USER MOD reduce.3.24.130724 H: found=0, std=0, add=726, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 722 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 55 SER OG : rot -100:sc= 0.89 USER MOD Set 1.2: A 83 THR OG1 : rot 112:sc= 0.621 USER MOD Set 2.1: A 22 GLN : amide:sc= -0.863 K(o=-1.6,f=-8.4!) USER MOD Set 2.2: A 29 MET CE :methyl 143:sc= -0.738 (180deg=-0.2) USER MOD Set 2.3: A 32 THR OG1 : rot 140:sc=-0.00701 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot -147:sc= 1.25 USER MOD Single : A 8 SER OG : rot 180:sc= 0.00429 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 ASN : amide:sc= -0.157 K(o=-0.16,f=-1.9!) USER MOD Single : A 34 SER OG : rot 160:sc= -2.7 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 HIS : no HD1:sc= -0.0706 X(o=-0.071,f=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -0.235 K(o=-0.23,f=-2.7!) USER MOD Single : A 64 MET CE :methyl 179:sc= -0.96 (180deg=-0.961) USER MOD Single : A 65 THR OG1 : rot 180:sc= -0.393 USER MOD Single : A 66 HIS : no HE2:sc= -1.95 K(o=-1.9,f=-5.7!) USER MOD Single : A 70 GLN : amide:sc= -0.557 K(o=-0.56,f=-1.9!) USER MOD Single : A 71 ASN : amide:sc= -4.35! C(o=-4.4!,f=-3.2!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 CYS SG : rot 17:sc= -0.162 USER MOD Single : A 77 THR OG1 : rot -61:sc= 0.234 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 81 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 MET CE :methyl -169:sc= -1.59 (180deg=-2.07) USER MOD Single : A 85 GLN : amide:sc= -0.0111 K(o=-0.011,f=-1.4!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -16.971 6.545 19.173 1.00 0.00 N ATOM 2 CA GLY A 1 -15.947 5.521 19.290 1.00 0.00 C ATOM 3 C GLY A 1 -15.685 4.850 17.940 1.00 0.00 C ATOM 4 O GLY A 1 -15.396 5.526 16.953 1.00 0.00 O ATOM 0 H1 GLY A 1 -17.130 6.985 20.102 1.00 0.00 H new ATOM 0 H2 GLY A 1 -16.661 7.270 18.495 1.00 0.00 H new ATOM 0 H3 GLY A 1 -17.856 6.114 18.838 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -15.025 5.965 19.664 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -16.258 4.772 20.018 1.00 0.00 H new ATOM 8 N SER A 2 -15.795 3.530 17.940 1.00 0.00 N ATOM 9 CA SER A 2 -15.573 2.761 16.728 1.00 0.00 C ATOM 10 C SER A 2 -14.136 2.957 16.239 1.00 0.00 C ATOM 11 O SER A 2 -13.841 3.925 15.541 1.00 0.00 O ATOM 12 CB SER A 2 -16.565 3.160 15.633 1.00 0.00 C ATOM 13 OG SER A 2 -17.914 2.910 16.018 1.00 0.00 O ATOM 0 H SER A 2 -16.035 2.973 18.760 1.00 0.00 H new ATOM 0 HA SER A 2 -15.731 1.707 16.958 1.00 0.00 H new ATOM 0 HB2 SER A 2 -16.444 4.218 15.402 1.00 0.00 H new ATOM 0 HB3 SER A 2 -16.340 2.607 14.721 1.00 0.00 H new ATOM 0 HG SER A 2 -18.516 3.179 15.293 1.00 0.00 H new ATOM 19 N SER A 3 -13.281 2.022 16.626 1.00 0.00 N ATOM 20 CA SER A 3 -11.882 2.080 16.236 1.00 0.00 C ATOM 21 C SER A 3 -11.491 0.797 15.499 1.00 0.00 C ATOM 22 O SER A 3 -12.047 -0.268 15.762 1.00 0.00 O ATOM 23 CB SER A 3 -10.979 2.289 17.453 1.00 0.00 C ATOM 24 OG SER A 3 -9.759 2.939 17.107 1.00 0.00 O ATOM 0 H SER A 3 -13.530 1.220 17.205 1.00 0.00 H new ATOM 0 HA SER A 3 -11.748 2.931 15.568 1.00 0.00 H new ATOM 0 HB2 SER A 3 -11.507 2.883 18.199 1.00 0.00 H new ATOM 0 HB3 SER A 3 -10.759 1.325 17.911 1.00 0.00 H new ATOM 0 HG SER A 3 -9.211 3.056 17.911 1.00 0.00 H new ATOM 30 N GLY A 4 -10.537 0.942 14.590 1.00 0.00 N ATOM 31 CA GLY A 4 -10.065 -0.192 13.814 1.00 0.00 C ATOM 32 C GLY A 4 -9.025 -0.996 14.595 1.00 0.00 C ATOM 33 O GLY A 4 -7.876 -1.111 14.170 1.00 0.00 O ATOM 0 H GLY A 4 -10.079 1.827 14.374 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -10.906 -0.835 13.554 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -9.631 0.159 12.878 1.00 0.00 H new ATOM 37 N SER A 5 -9.464 -1.533 15.724 1.00 0.00 N ATOM 38 CA SER A 5 -8.585 -2.324 16.569 1.00 0.00 C ATOM 39 C SER A 5 -8.319 -3.683 15.919 1.00 0.00 C ATOM 40 O SER A 5 -9.067 -4.635 16.136 1.00 0.00 O ATOM 41 CB SER A 5 -9.183 -2.510 17.964 1.00 0.00 C ATOM 42 OG SER A 5 -8.351 -3.311 18.799 1.00 0.00 O ATOM 0 H SER A 5 -10.417 -1.436 16.073 1.00 0.00 H new ATOM 0 HA SER A 5 -7.641 -1.789 16.677 1.00 0.00 H new ATOM 0 HB2 SER A 5 -9.331 -1.535 18.428 1.00 0.00 H new ATOM 0 HB3 SER A 5 -10.165 -2.975 17.878 1.00 0.00 H new ATOM 0 HG SER A 5 -8.767 -3.405 19.681 1.00 0.00 H new ATOM 48 N SER A 6 -7.252 -3.731 15.136 1.00 0.00 N ATOM 49 CA SER A 6 -6.878 -4.958 14.454 1.00 0.00 C ATOM 50 C SER A 6 -5.457 -5.364 14.848 1.00 0.00 C ATOM 51 O SER A 6 -5.268 -6.182 15.747 1.00 0.00 O ATOM 52 CB SER A 6 -6.983 -4.798 12.936 1.00 0.00 C ATOM 53 OG SER A 6 -6.503 -5.948 12.244 1.00 0.00 O ATOM 0 H SER A 6 -6.634 -2.939 14.958 1.00 0.00 H new ATOM 0 HA SER A 6 -7.570 -5.743 14.758 1.00 0.00 H new ATOM 0 HB2 SER A 6 -8.022 -4.617 12.661 1.00 0.00 H new ATOM 0 HB3 SER A 6 -6.414 -3.923 12.623 1.00 0.00 H new ATOM 0 HG SER A 6 -6.095 -5.673 11.396 1.00 0.00 H new ATOM 59 N GLY A 7 -4.493 -4.773 14.156 1.00 0.00 N ATOM 60 CA GLY A 7 -3.095 -5.063 14.423 1.00 0.00 C ATOM 61 C GLY A 7 -2.188 -4.375 13.400 1.00 0.00 C ATOM 62 O GLY A 7 -2.484 -4.371 12.207 1.00 0.00 O ATOM 0 H GLY A 7 -4.653 -4.095 13.411 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -2.836 -4.728 15.427 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.931 -6.140 14.394 1.00 0.00 H new ATOM 66 N SER A 8 -1.101 -3.811 13.906 1.00 0.00 N ATOM 67 CA SER A 8 -0.149 -3.122 13.052 1.00 0.00 C ATOM 68 C SER A 8 0.949 -4.089 12.605 1.00 0.00 C ATOM 69 O SER A 8 1.161 -5.125 13.233 1.00 0.00 O ATOM 70 CB SER A 8 0.464 -1.918 13.770 1.00 0.00 C ATOM 71 OG SER A 8 0.844 -2.230 15.108 1.00 0.00 O ATOM 0 H SER A 8 -0.859 -3.817 14.897 1.00 0.00 H new ATOM 0 HA SER A 8 -0.681 -2.755 12.174 1.00 0.00 H new ATOM 0 HB2 SER A 8 1.337 -1.572 13.217 1.00 0.00 H new ATOM 0 HB3 SER A 8 -0.253 -1.097 13.779 1.00 0.00 H new ATOM 0 HG SER A 8 1.232 -1.436 15.531 1.00 0.00 H new ATOM 77 N VAL A 9 1.618 -3.716 11.524 1.00 0.00 N ATOM 78 CA VAL A 9 2.688 -4.538 10.986 1.00 0.00 C ATOM 79 C VAL A 9 3.984 -3.724 10.955 1.00 0.00 C ATOM 80 O VAL A 9 3.957 -2.503 11.097 1.00 0.00 O ATOM 81 CB VAL A 9 2.291 -5.081 9.612 1.00 0.00 C ATOM 82 CG1 VAL A 9 2.483 -6.597 9.545 1.00 0.00 C ATOM 83 CG2 VAL A 9 0.852 -4.694 9.265 1.00 0.00 C ATOM 0 H VAL A 9 1.440 -2.855 11.006 1.00 0.00 H new ATOM 0 HA VAL A 9 2.862 -5.404 11.625 1.00 0.00 H new ATOM 0 HB VAL A 9 2.948 -4.628 8.870 1.00 0.00 H new ATOM 0 HG11 VAL A 9 2.193 -6.957 8.558 1.00 0.00 H new ATOM 0 HG12 VAL A 9 3.530 -6.840 9.727 1.00 0.00 H new ATOM 0 HG13 VAL A 9 1.863 -7.076 10.302 1.00 0.00 H new ATOM 0 HG21 VAL A 9 0.595 -5.092 8.283 1.00 0.00 H new ATOM 0 HG22 VAL A 9 0.174 -5.106 10.013 1.00 0.00 H new ATOM 0 HG23 VAL A 9 0.761 -3.608 9.251 1.00 0.00 H new ATOM 93 N SER A 10 5.087 -4.434 10.770 1.00 0.00 N ATOM 94 CA SER A 10 6.390 -3.793 10.719 1.00 0.00 C ATOM 95 C SER A 10 7.235 -4.414 9.604 1.00 0.00 C ATOM 96 O SER A 10 7.592 -5.589 9.672 1.00 0.00 O ATOM 97 CB SER A 10 7.114 -3.910 12.061 1.00 0.00 C ATOM 98 OG SER A 10 8.389 -3.274 12.037 1.00 0.00 O ATOM 0 H SER A 10 5.105 -5.447 10.654 1.00 0.00 H new ATOM 0 HA SER A 10 6.242 -2.734 10.508 1.00 0.00 H new ATOM 0 HB2 SER A 10 6.501 -3.464 12.844 1.00 0.00 H new ATOM 0 HB3 SER A 10 7.239 -4.963 12.315 1.00 0.00 H new ATOM 0 HG SER A 10 8.819 -3.369 12.913 1.00 0.00 H new ATOM 104 N LEU A 11 7.530 -3.596 8.604 1.00 0.00 N ATOM 105 CA LEU A 11 8.326 -4.050 7.477 1.00 0.00 C ATOM 106 C LEU A 11 9.693 -3.363 7.514 1.00 0.00 C ATOM 107 O LEU A 11 9.814 -2.240 8.001 1.00 0.00 O ATOM 108 CB LEU A 11 7.567 -3.839 6.165 1.00 0.00 C ATOM 109 CG LEU A 11 6.168 -4.454 6.094 1.00 0.00 C ATOM 110 CD1 LEU A 11 5.580 -4.318 4.687 1.00 0.00 C ATOM 111 CD2 LEU A 11 6.183 -5.908 6.570 1.00 0.00 C ATOM 0 H LEU A 11 7.232 -2.622 8.551 1.00 0.00 H new ATOM 0 HA LEU A 11 8.506 -5.123 7.545 1.00 0.00 H new ATOM 0 HB2 LEU A 11 7.481 -2.767 5.986 1.00 0.00 H new ATOM 0 HB3 LEU A 11 8.165 -4.251 5.352 1.00 0.00 H new ATOM 0 HG LEU A 11 5.517 -3.900 6.771 1.00 0.00 H new ATOM 0 HD11 LEU A 11 4.585 -4.763 4.664 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.512 -3.263 4.422 1.00 0.00 H new ATOM 0 HD13 LEU A 11 6.224 -4.831 3.972 1.00 0.00 H new ATOM 0 HD21 LEU A 11 5.176 -6.321 6.509 1.00 0.00 H new ATOM 0 HD22 LEU A 11 6.853 -6.491 5.938 1.00 0.00 H new ATOM 0 HD23 LEU A 11 6.531 -5.949 7.602 1.00 0.00 H new ATOM 123 N VAL A 12 10.687 -4.066 6.992 1.00 0.00 N ATOM 124 CA VAL A 12 12.040 -3.538 6.959 1.00 0.00 C ATOM 125 C VAL A 12 12.496 -3.403 5.505 1.00 0.00 C ATOM 126 O VAL A 12 12.777 -4.402 4.844 1.00 0.00 O ATOM 127 CB VAL A 12 12.968 -4.422 7.796 1.00 0.00 C ATOM 128 CG1 VAL A 12 14.424 -3.977 7.655 1.00 0.00 C ATOM 129 CG2 VAL A 12 12.537 -4.432 9.265 1.00 0.00 C ATOM 0 H VAL A 12 10.582 -4.997 6.588 1.00 0.00 H new ATOM 0 HA VAL A 12 12.072 -2.543 7.403 1.00 0.00 H new ATOM 0 HB VAL A 12 12.892 -5.441 7.417 1.00 0.00 H new ATOM 0 HG11 VAL A 12 15.062 -4.622 8.260 1.00 0.00 H new ATOM 0 HG12 VAL A 12 14.726 -4.045 6.610 1.00 0.00 H new ATOM 0 HG13 VAL A 12 14.524 -2.946 7.995 1.00 0.00 H new ATOM 0 HG21 VAL A 12 13.212 -5.067 9.838 1.00 0.00 H new ATOM 0 HG22 VAL A 12 12.570 -3.417 9.661 1.00 0.00 H new ATOM 0 HG23 VAL A 12 11.521 -4.819 9.343 1.00 0.00 H new ATOM 139 N GLY A 13 12.554 -2.160 5.050 1.00 0.00 N ATOM 140 CA GLY A 13 12.970 -1.882 3.686 1.00 0.00 C ATOM 141 C GLY A 13 13.064 -0.375 3.438 1.00 0.00 C ATOM 142 O GLY A 13 12.419 0.413 4.128 1.00 0.00 O ATOM 0 H GLY A 13 12.320 -1.334 5.601 1.00 0.00 H new ATOM 0 HA2 GLY A 13 13.937 -2.347 3.495 1.00 0.00 H new ATOM 0 HA3 GLY A 13 12.260 -2.326 2.988 1.00 0.00 H new ATOM 146 N PRO A 14 13.895 -0.010 2.425 1.00 0.00 N ATOM 147 CA PRO A 14 14.081 1.389 2.077 1.00 0.00 C ATOM 148 C PRO A 14 12.866 1.933 1.324 1.00 0.00 C ATOM 149 O PRO A 14 12.792 3.128 1.039 1.00 0.00 O ATOM 150 CB PRO A 14 15.356 1.422 1.250 1.00 0.00 C ATOM 151 CG PRO A 14 15.582 -0.004 0.775 1.00 0.00 C ATOM 152 CD PRO A 14 14.675 -0.915 1.586 1.00 0.00 C ATOM 0 HA PRO A 14 14.173 2.032 2.953 1.00 0.00 H new ATOM 0 HB2 PRO A 14 15.256 2.104 0.405 1.00 0.00 H new ATOM 0 HB3 PRO A 14 16.199 1.773 1.845 1.00 0.00 H new ATOM 0 HG2 PRO A 14 15.359 -0.092 -0.288 1.00 0.00 H new ATOM 0 HG3 PRO A 14 16.626 -0.289 0.907 1.00 0.00 H new ATOM 0 HD2 PRO A 14 14.030 -1.510 0.939 1.00 0.00 H new ATOM 0 HD3 PRO A 14 15.254 -1.615 2.189 1.00 0.00 H new ATOM 160 N ALA A 15 11.943 1.031 1.023 1.00 0.00 N ATOM 161 CA ALA A 15 10.735 1.407 0.308 1.00 0.00 C ATOM 162 C ALA A 15 10.094 0.155 -0.294 1.00 0.00 C ATOM 163 O ALA A 15 8.899 -0.079 -0.122 1.00 0.00 O ATOM 164 CB ALA A 15 