USER MOD reduce.3.24.130724 H: found=0, std=0, add=951, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 949 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 Single : A 1 GLY N :NH3+ -100:sc= 0.0316 (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 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 ASN : amide:sc= -6.06! C(o=-6.1!,f=-14!) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 ASN : amide:sc= -0.368 K(o=-0.37,f=-1.1) USER MOD Single : A 20 TYR OH : rot -43:sc= 0.595 USER MOD Single : A 23 THR OG1 : rot 91:sc= -1.02 USER MOD Single : A 24 GLN : amide:sc= -2.38! C(o=-2.4!,f=-6.2!) USER MOD Single : A 25 THR OG1 : rot -42:sc= 0.646 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= -0.548 K(o=-0.55,f=-1.1) USER MOD Single : A 54 HIS : no HD1:sc= -0.212 X(o=-0.21,f=-0.015) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 GLN : amide:sc= -0.0525 K(o=-0.053,f=-0.67) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -0.345 K(o=-0.34,f=-5.1!) USER MOD Single : A 75 LYS NZ :NH3+ -178:sc= -2.14 (180deg=-2.26) USER MOD Single : A 79 SER OG : rot 78:sc= 0.727 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= -0.889 USER MOD Single : A 92 HIS : no HD1:sc= -1.97! K(o=-2!,f=-0.55) USER MOD Single : A 95 LYS NZ :NH3+ 140:sc= 0.215 (180deg=-1.47!) USER MOD Single : A 97 ASN : amide:sc= -0.114 K(o=-0.11,f=-1.5!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 MET CE :methyl 165:sc= -1.12 (180deg=-1.57) USER MOD Single : A 103 ASN : amide:sc= -1.13 K(o=-1.1,f=-4.2!) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -0.79 K(o=-0.79,f=-2.2!) USER MOD Single : A 114 THR OG1 : rot 180:sc= -0.0374 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 SER OG : rot -136:sc= 1.81 USER MOD Single : A 119 SER OG : rot 36:sc= 0.596 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.849 -9.721 -2.108 1.00 0.00 N ATOM 2 CA GLY A 1 4.728 -10.529 -1.283 1.00 0.00 C ATOM 3 C GLY A 1 5.099 -11.841 -1.944 1.00 0.00 C ATOM 4 O GLY A 1 4.328 -12.386 -2.733 1.00 0.00 O ATOM 0 H1 GLY A 1 4.404 -8.986 -2.591 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.385 -10.325 -2.816 1.00 0.00 H new ATOM 0 H3 GLY A 1 3.127 -9.272 -1.509 1.00 0.00 H new ATOM 0 HA2 GLY A 1 5.636 -9.966 -1.065 1.00 0.00 H new ATOM 0 HA3 GLY A 1 4.241 -10.731 -0.329 1.00 0.00 H new ATOM 8 N SER A 2 6.285 -12.349 -1.622 1.00 0.00 N ATOM 9 CA SER A 2 6.760 -13.603 -2.195 1.00 0.00 C ATOM 10 C SER A 2 6.646 -14.740 -1.183 1.00 0.00 C ATOM 11 O SER A 2 5.959 -15.733 -1.424 1.00 0.00 O ATOM 12 CB SER A 2 8.211 -13.460 -2.657 1.00 0.00 C ATOM 13 OG SER A 2 8.292 -12.721 -3.863 1.00 0.00 O ATOM 0 H SER A 2 6.934 -11.912 -0.968 1.00 0.00 H new ATOM 0 HA SER A 2 6.134 -13.841 -3.055 1.00 0.00 H new ATOM 0 HB2 SER A 2 8.795 -12.963 -1.882 1.00 0.00 H new ATOM 0 HB3 SER A 2 8.649 -14.448 -2.802 1.00 0.00 H new ATOM 0 HG SER A 2 9.230 -12.642 -4.136 1.00 0.00 H new ATOM 19 N SER A 3 7.324 -14.586 -0.051 1.00 0.00 N ATOM 20 CA SER A 3 7.303 -15.600 0.997 1.00 0.00 C ATOM 21 C SER A 3 6.503 -15.119 2.203 1.00 0.00 C ATOM 22 O SER A 3 6.594 -13.958 2.599 1.00 0.00 O ATOM 23 CB SER A 3 8.730 -15.952 1.424 1.00 0.00 C ATOM 24 OG SER A 3 8.792 -17.260 1.965 1.00 0.00 O ATOM 0 H SER A 3 7.895 -13.769 0.164 1.00 0.00 H new ATOM 0 HA SER A 3 6.821 -16.492 0.596 1.00 0.00 H new ATOM 0 HB2 SER A 3 9.398 -15.878 0.566 1.00 0.00 H new ATOM 0 HB3 SER A 3 9.080 -15.232 2.164 1.00 0.00 H new ATOM 0 HG SER A 3 9.714 -17.462 2.229 1.00 0.00 H new ATOM 30 N GLY A 4 5.717 -16.022 2.782 1.00 0.00 N ATOM 31 CA GLY A 4 4.911 -15.671 3.937 1.00 0.00 C ATOM 32 C GLY A 4 3.509 -15.240 3.556 1.00 0.00 C ATOM 33 O GLY A 4 3.173 -14.058 3.635 1.00 0.00 O ATOM 0 H GLY A 4 5.624 -16.989 2.472 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.854 -16.526 4.610 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.399 -14.865 4.485 1.00 0.00 H new ATOM 37 N SER A 5 2.688 -16.199 3.140 1.00 0.00 N ATOM 38 CA SER A 5 1.316 -15.911 2.740 1.00 0.00 C ATOM 39 C SER A 5 0.453 -15.581 3.955 1.00 0.00 C ATOM 40 O SER A 5 0.361 -16.369 4.896 1.00 0.00 O ATOM 41 CB SER A 5 0.721 -17.101 1.986 1.00 0.00 C ATOM 42 OG SER A 5 1.407 -17.326 0.766 1.00 0.00 O ATOM 0 H SER A 5 2.949 -17.183 3.071 1.00 0.00 H new ATOM 0 HA SER A 5 1.331 -15.043 2.080 1.00 0.00 H new ATOM 0 HB2 SER A 5 0.776 -17.994 2.608 1.00 0.00 H new ATOM 0 HB3 SER A 5 -0.334 -16.917 1.785 1.00 0.00 H new ATOM 0 HG SER A 5 1.009 -18.093 0.304 1.00 0.00 H new ATOM 48 N SER A 6 -0.176 -14.411 3.926 1.00 0.00 N ATOM 49 CA SER A 6 -1.028 -13.974 5.026 1.00 0.00 C ATOM 50 C SER A 6 -2.231 -13.195 4.504 1.00 0.00 C ATOM 51 O SER A 6 -2.083 -12.140 3.888 1.00 0.00 O ATOM 52 CB SER A 6 -0.231 -13.110 6.004 1.00 0.00 C ATOM 53 OG SER A 6 0.794 -13.861 6.630 1.00 0.00 O ATOM 0 H SER A 6 -0.112 -13.748 3.153 1.00 0.00 H new ATOM 0 HA SER A 6 -1.390 -14.860 5.548 1.00 0.00 H new ATOM 0 HB2 SER A 6 0.206 -12.264 5.474 1.00 0.00 H new ATOM 0 HB3 SER A 6 -0.900 -12.701 6.761 1.00 0.00 H new ATOM 0 HG SER A 6 1.290 -13.285 7.249 1.00 0.00 H new ATOM 59 N GLY A 7 -3.426 -13.723 4.755 1.00 0.00 N ATOM 60 CA GLY A 7 -4.638 -13.065 4.305 1.00 0.00 C ATOM 61 C GLY A 7 -5.665 -12.922 5.410 1.00 0.00 C ATOM 62 O GLY A 7 -6.861 -13.107 5.184 1.00 0.00 O ATOM 0 H GLY A 7 -3.575 -14.595 5.262 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.389 -12.078 