996 1.00 0.00 H new ATOM 0 HH12 ARG A 115 14.917 83.862 -41.851 1.00 0.00 H new ATOM 0 HH21 ARG A 115 15.708 80.982 -43.724 1.00 0.00 H new ATOM 0 HH22 ARG A 115 16.048 81.912 -42.262 1.00 0.00 H new ATOM 1659 N THR A 116 9.788 82.169 -47.807 1.00 0.00 N ATOM 1660 CA THR A 116 10.144 82.391 -49.202 1.00 0.00 C ATOM 1661 C THR A 116 8.912 82.701 -50.043 1.00 0.00 C ATOM 1662 O THR A 116 8.943 83.576 -50.909 1.00 0.00 O ATOM 1663 CB THR A 116 10.863 81.166 -49.799 1.00 0.00 C ATOM 1664 OG1 THR A 116 11.209 81.420 -51.166 1.00 0.00 O ATOM 1665 CG2 THR A 116 9.984 79.929 -49.716 1.00 0.00 C ATOM 0 H THR A 116 9.409 81.243 -47.611 1.00 0.00 H new ATOM 0 HA THR A 116 10.819 83.247 -49.223 1.00 0.00 H new ATOM 0 HB THR A 116 11.770 80.987 -49.221 1.00 0.00 H new ATOM 0 HG1 THR A 116 11.667 80.638 -51.538 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.513 79.077 -50.144 1.00 0.00 H new ATOM 0 HG22 THR A 116 9.745 79.722 -48.673 1.00 0.00 H new ATOM 0 HG23 THR A 116 9.062 80.100 -50.272 1.00 0.00 H new ATOM 1673 N LEU A 117 7.825 81.981 -49.780 1.00 0.00 N ATOM 1674 CA LEU A 117 6.580 82.182 -50.512 1.00 0.00 C ATOM 1675 C LEU A 117 5.998 83.562 -50.229 1.00 0.00 C ATOM 1676 O LEU A 117 5.169 84.065 -50.988 1.00 0.00 O ATOM 1677 CB LEU A 117 5.565 81.100 -50.136 1.00 0.00 C ATOM 1678 CG LEU A 117 4.233 81.139 -50.885 1.00 0.00 C ATOM 1679 CD1 LEU A 117 3.754 79.730 -51.197 1.00 0.00 C ATOM 1680 CD2 LEU A 117 3.189 81.895 -50.077 1.00 0.00 C ATOM 0 H LEU A 117 7.782 81.254 -49.066 1.00 0.00 H new ATOM 0 HA LEU A 117 6.798 82.113 -51.578 1.00 0.00 H new ATOM 0 HB2 LEU A 117 6.024 80.126 -50.303 1.00 0.00 H new ATOM 0 HB3 LEU A 117 5.361 81.177 -49.068 1.00 0.00 H new ATOM 0 HG LEU A 117 4.383 81.665 -51.828 1.00 0.00 H new ATOM 0 HD11 LEU A 117 2.805 79.778 -51.730 1.00 0.00 H new ATOM 0 HD12 LEU A 117 4.493 79.223 -51.817 1.00 0.00 H new ATOM 0 HD13 LEU A 117 3.620 79.177 -50.267 1.00 0.00 H new ATOM 0 HD21 LEU A 117 2.247 81.913 -50.625 1.00 0.00 H new ATOM 0 HD22 LEU A 117 3.041 81.398 -49.118 1.00 0.00 H new ATOM 0 HD23 LEU A 117 3.530 82.916 -49.908 1.00 0.00 H new ATOM 1692 N VAL A 118 6.439 84.172 -49.133 1.00 0.00 N ATOM 1693 CA VAL A 118 5.965 85.497 -48.752 1.00 0.00 C ATOM 1694 C VAL A 118 6.992 86.569 -49.098 1.00 0.00 C ATOM 1695 O VAL A 118 6.647 87.625 -49.628 1.00 0.00 O ATOM 1696 CB VAL A 118 5.651 85.569 -47.246 1.00 0.00 C ATOM 1697 CG1 VAL A 118 5.153 86.956 -46.869 1.00 0.00 C ATOM 1698 CG2 VAL A 118 4.633 84.505 -46.864 1.00 0.00 C ATOM 0 H VAL A 118 7.124 83.769 -48.493 1.00 0.00 H new ATOM 0 HA VAL A 118 5.050 85.680 -49.315 1.00 0.00 H new ATOM 0 HB VAL A 118 6.569 85.377 -46.691 1.00 0.00 H new ATOM 0 HG11 VAL A 118 4.936 86.987 -45.801 1.00 0.00 H new ATOM 0 HG12 VAL A 118 5.919 87.694 -47.106 1.00 0.00 H new ATOM 0 HG13 VAL A 118 4.246 87.182 -47.430 1.00 0.00 H new ATOM 0 HG21 VAL A 118 4.422 84.570 -45.797 1.00 0.00 H new ATOM 0 HG22 VAL A 118 3.713 84.664 -47.426 1.00 0.00 H new ATOM 0 HG23 VAL A 118 5.034 83.518 -47.096 1.00 0.00 