11.074 2.456 -0.753 1.00 0.00 C ATOM 0 H ALA A 15 12.007 0.041 1.261 1.00 0.00 H new ATOM 0 HA ALA A 15 10.010 1.855 0.988 1.00 0.00 H new ATOM 0 HB1 ALA A 15 10.168 2.738 -1.289 1.00 0.00 H new ATOM 0 HB2 ALA A 15 11.499 3.337 -0.271 1.00 0.00 H new ATOM 0 HB3 ALA A 15 11.797 2.042 -1.456 1.00 0.00 H new ATOM 170 N PRO A 16 10.940 -0.638 -1.006 1.00 0.00 N ATOM 171 CA PRO A 16 10.469 -1.860 -1.635 1.00 0.00 C ATOM 172 C PRO A 16 10.254 -2.963 -0.596 1.00 0.00 C ATOM 173 O PRO A 16 11.074 -3.871 -0.471 1.00 0.00 O ATOM 174 CB PRO A 16 11.533 -2.210 -2.662 1.00 0.00 C ATOM 175 CG PRO A 16 12.777 -1.439 -2.252 1.00 0.00 C ATOM 176 CD PRO A 16 12.361 -0.392 -1.231 1.00 0.00 C ATOM 0 HA PRO A 16 9.497 -1.739 -2.114 1.00 0.00 H new ATOM 0 HB2 PRO A 16 11.725 -3.283 -2.675 1.00 0.00 H new ATOM 0 HB3 PRO A 16 11.214 -1.931 -3.666 1.00 0.00 H new ATOM 0 HG2 PRO A 16 13.521 -2.113 -1.827 1.00 0.00 H new ATOM 0 HG3 PRO A 16 13.236 -0.965 -3.120 1.00 0.00 H new ATOM 0 HD2 PRO A 16 12.931 -0.491 -0.307 1.00 0.00 H new ATOM 0 HD3 PRO A 16 12.534 0.617 -1.606 1.00 0.00 H new ATOM 184 N TRP A 17 9.146 -2.848 0.122 1.00 0.00 N ATOM 185 CA TRP A 17 8.813 -3.824 1.145 1.00 0.00 C ATOM 186 C TRP A 17 8.417 -5.126 0.446 1.00 0.00 C ATOM 187 O TRP A 17 8.531 -6.205 1.025 1.00 0.00 O ATOM 188 CB TRP A 17 7.724 -3.291 2.078 1.00 0.00 C ATOM 189 CG TRP A 17 7.787 -1.780 2.308 1.00 0.00 C ATOM 190 CD1 TRP A 17 7.196 -0.811 1.595 1.00 0.00 C ATOM 191 CD2 TRP A 17 8.507 -1.099 3.357 1.00 0.00 C ATOM 192 NE1 TRP A 17 7.482 0.439 2.105 1.00 0.00 N ATOM 193 CE2 TRP A 17 8.305 0.258 3.211 1.00 0.00 C ATOM 194 CE3 TRP A 17 9.304 -1.613 4.395 1.00 0.00 C ATOM 195 CZ2 TRP A 17 8.865 1.213 4.067 1.00 0.00 C ATOM 196 CZ3 TRP A 17 9.857 -0.646 5.242 1.00 0.00 C ATOM 197 CH2 TRP A 17 9.663 0.724 5.109 1.00 0.00 C ATOM 0 H TRP A 17 8.468 -2.094 0.015 1.00 0.00 H new ATOM 0 HA TRP A 17 9.673 -4.020 1.785 1.00 0.00 H new ATOM 0 HB2 TRP A 17 6.748 -3.545 1.663 1.00 0.00 H new ATOM 0 HB3 TRP A 17 7.803 -3.798 3.040 1.00 0.00 H new ATOM 0 HD1 TRP A 17 6.574 -0.987 0.730 1.00 0.00 H new ATOM 0 HE1 TRP A 17 7.151 1.331 1.738 1.00 0.00 H new ATOM 0 HE3 TRP A 17 9.476 -2.671 4.528 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 8.691 2.270 3.931 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 10.478 -0.988 6.056 1.00 0.00 H new ATOM 0 HH2 TRP A 17 10.125 1.408 5.806 1.00 0.00 H new ATOM 208 N GLY A 18 7.960 -4.982 -0.789 1.00 0.00 N ATOM 209 CA GLY A 18 7.546 -6.132 -1.574 1.00 0.00 C ATOM 210 C GLY A 18 6.022 -6.197 -1.691 1.00 0.00 C ATOM 211 O GLY A 18 5.451 -7.277 -1.832 1.00 0.00 O ATOM 0 H GLY A 18 7.867 -4.085 -1.266 1.00 0.00 H new ATOM 0 HA2 GLY A 18 7.988 -6.076 -2.569 1.00 0.00 H new ATOM 0 HA3 GLY A 18 7.918 -7.046 -1.111 1.00 0.00 H new ATOM 215 N PHE A 19 5.405 -5.025 -1.629 1.00 0.00 N ATOM 216 CA PHE A 19 3.959 -4.935 -1.726 1.00 0.00 C ATOM 217 C PHE A 19 3.535 -3.629 -2.402 1.00 0.00 C ATOM 218 O PHE A 19 4.210 -2.609 -2.268 1.00 0.00 O ATOM 219 CB PHE A 19 3.411 -4.957 -0.298 1.00 0.00 C ATOM 220 CG PHE A 19 3.475 -3.603 0.414 1.00 0.00 C ATOM 221 CD1 PHE A 19 2.690 -2.576 -0.008 1.00 0.00 C ATOM 222 CD2 PHE A 19 4.317 -3.428 1.467 1.00 0.00 C ATOM 223 CE1 PHE A 19 2.749 -1.320 0.653 1.00 0.00 C ATOM 224 CE2 PHE A 19 4.376 -2.172 2.128 1.00 0.00 C ATOM 225 CZ PHE A 19 3.590 -1.145 1.706 1.00 0.00 C ATOM 0 H PHE A 19 5.881 -4.130 -1.513 1.00 0.00 H new ATOM 0 HA PHE A 19 3.575 -5.763 -2.321 1.00 0.00 H new ATOM 0 HB2 PHE A 19 2.375 -5.295 -0.322 1.00 0.00 H new ATOM 0 HB3 PHE A 19 3.971 -5.689 0.284 1.00 0.00 H new ATOM 0 HD1 PHE A 19 2.022 -2.715 -0.845 1.00 0.00 H new ATOM 0 HD2 PHE A 19 4.941 -4.244 1.801 1.00 0.00 H new ATOM 0 HE1 PHE A 19 2.125 -0.504 0.319 1.00 0.00 H new ATOM 0 HE2 PHE A 19 5.044 -2.033 2.965 1.00 0.00 H new ATOM 0 HZ PHE A 19 3.634 -0.190 2.208 1.00 0.00 H new ATOM 235 N ARG A 20 2.420 -3.703 -3.113 1.00 0.00 N ATOM 236 CA ARG A 20 1.899 -2.539 -3.810 1.00 0.00 C ATOM 237 C ARG A 20 0.575 -2.094 -3.185 1.00 0.00 C ATOM 238 O ARG A 20 0.018 -2.794 -2.340 1.00 0.00 O ATOM 239 CB ARG A 20 1.678 -2.839 -5.294 1.00 0.00 C ATOM 240 CG ARG A 20 2.979 -2.686 -6.084 1.00 0.00 C ATOM 241 CD ARG A 20 2.851 -1.591 -7.145 1.00 0.00 C ATOM 242 NE ARG A 20 3.854 -1.800 -8.213 1.00 0.00 N ATOM 243 CZ ARG A 20 3.836 -2.831 -9.069 1.00 0.00 C ATOM 244 NH1 ARG A 20 2.866 -3.752 -8.989 1.00 0.00 N ATOM 245 NH2 ARG A 20 4.788 -2.940 -10.006 1.00 0.00 N ATOM 0 H ARG A 20 1.863 -4.550 -3.222 1.00 0.00 H new ATOM 0 HA ARG A 20 2.635 -1.741 -3.717 1.00 0.00 H new ATOM 0 HB2 ARG A 20 1.295 -3.853 -5.411 1.00 0.00 H new ATOM 0 HB3 ARG A 20 0.922 -2.164 -5.696 1.00 0.00 H new ATOM 0 HG2 ARG A 20 3.795 -2.444 -5.404 1.00 0.00 H new ATOM 0 HG3 ARG A 20 3.232 -3.632 -6.562 1.00 0.00 H new ATOM 0 HD2 ARG A 20 1.847 -1.601 -7.570 1.00 0.00 H new ATOM 0 HD3 ARG A 20 2.993 -0.612 -6.688 1.00 0.00 H new ATOM 0 HE ARG A 20 4.606 -1.117 -8.303 1.00 0.00 H new ATOM 0 HH11 ARG A 20 2.141 -3.668 -8.276 1.00 0.00 H new ATOM 0 HH12 ARG A 20 2.853 -4.537 -9.641 1.00 0.00 H new ATOM 0 HH21 ARG A 20 5.526 -2.238 -10.067 1.00 0.00 H new ATOM 0 HH22 ARG A 20 4.775 -3.725 -10.658 1.00 0.00 H new ATOM 259 N LEU A 21 0.110 -0.934 -3.623 1.00 0.00 N ATOM 260 CA LEU A 21 -1.137 -0.388 -3.117 1.00 0.00 C ATOM 261 C LEU A 21 -2.023 0.025 -4.294 1.00 0.00 C ATOM 262 O LEU A 21 -1.525 0.307 -5.382 1.00 0.00 O ATOM 263 CB LEU A 21 -0.863 0.746 -2.127 1.00 0.00 C ATOM 264 CG LEU A 21 -0.312 0.327 -0.762 1.00 0.00 C ATOM 265 CD1 LEU A 21 0.112 1.547 0.057 1.00 0.00 C ATOM 266 CD2 LEU A 21 -1.318 -0.547 -0.010 1.00 0.00 C ATOM 0 H LEU A 21 0.575 -0.357 -4.323 1.00 0.00 H new ATOM 0 HA LEU A 21 -1.684 -1.145 -2.556 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -0.156 1.438 -2.585 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -1.791 1.296 -1.969 1.00 0.00 H new ATOM 0 HG LEU A 21 0.581 -0.277 -0.925 1.00 0.00 H new ATOM 0 HD11 LEU A 21 0.500 1.221 1.022 1.00 0.00 H new ATOM 0 HD12 LEU A 21 0.888 2.094 -0.479 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -0.749 2.198 0.213 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -0.902 -0.831 0.957 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -2.242 0.011 0.142 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -1.528 -1.444 -0.593 1.00 0.00 H new ATOM 278 N GLN A 22 -3.323 0.047 -4.035 1.00 0.00 N ATOM 279 CA GLN A 22 -4.283 0.421 -5.060 1.00 0.00 C ATOM 280 C GLN A 22 -5.554 0.979 -4.417 1.00 0.00 C ATOM 281 O GLN A 22 -5.896 0.618 -3.292 1.00 0.00 O ATOM 282 CB GLN A 22 -4.605 -0.767 -5.969 1.00 0.00 C ATOM 283 CG GLN A 22 -5.380 -1.845 -5.208 1.00 0.00 C ATOM 284 CD GLN A 22 -6.397 -2.535 -6.120 1.00 0.00 C ATOM 285 OE1 GLN A 22 -7.508 -2.070 -6.318 1.00 0.00 O ATOM 286 NE2 GLN A 22 -5.958 -3.667 -6.662 1.00 0.00 N ATOM 0 H GLN A 22 -3.733 -0.188 -3.131 1.00 0.00 H new ATOM 0 HA GLN A 22 -3.839 1.201 -5.679 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -5.191 -0.428 -6.823 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -3.681 -1.189 -6.364 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -4.685 -2.583 -4.808 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -5.894 -1.397 -4.358 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -5.017 -4.000 -6.455 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -6.563 -4.202 -7.285 1.00 0.00 H new ATOM 295 N GLY A 23 -6.220 1.851 -5.160 1.00 0.00 N ATOM 296 CA GLY A 23 -7.446 2.464 -4.677 1.00 0.00 C ATOM 297 C GLY A 23 -7.162 3.817 -4.023 1.00 0.00 C ATOM 298 O GLY A 23 -6.142 4.444 -4.303 1.00 0.00 O ATOM 0 H GLY A 23 -5.934 2.148 -6.093 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.142 2.596 -5.506 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.929 1.802 -3.958 1.00 0.00 H new ATOM 302 N GLY A 24 -8.084 4.229 -3.164 1.00 0.00 N ATOM 303 CA GLY A 24 -7.945 5.497 -2.468 1.00 0.00 C ATOM 304 C GLY A 24 -9.179 6.377 -2.681 1.00 0.00 C ATOM 305 O GLY A 24 -10.187 5.919 -3.217 1.00 0.00 O ATOM 0 H GLY A 24 -8.930 3.707 -2.935 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -7.801 5.317 -1.403 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -7.057 6.017 -2.826 1.00 0.00 H new ATOM 309 N LYS A 25 -9.058 7.624 -2.250 1.00 0.00 N ATOM 310 CA LYS A 25 -10.151 8.572 -2.387 1.00 0.00 C ATOM 311 C LYS A 25 -10.292 8.972 -3.857 1.00 0.00 C ATOM 312 O LYS A 25 -11.391 8.942 -4.410 1.00 0.00 O ATOM 313 CB LYS A 25 -9.951 9.759 -1.443 1.00 0.00 C ATOM 314 CG LYS A 25 -10.528 9.461 -0.058 1.00 0.00 C ATOM 315 CD LYS A 25 -11.089 10.730 0.587 1.00 0.00 C ATOM 316 CE LYS A 25 -9.996 11.787 0.760 1.00 0.00 C ATOM 317 NZ LYS A 25 -10.517 13.131 0.426 1.00 0.00 N ATOM 0 H LYS A 25 -8.220 8.000 -1.806 1.00 0.00 H new ATOM 0 HA LYS A 25 -11.094 8.113 -2.090 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.888 9.985 -1.357 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -10.432 10.644 -1.859 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.316 8.713 -0.142 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -9.752 9.037 0.580 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.893 11.131 -0.030 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -11.522 10.488 1.557 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.631 11.777 1.787 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -9.148 11.550 0.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -9.763 13.836 0.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -10.843 13.141 -0.