3.915 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -5.072 -13.633 3.482 1.00 0.00 H new ATOM 66 N LYS A 8 -5.200 -12.594 6.610 1.00 0.00 N ATOM 67 CA LYS A 8 -6.086 -12.427 7.756 1.00 0.00 C ATOM 68 C LYS A 8 -6.047 -10.991 8.269 1.00 0.00 C ATOM 69 O LYS A 8 -5.047 -10.285 8.134 1.00 0.00 O ATOM 70 CB LYS A 8 -5.691 -13.391 8.877 1.00 0.00 C ATOM 71 CG LYS A 8 -4.405 -13.005 9.586 1.00 0.00 C ATOM 72 CD LYS A 8 -3.186 -13.583 8.885 1.00 0.00 C ATOM 73 CE LYS A 8 -2.060 -13.866 9.868 1.00 0.00 C ATOM 74 NZ LYS A 8 -1.253 -12.647 10.152 1.00 0.00 N ATOM 0 H LYS A 8 -4.213 -12.438 6.815 1.00 0.00 H new ATOM 0 HA LYS A 8 -7.103 -12.652 7.433 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -6.499 -13.436 9.607 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -5.580 -14.393 8.461 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -4.322 -11.919 9.625 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -4.436 -13.360 10.616 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -3.463 -14.504 8.372 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -2.838 -12.886 8.123 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -2.478 -14.250 10.799 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -1.413 -14.644 9.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -0.496 -12.881 10.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -0.833 -12.295 9.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -1.866 -11.913 10.561 1.00 0.00 H new ATOM 88 N PRO A 9 -7.159 -10.547 8.874 1.00 0.00 N ATOM 89 CA PRO A 9 -7.275 -9.192 9.421 1.00 0.00 C ATOM 90 C PRO A 9 -6.405 -8.989 10.657 1.00 0.00 C ATOM 91 O PRO A 9 -6.053 -9.948 11.343 1.00 0.00 O ATOM 92 CB PRO A 9 -8.758 -9.084 9.788 1.00 0.00 C ATOM 93 CG PRO A 9 -9.195 -10.490 10.017 1.00 0.00 C ATOM 94 CD PRO A 9 -8.388 -11.334 9.070 1.00 0.00 C ATOM 0 HA PRO A 9 -6.941 -8.436 8.711 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -8.902 -8.475 10.680 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -9.331 -8.617 8.987 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -9.022 -10.789 11.051 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -10.262 -10.603 9.827 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -8.173 -12.316 9.491 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -8.914 -11.498 8.130 1.00 0.00 H new ATOM 102 N ASN A 10 -6.062 -7.736 10.934 1.00 0.00 N ATOM 103 CA ASN A 10 -5.232 -7.408 12.088 1.00 0.00 C ATOM 104 C ASN A 10 -6.068 -6.776 13.197 1.00 0.00 C ATOM 105 O ASN A 10 -6.317 -7.396 14.231 1.00 0.00 O ATOM 106 CB ASN A 10 -4.106 -6.457 11.678 1.00 0.00 C ATOM 107 CG ASN A 10 -4.574 -5.390 10.708 1.00 0.00 C ATOM 108 OD1 ASN A 10 -4.812 -4.245 11.094 1.00 0.00 O ATOM 109 ND2 ASN A 10 -4.708 -5.761 9.440 1.00 0.00 N ATOM 0 H ASN A 10 -6.346 -6.931 10.376 1.00 0.00 H new ATOM 0 HA ASN A 10 -4.798 -8.333 12.467 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -3.695 -5.980 12.568 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -3.299 -7.030 11.222 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -5.019 -5.086 8.741 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -4.500 -6.721 9.165 1.00 0.00 H new ATOM 116 N LEU A 11 -6.499 -5.539 12.973 1.00 0.00 N ATOM 117 CA LEU A 11 -7.308 -4.822 13.953 1.00 0.00 C ATOM 118 C LEU A 11 -8.487 -4.126 13.281 1.00 0.00 C ATOM 119 O LEU A 11 -9.604 -4.137 13.797 1.00 0.00 O ATOM 120 CB LEU A 11 -6.452 -3.796 14.698 1.00 0.00 C ATOM 121 CG LEU A 11 -6.991 -3.327 16.050 1.00 0.00 C ATOM 122 CD1 LEU A 11 -5.948 -2.495 16.780 1.00 0.00 C ATOM 123 CD2 LEU A 11 -8.276 -2.532 15.865 1.00 0.00 C ATOM 0 H LEU A 11 -6.302 -5.012 12.122 1.00 0.00 H new ATOM 0 HA LEU A 11 -7.697 -5.548 14.667 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -5.461 -4.223 14.853 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -6.326 -2.923 14.057 1.00 0.00 H new ATOM 0 HG LEU A 11 -7.215 -4.205 16.655 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -6.349 -2.170 17.740 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -5.054 -3.096 16.945 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -5.693 -1.622 16.179 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -8.645 -2.206 16.837 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -8.078 -1.660 15.241 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -9.026 -3.160 15.384 1.00 0.00 H new ATOM 135 N GLY A 12 -8.231 -3.523 12.124 1.00 0.00 N ATOM 136 CA GLY A 12 -9.281 -2.832 11.399 1.00 0.00 C ATOM 137 C GLY A 12 -9.768 -3.617 10.197 1.00 0.00 C ATOM 138 O GLY A 12 -9.855 -3.082 9.092 1.00 0.00 O ATOM 0 H GLY A 12 -7.315 -3.501 11.676 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -10.119 -2.644 12.070 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -8.912 -1.861 11.070 1.00 0.00 H new ATOM 142 N ASN A 13 -10.084 -4.890 10.411 1.00 0.00 N ATOM 143 CA ASN A 13 -10.562 -5.750 9.335 1.00 0.00 C ATOM 144 C ASN A 13 -9.687 -5.606 8.093 1.00 0.00 C ATOM 145 O ASN A 13 -10.164 -5.733 6.967 1.00 0.00 O ATOM 146 CB ASN A 13 -12.014 -5.413 8.991 1.00 0.00 C ATOM 147 CG ASN A 13 -12.944 -5.585 10.177 1.00 0.00 C ATOM 148 OD1 ASN A 13 -13.488 -6.667 10.401 1.00 0.00 O ATOM 149 ND2 ASN A 13 -13.131 -4.517 10.942 1.00 0.00 N ATOM 0 H ASN A 13 -10.018 -5.349 11.320 1.00 0.00 H new ATOM 0 HA ASN A 13 -10.507 -6.783 9.678 