H new ATOM 1708 N VAL A 119 8.256 86.290 -48.795 1.00 0.00 N ATOM 1709 CA VAL A 119 9.333 87.230 -49.076 1.00 0.00 C ATOM 1710 C VAL A 119 9.740 87.176 -50.544 1.00 0.00 C ATOM 1711 O VAL A 119 9.665 88.178 -51.258 1.00 0.00 O ATOM 1712 CB VAL A 119 10.568 86.944 -48.201 1.00 0.00 C ATOM 1713 CG1 VAL A 119 11.705 87.891 -48.556 1.00 0.00 C ATOM 1714 CG2 VAL A 119 10.213 87.054 -46.726 1.00 0.00 C ATOM 0 H VAL A 119 8.558 85.421 -48.355 1.00 0.00 H new ATOM 0 HA VAL A 119 8.954 88.225 -48.844 1.00 0.00 H new ATOM 0 HB VAL A 119 10.901 85.925 -48.396 1.00 0.00 H new ATOM 0 HG11 VAL A 119 12.569 87.674 -47.928 1.00 0.00 H new ATOM 0 HG12 VAL A 119 11.976 87.758 -49.603 1.00 0.00 H new ATOM 0 HG13 VAL A 119 11.386 88.920 -48.391 1.00 0.00 H new ATOM 0 HG21 VAL A 119 11.097 86.849 -46.123 1.00 0.00 H new ATOM 0 HG22 VAL A 119 9.854 88.061 -46.512 1.00 0.00 H new ATOM 0 HG23 VAL A 119 9.433 86.331 -46.485 1.00 0.00 H new ATOM 1724 N HIS A 120 10.175 86.002 -50.991 1.00 0.00 N ATOM 1725 CA HIS A 120 10.593 85.818 -52.375 1.00 0.00 C ATOM 1726 C HIS A 120 9.477 85.186 -53.200 1.00 0.00 C ATOM 1727 O HIS A 120 9.730 84.336 -54.055 1.00 0.00 O ATOM 1728 CB HIS A 120 11.848 84.946 -52.438 1.00 0.00 C ATOM 1729 CG HIS A 120 13.046 85.571 -51.794 1.00 0.00 C ATOM 1730 ND1 HIS A 120 13.922 84.868 -50.993 1.00 0.00 N ATOM 1731 CD2 HIS A 120 13.514 86.840 -51.839 1.00 0.00 C ATOM 1732 CE1 HIS A 120 14.875 85.679 -50.570 1.00 0.00 C ATOM 1733 NE2 HIS A 120 14.651 86.882 -51.069 1.00 0.00 N ATOM 0 H HIS A 120 10.247 85.164 -50.414 1.00 0.00 H new ATOM 0 HA HIS A 120 10.819 86.798 -52.795 1.00 0.00 H new ATOM 0 HB2 HIS A 120 11.642 83.992 -51.953 1.00 0.00 H new ATOM 0 HB3 HIS A 120 12.078 84.730 -53.481 1.00 0.00 H new ATOM 0 HD2 HIS A 120 13.075 87.666 -52.379 1.00 0.00 H new ATOM 0 HE1 HIS A 120 15.698 85.405 -49.926 1.00 0.00 H new ATOM 0 HE2 HIS A 120 15.228 87.707 -50.909 1.00 0.00 H new ATOM 1741 N GLU A 121 8.243 85.605 -52.938 1.00 0.00 N ATOM 1742 CA GLU A 121 7.090 85.079 -53.657 1.00 0.00 C ATOM 1743 C GLU A 121 7.268 85.237 -55.165 1.00 0.00 C ATOM 1744 O GLU A 121 6.843 84.385 -55.945 1.00 0.00 O ATOM 1745 CB GLU A 121 5.813 85.790 -53.207 1.00 0.00 C ATOM 1746 CG GLU A 121 4.538 85.075 -53.623 1.00 0.00 C ATOM 1747 CD GLU A 121 3.292 85.718 -53.044 1.00 0.00 C ATOM 1748 OE1 GLU A 121 3.295 86.034 -51.837 1.00 0.00 O ATOM 1749 OE2 GLU A 121 2.315 85.904 -53.798 1.00 0.00 O1- ATOM 0 H GLU A 121 8.017 86.307 -52.233 1.00 0.00 H new ATOM 0 HA GLU A 121 7.007 84.017 -53.428 1.00 0.00 H new ATOM 0 HB2 GLU A 121 5.826 85.889 -52.122 1.00 0.00 H new ATOM 0 HB3 GLU A 121 5.805 86.799 -53.619 1.00 0.00 H new ATOM 0 HG2 GLU A 121 4.467 85.070 -54.711 1.00 0.00 H new ATOM 0 HG3 GLU A 121 4.588 84.035 -53.302 1.00 0.00 H new ATOM 1756 N LYS A 122 7.901 86.335 -55.567 1.00 0.00 N ATOM 1757 CA LYS A 122 8.138 86.606 -56.981 1.00 0.00 C ATOM 1758 C LYS A 122 8.947 85.485 -57.622 1.00 0.00 C ATOM 1759 O LYS A 122 8.914 85.301 -58.839 1.00 0.00 O ATOM 1760 CB LYS A 122 8.870 