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -11.312 13.361 1.056 1.00 0.00 H new ATOM 331 N ASP A 26 -9.164 9.337 -4.449 1.00 0.00 N ATOM 332 CA ASP A 26 -9.148 9.742 -5.844 1.00 0.00 C ATOM 333 C ASP A 26 -9.544 8.552 -6.721 1.00 0.00 C ATOM 334 O ASP A 26 -9.904 8.727 -7.884 1.00 0.00 O ATOM 335 CB ASP A 26 -7.751 10.199 -6.269 1.00 0.00 C ATOM 336 CG ASP A 26 -7.512 10.227 -7.780 1.00 0.00 C ATOM 337 OD1 ASP A 26 -8.402 10.748 -8.486 1.00 0.00 O ATOM 338 OD2 ASP A 26 -6.445 9.726 -8.195 1.00 0.00 O ATOM 0 H ASP A 26 -8.255 9.361 -3.988 1.00 0.00 H new ATOM 0 HA ASP A 26 -9.849 10.568 -5.963 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -7.575 11.198 -5.870 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -7.014 9.538 -5.812 1.00 0.00 H new ATOM 343 N PHE A 27 -9.463 7.370 -6.130 1.00 0.00 N ATOM 344 CA PHE A 27 -9.808 6.151 -6.842 1.00 0.00 C ATOM 345 C PHE A 27 -11.258 5.747 -6.567 1.00 0.00 C ATOM 346 O PHE A 27 -11.823 4.924 -7.285 1.00 0.00 O ATOM 347 CB PHE A 27 -8.877 5.052 -6.326 1.00 0.00 C ATOM 348 CG PHE A 27 -7.453 5.131 -6.880 1.00 0.00 C ATOM 349 CD1 PHE A 27 -6.731 6.275 -6.738 1.00 0.00 C ATOM 350 CD2 PHE A 27 -6.910 4.058 -7.514 1.00 0.00 C ATOM 351 CE1 PHE A 27 -5.410 6.348 -7.252 1.00 0.00 C ATOM 352 CE2 PHE A 27 -5.588 4.131 -8.028 1.00 0.00 C ATOM 353 CZ PHE A 27 -4.866 5.275 -7.886 1.00 0.00 C ATOM 0 H PHE A 27 -9.163 7.230 -5.165 1.00 0.00 H new ATOM 0 HA PHE A 27 -9.700 6.304 -7.916 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -8.836 5.106 -5.238 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -9.302 4.081 -6.581 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -7.163 7.127 -6.234 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -7.484 3.150 -7.627 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -4.837 7.256 -7.140 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -5.156 3.279 -8.531 1.00 0.00 H new ATOM 0 HZ PHE A 27 -3.861 5.331 -8.277 1.00 0.00 H new ATOM 363 N ASN A 28 -11.818 6.344 -5.526 1.00 0.00 N ATOM 364 CA ASN A 28 -13.191 6.057 -5.147 1.00 0.00 C ATOM 365 C ASN A 28 -13.269 4.644 -4.565 1.00 0.00 C ATOM 366 O ASN A 28 -14.205 3.900 -4.855 1.00 0.00 O ATOM 367 CB ASN A 28 -14.122 6.121 -6.359 1.00 0.00 C ATOM 368 CG ASN A 28 -15.495 6.671 -5.967 1.00 0.00 C ATOM 369 OD1 ASN A 28 -15.792 6.900 -4.806 1.00 0.00 O ATOM 370 ND2 ASN A 28 -16.312 6.869 -6.997 1.00 0.00 N ATOM 0 H ASN A 28 -11.346 7.026 -4.932 1.00 0.00 H new ATOM 0 HA ASN A 28 -13.502 6.802 -4.414 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -13.679 6.753 -7.129 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -14.234 5.126 -6.789 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -17.251 7.234 -6.840 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -15.999 6.656 -7.944 1.00 0.00 H new ATOM 377 N MET A 29 -12.274 4.316 -3.755 1.00 0.00 N ATOM 378 CA MET A 29 -12.218 3.005 -3.130 1.00 0.00 C ATOM 379 C MET A 29 -11.223 2.993 -1.968 1.00 0.00 C ATOM 380 O MET A 29 -10.411 3.907 -1.832 1.00 0.00 O ATOM 381 CB MET A 29 -11.804 1.961 -4.169 1.00 0.00 C ATOM 382 CG MET A 29 -10.282 1.811 -4.217 1.00 0.00 C ATOM 383 SD MET A 29 -9.825 0.622 -5.469 1.00 0.00 S ATOM 384 CE MET A 29 -9.211 -0.697 -4.435 1.00 0.00 C ATOM 0 H MET A 29 -11.499 4.935 -3.517 1.00 0.00 H new ATOM 0 HA MET A 29 -13.207 2.768 -2.738 1.00 0.00 H new ATOM 0 HB2 MET A 29 -12.260 1.001 -3.927 1.00 0.00 H new ATOM 0 HB3 MET A 29 -12.176 2.253 -5.151 1.00 0.00 H new ATOM 0 HG2 MET A 29 -9.820 2.774 -4.433 1.00 0.00 H new ATOM 0 HG3 MET A 29 -9.909 1.489 -3.245 1.00 0.00 H new ATOM 0 HE1 MET A 29 -9.490 -1.658 -4.867 1.00 0.00 H new ATOM 0 HE2 MET A 29 -8.125 -0.631 -4.367 1.00 0.00 H new ATOM 0 HE3 MET A 29 -9.643 -0.609 -3.438 1.00 0.00 H new ATOM 394 N PRO A 30 -11.320 1.919 -1.139 1.00 0.00 N ATOM 395 CA PRO A 30 -10.438 1.776 0.007 1.00 0.00 C ATOM 396 C PRO A 30 -9.034 1.354 -0.431 1.00 0.00 C ATOM 397 O PRO A 30 -8.866 0.744 -1.486 1.00 0.00 O ATOM 398 CB PRO A 30 -11.116 0.749 0.899 1.00 0.00 C ATOM 399 CG PRO A 30 -12.107 0.015 0.011 1.00 0.00 C ATOM 400 CD PRO A 30 -12.269 0.818 -1.269 1.00 0.00 C ATOM 0 HA PRO A 30 -10.289 2.713 0.543 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -10.387 0.059 1.324 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -11.623 1.232 1.734 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -11.749 -0.990 -0.212 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -13.066 -0.094 0.518 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -12.052 0.210 -2.148 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -13.289 1.186 -1.379 1.00 0.00 H new ATOM 408 N LEU A 31 -8.061 1.696 0.401 1.00 0.00 N ATOM 409 CA LEU A 31 -6.677 1.360 0.112 1.00 0.00 C ATOM 410 C LEU A 31 -6.454 -0.131 0.374 1.00 0.00 C ATOM 411 O LEU A 31 -6.574 -0.591 1.508 1.00 0.00 O ATOM 412 CB LEU A 31 -5.730 2.270 0.896 1.00 0.00 C ATOM 413 CG LEU A 31 -5.776 3.756 0.534 1.00 0.00 C ATOM 414 CD1 LEU A 31 -5.894 4.623 1.789 1.00 0.00 C ATOM 415 CD2 LEU A 31 -4.570 4.149 -0.322 1.00 0.00 C ATOM 0 H LEU A 31 -8.204 2.202 1.275 1.00 0.00 H new ATOM 0 HA LEU A 31 -6.454 1.537 -0.940 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -5.955 2.168 1.958 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -4.711 1.912 0.751 1.00 0.00 H new ATOM 0 HG LEU A 31 -6.669 3.934 -0.065 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -5.925 5.674 1.503 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -6.808 4.366 2.324 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -5.034 4.447 2.435 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -4.627 5.210 -0.565 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -3.652 3.952 0.231 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -4.571 3.565 -1.242 1.00 0.00 H new ATOM 427 N THR A 32 -6.132 -0.845 -0.695 1.00 0.00 N ATOM 428 CA THR A 32 -5.891 -2.274 -0.595 1.00 0.00 C ATOM 429 C THR A 32 -4.501 -2.619 -1.133 1.00 0.00 C ATOM 430 O THR A 32 -3.865 -1.798 -1.793 1.00 0.00 O ATOM 431 CB THR A 32 -7.023 -2.997 -1.328 1.00 0.00 C ATOM 432 OG1 THR A 32 -7.462 -2.056 -2.304 1.00 0.00 O ATOM 433 CG2 THR A 32 -8.250 -3.215 -0.441 1.00 0.00 C ATOM 0 H THR A 32 -6.033 -0.460 -1.634 1.00 0.00 H new ATOM 0 HA THR A 32 -5.894 -2.604 0.444 1.00 0.00 H new ATOM 0 HB THR A 32 -6.663 -3.959 -1.692 1.00 0.00 H new ATOM 0 HG1 THR A 32 -7.654 -2.522 -3.144 1.00 0.00 H new ATOM 0 HG21 THR A 32 -9.023 -3.732 -1.010 1.00 0.00 H new ATOM 0 HG22 THR A 32 -7.972 -3.818 0.423 1.00 0.00 H new ATOM 0 HG23 THR A 32 -8.631 -2.251 -0.104 1.00 0.00 H new ATOM 441 N ILE A 33 -4.069 -3.835 -0.831 1.00 0.00 N ATOM 442 CA ILE A 33 -2.766 -4.299 -1.276 1.00 0.00 C ATOM 443 C ILE A 33 -2.851 -4.709 -2.748 1.00 0.00 C ATOM 444 O ILE A 33 -3.377 -5.773 -3.070 1.00 0.00 O ATOM 445 CB ILE A 33 -2.249 -5.408 -0.357 1.00 0.00 C ATOM 446 CG1 ILE A 33 -2.125 -4.911 1.085 1.00 0.00 C ATOM 447 CG2 ILE A 33 -0.933 -5.984 -0.881 1.00 0.00 C ATOM 448 CD1 ILE A 33 -0.932 -3.965 1.238 1.00 0.00 C ATOM 0 H ILE A 33 -4.599 -4.513 -0.283 1.00 0.00 H new ATOM 0 HA ILE A 33 -2.033 -3.495 -1.210 1.00 0.00 H new ATOM 0 HB ILE A 33 -2.977 -6.219 -0.356 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -3.041 -4.397 1.376 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -2.009 -5.761 1.758 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -0.587 -6.770 -0.210 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -1.088 -6.399 -1.877 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -0.184 -5.194 -0.930 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -0.866 -3.626 2.272 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -0.015 -4.489 0.969 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -1.064 -3.104 0.582 1.00 0.00 H new ATOM 460 N SER A 34 -2.325 -3.843 -3.601 1.00 0.00 N ATOM 461 CA SER A 34 -2.334 -4.102 -5.031 1.00 0.00 C ATOM 462 C SER A 34 -1.838 -5.523 -5.309 1.00 0.00 C ATOM 463 O SER A 34 -2.583 -6.355 -5.823 1.00 0.00 O ATOM 464 CB SER A 34 -1.474 -3.083 -5.781 1.00 0.00 C ATOM 465 OG SER A 34 -0.523 -3.713 -6.635 1.00 0.00 O ATOM 0 H SER A 34 -1.890 -2.961 -3.330 1.00 0.00 H new ATOM 0 HA SER A 34 -3.359 -4.005 -5.389 1.00 0.00 H new ATOM 0 HB2 SER A 34 -2.117 -2.431 -6.373 1.00 0.00 H new ATOM 0 HB3 SER A 34 -0.953 -2.450 -5.063 1.00 0.00 H new ATOM 0 HG SER A 34 -0.224 -3.076 -7.317 1.00 0.00 H new ATOM 471 N SER A 35 -0.582 -5.756 -4.956 1.00 0.00 N ATOM 472 CA SER A 35 0.023 -7.061 -5.161 1.00 0.00 C ATOM 473 C SER A 35 1.095 -7.313 -4.100 1.00 0.00 C ATOM 474 O SER A 35 1.381 -6.441 -3.281 1.00 0.00 O ATOM 475 CB SER A 35 0.626 -7.175 -6.563 1.00 0.00 C ATOM 476 OG SER A 35 -0.048 -8.147 -7.357 1.00 0.00 O ATOM 0 H SER A 35 0.033 -5.063 -4.529 1.00 0.00 H new ATOM 0 HA SER A 35 -0.756 -7.818 -5.068 1.00 0.00 H new ATOM 0 HB2 SER A 35 0.577 -6.205 -7.058 1.00 0.00 H new ATOM 0 HB3 SER A 35 1.680 -7.440 -6.484 1.00 0.00 H new ATOM 0 HG SER A 35 0.366 -8.188 -8.245 1.00 0.00 H new ATOM 482 N LEU A 36 1.660 -8.511 -4.148 1.00 0.00 N ATOM 483 CA LEU A 36 2.695 -8.889 -3.201 1.00 0.00 C ATOM 484 C LEU A 36 3.947 -9.322 -3.966 1.00 0.00 C ATOM 485 O LEU A 36 3.881 -9.611 -5.160 1.00 0.00 O ATOM 486 CB LEU A 36 2.171 -9.948 -2.229 1.00 0.00 C ATOM 487 CG LEU A 36 2.097 -9.530 -0.759 1.00 0.00 C ATOM 488 CD1 LEU A 36 3.495 -9.303 -0.182 1.00 0.00 C ATOM 489 CD2 LEU A 36 1.197 -8.306 -0.581 1.00 0.00 C ATOM 0 H LEU A 36 1.420 -9.232 -4.828 1.00 0.00 H new ATOM 0 HA LEU A 36 2.977 -8.036 -2.584 1.00 0.00 H new ATOM 0 HB2 LEU A 36 1.174 -10.247 -2.552 1.00 0.00 H new ATOM 0 HB3 LEU A 36 2.808 -10.829 -2.304 1.00 0.00 H new ATOM 0 HG LEU A 36 1.645 -10.346 -0.195 1.00 0.00 H new ATOM 0 HD11 LEU A 36 3.413 -9.007 0.864 1.00 0.00 H new ATOM 0 HD12 LEU A 36 4.072 -10.225 -0.254 1.00 0.00 H new ATOM 0 HD13 LEU A 36 3.997 -8.515 -0.744 1.00 0.00 H new ATOM 0 HD21 LEU A 36 1.162 -8.030 0.473 1.00 0.00 H new ATOM 0 HD22 LEU A 36 1.596 -7.474 -1.161 1.00 0.00 H new ATOM 0 HD23 LEU A 36 0.191 -8.541 -0.928 1.00 0.00 H new ATOM 501 N LYS A 37 5.060 -9.354 -3.247 1.00 0.00 N ATOM 502 CA LYS A 37 6.325 -9.747 -3.843 1.00 0.00 C ATOM 503 C LYS A 37 6.760 -11.095 -3.264 1.00 0.00 C ATOM 504 O LYS A 37 6.578 -11.351 -2.074 1.00 0.00 O ATOM 505 CB LYS A 37 7.366 -8.639 -3.672 1.00 0.00 C ATOM 506 CG LYS A 37 8.757 -9.125 -4.082 1.00 0.00 C ATOM 507 CD LYS A 37 9.608 -7.969 -4.612 1.00 0.00 C ATOM 508 CE LYS A 37 11.052 -8.081 -4.119 1.00 0.00 C ATOM 509 NZ LYS A 37 11.870 -6.969 -4.655 1.00 0.00 N ATOM 0 H LYS A 37 5.111 -9.114 -2.257 1.00 0.00 H new ATOM 0 HA LYS A 37 6.213 -9.883 -4.919 1.00 0.00 H new ATOM 0 HB2 LYS A 37 7.086 -7.776 -4.276 1.00 0.00 H new ATOM 0 HB3 LYS A 37 7.384 -8.309 -2.633 1.00 0.00 H new ATOM 0 HG2 LYS A 37 9.253 -9.584 -3.226 1.00 0.00 H new ATOM 0 HG3 LYS A 37 8.666 -9.895 -4.848 1.00 0.00 H new ATOM 0 HD2 LYS A 37 9.591 -7.970 -5.702 1.00 0.00 H new ATOM 0 HD3 LYS A 37 9.182 -7.020 -4.287 1.00 0.00 H new ATOM 0 HE2 LYS A 37 11.073 -8.063 -3.029 1.00 0.00 H new ATOM 0 HE3 LYS A 37 11.476 -9.036 -4.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 12.847 -7.060 -4.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 11.864 -7.003 -5.