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -12.071 -4.385 8.634 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -12.349 -6.053 8.174 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -13.746 -4.572 11.754 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -12.659 -3.641 10.718 1.00 0.00 H new ATOM 156 N GLY A 14 -8.402 -5.339 8.309 1.00 0.00 N ATOM 157 CA GLY A 14 -7.481 -5.182 7.199 1.00 0.00 C ATOM 158 C GLY A 14 -6.821 -6.488 6.804 1.00 0.00 C ATOM 159 O GLY A 14 -7.477 -7.527 6.736 1.00 0.00 O ATOM 0 H GLY A 14 -7.983 -5.229 9.232 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -8.017 -4.775 6.341 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -6.713 -4.457 7.468 1.00 0.00 H new ATOM 163 N ALA A 15 -5.519 -6.436 6.542 1.00 0.00 N ATOM 164 CA ALA A 15 -4.770 -7.624 6.152 1.00 0.00 C ATOM 165 C ALA A 15 -3.319 -7.533 6.610 1.00 0.00 C ATOM 166 O ALA A 15 -2.618 -6.571 6.296 1.00 0.00 O ATOM 167 CB ALA A 15 -4.838 -7.820 4.645 1.00 0.00 C ATOM 0 H ALA A 15 -4.961 -5.584 6.593 1.00 0.00 H new ATOM 0 HA ALA A 15 -5.225 -8.486 6.640 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -4.274 -8.711 4.368 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -5.878 -7.939 4.340 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -4.411 -6.951 4.145 1.00 0.00 H new ATOM 173 N ASP A 16 -2.874 -8.539 7.355 1.00 0.00 N ATOM 174 CA ASP A 16 -1.505 -8.572 7.857 1.00 0.00 C ATOM 175 C ASP A 16 -0.570 -9.223 6.843 1.00 0.00 C ATOM 176 O ASP A 16 -0.492 -10.449 6.753 1.00 0.00 O ATOM 177 CB ASP A 16 -1.444 -9.329 9.185 1.00 0.00 C ATOM 178 CG ASP A 16 -1.616 -8.413 10.381 1.00 0.00 C ATOM 179 OD1 ASP A 16 -1.215 -7.235 10.289 1.00 0.00 O ATOM 180 OD2 ASP A 16 -2.152 -8.876 11.411 1.00 0.00 O ATOM 0 H ASP A 16 -3.441 -9.343 7.625 1.00 0.00 H new ATOM 0 HA ASP A 16 -1.178 -7.545 8.018 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -2.222 -10.093 9.201 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -0.488 -9.846 9.262 1.00 0.00 H new ATOM 185 N LEU A 17 0.136 -8.396 6.080 1.00 0.00 N ATOM 186 CA LEU A 17 1.065 -8.891 5.071 1.00 0.00 C ATOM 187 C LEU A 17 2.506 -8.787 5.559 1.00 0.00 C ATOM 188 O LEU A 17 2.844 -7.952 6.399 1.00 0.00 O ATOM 189 CB LEU A 17 0.899 -8.108 3.768 1.00 0.00 C ATOM 190 CG LEU A 17 -0.504 -7.570 3.482 1.00 0.00 C ATOM 191 CD1 LEU A 17 -0.436 -6.363 2.559 1.00 0.00 C ATOM 192 CD2 LEU A 17 -1.379 -8.658 2.877 1.00 0.00 C ATOM 0 H LEU A 17 0.083 -7.379 6.141 1.00 0.00 H new ATOM 0 HA LEU A 17 0.837 -9.941 4.888 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.593 -7.267 3.782 1.00 0.00 H new ATOM 0 HB3 LEU A 17 1.195 -8.752 2.940 1.00 0.00 H new ATOM 0 HG LEU A 17 -0.950 -7.255 4.425 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -1.444 -5.994 2.367 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.154 -5.577 3.031 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.030 -6.651 1.617 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -2.373 -8.258 2.680 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.936 -9.004 1.943 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -1.455 -9.493 3.574 1.00 0.00 H new ATOM 204 N PRO A 18 3.378 -9.654 5.022 1.00 0.00 N ATOM 205 CA PRO A 18 4.797 -9.677 5.386 1.00 0.00 C ATOM 206 C PRO A 18 5.548 -8.453 4.874 1.00 0.00 C ATOM 207 O PRO A 18 6.625 -8.123 5.367 1.00 0.00 O ATOM 208 CB PRO A 18 5.317 -10.947 4.706 1.00 0.00 C ATOM 209 CG PRO A 18 4.390 -11.169 3.561 1.00 0.00 C ATOM 210 CD PRO A 18 3.044 -10.676 4.016 1.00 0.00 C ATOM 0 HA PRO A 18 4.940 -9.666 6.466 1.00 0.00 H new ATOM 0 HB2 PRO A 18 6.345 -10.821 4.365 1.00 0.00 H new ATOM 0 HB3 PRO A 18 5.310 -11.795 5.391 1.00 0.00 H new ATOM 0 HG2 PRO A 18 4.725 -10.627 2.677 1.00 0.00 H new ATOM 0 HG3 PRO A 18 4.348 -12.224 3.292 1.00 0.00 H new ATOM 0 HD2 PRO A 18 2.470 -10.255 3.191 1.00 0.00 H new ATOM 0 HD3 PRO A 18 2.445 -11.480 4.443 1.00 0.00 H new ATOM 218 N ASN A 19 4.971 -7.783 3.881 1.00 0.00 N ATOM 219 CA ASN A 19 5.586 -6.595 3.302 1.00 0.00 C ATOM 220 C ASN A 19 5.090 -5.331 3.998 1.00 0.00 C ATOM 221 O ASN A 19 5.821 -4.347 4.117 1.00 0.00 O ATOM 222 CB ASN A 19 5.284 -6.517 1.804 1.00 0.00 C ATOM 223 CG ASN A 19 6.333 -7.222 0.966 1.00 0.00 C ATOM 224 OD1 ASN A 19 6.182 -8.394 0.619 1.00 0.00 O ATOM 225 ND2 ASN A 19 7.404 -6.509 0.636 1.00 0.00 N ATOM 0 H ASN A 19 4.079 -8.043 3.461 1.00 0.00 H new ATOM 0 HA ASN A 19 6.664 -6.668 3.445 1.00 0.00 H new ATOM 0 HB2 ASN A 19 4.308 -6.962 1.609 1.00 0.00 H new ATOM 0 HB3 ASN A 19 5.224 -5.471 1.502 1.00 0.00 H new ATOM 0 HD21 ASN A 19 8.143 -6.930 0.073 1.00 0.00 H new ATOM 0 HD22 ASN A 19 7.487 -5.541 0.946 1.00 0.00 H new ATOM 232 N TYR A 20 3.844 -5.366 4.457 1.00 0.00 N ATOM 233 CA TYR A 20 3.249 -4.223 5.140 1.00 0.00 C ATOM 234 C TYR A 20 1.861 -4.568 5.671 1.00 0.00 C ATOM 235 O TYR A 20 1.225 -5.516 5.209 1.00 0.00 O ATOM 236 CB TYR A 20 3.162 -3.025 4.193 1.00 0.00 C ATOM 237 CG TYR A 20 2.617 -3.372 2.826 1.00 0.00 C ATOM 238 CD1 TYR A 20 1.285 -3.730 2.658 1.00 0.00 C ATOM 239 CD2 TYR A 20 3.434 -3.344 1.703 1.00 0.00 C ATOM 240 CE1 TYR A 20 0.782 -4.048 1.411 1.00 0.00 C ATOM 241 CE2 TYR A 20 2.940 -3.660 0.452 1.00 0.00 C ATOM 242 CZ TYR A 20 1.614 -4.011 0.311 1.00 0.00 C ATOM 243 OH TYR A 20 1.119 -4.328 -0.933 1.00 0.00 O ATOM 0 H TYR A 20 3.226 -6.173 4.369 1.00 0.00 H new ATOM 0 HA TYR A 20 3.887 -3.964 5.985 1.00 0.00 H