87.939 -57.149 1.00 0.00 C ATOM 1761 CG LYS A 122 9.538 88.099 -58.503 1.00 0.00 C ATOM 1762 CD LYS A 122 9.957 89.538 -58.752 1.00 0.00 C ATOM 1763 CE LYS A 122 8.785 90.388 -59.217 1.00 0.00 C ATOM 1764 NZ LYS A 122 9.235 91.582 -59.983 1.00 0.00 N1+ ATOM 0 H LYS A 122 8.259 87.051 -54.934 1.00 0.00 H new ATOM 0 HA LYS A 122 7.171 86.663 -57.482 1.00 0.00 H new ATOM 0 HB2 LYS A 122 8.161 88.754 -57.004 1.00 0.00 H new ATOM 0 HB3 LYS A 122 9.625 88.031 -56.368 1.00 0.00 H new ATOM 0 HG2 LYS A 122 10.412 87.450 -58.557 1.00 0.00 H new ATOM 0 HG3 LYS A 122 8.853 87.778 -59.288 1.00 0.00 H new ATOM 0 HD2 LYS A 122 10.373 89.960 -57.837 1.00 0.00 H new ATOM 0 HD3 LYS A 122 10.747 89.563 -59.503 1.00 0.00 H new ATOM 0 HE2 LYS A 122 8.124 89.785 -59.840 1.00 0.00 H new ATOM 0 HE3 LYS A 122 8.204 90.709 -58.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 8.407 92.135 -60.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 9.845 92.171 -59.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 9.768 91.276 -60.822 1.00 0.00 H new ATOM 1778 N ALA A 123 9.671 84.737 -56.797 1.00 0.00 N ATOM 1779 CA ALA A 123 10.486 83.631 -57.283 1.00 0.00 C ATOM 1780 C ALA A 123 11.642 84.136 -58.139 1.00 0.00 C ATOM 1781 O ALA A 123 11.435 84.660 -59.233 1.00 0.00 O ATOM 1782 CB ALA A 123 9.630 82.652 -58.075 1.00 0.00 C ATOM 0 H ALA A 123 9.710 84.877 -55.787 1.00 0.00 H new ATOM 0 HA ALA A 123 10.905 83.115 -56.419 1.00 0.00 H new ATOM 0 HB1 ALA A 123 10.252 81.831 -58.432 1.00 0.00 H new ATOM 0 HB2 ALA A 123 8.841 82.258 -57.434 1.00 0.00 H new ATOM 0 HB3 ALA A 123 9.183 83.165 -58.926 1.00 0.00 H new ATOM 1788 N ASP A 124 12.861 83.976 -57.633 1.00 0.00 N ATOM 1789 CA ASP A 124 14.051 84.416 -58.350 1.00 0.00 C ATOM 1790 C ASP A 124 14.051 85.931 -58.524 1.00 0.00 C ATOM 1791 O ASP A 124 14.358 86.442 -59.602 1.00 0.00 O ATOM 1792 CB ASP A 124 14.130 83.735 -59.718 1.00 0.00 C ATOM 1793 CG ASP A 124 15.558 83.488 -60.161 1.00 0.00 C ATOM 1794 OD1 ASP A 124 16.172 84.419 -60.724 1.00 0.00 O ATOM 1795 OD2 ASP A 124 16.062 82.366 -59.945 1.00 0.00 O1- ATOM 0 H ASP A 124 13.050 83.544 -56.728 1.00 0.00 H new ATOM 0 HA ASP A 124 14.924 84.135 -57.761 1.00 0.00 H new ATOM 0 HB2 ASP A 124 13.596 82.786 -59.679 1.00 0.00 H new ATOM 0 HB3 ASP A 124 13.625 84.355 -60.459 1.00 0.00 H new ATOM 1800 N ASP A 125 13.704 86.644 -57.458 1.00 0.00 N ATOM 1801 CA ASP A 125 13.665 88.101 -57.493 1.00 0.00 C ATOM 1802 C ASP A 125 15.022 88.690 -57.120 1.00 0.00 C ATOM 1803 O ASP A 125 15.884 87.996 -56.581 1.00 0.00 O ATOM 1804 CB ASP A 125 12.588 88.626 -56.540 1.00 0.00 C ATOM 1805 CG ASP A 125 12.780 90.092 -56.200 1.00 0.00 C ATOM 1806 OD1 ASP A 125 12.471 90.944 -57.057 1.00 0.00 O ATOM 1807 OD2 ASP A 125 13.243 90.384 -55.076 1.00 0.00 O1- ATOM 0 H ASP A 125 13.446 86.237 -56.559 1.00 0.00 H new ATOM 0 HA ASP A 125 13.422 88.410 -58.510 1.00 0.00 H new ATOM 0 HB2 ASP A 125 11.607 88.487 -56.993 1.00 0.00 H new ATOM 0 HB3 ASP A 125 12.601 88.038 -55.622 1.00 0.00 H new TER 1812 ASP A 125