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 11.474 -6.062 -4.337 1.00 0.00 H new ATOM 523 N ASP A 38 7.327 -11.921 -4.131 1.00 0.00 N ATOM 524 CA ASP A 38 7.789 -13.235 -3.720 1.00 0.00 C ATOM 525 C ASP A 38 8.770 -13.085 -2.555 1.00 0.00 C ATOM 526 O ASP A 38 9.778 -12.390 -2.674 1.00 0.00 O ATOM 527 CB ASP A 38 8.518 -13.945 -4.863 1.00 0.00 C ATOM 528 CG ASP A 38 7.639 -14.856 -5.723 1.00 0.00 C ATOM 529 OD1 ASP A 38 6.733 -15.488 -5.138 1.00 0.00 O ATOM 530 OD2 ASP A 38 7.893 -14.899 -6.946 1.00 0.00 O ATOM 0 H ASP A 38 7.477 -11.705 -5.117 1.00 0.00 H new ATOM 0 HA ASP A 38 6.918 -13.822 -3.427 1.00 0.00 H new ATOM 0 HB2 ASP A 38 8.974 -13.192 -5.506 1.00 0.00 H new ATOM 0 HB3 ASP A 38 9.329 -14.539 -4.443 1.00 0.00 H new ATOM 535 N GLY A 39 8.441 -13.748 -1.457 1.00 0.00 N ATOM 536 CA GLY A 39 9.281 -13.697 -0.272 1.00 0.00 C ATOM 537 C GLY A 39 9.583 -12.250 0.124 1.00 0.00 C ATOM 538 O GLY A 39 10.740 -11.887 0.327 1.00 0.00 O ATOM 0 H GLY A 39 7.604 -14.324 -1.362 1.00 0.00 H new ATOM 0 HA2 GLY A 39 8.784 -14.207 0.553 1.00 0.00 H new ATOM 0 HA3 GLY A 39 10.214 -14.229 -0.460 1.00 0.00 H new ATOM 542 N GLY A 40 8.521 -11.464 0.223 1.00 0.00 N ATOM 543 CA GLY A 40 8.658 -10.065 0.591 1.00 0.00 C ATOM 544 C GLY A 40 8.269 -9.842 2.054 1.00 0.00 C ATOM 545 O GLY A 40 7.554 -10.654 2.640 1.00 0.00 O ATOM 0 H GLY A 40 7.562 -11.769 0.055 1.00 0.00 H new ATOM 0 HA2 GLY A 40 9.687 -9.742 0.431 1.00 0.00 H new ATOM 0 HA3 GLY A 40 8.028 -9.452 -0.054 1.00 0.00 H new ATOM 549 N LYS A 41 8.756 -8.738 2.601 1.00 0.00 N ATOM 550 CA LYS A 41 8.468 -8.399 3.984 1.00 0.00 C ATOM 551 C LYS A 41 6.958 -8.476 4.220 1.00 0.00 C ATOM 552 O LYS A 41 6.504 -9.153 5.141 1.00 0.00 O ATOM 553 CB LYS A 41 9.077 -7.041 4.341 1.00 0.00 C ATOM 554 CG LYS A 41 10.604 -7.090 4.271 1.00 0.00 C ATOM 555 CD LYS A 41 11.119 -6.376 3.020 1.00 0.00 C ATOM 556 CE LYS A 41 12.174 -7.220 2.301 1.00 0.00 C ATOM 557 NZ LYS A 41 12.434 -6.682 0.948 1.00 0.00 N ATOM 0 H LYS A 41 9.348 -8.067 2.112 1.00 0.00 H new ATOM 0 HA LYS A 41 8.934 -9.119 4.657 1.00 0.00 H new ATOM 0 HB2 LYS A 41 8.702 -6.279 3.657 1.00 0.00 H new ATOM 0 HB3 LYS A 41 8.764 -6.751 5.344 1.00 0.00 H new ATOM 0 HG2 LYS A 41 11.027 -6.624 5.160 1.00 0.00 H new ATOM 0 HG3 LYS A 41 10.938 -8.127 4.265 1.00 0.00 H new ATOM 0 HD2 LYS A 41 10.288 -6.174 2.344 1.00 0.00 H new ATOM 0 HD3 LYS A 41 11.546 -5.412 3.297 1.00 0.00 H new ATOM 0 HE2 LYS A 41 13.098 -7.228 2.879 1.00 0.00 H new ATOM 0 HE3 LYS A 41 11.834 -8.253 2.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 13.152 -7.266 0.474 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 11.554 -6.697 0.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 12.779 -5.704 1.024 1.00 0.00 H new ATOM 571 N ALA A 42 6.222 -7.774 3.371 1.00 0.00 N ATOM 572 CA ALA A 42 4.773 -7.754 3.476 1.00 0.00 C ATOM 573 C ALA A 42 4.260 -9.184 3.658 1.00 0.00 C ATOM 574 O ALA A 42 3.693 -9.517 4.698 1.00 0.00 O ATOM 575 CB ALA A 42 4.181 -7.076 2.239 1.00 0.00 C ATOM 0 H ALA A 42 6.602 -7.215 2.607 1.00 0.00 H new ATOM 0 HA ALA A 42 4.459 -7.177 4.346 1.00 0.00 H new ATOM 0 HB1 ALA A 42 3.094 -7.061 2.318 1.00 0.00 H new ATOM 0 HB2 ALA A 42 4.554 -6.054 2.171 1.00 0.00 H new ATOM 0 HB3 ALA A 42 4.473 -7.629 1.346 1.00 0.00 H new ATOM 581 N SER A 43 4.477 -9.992 2.630 1.00 0.00 N ATOM 582 CA SER A 43 4.044 -11.379 2.664 1.00 0.00 C ATOM 583 C SER A 43 4.469 -12.028 3.983 1.00 0.00 C ATOM 584 O SER A 43 3.667 -12.689 4.640 1.00 0.00 O ATOM 585 CB SER A 43 4.612 -12.162 1.479 1.00 0.00 C ATOM 586 OG SER A 43 4.747 -13.550 1.772 1.00 0.00 O ATOM 0 H SER A 43 4.947 -9.713 1.769 1.00 0.00 H new ATOM 0 HA SER A 43 2.957 -11.400 2.591 1.00 0.00 H new ATOM 0 HB2 SER A 43 3.960 -12.036 0.615 1.00 0.00 H new ATOM 0 HB3 SER A 43 5.585 -11.753 1.207 1.00 0.00 H new ATOM 0 HG SER A 43 5.111 -14.015 0.990 1.00 0.00 H new ATOM 592 N GLN A 44 5.730 -11.817 4.329 1.00 0.00 N ATOM 593 CA GLN A 44 6.272 -12.374 5.558 1.00 0.00 C ATOM 594 C GLN A 44 5.520 -11.818 6.769 1.00 0.00 C ATOM 595 O GLN A 44 5.522 -12.426 7.838 1.00 0.00 O ATOM 596 CB GLN A 44 7.772 -12.098 5.670 1.00 0.00 C ATOM 597 CG GLN A 44 8.555 -12.894 4.624 1.00 0.00 C ATOM 598 CD GLN A 44 10.006 -13.099 5.064 1.00 0.00 C ATOM 599 OE1 GLN A 44 10.351 -14.065 5.725 1.00 0.00 O ATOM 600 NE2 GLN A 44 10.835 -12.140 4.662 1.00 0.00 N ATOM 0 H GLN A 44 6.392 -11.268 3.781 1.00 0.00 H new ATOM 0 HA GLN A 44 6.136 -13.455 5.535 1.00 0.00 H new ATOM 0 HB2 GLN A 44 7.960 -11.033 5.537 1.00 0.00 H new ATOM 0 HB3 GLN A 44 8.120 -12.362 6.669 1.00 0.00 H new ATOM 0 HG2 GLN A 44 8.079 -13.862 4.467 1.00 0.00 H new ATOM 0 HG3 GLN A 44 8.532 -12.368 3.669 1.00 0.00 H new ATOM 0 HE21 GLN A 44 10.481 -11.358 4.111 1.00 0.00 H new ATOM 0 HE22 GLN A 44 11.825 -12.186 4.905 1.00 0.00 H new ATOM 609 N ALA A 45 4.895 -10.668 6.561 1.00 0.00 N ATOM 610 CA ALA A 45 4.141 -10.023 7.622 1.00 0.00 C ATOM 611 C ALA A 45 2.677 -10.462 7.541 1.00 0.00 C ATOM 612 O ALA A 45 1.792 -9.782 8.058 1.00 0.00 O ATOM 613 CB ALA A 45 4.302 -8.506 7.513 1.00 0.00 C ATOM 0 H ALA A 45 4.896 -10.166 5.673 1.00 0.00 H new ATOM 0 HA ALA A 45 4.521 -10.321 8.599 1.00 0.00 H new ATOM 0 HB1 ALA A 45 3.736 -8.022 8.309 1.00 0.00 H new ATOM 0 HB2 ALA A 45 5.356 -8.244 7.606 1.00 0.00 H new ATOM 0 HB3 ALA A 45 3.929 -8.169 6.546 1.00 0.00 H new ATOM 619 N HIS A 46 2.468 -11.596 6.888 1.00 0.00 N ATOM 620 CA HIS A 46 1.127 -12.133 6.732 1.00 0.00 C ATOM 621 C HIS A 46 0.218 -11.072 6.107 1.00 0.00 C ATOM 622 O HIS A 46 -0.867 -10.800 6.618 1.00 0.00 O ATOM 623 CB HIS A 46 0.594 -12.658 8.067 1.00 0.00 C ATOM 624 CG HIS A 46 1.282 -13.912 8.552 1.00 0.00 C ATOM 625 ND1 HIS A 46 0.588 -15.019 9.009 1.00 0.00 N ATOM 626 CD2 HIS A 46 2.607 -14.221 8.647 1.00 0.00 C ATOM 627 CE1 HIS A 46 1.466 -15.947 9.360 1.00 0.00 C ATOM 628 NE2 HIS A 46 2.716 -15.450 9.136 1.00 0.00 N ATOM 0 H HIS A 46 3.205 -12.157 6.461 1.00 0.00 H new ATOM 0 HA HIS A 46 1.150 -12.987 6.054 1.00 0.00 H new ATOM 0 HB2 HIS A 46 0.705 -11.880 8.822 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -0.473 -12.856 7.968 1.00 0.00 H new ATOM 0 HD2 HIS A 46 3.428 -13.575 8.371 1.00 0.00 H new ATOM 0 HE1 HIS A 46 1.233 -16.925 9.754 1.00 0.00 H new ATOM 0 HE2 HIS A 46 3.591 -15.942 9.315 1.00 0.00 H new ATOM 636 N VAL A 47 0.696 -10.502 5.011 1.00 0.00 N ATOM 637 CA VAL A 47 -0.060 -9.477 4.310 1.00 0.00 C ATOM 638 C VAL A 47 -0.592 -10.051 2.996 1.00 0.00 C ATOM 639 O VAL A 47 0.132 -10.115 2.004 1.00 0.00 O ATOM 640 CB VAL A 47 0.807 -8.232 4.112 1.00 0.00 C ATOM 641 CG1 VAL A 47 -0.003 -7.095 3.487 1.00 0.00 C ATOM 642 CG2 VAL A 47 1.444 -7.792 5.431 1.00 0.00 C ATOM 0 H VAL A 47 1.597 -10.730 4.591 1.00 0.00 H new ATOM 0 HA VAL A 47 -0.922 -9.166 4.901 1.00 0.00 H new ATOM 0 HB VAL A 47 1.611 -8.489 3.422 1.00 0.00 H new ATOM 0 HG11 VAL A 47 0.636 -6.222 3.357 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -0.387 -7.412 2.517 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.837 -6.840 4.141 1.00 0.00 H new ATOM 0 HG21 VAL A 47 2.055 -6.905 5.262 1.00 0.00 H new ATOM 0 HG22 VAL A 47 0.661 -7.561 6.154 1.00 0.00 H new ATOM 0 HG23 VAL A 47 2.070 -8.596 5.818 1.00 0.00 H new ATOM 652 N ARG A 48 -1.854 -10.454 3.031 1.00 0.00 N ATOM 653 CA ARG A 48 -2.492 -11.020 1.855 1.00 0.00 C ATOM 654 C ARG A 48 -3.106 -9.911 0.998 1.00 0.00 C ATOM 655 O ARG A 48 -3.254 -8.779 1.455 1.00 0.00 O ATOM 656 CB ARG A 48 -3.585 -12.017 2.247 1.00 0.00 C ATOM 657 CG ARG A 48 -2.978 -13.296 2.826 1.00 0.00 C ATOM 658 CD ARG A 48 -1.830 -13.803 1.952 1.00 0.00 C ATOM 659 NE ARG A 48 -0.538 -13.301 2.472 1.00 0.00 N ATOM 660 CZ ARG A 48 0.200 -13.937 3.392 1.00 0.00 C ATOM 661 NH1 ARG A 48 -0.221 -15.103 3.899 1.00 0.00 N ATOM 662 NH2 ARG A 48 1.359 -13.406 3.805 1.00 0.00 N ATOM 0 H ARG A 48 -2.452 -10.400 3.856 1.00 0.00 H new ATOM 0 HA ARG A 48 -1.727 -11.544 1.283 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -4.251 -11.562 2.980 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -4.190 -12.260 1.374 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -2.614 -13.105 3.836 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -3.747 -14.065 2.904 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -1.827 -14.893 1.938 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -1.971 -13.471 0.923 1.00 0.00 H new ATOM 0 HE ARG A 48 -0.188 -12.415 2.107 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -1.103 -15.507 3.585 1.00 0.00 H new ATOM 0 HH12 ARG A 48 0.341 -15.587 4.599 1.00 0.00 H new ATOM 0 HH21 ARG A 48 1.679 -12.518 3.419 1.00 0.00 H new ATOM 0 HH22 ARG A 48 1.921 -13.890 4.505 1.00 0.00 H new ATOM 676 N ILE A 49 -3.446 -10.276 -0.230 1.00 0.00 N ATOM 677 CA ILE A 49 -4.040 -9.326 -1.155 1.00 0.00 C ATOM 678 C ILE A 49 -5.470 -9.014 -0.710 1.00 0.00 C ATOM 679 O ILE A 49 -6.206 -9.910 -0.299 1.00 0.00 O ATOM 680 CB ILE A 49 -3.942 -9.843 -2.591 1.00 0.00 C ATOM 681 CG1 ILE A 49 -2.481 -9.996 -3.020 1.00 0.00 C ATOM 682 CG2 ILE A 49 -4.731 -8.950 -3.551 1.00 0.00 C ATOM 683 CD1 ILE A 49 -1.677 -8.738 -2.684 1.00 0.00 C ATOM 0 H ILE A 49 -3.321 -11.216 -0.605 1.00 0.00 H new ATOM 0 HA ILE A 49 -3.489 -8.386 -1.141 1.00 0.00 H new ATOM 0 HB ILE A 49 -4.394 -10.834 -2.629 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -2.040 -10.858 -2.520 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -2.431 -10.189 -4.092 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -4.644 -9.340 -4.565 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -5.780 -8.936 -3.256 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -4.331 -7.937 -3.517 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -0.642 -8.873 -2.999 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -2.106 -7.882 -3.205 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -1.709 -8.562 -1.609 1.00 0.00 H new ATOM 695 N GLY A 50 -5.822 -7.740 -0.807 1.00 0.00 N ATOM 696 CA GLY A 50 -7.151 -7.299 -0.420 1.00 0.00 C ATOM 697 C GLY A 50 -7.125 -6.615 0.949 1.00 0.00 C ATOM 698 O GLY A 50 -8.085 -5.950 1.333 1.00 0.00 O ATOM 0 H GLY A 50 -5.209 -6.999 -1.148 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -7.541 -6.609 -1.168 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -7.827 -8.153 -0.391 1.00 0.00 H new ATOM 702 N ASP A 51 -6.014 -6.802 1.647 1.00 0.00 N ATOM 703 CA ASP A 51 -5.850 -6.212 2.965 1.00 0.00 C ATOM 704 C ASP A 51 -6.105 -4.706 2.879 1.00 0.00 C ATOM 705 O ASP A 51 -5.512 -4.019 2.049 1.00 0.00 O ATOM 706 CB ASP A 51 -4.429 -6.422 3.489 1.00 0.00 C ATOM 707 CG ASP A 51 -4.093 -7.859 3.892 1.00 0.00 C ATOM 708 OD1 ASP A 51 -5.015 -8.700 3.813 1.00 0.00 O ATOM 709 OD2 ASP A 51 -2.923 -8.085 4.268 1.00 0.00 O ATOM 0 H ASP A 51 -5.219 -7.354 1.325 1.00 0.00 H new ATOM 0 HA ASP A 51 -6.558 -6.692 3.641 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -3.724 -6.102 2.722 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -4.277 -5.774 4.352 1.00 0.00 H new ATOM 714 N VAL A 52 -6.988 -4.237 3.748 1.00 0.00 N ATOM 715 CA VAL A 52 -7.328 -2.824 3.781 1.00 