new ATOM 0 HB2 TYR A 20 2.529 -2.261 4.644 1.00 0.00 H new ATOM 0 HB3 TYR A 20 4.155 -2.590 4.079 1.00 0.00 H new ATOM 0 HD1 TYR A 20 0.631 -3.760 3.517 1.00 0.00 H new ATOM 0 HD2 TYR A 20 4.473 -3.070 1.810 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -0.256 -4.324 1.298 1.00 0.00 H new ATOM 0 HE2 TYR A 20 3.589 -3.632 -0.411 1.00 0.00 H new ATOM 0 HH TYR A 20 0.542 -5.117 -0.864 1.00 0.00 H new ATOM 253 N ARG A 21 1.397 -3.791 6.644 1.00 0.00 N ATOM 254 CA ARG A 21 0.085 -4.014 7.240 1.00 0.00 C ATOM 255 C ARG A 21 -0.821 -2.804 7.027 1.00 0.00 C ATOM 256 O ARG A 21 -0.393 -1.661 7.187 1.00 0.00 O ATOM 257 CB ARG A 21 0.223 -4.305 8.735 1.00 0.00 C ATOM 258 CG ARG A 21 0.947 -3.212 9.504 1.00 0.00 C ATOM 259 CD ARG A 21 1.504 -3.732 10.820 1.00 0.00 C ATOM 260 NE ARG A 21 2.461 -2.804 11.415 1.00 0.00 N ATOM 261 CZ ARG A 21 3.749 -2.769 11.092 1.00 0.00 C ATOM 262 NH1 ARG A 21 4.232 -3.607 10.185 1.00 0.00 N ATOM 263 NH2 ARG A 21 4.558 -1.895 11.678 1.00 0.00 N ATOM 0 H ARG A 21 1.910 -3.002 7.036 1.00 0.00 H new ATOM 0 HA ARG A 21 -0.368 -4.876 6.750 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -0.770 -4.442 9.163 1.00 0.00 H new ATOM 0 HB3 ARG A 21 0.759 -5.245 8.866 1.00 0.00 H new ATOM 0 HG2 ARG A 21 1.759 -2.815 8.896 1.00 0.00 H new ATOM 0 HG3 ARG A 21 0.261 -2.387 9.698 1.00 0.00 H new ATOM 0 HD2 ARG A 21 0.684 -3.904 11.518 1.00 0.00 H new ATOM 0 HD3 ARG A 21 1.988 -4.694 10.654 1.00 0.00 H new ATOM 0 HE ARG A 21 2.122 -2.146 12.117 1.00 0.00 H new ATOM 0 HH11 ARG A 21 3.614 -4.281 9.733 1.00 0.00 H new ATOM 0 HH12 ARG A 21 5.221 -3.578 9.939 1.00 0.00 H new ATOM 0 HH21 ARG A 21 4.191 -1.249 12.377 1.00 0.00 H new ATOM 0 HH22 ARG A 21 5.547 -1.869 11.429 1.00 0.00 H new ATOM 277 N TRP A 22 -2.072 -3.064 6.666 1.00 0.00 N ATOM 278 CA TRP A 22 -3.037 -1.997 6.431 1.00 0.00 C ATOM 279 C TRP A 22 -4.388 -2.339 7.051 1.00 0.00 C ATOM 280 O TRP A 22 -4.740 -3.510 7.190 1.00 0.00 O ATOM 281 CB TRP A 22 -3.199 -1.748 4.931 1.00 0.00 C ATOM 282 CG TRP A 22 -3.693 -2.948 4.180 1.00 0.00 C ATOM 283 CD1 TRP A 22 -2.934 -3.864 3.509 1.00 0.00 C ATOM 284 CD2 TRP A 22 -5.055 -3.358 4.022 1.00 0.00 C ATOM 285 NE1 TRP A 22 -3.743 -4.820 2.943 1.00 0.00 N ATOM 286 CE2 TRP A 22 -5.049 -4.533 3.244 1.00 0.00 C ATOM 287 CE3 TRP A 22 -6.280 -2.850 4.464 1.00 0.00 C ATOM 288 CZ2 TRP A 22 -6.219 -5.204 2.899 1.00 0.00 C ATOM 289 CZ3 TRP A 22 -7.440 -3.517 4.120 1.00 0.00 C ATOM 290 CH2 TRP A 22 -7.404 -4.683 3.345 1.00 0.00 C ATOM 0 H TRP A 22 -2.442 -4.005 6.530 1.00 0.00 H new ATOM 0 HA TRP A 22 -2.660 -1.090 6.904 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -3.894 -0.922 4.780 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -2.240 -1.438 4.516 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -1.857 -3.841 3.434 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -3.423 -5.614 2.389 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -6.319 -1.952 5.063 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 -6.193 -6.103 2.301 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -8.392 -3.132 4.455 1.00 0.00 H new ATOM 0 HH2 TRP A 22 -8.329 -5.181 3.094 1.00 0.00 H new ATOM 301 N THR A 23 -5.142 -1.308 7.421 1.00 0.00 N ATOM 302 CA THR A 23 -6.454 -1.500 8.026 1.00 0.00 C ATOM 303 C THR A 23 -7.538 -0.783 7.229 1.00 0.00 C ATOM 304 O THR A 23 -7.243 0.077 6.399 1.00 0.00 O ATOM 305 CB THR A 23 -6.482 -0.992 9.480 1.00 0.00 C ATOM 306 OG1 THR A 23 -6.145 0.399 9.520 1.00 0.00 O ATOM 307 CG2 THR A 23 -5.510 -1.779 10.347 1.00 0.00 C ATOM 0 H THR A 23 -4.866 -0.332 7.312 1.00 0.00 H new ATOM 0 HA THR A 23 -6.651 -2.572 8.019 1.00 0.00 H new ATOM 0 HB THR A 23 -7.490 -1.133 9.871 1.00 0.00 H new ATOM 0 HG1 THR A 23 -6.962 0.936 9.450 1.00 0.00 H new ATOM 0 HG21 THR A 23 -5.547 -1.402 11.369 1.00 0.00 H new ATOM 0 HG22 THR A 23 -5.786 -2.833 10.338 1.00 0.00 H new ATOM 0 HG23 THR A 23 -4.499 -1.666 9.955 1.00 0.00 H new ATOM 315 N GLN A 24 -8.791 -1.141 7.487 1.00 0.00 N ATOM 316 CA GLN A 24 -9.918 -0.531 6.793 1.00 0.00 C ATOM 317 C GLN A 24 -11.113 -0.374 7.727 1.00 0.00 C ATOM 318 O GLN A 24 -11.421 -1.269 8.516 1.00 0.00 O ATOM 319 CB GLN A 24 -10.313 -1.373 5.578 1.00 0.00 C ATOM 320 CG GLN A 24 -10.869 -2.740 5.940 1.00 0.00 C ATOM 321 CD GLN A 24 -11.059 -3.632 4.729 1.00 0.00 C ATOM 322 OE1 GLN A 24 -10.585 -3.323 3.636 1.00 0.00 O ATOM 323 NE2 GLN A 24 -11.755 -4.747 4.919 1.00 0.00 N ATOM 0 H GLN A 24 -9.051 -1.851 8.172 1.00 0.00 H new ATOM 0 HA GLN A 24 -9.611 0.459 6.456 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -11.058 -0.830 4.996 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -9.441 -1.503 4.937 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -10.194 -3.228 6.644 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -11.825 -2.616 6.449 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -12.130 -4.963 5.843 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -11.915 -5.387 4.141 1.00 0.00 H new ATOM 332 N THR A 25 -11.786 0.769 7.634 1.00 0.00 N ATOM 333 CA THR A 25 -12.946 1.044 8.471 1.00 0.00 C ATOM 334 C THR A 25 -14.073 1.673 7.660 1.00 0.00 C ATOM 335 O THR A 25 -13.939 1.888 6.455 1.00 0.00 O ATOM 336 CB THR A 25 -12.586 1.980 9.640 1.00 0.00 C ATOM 337 OG1 THR A 25 -12.174 3.256 9.137 1.00 0.00 O ATOM 338 CG2 THR A 25 -11.476 1.382 10.491 1.00 0.00 C ATOM 0 H THR A 25 -11.547 1.520 6.986 1.00 0.00 H new ATOM 0 HA THR A 25 -13.281 0.087 8.871 1.00 0.00 H new ATOM 0 HB THR A 25 -13.472 2.104 10.263 1.00 0.00 H new ATOM 0 HG1 THR A 25 -11.592 3.128 8.359 1.00 0.00 H new ATOM 0 HG21 THR A 25 -11.239 2.061 11.310 1.00 0.00 H new ATOM 0 HG22 THR A 25 -11.804 0.425 10.897 1.00 0.00 H new ATOM 0 HG23 THR A 25 -10.588 1.231 9.877 1.00 0.00 H new ATOM 346 N LEU A 26 -15.184 1.965 8.328 1.00 0.00 N ATOM 347 CA LEU A 26 -16.336 2.571 7.668 1.00 0.00 C ATOM 348 C LEU A 26 -16.166 4.082 7.554 1.00 0.00 C ATOM 349 O LEU A 26 -17.144 4.820 7.434 1.00 0.00 O ATOM 350 CB LEU A 26 -17.618 2.247 8.438 1.00 0.00 C ATOM 351 CG LEU A 26 -18.232 0.872 8.170 1.00 0.00 C ATOM 352 CD1 LEU A 26 -19.483 0.674 9.011 1.00 0.00 C ATOM 353 CD2 LEU A 26 -18.549 0.709 6.691 1.00 0.00 C ATOM 0 H LEU A 26 -15.312 1.792 9.325 1.00 0.00 H new ATOM 0 HA LEU A 26 -16.408 2.156 6.663 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -17.408 2.327 9.505 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -18.362 3.008 8.202 1.00 0.00 H new ATOM 0 HG LEU A 26 -17.506 0.109 8.451 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -19.906 -0.310 8.807 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -19.226 0.747 10.068 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -20.215 1.443 8.762 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -18.985 -0.275 6.519 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -19.257 1.479 6.384 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -17.632 0.806 6.110 1.00 0.00 H new ATOM 365 N ALA A 27 -14.917 4.537 7.592 1.00 0.00 N ATOM 366 CA ALA A 27 -14.619 5.960 7.488 1.00 0.00 C ATOM 367 C ALA A 27 -13.466 6.210 6.522 1.00 0.00 C ATOM 368 O ALA A 27 -13.518 7.130 5.706 1.00 0.00 O ATOM 369 CB ALA A 27 -14.293 6.531 8.860 1.00 0.00 C ATOM 0 H ALA A 27 -14.096 3.940 7.694 1.00 0.00 H new ATOM 0 HA ALA A 27 -15.503 6.464 7.096 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -14.072 7.594 8.768 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -15.147 6.393 9.524 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -13.426 6.015 9.272 1.00 0.00 H new ATOM 375 N GLU A 28 -12.427 5.386 6.621 1.00 0.00 N ATOM 376 CA GLU A 28 -11.261 5.521 5.755 1.00 0.00 C ATOM 377 C GLU A 28 -10.350 4.303 5.877 1.00 0.00 C ATOM 378 O GLU A 28 -10.571 3.429 6.716 1.00 0.00 O ATOM 379 CB GLU A 28 -10.483 6.791 6.105 1.00 0.00 C ATOM 380 CG GLU A 28 -10.040 6.853 7.557 1.00 0.00 C ATOM 381 CD GLU A 28 -8.805 6.016 7.826 1.00 0.00 C ATOM 382 OE1 GLU A 28 -7.933 5.940 6.936 1.00 0.00 O ATOM 383 OE2 GLU A 28 -8.710 5.436 8.929 1.00 0.00 O ATOM 0 H GLU A 28 -12.369 4.619 7.291 1.00 0.00 H new ATOM 0 HA GLU A 28 -11.611 5.590 4.725 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -9.605 6.857 5.463 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -11.104 7.659 5.886 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -9.838 7.889 7.827 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -10.853 6.510 8.196 1.00 0.00 H new ATOM 390 N LEU A 29 -9.325 4.252 5.033 1.00 0.00 N ATOM 391 CA LEU A 29 -8.379 3.142 5.045 1.00 0.00 C ATOM 392 C LEU A 29 -6.997 3.608 5.490 1.00 0.00 C ATOM 393 O LEU A 29 -6.561 4.707 5.146 1.00 0.00 O ATOM 394 CB LEU A 29 -8.293 2.505 3.656 1.00 0.00 C ATOM 395 CG LEU A 29 -7.975 1.010 3.622 1.00 0.00 C ATOM 396 CD1 LEU A 29 -8.625 0.354 2.414 1.00 0.00 C ATOM 397 CD2 LEU A 29 -6.470 0.786 3.606 1.00 0.00 C ATOM 0 H LEU A 29 -9.128 4.966 4.332 1.00 0.00 H new ATOM 0 HA LEU A 29 -8.737 2.399 5.758 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -9.242 2.666 3.145 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -7.530 3.032 3.083 1.00 0.00 H new ATOM 0 HG LEU A 29 -8.382 0.551 4.523 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -8.388 -0.710 2.406 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -9.706 0.484 2.467 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -8.248 0.817 1.502 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -6.262 -0.284 3.582 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -6.041 1.259 2.723 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -6.028 1.222 4.502 1.00 0.00 H new ATOM 409 N ASP A 30 -6.312 2.765 6.254 1.00 0.00 N ATOM 410 CA ASP A 30 -4.977 3.089 6.744 1.00 0.00 C ATOM 411 C ASP A 30 -3.951 2.083 6.233 1.00 0.00 C ATOM 412 O ASP A 30 -4.245 0.894 6.098 1.00 0.00 O ATOM 413 CB ASP A 30 -4.964 3.117 8.273 1.00 0.00 C ATOM 414 CG ASP A 30 -5.276 4.492 8.830 1.00 0.00 C ATOM 415 OD1 ASP A 30 -4.719 5.483 8.311 1.00 0.00 O ATOM 416 OD2 ASP A 30 -6.076 4.578 9.785 1.00 0.00 O ATOM 0 H ASP A 30 -6.659 1.852 6.548 1.00 0.00 H new ATOM 0 HA ASP A 30 -4.709 4.076 6.368 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -5.693 2.401 8.653 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -3.986 2.797 8.631 1.00 0.00 H new ATOM 421 N LEU A 31 -2.747 2.566 5.948 1.00 0.00 N ATOM 422 CA LEU A 31 -1.677 1.709 5.450 1.00 0.00 C ATOM 423 C LEU A 31 -0.351 2.046 6.124 1.00 0.00 C ATOM 424 O LEU A 31 -0.062 3.209 6.401 1.00 0.00 O ATOM 425 CB LEU A 31 -1.542 1.857 3.933 1.00 0.00 C ATOM 426 CG LEU A 31 -0.157 1.572 3.351 1.00 0.00 C ATOM 427 CD1 LEU A 31 0.146 0.083 3.398 1.00 0.00 C ATOM 428 CD2 LEU A 31 -0.061 2.094 1.925 1.00 0.00 C ATOM 0 H LEU A 31 -2.487 3.547 6.053 1.00 0.00 H new ATOM 0 HA LEU A 31 -1.933 0.676 