0.00 C ATOM 716 C VAL A 52 -6.469 -2.122 4.835 1.00 0.00 C ATOM 717 O VAL A 52 -6.446 -2.530 5.995 1.00 0.00 O ATOM 718 CB VAL A 52 -8.829 -2.654 4.023 1.00 0.00 C ATOM 719 CG1 VAL A 52 -9.190 -1.178 4.211 1.00 0.00 C ATOM 720 CG2 VAL A 52 -9.642 -3.277 2.887 1.00 0.00 C ATOM 0 H VAL A 52 -7.479 -4.810 4.435 1.00 0.00 H new ATOM 0 HA VAL A 52 -7.111 -2.356 2.821 1.00 0.00 H new ATOM 0 HB VAL A 52 -9.082 -3.181 4.943 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -10.263 -1.085 4.381 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -8.650 -0.778 5.069 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -8.915 -0.619 3.316 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -10.705 -3.142 3.084 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -9.383 -2.792 1.946 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -9.418 -4.342 2.820 1.00 0.00 H new ATOM 730 N VAL A 53 -5.784 -1.077 4.393 1.00 0.00 N ATOM 731 CA VAL A 53 -4.926 -0.314 5.283 1.00 0.00 C ATOM 732 C VAL A 53 -5.770 0.712 6.042 1.00 0.00 C ATOM 733 O VAL A 53 -6.313 1.639 5.443 1.00 0.00 O ATOM 734 CB VAL A 53 -3.782 0.321 4.489 1.00 0.00 C ATOM 735 CG1 VAL A 53 -2.776 0.997 5.423 1.00 0.00 C ATOM 736 CG2 VAL A 53 -3.093 -0.713 3.597 1.00 0.00 C ATOM 0 H VAL A 53 -5.806 -0.741 3.430 1.00 0.00 H new ATOM 0 HA VAL A 53 -4.466 -0.967 6.024 1.00 0.00 H new ATOM 0 HB VAL A 53 -4.208 1.089 3.843 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.973 1.440 4.834 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -3.278 1.776 5.996 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -2.359 0.257 6.106 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -2.284 -0.235 3.044 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -2.687 -1.514 4.215 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -3.817 -1.128 2.895 1.00 0.00 H new ATOM 746 N LEU A 54 -5.852 0.512 7.349 1.00 0.00 N ATOM 747 CA LEU A 54 -6.621 1.409 8.196 1.00 0.00 C ATOM 748 C LEU A 54 -5.790 2.658 8.494 1.00 0.00 C ATOM 749 O LEU A 54 -6.333 3.755 8.616 1.00 0.00 O ATOM 750 CB LEU A 54 -7.104 0.678 9.450 1.00 0.00 C ATOM 751 CG LEU A 54 -7.978 -0.556 9.212 1.00 0.00 C ATOM 752 CD1 LEU A 54 -8.012 -1.450 10.453 1.00 0.00 C ATOM 753 CD2 LEU A 54 -9.382 -0.154 8.756 1.00 0.00 C ATOM 0 H LEU A 54 -5.399 -0.257 7.842 1.00 0.00 H new ATOM 0 HA LEU A 54 -7.523 1.741 7.681 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -6.231 0.375 10.029 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -7.664 1.383 10.064 1.00 0.00 H new ATOM 0 HG LEU A 54 -7.533 -1.140 8.406 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -8.640 -2.320 10.258 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -7.001 -1.779 10.692 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -8.420 -0.890 11.294 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -9.982 -1.049 8.594 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -9.851 0.463 9.522 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -9.315 0.411 7.826 1.00 0.00 H new ATOM 765 N SER A 55 -4.486 2.451 8.603 1.00 0.00 N ATOM 766 CA SER A 55 -3.574 3.547 8.885 1.00 0.00 C ATOM 767 C SER A 55 -2.241 3.316 8.172 1.00 0.00 C ATOM 768 O SER A 55 -1.949 2.202 7.740 1.00 0.00 O ATOM 769 CB SER A 55 -3.351 3.704 10.391 1.00 0.00 C ATOM 770 OG SER A 55 -3.141 2.449 11.033 1.00 0.00 O ATOM 0 H SER A 55 -4.039 1.540 8.501 1.00 0.00 H new ATOM 0 HA SER A 55 -4.022 4.469 8.513 1.00 0.00 H new ATOM 0 HB2 SER A 55 -2.490 4.349 10.565 1.00 0.00 H new ATOM 0 HB3 SER A 55 -4.214 4.199 10.836 1.00 0.00 H new ATOM 0 HG SER A 55 -3.972 2.159 11.464 1.00 0.00 H new ATOM 776 N ILE A 56 -1.467 4.386 8.070 1.00 0.00 N ATOM 777 CA ILE A 56 -0.172 4.314 7.417 1.00 0.00 C ATOM 778 C ILE A 56 0.835 5.164 8.194 1.00 0.00 C ATOM 779 O ILE A 56 0.877 6.383 8.036 1.00 0.00 O ATOM 780 CB ILE A 56 -0.294 4.701 5.941 1.00 0.00 C ATOM 781 CG1 ILE A 56 -0.819 3.530 5.109 1.00 0.00 C ATOM 782 CG2 ILE A 56 1.035 5.236 5.403 1.00 0.00 C ATOM 783 CD1 ILE A 56 -1.040 3.947 3.653 1.00 0.00 C ATOM 0 H ILE A 56 -1.712 5.309 8.429 1.00 0.00 H new ATOM 0 HA ILE A 56 0.202 3.290 7.425 1.00 0.00 H new ATOM 0 HB ILE A 56 -1.023 5.507 5.858 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -0.110 2.703 5.151 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -1.756 3.169 5.534 1.00 0.00 H new ATOM 0 HG21 ILE A 56 0.921 5.504 4.353 1.00 0.00 H new ATOM 0 HG22 ILE A 56 1.329 6.118 5.972 1.00 0.00 H new ATOM 0 HG23 ILE A 56 1.803 4.468 5.501 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -1.413 3.096 3.083 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.768 4.758 3.613 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -0.097 4.285 3.224 1.00 0.00 H new ATOM 795 N ASP A 57 1.622 4.487 9.017 1.00 0.00 N ATOM 796 CA ASP A 57 2.626 5.165 9.819 1.00 0.00 C ATOM 797 C ASP A 57 1.936 5.939 10.944 1.00 0.00 C ATOM 798 O ASP A 57 2.288 7.086 11.219 1.00 0.00 O ATOM 799 CB ASP A 57 3.423 6.163 8.977 1.00 0.00 C ATOM 800 CG ASP A 57 4.925 6.198 9.265 1.00 0.00 C ATOM 801 OD1 ASP A 57 5.286 5.929 10.431 1.00 0.00 O ATOM 802 OD2 ASP A 57 5.678 6.494 8.312 1.00 0.00 O ATOM 0 H ASP A 57 1.585 3.476 9.146 1.00 0.00 H new ATOM 0 HA ASP A 57 3.303 4.411 10.219 1.00 0.00 H new ATOM 0 HB2 ASP A 57 3.276 5.925 7.923 1.00 0.00 H new ATOM 0 HB3 ASP A 57 3.014 7.160 9.139 1.00 0.00 H new ATOM 807 N GLY A 58 0.967 5.283 11.563 1.00 0.00 N ATOM 808 CA GLY A 58 0.225 5.895 12.652 1.00 0.00 C ATOM 809 C GLY A 58 -0.672 7.023 12.137 1.00 0.00 C ATOM 810 O GLY A 58 -1.180 7.824 12.920 1.00 0.00 O ATOM 0 H GLY A 58 0.678 4.333 11.331 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -0.383 5.141 13.152 1.00 0.00 H new ATOM 0 HA3 GLY A 58 0.919 6.288 13.395 1.00 0.00 H new ATOM 814 N ILE A 59 -0.840 7.050 10.823 1.00 0.00 N ATOM 815 CA ILE A 59 -1.666 8.066 10.194 1.00 0.00 C ATOM 816 C ILE A 59 -2.951 7.420 9.670 1.00 0.00 C ATOM 817 O ILE A 59 -2.929 6.289 9.189 1.00 0.00 O ATOM 818 CB ILE A 59 -0.873 8.815 9.122 1.00 0.00 C ATOM 819 CG1 ILE A 59 0.302 9.575 9.740 1.00 0.00 C ATOM 820 CG2 ILE A 59 -1.784 9.733 8.306 1.00 0.00 C ATOM 821 CD1 ILE A 59 -0.099 11.008 10.096 1.00 0.00 C ATOM 0 H ILE A 59 -0.418 6.384 10.176 1.00 0.00 H new ATOM 0 HA ILE A 59 -1.962 8.821 10.923 1.00 0.00 H new ATOM 0 HB ILE A 59 -0.455 8.082 8.432 1.00 0.00 H new ATOM 0 HG12 ILE A 59 0.645 9.056 10.635 1.00 0.00 H new ATOM 0 HG13 ILE A 59 1.138 9.590 9.041 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -1.194 10.253 7.551 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -2.556 9.139 7.817 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -2.252 10.462 8.967 1.00 0.00 H new ATOM 0 HD11 ILE A 59 0.754 11.527 10.534 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -0.418 11.531 9.195 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -0.919 10.989 10.814 1.00 0.00 H new ATOM 833 N SER A 60 -4.039 8.168 9.782 1.00 0.00 N ATOM 834 CA SER A 60 -5.330 7.682 9.325 1.00 0.00 C ATOM 835 C SER A 60 -5.368 7.654 7.796 1.00 0.00 C ATOM 836 O SER A 60 -5.214 8.689 7.149 1.00 0.00 O ATOM 837 CB SER A 60 -6.468 8.549 9.868 1.00 0.00 C ATOM 838 OG SER A 60 -7.316 7.823 10.754 1.00 0.00 O ATOM 0 H SER A 60 -4.053 9.106 10.182 1.00 0.00 H new ATOM 0 HA SER A 60 -5.468 6.669 9.704 1.00 0.00 H new ATOM 0 HB2 SER A 60 -6.050 9.410 10.390 1.00 0.00 H new ATOM 0 HB3 SER A 60 -7.058 8.935 9.037 1.00 0.00 H new ATOM 0 HG SER A 60 -8.029 8.411 11.080 1.00 0.00 H new ATOM 844 N ALA A 61 -5.573 6.459 7.263 1.00 0.00 N ATOM 845 CA ALA A 61 -5.632 6.282 5.822 1.00 0.00 C ATOM 846 C ALA A 61 -7.092 6.332 5.366 1.00 0.00 C ATOM 847 O ALA A 61 -7.444 5.764 4.333 1.00 0.00 O ATOM 848 CB ALA A 61 -4.947 4.969 5.439 1.00 0.00 C ATOM 0 H ALA A 61 -5.700 5.603 7.803 1.00 0.00 H new ATOM 0 HA ALA A 61 -5.100 7.087 5.315 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -4.992 4.837 4.358 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -3.905 4.995 5.759 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -5.455 4.138 5.927 1.00 0.00 H new ATOM 854 N GLN A 62 -7.903 7.018 6.159 1.00 0.00 N ATOM 855 CA GLN A 62 -9.317 7.149 5.850 1.00 0.00 C ATOM 856 C GLN A 62 -9.542 8.312 4.881 1.00 0.00 C ATOM 857 O GLN A 62 -10.061 8.118 3.783 1.00 0.00 O ATOM 858 CB GLN A 62 -10.142 7.331 7.126 1.00 0.00 C ATOM 859 CG GLN A 62 -10.089 6.073 7.996 1.00 0.00 C ATOM 860 CD GLN A 62 -11.355 5.233 7.822 1.00 0.00 C ATOM 861 OE1 GLN A 62 -12.275 5.590 7.105 1.00 0.00 O ATOM 862 NE2 GLN A 62 -11.351 4.098 8.517 1.00 0.00 N ATOM 0 H GLN A 62 -7.608 7.489 7.014 1.00 0.00 H new ATOM 0 HA GLN A 62 -9.651 6.230 5.368 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -9.764 8.184 7.690 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -11.177 7.555 6.866 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -9.215 5.479 7.730 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -9.976 6.355 9.043 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -10.548 3.859 9.099 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -12.151 3.467 8.468 1.00 0.00 H new ATOM 871 N GLY A 63 -9.141 9.495 5.323 1.00 0.00 N ATOM 872 CA GLY A 63 -9.293 10.689 4.509 1.00 0.00 C ATOM 873 C GLY A 63 -7.984 11.035 3.795 1.00 0.00 C ATOM 874 O GLY A 63 -7.539 12.181 3.830 1.00 0.00 O ATOM 0 H GLY A 63 -8.711 9.652 6.234 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -10.083 10.534 3.774 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -9.601 11.525 5.137 1.00 0.00 H new ATOM 878 N MET A 64 -7.406 10.024 3.164 1.00 0.00 N ATOM 879 CA MET A 64 -6.158 10.207 2.443 1.00 0.00 C ATOM 880 C MET A 64 -6.228 9.571 1.054 1.00 0.00 C ATOM 881 O MET A 64 -6.776 8.481 0.894 1.00 0.00 O ATOM 882 CB MET A 64 -5.012 9.576 3.237 1.00 0.00 C ATOM 883 CG MET A 64 -4.691 10.399 4.486 1.00 0.00 C ATOM 884 SD MET A 64 -2.934 10.370 4.801 1.00 0.00 S ATOM 885 CE MET A 64 -2.691 8.619 5.044 1.00 0.00 C ATOM 0 H MET A 64 -7.779 9.075 3.137 1.00 0.00 H new ATOM 0 HA MET A 64 -5.983 11.276 2.323 1.00 0.00 H new ATOM 0 HB2 MET A 64 -5.281 8.560 3.526 1.00 0.00 H new ATOM 0 HB3 MET A 64 -4.125 9.504 2.607 1.00 0.00 H new ATOM 0 HG2 MET A 64 -5.028 11.427 4.351 1.00 0.00 H new ATOM 0 HG3 MET A 64 -5.229 9.998 5.344 1.00 0.00 H new ATOM 0 HE1 MET A 64 -1.636 8.421 5.235 1.00 0.00 H new ATOM 0 HE2 MET A 64 -3.283 8.284 5.896 1.00 0.00 H new ATOM 0 HE3 MET A 64 -3.005 8.081 4.150 1.00 0.00 H new ATOM 895 N THR A 65 -5.667 10.279 0.084 1.00 0.00 N ATOM 896 CA THR A 65 -5.660 9.797 -1.286 1.00 0.00 C ATOM 897 C THR A 65 -4.588 8.720 -1.467 1.00 0.00 C ATOM 898 O THR A 65 -3.778 8.488 -0.570 1.00 