5.687 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -2.259 1.187 3.458 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -1.826 2.873 3.661 1.00 0.00 H new ATOM 0 HG LEU A 31 0.585 2.091 3.957 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.136 -0.100 2.980 1.00 0.00 H new ATOM 0 HD12 LEU A 31 0.120 -0.261 4.432 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -0.600 -0.459 2.816 1.00 0.00 H new ATOM 0 HD21 LEU A 31 0.931 1.883 1.526 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -0.813 1.603 1.307 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -0.233 3.170 1.919 1.00 0.00 H new ATOM 440 N ALA A 32 0.453 1.019 6.384 1.00 0.00 N ATOM 441 CA ALA A 32 1.750 1.207 7.022 1.00 0.00 C ATOM 442 C ALA A 32 2.801 0.289 6.407 1.00 0.00 C ATOM 443 O ALA A 32 2.756 -0.929 6.583 1.00 0.00 O ATOM 444 CB ALA A 32 1.642 0.961 8.519 1.00 0.00 C ATOM 0 H ALA A 32 0.228 0.049 6.162 1.00 0.00 H new ATOM 0 HA ALA A 32 2.064 2.238 6.857 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.618 1.105 8.983 1.00 0.00 H new ATOM 0 HB2 ALA A 32 0.928 1.661 8.952 1.00 0.00 H new ATOM 0 HB3 ALA A 32 1.303 -0.060 8.696 1.00 0.00 H new ATOM 450 N VAL A 33 3.747 0.881 5.685 1.00 0.00 N ATOM 451 CA VAL A 33 4.811 0.116 5.044 1.00 0.00 C ATOM 452 C VAL A 33 6.129 0.273 5.794 1.00 0.00 C ATOM 453 O VAL A 33 6.816 1.289 5.685 1.00 0.00 O ATOM 454 CB VAL A 33 5.011 0.550 3.580 1.00 0.00 C ATOM 455 CG1 VAL A 33 6.188 -0.187 2.960 1.00 0.00 C ATOM 456 CG2 VAL A 33 3.741 0.315 2.777 1.00 0.00 C ATOM 0 H VAL A 33 3.799 1.888 5.529 1.00 0.00 H new ATOM 0 HA VAL A 33 4.506 -0.930 5.066 1.00 0.00 H new ATOM 0 HB VAL A 33 5.232 1.617 3.563 1.00 0.00 H new ATOM 0 HG11 VAL A 33 6.314 0.133 1.926 1.00 0.00 H new ATOM 0 HG12 VAL A 33 7.095 0.037 3.522 1.00 0.00 H new ATOM 0 HG13 VAL A 33 6.001 -1.260 2.988 1.00 0.00 H new ATOM 0 HG21 VAL A 33 3.900 0.627 1.745 1.00 0.00 H new ATOM 0 HG22 VAL A 33 3.487 -0.745 2.800 1.00 0.00 H new ATOM 0 HG23 VAL A 33 2.925 0.894 3.209 1.00 0.00 H new ATOM 466 N PRO A 34 6.492 -0.755 6.575 1.00 0.00 N ATOM 467 CA PRO A 34 7.731 -0.756 7.357 1.00 0.00 C ATOM 468 C PRO A 34 8.973 -0.858 6.478 1.00 0.00 C ATOM 469 O PRO A 34 9.053 -1.714 5.597 1.00 0.00 O ATOM 470 CB PRO A 34 7.595 -2.002 8.236 1.00 0.00 C ATOM 471 CG PRO A 34 6.678 -2.900 7.480 1.00 0.00 C ATOM 472 CD PRO A 34 5.721 -1.997 6.752 1.00 0.00 C ATOM 0 HA PRO A 34 7.857 0.169 7.920 1.00 0.00 H new ATOM 0 HB2 PRO A 34 8.562 -2.475 8.405 1.00 0.00 H new ATOM 0 HB3 PRO A 34 7.187 -1.753 9.216 1.00 0.00 H new ATOM 0 HG2 PRO A 34 7.233 -3.525 6.781 1.00 0.00 H new ATOM 0 HG3 PRO A 34 6.145 -3.571 8.154 1.00 0.00 H new ATOM 0 HD2 PRO A 34 5.417 -2.421 5.795 1.00 0.00 H new ATOM 0 HD3 PRO A 34 4.812 -1.827 7.328 1.00 0.00 H new ATOM 480 N PHE A 35 9.939 0.022 6.722 1.00 0.00 N ATOM 481 CA PHE A 35 11.177 0.031 5.951 1.00 0.00 C ATOM 482 C PHE A 35 12.369 -0.329 6.833 1.00 0.00 C ATOM 483 O PHE A 35 12.514 0.189 7.941 1.00 0.00 O ATOM 484 CB PHE A 35 11.395 1.404 5.314 1.00 0.00 C ATOM 485 CG PHE A 35 10.524 1.655 4.117 1.00 0.00 C ATOM 486 CD1 PHE A 35 10.627 0.857 2.989 1.00 0.00 C ATOM 487 CD2 PHE A 35 9.601 2.689 4.119 1.00 0.00 C ATOM 488 CE1 PHE A 35 9.826 1.086 1.886 1.00 0.00 C ATOM 489 CE2 PHE A 35 8.798 2.923 3.019 1.00 0.00 C ATOM 490 CZ PHE A 35 8.910 2.119 1.901 1.00 0.00 C ATOM 0 H PHE A 35 9.888 0.738 7.447 1.00 0.00 H new ATOM 0 HA PHE A 35 11.091 -0.718 5.163 1.00 0.00 H new ATOM 0 HB2 PHE A 35 11.205 2.176 6.060 1.00 0.00 H new ATOM 0 HB3 PHE A 35 12.440 1.497 5.019 1.00 0.00 H new ATOM 0 HD1 PHE A 35 11.341 0.047 2.971 1.00 0.00 H new ATOM 0 HD2 PHE A 35 9.508 3.320 4.991 1.00 0.00 H new ATOM 0 HE1 PHE A 35 9.917 0.457 1.013 1.00 0.00 H new ATOM 0 HE2 PHE A 35 8.084 3.733 3.033 1.00 0.00 H new ATOM 0 HZ PHE A 35 8.282 2.298 1.041 1.00 0.00 H new ATOM 500 N ARG A 36 13.219 -1.220 6.334 1.00 0.00 N ATOM 501 CA ARG A 36 14.398 -1.651 7.076 1.00 0.00 C ATOM 502 C ARG A 36 15.489 -0.586 7.029 1.00 0.00 C ATOM 503 O ARG A 36 16.649 -0.882 6.741 1.00 0.00 O ATOM 504 CB ARG A 36 14.931 -2.968 6.509 1.00 0.00 C ATOM 505 CG ARG A 36 15.286 -2.896 5.033 1.00 0.00 C ATOM 506 CD ARG A 36 15.860 -4.212 4.533 1.00 0.00 C ATOM 507 NE ARG A 36 17.135 -4.530 5.170 1.00 0.00 N ATOM 508 CZ ARG A 36 18.055 -5.316 4.621 1.00 0.00 C ATOM 509 NH1 ARG A 36 17.842 -5.861 3.431 1.00 0.00 N ATOM 510 NH2 ARG A 36 19.190 -5.559 5.263 1.00 0.00 N ATOM 0 H ARG A 36 13.113 -1.658 5.419 1.00 0.00 H new ATOM 0 HA ARG A 36 14.107 -1.803 8.115 1.00 0.00 H new ATOM 0 HB2 ARG A 36 15.815 -3.265 7.073 1.00 0.00 H new ATOM 0 HB3 ARG A 36 14.183 -3.747 6.657 1.00 0.00 H new ATOM 0 HG2 ARG A 36 14.397 -2.643 4.456 1.00 0.00 H new ATOM 0 HG3 ARG A 36 16.009 -2.097 4.870 1.00 0.00 H new ATOM 0 HD2 ARG A 36 15.148 -5.015 4.726 1.00 0.00 H new ATOM 0 HD3 ARG A 36 15.997 -4.161 3.453 1.00 0.00 H new ATOM 0 HE ARG A 36 17.330 -4.127 6.086 1.00 0.00 H new ATOM 0 HH11 ARG A 36 16.970 -5.677 2.935 1.00 0.00 H new ATOM 0 HH12 ARG A 36 18.550 -6.464 3.012 1.00 0.00 H new ATOM 0 HH21 ARG A 36 19.357 -5.142 6.179 1.00 0.00 H new ATOM 0 HH22 ARG A 36 19.896 -6.163 4.841 1.00 0.00 H new ATOM 524 N VAL A 37 15.110 0.656 7.314 1.00 0.00 N ATOM 525 CA VAL A 37 16.056 1.765 7.305 1.00 0.00 C ATOM 526 C VAL A 37 16.591 2.043 8.706 1.00 0.00 C ATOM 527 O VAL A 37 15.887 1.858 9.698 1.00 0.00 O ATOM 528 CB VAL A 37 15.410 3.049 6.751 1.00 0.00 C ATOM 529 CG1 VAL A 37 14.934 2.833 5.322 1.00 0.00 C ATOM 530 CG2 VAL A 37 14.261 3.495 7.642 1.00 0.00 C ATOM 0 H VAL A 37 14.154 0.919 7.554 1.00 0.00 H new ATOM 0 HA VAL A 37 16.881 1.472 6.655 1.00 0.00 H new ATOM 0 HB VAL A 37 16.161 3.839 6.744 1.00 0.00 H new ATOM 0 HG11 VAL A 37 14.480 3.750 4.947 1.00 0.00 H new ATOM 0 HG12 VAL A 37 15.782 2.564 4.693 1.00 0.00 H new ATOM 0 HG13 VAL A 37 14.198 2.029 5.301 1.00 0.00 H new ATOM 0 HG21 VAL A 37 13.817 4.403 7.235 1.00 0.00 H new ATOM 0 HG22 VAL A 37 13.507 2.709 7.684 1.00 0.00 H new ATOM 0 HG23 VAL A 37 14.635 3.692 8.647 1.00 0.00 H new ATOM 540 N SER A 38 17.841 2.489 8.778 1.00 0.00 N ATOM 541 CA SER A 38 18.472 2.790 10.058 1.00 0.00 C ATOM 542 C SER A 38 18.662 4.294 10.230 1.00 0.00 C ATOM 543 O SER A 38 19.555 4.740 10.950 1.00 0.00 O ATOM 544 CB SER A 38 19.822 2.079 10.164 1.00 0.00 C ATOM 545 OG SER A 38 19.657 0.728 10.558 1.00 0.00 O ATOM 0 H SER A 38 18.437 2.650 7.966 1.00 0.00 H new ATOM 0 HA SER A 38 17.817 2.431 10.852 1.00 0.00 H new ATOM 0 HB2 SER A 38 20.335 2.121 9.203 1.00 0.00 H new ATOM 0 HB3 SER A 38 20.454 2.597 10.886 1.00 0.00 H new ATOM 0 HG SER A 38 20.534 0.295 10.617 1.00 0.00 H new ATOM 551 N PHE A 39 17.815 5.071 9.563 1.00 0.00 N ATOM 552 CA PHE A 39 17.888 6.525 9.640 1.00 0.00 C ATOM 553 C PHE A 39 16.503 7.149 9.498 1.00 0.00 C ATOM 554 O PHE A 39 15.500 6.442 9.394 1.00 0.00 O ATOM 555 CB PHE A 39 18.818 7.069 8.553 1.00 0.00 C ATOM 556 CG PHE A 39 18.443 6.627 7.168 1.00 0.00 C ATOM 557 CD1 PHE A 39 18.897 5.419 6.665 1.00 0.00 C ATOM 558 CD2 PHE A 39 17.636 7.421 6.368 1.00 0.00 C ATOM 559 CE1 PHE A 39 18.553 5.011 5.390 1.00 0.00 C ATOM 560 CE2 PHE A 39 17.289 7.018 5.093 1.00 0.00 C ATOM 561 CZ PHE A 39 17.747 5.810 4.603 1.00 0.00 C ATOM 0 H PHE A 39 17.070 4.718 8.963 1.00 0.00 H new ATOM 0 HA PHE A 39 18.288 6.791 10.618 1.00 0.00 H new ATOM 0 HB2 PHE A 39 18.812 8.158 8.592 1.00 0.00 H new ATOM 0 HB3 PHE A 39 19.838 6.748 8.765 1.00 0.00 H new ATOM 0 HD1 PHE A 39 19.527 4.789 7.276 1.00 0.00 H new ATOM 0 HD2 PHE A 39 17.274 8.366 6.746 1.00 0.00 H new ATOM 0 HE1 PHE A 39 18.915 4.067 5.009 1.00 0.00 H new ATOM 0 HE2 PHE A 39 16.660 7.647 4.480 1.00 0.00 H new ATOM 0 HZ PHE A 39 17.475 5.491 3.607 1.00 0.00 H new ATOM 571 N ARG A 40 16.455 8.477 9.495 1.00 0.00 N ATOM 572 CA ARG A 40 15.193 9.196 9.367 1.00 0.00 C ATOM 573 C ARG A 40 14.870 9.470 7.902 1.00 0.00 C ATOM 574 O ARG A 40 15.657 10.092 7.187 1.00 0.00 O ATOM 575 CB ARG A 40 15.252 10.513 10.143 1.00 0.00 C ATOM 576 CG ARG A 40 13.896 10.989 10.638 1.00 0.00 C ATOM 577 CD ARG A 40 13.500 10.295 11.932 1.00 0.00 C ATOM 578 NE ARG A 40 14.136 10.905 13.097 1.00 0.00 N ATOM 579 CZ ARG A 40 13.863 10.559 14.350 1.00 0.00 C ATOM 580 NH1 ARG A 40 12.969 9.611 14.599 1.00 0.00 N ATOM 581 NH2 ARG A 40 14.483 11.160 15.357 1.00 0.00 N ATOM 0 H ARG A 40 17.275 9.077 9.580 1.00 0.00 H new ATOM 0 HA ARG A 40 14.403 8.571 9.784 1.00 0.00 H new ATOM 0 HB2 ARG A 40 15.919 10.393 10.997 1.00 0.00 H new ATOM 0 HB3 ARG A 40 15.687 11.282 9.505 1.00 0.00 H new ATOM 0 HG2 ARG A 40 13.923 12.067 10.796 1.00 0.00 H new ATOM 0 HG3 ARG A 40 13.141 10.797 9.875 1.00 0.00 H new ATOM 0 HD2 ARG A 40 12.417 10.335 12.048 1.00 0.00 H new ATOM 0 HD3 ARG A 40 13.776 9.242 11.878 1.00 0.00 H new ATOM 0 HE ARG A 40 14.828 11.637 12.940 1.00 0.00 H new ATOM 0 HH11 ARG A 40 12.490 9.146 13.828 1.00 0.00 H new ATOM 0 HH12 ARG A 40 12.761 9.347 15.562 1.00 0.00 H new ATOM 0 HH21 ARG A 40 15.171 11.889 15.170 1.00 0.00 H new ATOM 0 HH22 ARG A 40 14.272 10.893 16.318 1.00 0.00 H new ATOM 595 N LEU A 41 13.708 9.003 7.460 1.00 0.00 N ATOM 596 CA LEU A 41 13.279 9.197 6.079 1.00 0.00 C ATOM 597 C LEU A 41 12.735 10.607 5.871 1.00 0.00 C ATOM 598 O LEU A 41 12.126 11.188 6.770 1.00 0.00 O ATOM 599 CB LEU A 41 12.213 8.166 5.705 1.00 0.00 C ATOM 600 CG LEU A 41 12.678 6.711 5.645 1.00 0.00 C ATOM 601 CD1 LEU A 41 11.508 5.788 5.343 1.00 0.00 C ATOM 602 CD2 LEU A 41 13.774 6.544 4.602 1.00 0.00 C ATOM 0 H LEU A 41 13.045 8.487 8.038 1.00 0.00 H new ATOM 0 HA LEU A 41 14.147 9.063 5.433 1.00 0.00 H new ATOM 0 HB2 LEU A 41 11.399 8.237 6.426 1.00 0.00 H new ATOM 0 HB3 LEU A 41 11.801 8.435 4.732 1.00 0.00 H new ATOM 0 HG LEU A 41 13.086 6.440 6.619 1.00 0.00 H new ATOM 0 HD11 LEU A 41 11.859 4.757 5.304 1.00 0.00 H new ATOM 0 HD12 LEU A 41 10.756 5.886 6.126 1.00 0.00 H new ATOM 0 HD13 LEU A 41 11.070 6.058 4.382 1.00 0.00 H new ATOM 0 HD21 LEU A 41 14.093 5.502 4.573 1.00 0.00 H new ATOM 0 HD22 LEU A 41 13.392 6.834 3.623 1.00 0.00 H new ATOM 0 HD23 LEU A 41 14.623 7.176 4.862 1.00 0.00 H new ATOM 614 N LYS A 42 12.957 11.151 4.680 1.00 0.00 N ATOM 615 CA LYS A 42 12.486 12.491 4.351 1.00 0.00 C ATOM 616 C LYS A 42 11.509 12.453 3.180 1.00 0.00 C ATOM 617 O LYS A 42 11.695 11.695 2.229 1.00 0.00 O ATOM 618 CB LYS A 42 13.670 13.401 4.012 1.00 0.00 C ATOM 619 CG LYS A 42 14.714 13.476 5.112 1.00 0.00 C ATOM 620 CD LYS A 42 14.367 14.541 6.139 1.00 0.00 C ATOM 621 CE LYS A 42 15.264 14.448 7.363 1.00 0.00 C ATOM 622 NZ LYS A 42 15.312 15.733 8.114 1.00 0.00 N ATOM 0 H LYS A 42 13.461 10.684 3.926 1.00 0.00 H new ATOM 0 HA LYS A 42 11.966 12.890 5.222 1.00 0.00 H new ATOM 0 HB2 LYS A 42 14.143 13.042 3.098 1.00 0.00 H new ATOM 0 HB3 LYS A 42 13.299 14.405 3.806 1.00 0.00 H new ATOM 0 HG2 LYS A 42 14.795 12.507 5.605 1.00 0.00 H new ATOM 0 HG3 LYS A 42 15.689 13.694 4.675 1.00 0.00 H new ATOM 0 HD2 LYS A 42 14.466 15.529 5.688 1.00 0.00 H new ATOM 0 HD3 LYS A 42 13.325 14.431 6.441 1.00 0.00 H new ATOM 0 HE2 LYS A 42 14.902 13.657 8.020 1.00 0.00 H new ATOM 0 HE3 LYS A 42 16.272 14.170 7.