0.00 O ATOM 899 CB THR A 65 -5.473 11.002 -2.210 1.00 0.00 C ATOM 900 OG1 THR A 65 -4.515 11.812 -1.535 1.00 0.00 O ATOM 901 CG2 THR A 65 -6.722 11.883 -2.282 1.00 0.00 C ATOM 0 H THR A 65 -5.214 11.183 0.220 1.00 0.00 H new ATOM 0 HA THR A 65 -6.605 9.317 -1.541 1.00 0.00 H new ATOM 0 HB THR A 65 -5.215 10.656 -3.211 1.00 0.00 H new ATOM 0 HG1 THR A 65 -4.334 12.615 -2.066 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.536 12.724 -2.951 1.00 0.00 H new ATOM 0 HG22 THR A 65 -7.559 11.297 -2.660 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.961 12.257 -1.287 1.00 0.00 H new ATOM 909 N HIS A 66 -4.616 8.092 -2.633 1.00 0.00 N ATOM 910 CA HIS A 66 -3.657 7.046 -2.943 1.00 0.00 C ATOM 911 C HIS A 66 -2.236 7.600 -2.822 1.00 0.00 C ATOM 912 O HIS A 66 -1.422 7.071 -2.066 1.00 0.00 O ATOM 913 CB HIS A 66 -3.941 6.438 -4.319 1.00 0.00 C ATOM 914 CG HIS A 66 -3.283 5.098 -4.546 1.00 0.00 C ATOM 915 ND1 HIS A 66 -2.591 4.790 -5.705 1.00 0.00 N ATOM 916 CD2 HIS A 66 -3.217 3.991 -3.752 1.00 0.00 C ATOM 917 CE1 HIS A 66 -2.135 3.550 -5.602 1.00 0.00 C ATOM 918 NE2 HIS A 66 -2.524 3.057 -4.391 1.00 0.00 N ATOM 0 H HIS A 66 -5.288 8.288 -3.375 1.00 0.00 H new ATOM 0 HA HIS A 66 -3.756 6.233 -2.224 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -5.019 6.327 -4.441 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -3.603 7.132 -5.088 1.00 0.00 H new ATOM 0 HD1 HIS A 66 -2.455 5.412 -6.502 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -3.655 3.891 -2.770 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -1.557 3.022 -6.346 1.00 0.00 H new ATOM 926 N LEU A 67 -1.981 8.658 -3.578 1.00 0.00 N ATOM 927 CA LEU A 67 -0.673 9.289 -3.564 1.00 0.00 C ATOM 928 C LEU A 67 -0.251 9.548 -2.117 1.00 0.00 C ATOM 929 O LEU A 67 0.865 9.213 -1.722 1.00 0.00 O ATOM 930 CB LEU A 67 -0.675 10.545 -4.438 1.00 0.00 C ATOM 931 CG LEU A 67 0.004 11.780 -3.841 1.00 0.00 C ATOM 932 CD1 LEU A 67 -0.878 12.425 -2.769 1.00 0.00 C ATOM 933 CD2 LEU A 67 1.395 11.435 -3.307 1.00 0.00 C ATOM 0 H LEU A 67 -2.658 9.094 -4.204 1.00 0.00 H new ATOM 0 HA LEU A 67 0.074 8.626 -4.000 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -0.186 10.307 -5.382 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -1.709 10.800 -4.670 1.00 0.00 H new ATOM 0 HG LEU A 67 0.137 12.515 -4.635 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.373 13.300 -2.361 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -1.827 12.727 -3.212 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -1.063 11.707 -1.970 1.00 0.00 H new ATOM 0 HD21 LEU A 67 1.856 12.329 -2.888 1.00 0.00 H new ATOM 0 HD22 LEU A 67 1.309 10.674 -2.531 1.00 0.00 H new ATOM 0 HD23 LEU A 67 2.013 11.055 -4.120 1.00 0.00 H new ATOM 945 N GLU A 68 -1.166 10.143 -1.365 1.00 0.00 N ATOM 946 CA GLU A 68 -0.903 10.450 0.031 1.00 0.00 C ATOM 947 C GLU A 68 -0.342 9.221 0.749 1.00 0.00 C ATOM 948 O GLU A 68 0.805 9.226 1.193 1.00 0.00 O ATOM 949 CB GLU A 68 -2.165 10.964 0.726 1.00 0.00 C ATOM 950 CG GLU A 68 -2.422 12.432 0.382 1.00 0.00 C ATOM 951 CD GLU A 68 -1.411 13.345 1.079 1.00 0.00 C ATOM 952 OE1 GLU A 68 -1.046 13.013 2.228 1.00 0.00 O ATOM 953 OE2 GLU A 68 -1.027 14.353 0.448 1.00 0.00 O ATOM 0 H GLU A 68 -2.090 10.421 -1.696 1.00 0.00 H new ATOM 0 HA GLU A 68 -0.156 11.243 0.074 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -3.022 10.361 0.425 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -2.061 10.853 1.805 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -2.360 12.572 -0.697 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -3.433 12.708 0.682 1.00 0.00 H new ATOM 960 N ALA A 69 -1.178 8.197 0.841 1.00 0.00 N ATOM 961 CA ALA A 69 -0.781 6.963 1.497 1.00 0.00 C ATOM 962 C ALA A 69 0.610 6.555 1.008 1.00 0.00 C ATOM 963 O ALA A 69 1.442 6.106 1.795 1.00 0.00 O ATOM 964 CB ALA A 69 -1.831 5.883 1.233 1.00 0.00 C ATOM 0 H ALA A 69 -2.129 8.197 0.472 1.00 0.00 H new ATOM 0 HA ALA A 69 -0.723 7.104 2.576 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -1.533 4.957 1.725 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -2.794 6.209 1.625 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -1.915 5.712 0.160 1.00 0.00 H new ATOM 970 N GLN A 70 0.821 6.727 -0.289 1.00 0.00 N ATOM 971 CA GLN A 70 2.097 6.383 -0.892 1.00 0.00 C ATOM 972 C GLN A 70 3.193 7.324 -0.389 1.00 0.00 C ATOM 973 O GLN A 70 4.321 6.896 -0.148 1.00 0.00 O ATOM 974 CB GLN A 70 2.007 6.412 -2.419 1.00 0.00 C ATOM 975 CG GLN A 70 0.983 5.395 -2.928 1.00 0.00 C ATOM 976 CD GLN A 70 1.622 4.428 -3.927 1.00 0.00 C ATOM 977 OE1 GLN A 70 2.677 4.678 -4.485 1.00 0.00 O ATOM 978 NE2 GLN A 70 0.924 3.312 -4.121 1.00 0.00 N ATOM 0 H GLN A 70 0.129 7.100 -0.939 1.00 0.00 H new ATOM 0 HA GLN A 70 2.355 5.366 -0.595 1.00 0.00 H new ATOM 0 HB2 GLN A 70 1.728 7.412 -2.751 1.00 0.00 H new ATOM 0 HB3 GLN A 70 2.985 6.195 -2.849 1.00 0.00 H new ATOM 0 HG2 GLN A 70 0.571 4.836 -2.088 1.00 0.00 H new ATOM 0 HG3 GLN A 70 0.151 5.917 -3.402 1.00 0.00 H new ATOM 0 HE21 GLN A 70 0.047 3.165 -3.621 1.00 0.00 H new ATOM 0 HE22 GLN A 70 1.266 2.603 -4.770 1.00 0.00 H new ATOM 987 N ASN A 71 2.823 8.588 -0.246 1.00 0.00 N ATOM 988 CA ASN A 71 3.761 9.594 0.223 1.00 0.00 C ATOM 989 C ASN A 71 4.287 9.190 1.603 1.00 0.00 C ATOM 990 O ASN A 71 5.493 9.214 1.843 1.00 0.00 O ATOM 991 CB ASN A 71 3.084 10.959 0.356 1.00 0.00 C ATOM 992 CG ASN A 71 3.659 11.957 -0.652 1.00 0.00 C ATOM 993 OD1 ASN A 71 4.841 11.962 -0.954 1.00 0.00 O ATOM 994 ND2 ASN A 71 2.759 12.797 -1.154 1.00 0.00 N ATOM 0 H ASN A 71 1.886 8.939 -0.447 1.00 0.00 H new ATOM 0 HA ASN A 71 4.572 9.663 -0.502 1.00 0.00 H new ATOM 0 HB2 ASN A 71 2.011 10.854 0.197 1.00 0.00 H new ATOM 0 HB3 ASN A 71 3.221 11.340 1.368 1.00 0.00 H new ATOM 0 HD21 ASN A 71 3.043 13.501 -1.836 1.00 0.00 H new ATOM 0 HD22 ASN A 71 1.785 12.738 -0.857 1.00 0.00 H new ATOM 1001 N LYS A 72 3.355 8.829 2.473 1.00 0.00 N ATOM 1002 CA LYS A 72 3.709 8.421 3.822 1.00 0.00 C ATOM 1003 C LYS A 72 4.737 7.290 3.755 1.00 0.00 C ATOM 1004 O LYS A 72 5.758 7.333 4.439 1.00 0.00 O ATOM 1005 CB LYS A 72 2.453 8.064 4.620 1.00 0.00 C ATOM 1006 CG LYS A 72 1.768 9.323 5.156 1.00 0.00 C ATOM 1007 CD LYS A 72 2.583 9.951 6.288 1.00 0.00 C ATOM 1008 CE LYS A 72 1.721 10.903 7.121 1.00 0.00 C ATOM 1009 NZ LYS A 72 1.582 12.208 6.437 1.00 0.00 N ATOM 0 H LYS A 72 2.356 8.811 2.270 1.00 0.00 H new ATOM 0 HA LYS A 72 4.177 9.246 4.359 1.00 0.00 H new ATOM 0 HB2 LYS A 72 1.760 7.510 3.986 1.00 0.00 H new ATOM 0 HB3 LYS A 72 2.719 7.409 5.450 1.00 0.00 H new ATOM 0 HG2 LYS A 72 1.643 10.045 4.349 1.00 0.00 H new ATOM 0 HG3 LYS A 72 0.770 9.073 5.517 1.00 0.00 H new ATOM 0 HD2 LYS A 72 2.988 9.167 6.928 1.00 0.00 H new ATOM 0 HD3 LYS A 72 3.432 10.493 5.872 1.00 0.00 H new ATOM 0 HE2 LYS A 72 0.737 10.464 7.283 1.00 0.00 H new ATOM 0 HE3 LYS A 72 2.172 11.046 8.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 0.994 12.842 7.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 2.522 12.632 6.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 1.131 12.068 5.510 1.00 0.00 H new ATOM 1023 N ILE A 73 4.431 6.304 2.924 1.00 0.00 N ATOM 1024 CA ILE A 73 5.316 5.163 2.758 1.00 0.00 C ATOM 1025 C ILE A 73 6.737 5.661 2.485 1.00 0.00 C ATOM 1026 O ILE A 73 7.692 5.195 3.105 1.00 0.00 O ATOM 1027 CB ILE A 73 4.778 4.219 1.682 1.00 0.00 C ATOM 1028 CG1 ILE A 73 3.560 3.445 2.190 1.00 0.00 C ATOM 1029 CG2 ILE A 73 5.877 3.286 1.170 1.00 0.00 C ATOM 1030 CD1 ILE A 73 2.512 3.285 1.087 1.00 0.00 C ATOM 0 H ILE A 73 3.583 6.272 2.358 1.00 0.00 H new ATOM 0 HA ILE A 73 5.354 4.574 3.675 1.00 0.00 H new ATOM 0 HB ILE A 73 4.447 4.821 0.836 1.00 0.00 H new ATOM 0 HG12 ILE A 73 3.871 2.463 2.546 1.00 0.00 H new ATOM 0 HG13 ILE A 73 3.121 3.968 3.040 1.00 0.00 H new ATOM 0 HG21 ILE A 73 5.467 2.626 0.406 1.00 0.00 H new ATOM 0 HG22 ILE A 73 6.686 3.878 0.742 1.00 0.00 H new ATOM 0 HG23 ILE A 73 6.262 2.689 1.997 1.00 0.00 H new ATOM 0 HD11 ILE A 73 1.657 2.731 1.475 1.00 0.00 H new ATOM 0 HD12 ILE A 73 2.185 4.269 0.750 1.00 0.00 H new ATOM 0 HD13 ILE A 73 2.946 2.741 0.249 1.00 0.00 H new ATOM 1042 N LYS A 74 6.832 6.601 1.556 1.00 0.00 N ATOM 1043 CA LYS A 74 8.120 7.167 1.194 1.00 0.00 C ATOM 1044 C LYS A 74 8.736 7.849 2.417 1.00 0.00 C ATOM 1045 O LYS A 74 9.953 8.008 2.497 1.00 0.00 O ATOM 1046 CB LYS A 74 7.978 8.089 -0.019 1.00 0.00 C ATOM 1047 CG LYS A 74 8.335 7.354 -1.312 1.00 0.00 C ATOM 1048 CD LYS A 74 7.084 6.778 -1.978 1.00 0.00 C ATOM 1049 CE LYS A 74 6.975 7.237 -3.433 1.00 0.00 C ATOM 1050 NZ LYS A 74 5.993 8.337 -3.557 1.00 0.00 N ATOM 0 H LYS A 74 6.038 6.985 1.043 1.00 0.00 H new ATOM 0 HA LYS A 74 8.809 6.380 0.888 1.00 0.00 H new ATOM 0 HB2 LYS A 74 6.955 8.462 -0.079 1.00 0.00 H new ATOM 0 HB3 LYS A 74 8.627 8.956 0.101 1.00 0.00 H new ATOM 0 HG2 LYS A 74 8.834 8.039 -1.998 1.00 0.00 H new ATOM 0 HG3 LYS A 74 9.039 6.550 -1.095 1.00 0.00 H new ATOM 0 HD2 LYS A 74 7.115 5.689 -1.938 1.00 0.00 H new ATOM 0 HD3 LYS A 74 6.197 7.092 -1.427 1.00 0.00 H new ATOM 0 HE2 LYS A 74 7.950 7.570 -3.790 1.00 0.00 H new ATOM 0 HE3 LYS A 74 6.674 6.400 -4.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 5.931 8.637 -4.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 5.060 8.007 -3.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 6.296 9.141 -2.971 1.00 0.00 H new ATOM 1064 N ALA A 75 7.866 8.234 3.340 1.00 0.00 N ATOM 1065 CA ALA A 75 8.309 8.896 4.555 1.00 0.00 C ATOM 1066 C ALA A 75 9.066 7.894 5.429 1.00 0.00 C ATOM 1067 O ALA A 75 9.822 8.287 6.317 1.00 0.00 O ATOM 1068 CB ALA A 75 7.103 9.502 5.275 1.00 0.00 C ATOM 0 H ALA A 75 6.857 8.100 3.270 1.00 0.00 H new ATOM 0 HA ALA A 75 8.993 9.712 4.320 1.00 0.00 H new ATOM 0 HB1 ALA A 75 7.435 9.999 6.187 1.00 0.00 H new ATOM 0 HB2 ALA A 75 6.617 10.228 4.623 1.00 0.00 H new ATOM 0 HB3 ALA A 75 6.396 8.712 5.529 1.00 0.00 H new ATOM 1074 N CYS A 76 8.837 6.620 5.147 1.00 0.00 N ATOM 1075 CA CYS A 76 9.489 5.559 5.896 1.00 0.00 C ATOM 1076 C CYS A 76 10.951 5.953 6.114 1.00 0.00 C ATOM 1077 O CYS A 76 11.614 6.425 5.193 1.00 0.00 O ATOM 1078 CB CYS A 76 9.361 4.208 5.191 1.00 0.00 C ATOM 1079 SG CYS A 76 10.482 4.147 3.746 1.00 0.00 S ATOM 0 H CYS A 76 8.209 6.298 4.410 1.00 0.00 H new ATOM 0 HA CYS A 76 8.999 5.438 6.862 1.00 0.00 H new ATOM 0 HB2 CYS A 76 9.604 3.402 5.884 1.00 0.00 H new ATOM 0 HB3 CYS A 76 8.331 4.052 4.869 1.00 0.00 H new ATOM 0 HG CYS A 76 11.378 5.083 3.852 1.00 0.00 H new ATOM 1085 N THR A 77 11.411 5.744 7.339 1.00 0.00 N ATOM 1086 CA THR A 77 12.782 6.071 7.690 1.00 0.00 C ATOM 1087 C THR A 77 13.472 4.864 8.329 1.00 0.00 C ATOM 1088 O THR A 77 14.104 4.989 9.377 1.00 0.00 O ATOM 1089 CB THR A 77 12.757 7.306 8.593 1.00 0.00 C ATOM 1090 OG1 THR A 77 14.122 7.710 8.666 1.00 0.00 O ATOM 1091 CG2 THR A 77 12.393 6.966 10.040 1.00 0.00 C ATOM 0 H THR A 77 10.858 5.352 8.101 1.00 0.00 H new ATOM 0 HA THR A 77 13.371 6.310 6.804 1.00 0.00 H new ATOM 0 HB THR A 77 12.043 8.029 8.199 1.00 0.00 H new ATOM 0 HG1 THR A 77 14.656 6.989 9.060 1.00 0.00 H new ATOM 0 HG21 THR A 77 12.390 7.877 10.638 1.00 0.00 H new ATOM 0 HG22 THR A 77 11.404 6.509 10.069 1.00 0.00 H new ATOM 0 HG23 THR A 77 13.126 6.269 10.445 1.00 0.00 H new ATOM 1099 N GLY A 78 13.326 3.723 7.672 1.00 0.00 N ATOM 1100 CA GLY A 78 13.927 2.495 8.162 1.00 0.00 C ATOM 1101 C GLY A 78 12.945 1.326 8.064 1.00 0.00 C ATOM 1102 O GLY A 78 13.260 0.294 7.474 1.00 0.00 O ATOM 0 H GLY A 78 12.800 3.623 6.804 1.00 0.00 H new ATOM 0 HA2 GLY A 78 14.824 2.270 7.585 1.00 0.00 H new ATOM 0 HA3 GLY A 78 14.239 2.627 9.198 1.00 0.00 H new ATOM 1106 N SER A 79 11.774 1.528 8.650 1.00 0.00 N ATOM 1107 CA SER A 79 10.743 0.504 8.636 1.00 0.00 C ATOM 1108 C SER A 79 9.370 1.146 8.429 1.00 0.00 C ATOM 1109 O SER A 79 9.211 2.352 8.614 1.00 0.00 O ATOM 1110 CB SER A 79 10.759 -0.312 9.930 1.00 0.00 C ATOM 1111 OG SER A 79 11.202 0.461 11.042 1.00 0.00 O ATOM 0 H SER A 79 11.516 2.386 9.138 1.00 0.00 H new ATOM 0 HA SER A 79 10.947 -0.175 7.808 1.00 0.00 H new ATOM 0 HB2 SER A 79 9.758 -0.695 10.130 1.00 0.00 H new ATOM 0 HB3 SER A 79 11.412 -1.176 9.806 1.00 0.00 H new ATOM 0 HG SER A 79 11.197 -0.094 11.849 1.00 0.00 H new ATOM 1117 N LEU A 80 8.413 0.312 8.049 1.00 0.00 N ATOM 1118 CA LEU A 80 7.059 0.784 7.816 1.00 0.00 C ATOM 1119 C LEU A 80 6.146 0.275 8.933 1.00 0.00 C ATOM 1120 O LEU A 80 6.330 -0.834 9.432 1.00 0.00 O ATOM 1121 CB LEU A 80 6.590 0.393 6.413 1.00 0.00 C ATOM 1122 CG LEU A 80 5.528 1.297 5.784 1.00 0.00 C ATOM 1123 CD1 LEU A 80 6.086 2.697 5.519 1.00 0.00 C ATOM 1124 CD2 LEU A 80 4.946 0.663 4.519 1.00 0.00 C ATOM 0 H LEU A 80 8.549 -0.687 7.897 1.00 0.00 H new ATOM 0 HA LEU A 80 7.025 1.873 7.847 1.00 0.00 H new ATOM 0 HB2 LEU A 80 7.458 0.373 5.754 1.00 0.00 H new ATOM 0 HB3 LEU A 80 6.196 -0.623 6.453 1.00 0.00 H new ATOM 0 HG LEU A 80 4.709 1.406 6.495 1.00 0.00 H new ATOM 0 HD11 LEU A 80 5.311 3.319 5.072 1.00 0.00 H new ATOM 0 HD12 LEU A 80 6.412 3.143 6.459 1.00 0.00 H new ATOM 0 HD13 LEU A 80 6.934 2.628 4.837 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.194 1.327 4.092 1.00 0.00 H new ATOM 0 HD22 LEU A 80 5.743 0.503 3.793 1.00 0.00 H new ATOM 0 HD23 LEU A 80 4.486 -0.293 4.770 1.00 0.00 H new ATOM 1136 N ASN A 81 5.183 1.110 9.293 1.00 0.00 N ATOM 1137 CA ASN A 81 4.241 0.758 10.343 1.00 0.00 C ATOM 1138 C ASN A 81 2.825 1.126 9.896 1.00 0.00 C ATOM 1139 O ASN A 81 2.458 2.300 9.889 1.00 0.00 O ATOM 1140 CB ASN A 81 4.544 1.522 11.633 1.00 0.00 C ATOM 1141 CG ASN A 81 5.089 0.584 12.712 1.00 0.00 C ATOM 1142 OD1 ASN A 81 4.459 0.330 13.725 1.00 0.00 O ATOM 1143 ND2 ASN A 81 6.291 0.085 12.438 1.00 0.00 N ATOM 0 H ASN A 81 5.034 2.029 8.877 1.00 0.00 H new ATOM 0 HA ASN A 81 4.328 -0.312 10.529 1.00 0.00 H new ATOM 0 HB2 ASN A 81 5.270 2.310 11.431 1.00 0.00 H new ATOM 0 HB3 ASN A 81 3.637 2.008 11.993 1.00 0.00 H new ATOM 0 HD21 ASN A 81 6.741 -0.552 13.095 1.00 0.00 H new ATOM 0 HD22 ASN A 81 6.763 0.340 11.570 1.00 0.00 H new ATOM 1150 N MET A 82 2.068 0.101 9.533 1.00 0.00 N ATOM 1151 CA MET A 82 0.700 0.302 9.086 1.00 0.00 C ATOM 1152 C MET A 82 -0.238 -0.735 9.706 1.00 0.00 C ATOM 1153 O MET A 82 0.197 -1.821 10.087 1.00 0.00 O ATOM 1154 CB MET A 82 0.641 0.198 7.561 1.00 0.00 C ATOM 1155 CG MET A 82 1.891 0.804 6.921 1.00 0.00 C ATOM 1156 SD MET A 82 1.786 0.685 5.143 1.00 0.00 S ATOM 1157 CE MET A 82 1.959 -1.080 4.940 1.00 0.00 C ATOM 0 H MET A 82 2.376 -0.871 9.539 1.00 0.00 H new ATOM 0 HA MET A 82 0.376 1.293 9.404 1.00 0.00 H new ATOM 0 HB2 MET A 82 0.549 -0.848 7.268 1.00 0.00 H new ATOM 0 HB3 MET A 82 -0.246 0.712 7.192 1.00 0.00 H new ATOM 0 HG2 MET A 82 1.992 1.848 7.218 1.00 0.00 H new ATOM 0 HG3 MET A 82 2.780 0.284 7.277 1.00 0.00 H new ATOM 0 HE1 MET A 82 2.111 -1.312 3.886 1.00 0.00 H new ATOM 0 HE2 MET A 82 2.815 -1.430 5.516 1.00 0.00 H new ATOM 0 HE3 MET A 82 1.056 -1.577 5.294 1.00 0.00 H new ATOM 1167 N THR A 83 -1.507 -0.364 9.789 1.00 0.00 N ATOM 1168 CA THR A 83 -2.510 -1.249 10.356 1.00 0.00 C ATOM 1169 C THR A 83 -3.358 -1.875 9.247 1.00 0.00 C ATOM 1170 O THR A 83 -3.668 -1.219 8.253 1.00 0.00 O ATOM 1171 CB THR A 83 -3.330 -0.447 11.369 1.00 0.00 C ATOM 1172 OG1 THR A 83 -2.372 0.400 11.998 1.00 0.00 O ATOM 1173 CG2 THR A 83 -3.864 -1.316 12.509 1.00 0.00 C ATOM 0 H THR A 83 -1.864 0.538 9.473 1.00 0.00 H new ATOM 0 HA THR A 83 -2.048 -2.086 10.880 1.00 0.00 H new ATOM 0 HB THR A 83 -4.164 0.036 10.860 1.00 0.00 H new ATOM 0 HG1 THR A 83 -2.542 1.331 11.744 1.00 0.00 H new ATOM 0 HG21 THR A 83 -4.438 -0.698 13.199 1.00 0.00 H new ATOM 0 HG22 THR A 83 -4.506 -2.097 12.101 1.00 0.00 H new ATOM 0 HG23 THR A 83 -3.029 -1.773 13.040 1.00 0.00 H new ATOM 1181 N LEU A 84 -3.709 -3.135 9.454 1.00 0.00 N ATOM 1182 CA LEU A 84 -4.516 -3.857 8.484 1.00 0.00 C ATOM 1183 C LEU A 84 -5.872 -4.195 9.106 1.00 0.00 C ATOM 1184 O LEU A 84 -5.983 -4.335 10.323 1.00 0.00 O ATOM 1185 CB LEU A 84 -3.758 -5.078 7.960 1.00 0.00 C ATOM 1186 CG LEU A 84 -2.363 -4.808 7.392 1.00 0.00 C ATOM 1187 CD1 LEU A 84 -1.764 -6.078 6.783 1.00 0.00 C ATOM 1188 CD2 LEU A 84 -2.393 -3.652 6.390 1.00 0.00 C ATOM 0 H LEU A 84 -3.450 -3.675 10.279 1.00 0.00 H new ATOM 0 HA LEU A 84 -4.712 -3.234 7.612 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.665 -5.799 8.772 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -4.360 -5.549 7.183 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.713 -4.506 8.213 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.773 -5.859 6.387 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -1.686 -6.848 7.551 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -2.407 -6.433 5.977 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.389 -3.481 6.002 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -3.063 -3.901 5.567 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -2.749 -2.749 6.887 1.00 0.00 H new ATOM 1200 N GLN A 85 -6.869 -4.317 8.242 1.00 0.00 N ATOM 1201 CA GLN A 85 -8.214 -4.636 8.691 1.00 0.00 C ATOM 1202 C GLN A 85 -8.459 -6.144 8.601 1.00 0.00 C ATOM 1203 O GLN A 85 -8.405 -6.721 7.516 1.00 0.00 O ATOM 1204 CB GLN A 85 -9.259 -3.861 7.887 1.00 0.00 C ATOM 1205 CG GLN A 85 -10.644 -4.493 8.035 1.00 0.00 C ATOM 1206 CD GLN A 85 -11.689 -3.721 7.227 1.00 0.00 C ATOM 1207 OE1 GLN A 85 -11.503 -3.407 6.062 1.00 0.00 O ATOM 1208 NE2 GLN A 85 -12.795 -3.434 7.906 1.00 0.00 N ATOM 0 H GLN A 85 -6.772 -4.201 7.233 1.00 0.00 H new ATOM 0 HA GLN A 85 -8.310 -4.334 9.734 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -9.290 -2.826 8.226 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -8.974 -3.843 6.835 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -10.612 -5.529 7.699 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -10.930 -4.508 9.087 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -12.886 -3.726 8.879 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -13.552 -2.921 7.454 1.00 0.00 H new ATOM 1217 N ARG A 86 -8.725 -6.738 9.755 1.00 0.00 N ATOM 1218 CA ARG A 86 -8.979 -8.167 9.820 1.00 0.00 C ATOM 1219 C ARG A 86 -10.391 -8.478 9.319 1.00 0.00 C ATOM 1220 O ARG A 86 -11.287 -7.641 9.417 1.00 0.00 O ATOM 1221 CB ARG A 86 -8.826 -8.690 11.250 1.00 0.00 C ATOM 1222 CG ARG A 86 -10.094 -8.433 12.066 1.00 0.00 C ATOM 1223 CD ARG A 86 -10.378 -6.934 12.181 1.00 0.00 C ATOM 1224 NE ARG A 86 -11.477 -6.699 13.144 1.00 0.00 N ATOM 1225 CZ ARG A 86 -12.777 -6.817 12.845 1.00 0.00 C ATOM 1226 NH1 ARG A 86 -13.150 -7.167 11.606 1.00 0.00 N ATOM 1227 NH2 ARG A 86 -13.705 -6.585 13.783 1.00 0.00 N ATOM 0 H ARG A 86 -8.770 -6.256 10.653 1.00 0.00 H new ATOM 0 HA ARG A 86 -8.246 -8.663 9.184 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -8.613 -9.759 11.229 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -7.976 -8.205 11.730 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -10.941 -8.932 11.595 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -9.984 -8.863 13.061 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -9.480 -6.409 12.507 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -10.647 -6.530 11.205 1.00 0.00 H new ATOM 0 HE ARG A 86 -11.228 -6.430 14.096 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -12.444 -7.343 10.891 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -14.140 -7.257 11.378 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -13.422 -6.318 14.726 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -14.695 -6.675 13.554 1.00 0.00 H new ATOM 1241 N ALA A 87 -10.545 -9.684 8.792 1.00 0.00 N ATOM 1242 CA ALA A 87 -11.832 -10.116 8.276 1.00 0.00 C ATOM 1243 C ALA A 87 -11.768 -11.608 7.940 1.00 0.00 C ATOM 1244 O ALA A 87 -11.354 -11.983 6.844 1.00 0.00 O ATOM 1245 CB ALA A 87 -12.210 -9.261 7.065 1.00 0.00 C ATOM 0 H ALA A 87 -9.799 -10.375 8.711 1.00 0.00 H new ATOM 0 HA ALA A 87 -12.611 -9.981 9.026 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -13.176 -9.585 6.678 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -12.272 -8.214 7.363 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -11.452 -9.373 6.290 1.00 0.00 H new ATOM 1251 N SER A 88 -12.183 -12.417 8.903 1.00 0.00 N ATOM 1252 CA SER A 88 -12.177 -13.859 8.722 1.00 0.00 C ATOM 1253 C SER A 88 -12.775 -14.218 7.361 1.00 0.00 C ATOM 1254 O SER A 88 -13.354 -13.366 6.689 1.00 0.00 O ATOM 1255 CB SER A 88 -12.951 -14.557 9.843 1.00 0.00 C ATOM 1256 OG SER A 88 -14.248 -13.995 10.027 1.00 0.00 O ATOM 0 H SER A 88 -12.525 -12.102 9.811 1.00 0.00 H new ATOM 0 HA SER A 88 -11.144 -14.205 8.760 1.00 0.00 H new ATOM 0 HB2 SER A 88 -13.045 -15.618 9.612 1.00 0.00 H new ATOM 0 HB3 SER A 88 -12.388 -14.482 10.773 1.00 0.00 H new ATOM 0 HG SER A 88 -14.710 -14.469 10.750 1.00 0.00 H new ATOM 1262 N ALA A 89 -12.614 -15.481 6.994 1.00 0.00 N ATOM 1263 CA ALA A 89 -13.131 -15.964 5.725 1.00 0.00 C ATOM 1264 C ALA A 89 -14.278 -16.943 5.985 1.00 0.00 C ATOM 1265 O ALA A 89 -14.289 -17.635 7.002 1.00 0.00 O ATOM 1266 CB ALA A 89 -11.995 -16.597 4.918 1.00 0.00 C ATOM 0 H ALA A 89 -12.133 -16.185 7.554 1.00 0.00 H new ATOM 0 HA ALA A 89 -13.530 -15.139 5.135 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -12.383 -16.959 3.966 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -11.220 -15.852 4.734 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -11.571 -17.431 5.478 1.00 0.00 H new ATOM 1272 N ALA A 90 -15.214 -16.971 5.048 1.00 0.00 N ATOM 1273 CA ALA A 90 -16.362 -17.854 5.163 1.00 0.00 C ATOM 1274 C ALA A 90 -16.318 -18.890 4.037 1.00 0.00 C ATOM 1275 O ALA A 90 -16.674 -18.590 2.899 1.00 0.00 O ATOM 1276 CB ALA A 90 -17.648 -17.025 5.143 1.00 0.00 C ATOM 0 H ALA A 90 -15.201 -16.396 4.205 1.00 0.00 H new ATOM 0 HA ALA A 90 -16.337 -18.394 6.109 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -18.509 -17.687 5.229 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -17.643 -16.326 5.979 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -17.709 -16.471 4.206 1.00 0.00 H new ATOM 1282 N ALA A 91 -15.879 -20.087 4.395 1.00 0.00 N ATOM 1283 CA ALA A 91 -15.784 -21.169 3.429 1.00 0.00 C ATOM 1284 C ALA A 91 -16.220 -22.477 4.091 1.00 0.00 C ATOM 1285 O ALA A 91 -15.952 -22.700 5.271 1.00 0.00 O ATOM 1286 CB ALA A 91 -14.357 -21.240 2.881 1.00 0.00 C ATOM 0 H ALA A 91 -15.585 -20.332 5.340 1.00 0.00 H new ATOM 0 HA ALA A 91 -16.449 -20.989 2.584 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -14.285 -22.051 2.157 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -14.106 -20.297 2.396 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -13.661 -21.423 3.700 1.00 0.00 H new ATOM 1292 N LYS A 92 -16.884 -23.310 3.303 1.00 0.00 N ATOM 1293 CA LYS A 92 -17.360 -24.590 3.798 1.00 0.00 C ATOM 1294 C LYS A 92 -16.864 -25.705 2.875 1.00 0.00 C ATOM 1295 O LYS A 92 -17.662 -26.465 2.328 1.00 0.00 O ATOM 1296 CB LYS A 92 -18.880 -24.566 3.971 1.00 0.00 C ATOM 1297 CG LYS A 92 -19.580 -24.318 2.633 1.00 0.00 C ATOM 1298 CD LYS A 92 -20.142 -22.896 2.565 1.00 0.00 C ATOM 1299 CE LYS A 92 -21.417 -22.851 1.721 1.00 0.00 C ATOM 1300 NZ LYS A 92 -21.136 -22.271 0.388 1.00 0.00 N ATOM 0 H LYS A 92 -17.104 -23.123 2.325 1.00 0.00 H new ATOM 0 HA LYS A 92 -16.953 -24.791 4.789 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -19.217 -25.514 4.392 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -19.157 -23.786 4.680 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -18.876 -24.474 1.816 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -20.387 -25.039 2.501 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -20.355 -22.537 3.572 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -19.395 -22.226 2.139 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -21.821 -23.857 1.609 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -22.176 -22.257 2.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -22.012 -22.248 -0.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -20.771 -21.304 0.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -20.427 -22.854 -0.102 1.00 0.00 H new ATOM 1314 N SER A 93 -15.548 -25.767 2.730 1.00 0.00 N ATOM 1315 CA SER A 93 -14.936 -26.777 1.882 1.00 0.00 C ATOM 1316 C SER A 93 -14.921 -28.126 2.603 1.00 0.00 C ATOM 1317 O SER A 93 -14.521 -28.210 3.763 1.00 0.00 O ATOM 1318 CB SER A 93 -13.515 -26.373 1.484 1.00 0.00 C ATOM 1319 OG SER A 93 -13.380 -26.218 0.074 1.00 0.00 O ATOM 0 H SER A 93 -14.889 -25.135 3.185 1.00 0.00 H new ATOM 0 HA SER A 93 -15.529 -26.865 0.972 1.00 0.00 H new ATOM 0 HB2 SER A 93 -13.252 -25.438 1.978 1.00 0.00 H new ATOM 0 HB3 SER A 93 -12.812 -27.128 1.835 1.00 0.00 H new ATOM 0 HG SER A 93 -12.460 -25.958 -0.140 1.00 0.00 H new ATOM 1325 N GLU A 94 -15.364 -29.149 1.886 1.00 0.00 N ATOM 1326 CA GLU A 94 -15.407 -30.490 2.442 1.00 0.00 C ATOM 1327 C GLU A 94 -14.162 -31.277 2.027 1.00 0.00 C ATOM 1328 O GLU A 94 -13.631 -31.076 0.936 1.00 0.00 O ATOM 1329 CB GLU A 94 -16.683 -31.219 2.017 1.00 0.00 C ATOM 1330 CG GLU A 94 -16.698 -31.463 0.507 1.00 0.00 C ATOM 1331 CD GLU A 94 -17.689 -32.570 0.140 1.00 0.00 C ATOM 1332 OE1 GLU A 94 -18.889 -32.376 0.428 1.00 0.00 O ATOM 1333 OE2 GLU A 94 -17.223 -33.586 -0.419 1.00 0.00 O ATOM 0 H GLU A 94 -15.696 -29.075 0.924 1.00 0.00 H new ATOM 0 HA GLU A 94 -15.418 -30.411 3.529 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -16.755 -32.171 2.543 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -17.555 -30.630 2.303 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -16.967 -30.543 -0.011 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -15.699 -31.738 0.170 1.00 0.00 H new ATOM 1340 N PRO A 95 -13.721 -32.180 2.944 1.00 0.00 N ATOM 1341 CA PRO A 95 -12.548 -32.998 2.684 1.00 0.00 C ATOM 1342 C PRO A 95 -12.868 -34.114 1.688 1.00 0.00 C ATOM 1343 O PRO A 95 -13.998 -34.596 1.632 1.00 0.00 O ATOM 1344 CB PRO A 95 -12.124 -33.522 4.047 1.00 0.00 C ATOM 1345 CG PRO A 95 -13.336 -33.360 4.950 1.00 0.00 C ATOM 1346 CD PRO A 95 -14.324 -32.445 4.247 1.00 0.00 C ATOM 0 HA PRO A 95 -11.738 -32.436 2.218 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -11.819 -34.567 3.986 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -11.272 -32.963 4.433 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -13.792 -34.329 5.154 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -13.042 -32.938 5.911 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -15.299 -32.921 4.143 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -14.477 -31.523 4.807 1.00 0.00 H new ATOM 1354 N VAL A 96 -11.852 -34.492 0.925 1.00 0.00 N ATOM 1355 CA VAL A 96 -12.011 -35.542 -0.066 1.00 0.00 C ATOM 1356 C VAL A 96 -10.890 -36.570 0.102 1.00 0.00 C ATOM 1357 O VAL A 96 -9.722 -36.205 0.228 1.00 0.00 O ATOM 1358 CB VAL A 96 -12.059 -34.934 -1.469 1.00 0.00 C ATOM 1359 CG1 VAL A 96 -10.709 -34.322 -1.848 1.00 0.00 C ATOM 1360 CG2 VAL A 96 -12.499 -35.974 -2.502 1.00 0.00 C ATOM 0 H VAL A 96 -10.916 -34.090 0.974 1.00 0.00 H new ATOM 0 HA VAL A 96 -12.956 -36.065 0.080 1.00 0.00 H new ATOM 0 HB VAL A 96 -12.799 -34.134 -1.462 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -10.771 -33.897 -2.850 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -10.452 -33.538 -1.136 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -9.941 -35.095 -1.829 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -12.525 -35.516 -3.491 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -11.793 -36.805 -2.505 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -13.492 -36.343 -2.247 1.00 0.00 H new ATOM 1370 N SER A 97 -11.285 -37.835 0.098 1.00 0.00 N ATOM 1371 CA SER A 97 -10.328 -38.918 0.248 1.00 0.00 C ATOM 1372 C SER A 97 -10.208 -39.696 -1.063 1.00 0.00 C ATOM 1373 O SER A 97 -11.183 -39.827 -1.803 1.00 0.00 O ATOM 1374 CB SER A 97 -10.733 -39.856 1.387 1.00 0.00 C ATOM 1375 OG SER A 97 -9.807 -40.926 1.552 1.00 0.00 O ATOM 0 H SER A 97 -12.255 -38.134 -0.007 1.00 0.00 H new ATOM 0 HA SER A 97 -9.358 -38.486 0.496 1.00 0.00 H new ATOM 0 HB2 SER A 97 -10.802 -39.290 2.316 1.00 0.00 H new ATOM 0 HB3 SER A 97 -11.725 -40.262 1.187 1.00 0.00 H new ATOM 0 HG SER A 97 -10.100 -41.501 2.289 1.00 0.00 H new ATOM 1381 N SER A 98 -9.005 -40.192 -1.312 1.00 0.00 N ATOM 1382 CA SER A 98 -8.745 -40.954 -2.522 1.00 0.00 C ATOM 1383 C SER A 98 -7.343 -41.563 -2.465 1.00 0.00 C ATOM 1384 O SER A 98 -6.403 -40.924 -1.997 1.00 0.00 O ATOM 1385 CB SER A 98 -8.893 -40.078 -3.767 1.00 0.00 C ATOM 1386 OG SER A 98 -8.169 -38.856 -3.649 1.00 0.00 O ATOM 0 H SER A 98 -8.199 -40.081 -0.696 1.00 0.00 H new ATOM 0 HA SER A 98 -9.480 -41.756 -2.586 1.00 0.00 H new ATOM 0 HB2 SER A 98 -8.539 -40.626 -4.640 1.00 0.00 H new ATOM 0 HB3 SER A 98 -9.948 -39.860 -3.934 1.00 0.00 H new ATOM 0 HG SER A 98 -8.287 -38.326 -4.465 1.00 0.00 H new ATOM 1392 N GLY A 99 -7.247 -42.793 -2.949 1.00 0.00 N ATOM 1393 CA GLY A 99 -5.975 -43.496 -2.960 1.00 0.00 C ATOM 1394 C GLY A 99 -6.186 -45.011 -2.910 1.00 0.00 C ATOM 1395 O GLY A 99 -6.768 -45.529 -1.958 1.00 0.00 O ATOM 0 H GLY A 99 -8.029 -43.321 -3.336 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -5.417 -43.232 -3.859 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -5.374 -43.181 -2.107 1.00 0.00 H new ATOM 1399 N PRO A 100 -5.687 -45.696 -3.974 1.00 0.00 N ATOM 1400 CA PRO A 100 -5.815 -47.140 -4.060 1.00 0.00 C ATOM 1401 C PRO A 100 -4.836 -47.835 -3.111 1.00 0.00 C ATOM 1402 O PRO A 100 -3.622 -47.698 -3.255 1.00 0.00 O ATOM 1403 CB PRO A 100 -5.560 -47.471 -5.521 1.00 0.00 C ATOM 1404 CG PRO A 100 -4.846 -46.263 -6.104 1.00 0.00 C ATOM 1405 CD PRO A 100 -4.992 -45.115 -5.119 1.00 0.00 C ATOM 0 HA PRO A 100 -6.798 -47.494 -3.750 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -4.950 -48.369 -5.617 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -6.495 -47.663 -6.047 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -3.793 -46.488 -6.275 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -5.276 -45.995 -7.069 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -4.020 -44.714 -4.831 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -5.561 -44.292 -5.552 1.00 0.00 H new ATOM 1413 N SER A 101 -5.401 -48.565 -2.160 1.00 0.00 N ATOM 1414 CA SER A 101 -4.594 -49.281 -1.187 1.00 0.00 C ATOM 1415 C SER A 101 -4.359 -50.718 -1.658 1.00 0.00 C ATOM 1416 O SER A 101 -5.306 -51.428 -1.991 1.00 0.00 O ATOM 1417 CB SER A 101 -5.259 -49.276 0.191 1.00 0.00 C ATOM 1418 OG SER A 101 -4.931 -48.108 0.937 1.00 0.00 O ATOM 0 H SER A 101 -6.408 -48.676 -2.043 1.00 0.00 H new ATOM 0 HA SER A 101 -3.634 -48.773 -1.099 1.00 0.00 H new ATOM 0 HB2 SER A 101 -6.341 -49.338 0.072 1.00 0.00 H new ATOM 0 HB3 SER A 101 -4.948 -50.161 0.747 1.00 0.00 H new ATOM 0 HG SER A 101 -5.376 -48.141 1.810 1.00 0.00 H new ATOM 1424 N SER A 102 -3.091 -51.103 -1.671 1.00 0.00 N ATOM 1425 CA SER A 102 -2.719 -52.442 -2.095 1.00 0.00 C ATOM 1426 C SER A 102 -1.814 -53.091 -1.047 1.00 0.00 C ATOM 1427 O SER A 102 -0.692 -52.638 -0.824 1.00 0.00 O ATOM 1428 CB SER A 102 -2.020 -52.414 -3.456 1.00 0.00 C ATOM 1429 OG SER A 102 -2.527 -53.413 -4.337 1.00 0.00 O ATOM 0 H SER A 102 -2.308 -50.511 -1.395 1.00 0.00 H new ATOM 0 HA SER A 102 -3.629 -53.034 -2.196 1.00 0.00 H new ATOM 0 HB2 SER A 102 -2.149 -51.431 -3.910 1.00 0.00 H new ATOM 0 HB3 SER A 102 -0.949 -52.563 -3.317 1.00 0.00 H new ATOM 0 HG SER A 102 -2.057 -53.361 -5.195 1.00 0.00 H new ATOM 1435 N GLY A 103 -2.335 -54.142 -0.430 1.00 0.00 N ATOM 1436 CA GLY A 103 -1.588 -54.858 0.590 1.00 0.00 C ATOM 1437 C GLY A 103 -1.504 -56.350 0.261 1.00 0.00 C ATOM 1438 O GLY A 103 -2.520 -57.042 0.237 1.00 0.00 O ATOM 0 H GLY A 103 -3.266 -54.515 -0.617 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -0.584 -54.442 0.670 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -2.067 -54.722 1.560 1.00 0.00 H new TER 1442 GLY A 103