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 15.934 15.629 8.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 15.682 16.483 7.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 14.354 15.986 8.431 1.00 0.00 H new ATOM 636 N GLY A 43 10.468 13.277 3.256 1.00 0.00 N ATOM 637 CA GLY A 43 9.479 13.322 2.196 1.00 0.00 C ATOM 638 C GLY A 43 10.094 13.153 0.821 1.00 0.00 C ATOM 639 O GLY A 43 9.538 12.466 -0.037 1.00 0.00 O ATOM 0 H GLY A 43 10.293 13.914 4.033 1.00 0.00 H new ATOM 0 HA2 GLY A 43 8.740 12.537 2.359 1.00 0.00 H new ATOM 0 HA3 GLY A 43 8.948 14.273 2.239 1.00 0.00 H new ATOM 643 N LYS A 44 11.245 13.782 0.609 1.00 0.00 N ATOM 644 CA LYS A 44 11.938 13.699 -0.672 1.00 0.00 C ATOM 645 C LYS A 44 12.578 12.327 -0.856 1.00 0.00 C ATOM 646 O LYS A 44 12.585 11.778 -1.958 1.00 0.00 O ATOM 647 CB LYS A 44 13.007 14.790 -0.768 1.00 0.00 C ATOM 648 CG LYS A 44 14.009 14.762 0.373 1.00 0.00 C ATOM 649 CD LYS A 44 14.522 16.155 0.699 1.00 0.00 C ATOM 650 CE LYS A 44 15.783 16.482 -0.086 1.00 0.00 C ATOM 651 NZ LYS A 44 16.139 17.924 0.013 1.00 0.00 N ATOM 0 H LYS A 44 11.718 14.355 1.308 1.00 0.00 H new ATOM 0 HA LYS A 44 11.204 13.847 -1.464 1.00 0.00 H new ATOM 0 HB2 LYS A 44 13.541 14.682 -1.712 1.00 0.00 H new ATOM 0 HB3 LYS A 44 12.519 15.764 -0.788 1.00 0.00 H new ATOM 0 HG2 LYS A 44 13.542 14.329 1.258 1.00 0.00 H new ATOM 0 HG3 LYS A 44 14.847 14.118 0.107 1.00 0.00 H new ATOM 0 HD2 LYS A 44 13.750 16.890 0.472 1.00 0.00 H new ATOM 0 HD3 LYS A 44 14.728 16.227 1.767 1.00 0.00 H new ATOM 0 HE2 LYS A 44 16.610 15.877 0.287 1.00 0.00 H new ATOM 0 HE3 LYS A 44 15.639 16.214 -1.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 17.004 18.107 -0.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 15.361 18.501 -0.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 16.302 18.174 1.009 1.00 0.00 H new ATOM 665 N ASP A 45 13.114 11.779 0.228 1.00 0.00 N ATOM 666 CA ASP A 45 13.755 10.469 0.187 1.00 0.00 C ATOM 667 C ASP A 45 12.778 9.401 -0.294 1.00 0.00 C ATOM 668 O ASP A 45 13.142 8.513 -1.065 1.00 0.00 O ATOM 669 CB ASP A 45 14.296 10.099 1.568 1.00 0.00 C ATOM 670 CG ASP A 45 15.343 9.003 1.505 1.00 0.00 C ATOM 671 OD1 ASP A 45 15.067 7.954 0.886 1.00 0.00 O ATOM 672 OD2 ASP A 45 16.438 9.196 2.073 1.00 0.00 O ATOM 0 H ASP A 45 13.118 12.221 1.147 1.00 0.00 H new ATOM 0 HA ASP A 45 14.585 10.520 -0.518 1.00 0.00 H new ATOM 0 HB2 ASP A 45 14.728 10.984 2.035 1.00 0.00 H new ATOM 0 HB3 ASP A 45 13.472 9.774 2.203 1.00 0.00 H new ATOM 677 N VAL A 46 11.535 9.493 0.168 1.00 0.00 N ATOM 678 CA VAL A 46 10.504 8.535 -0.215 1.00 0.00 C ATOM 679 C VAL A 46 9.672 9.058 -1.380 1.00 0.00 C ATOM 680 O VAL A 46 9.693 10.251 -1.686 1.00 0.00 O ATOM 681 CB VAL A 46 9.569 8.215 0.966 1.00 0.00 C ATOM 682 CG1 VAL A 46 10.351 7.594 2.114 1.00 0.00 C ATOM 683 CG2 VAL A 46 8.841 9.469 1.424 1.00 0.00 C ATOM 0 H VAL A 46 11.217 10.221 0.808 1.00 0.00 H new ATOM 0 HA VAL A 46 11.018 7.623 -0.520 1.00 0.00 H new ATOM 0 HB VAL A 46 8.825 7.492 0.632 1.00 0.00 H new ATOM 0 HG11 VAL A 46 9.673 7.375 2.939 1.00 0.00 H new ATOM 0 HG12 VAL A 46 10.822 6.671 1.776 1.00 0.00 H new ATOM 0 HG13 VAL A 46 11.119 8.291 2.450 1.00 0.00 H new ATOM 0 HG21 VAL A 46 8.185 9.224 2.259 1.00 0.00 H new ATOM 0 HG22 VAL A 46 9.568 10.217 1.741 1.00 0.00 H new ATOM 0 HG23 VAL A 46 8.248 9.866 0.601 1.00 0.00 H new ATOM 693 N VAL A 47 8.939 8.158 -2.028 1.00 0.00 N ATOM 694 CA VAL A 47 8.098 8.529 -3.160 1.00 0.00 C ATOM 695 C VAL A 47 6.707 7.918 -3.034 1.00 0.00 C ATOM 696 O VAL A 47 6.520 6.722 -3.258 1.00 0.00 O ATOM 697 CB VAL A 47 8.724 8.083 -4.495 1.00 0.00 C ATOM 698 CG1 VAL A 47 7.758 8.323 -5.644 1.00 0.00 C ATOM 699 CG2 VAL A 47 10.041 8.806 -4.734 1.00 0.00 C ATOM 0 H VAL A 47 8.911 7.167 -1.788 1.00 0.00 H new ATOM 0 HA VAL A 47 8.017 9.616 -3.151 1.00 0.00 H new ATOM 0 HB VAL A 47 8.928 7.014 -4.441 1.00 0.00 H new ATOM 0 HG11 VAL A 47 8.218 8.002 -6.579 1.00 0.00 H new ATOM 0 HG12 VAL A 47 6.843 7.755 -5.475 1.00 0.00 H new ATOM 0 HG13 VAL A 47 7.519 9.385 -5.703 1.00 0.00 H new ATOM 0 HG21 VAL A 47 10.469 8.479 -5.681 1.00 0.00 H new ATOM 0 HG22 VAL A 47 9.865 9.881 -4.768 1.00 0.00 H new ATOM 0 HG23 VAL A 47 10.734 8.577 -3.924 1.00 0.00 H new ATOM 709 N VAL A 48 5.733 8.748 -2.674 1.00 0.00 N ATOM 710 CA VAL A 48 4.357 8.290 -2.520 1.00 0.00 C ATOM 711 C VAL A 48 3.411 9.078 -3.419 1.00 0.00 C ATOM 712 O VAL A 48 3.258 10.290 -3.266 1.00 0.00 O ATOM 713 CB VAL A 48 3.884 8.417 -1.059 1.00 0.00 C ATOM 714 CG1 VAL A 48 2.419 8.026 -0.937 1.00 0.00 C ATOM 715 CG2 VAL A 48 4.750 7.566 -0.143 1.00 0.00 C ATOM 0 H VAL A 48 5.871 9.741 -2.484 1.00 0.00 H new ATOM 0 HA VAL A 48 4.339 7.240 -2.811 1.00 0.00 H new ATOM 0 HB VAL A 48 3.984 9.458 -0.751 1.00 0.00 H new ATOM 0 HG11 VAL A 48 2.102 8.122 0.102 1.00 0.00 H new ATOM 0 HG12 VAL A 48 1.814 8.682 -1.563 1.00 0.00 H new ATOM 0 HG13 VAL A 48 2.290 6.994 -1.262 1.00 0.00 H new ATOM 0 HG21 VAL A 48 4.402 7.668 0.885 1.00 0.00 H new ATOM 0 HG22 VAL A 48 4.684 6.521 -0.447 1.00 0.00 H new ATOM 0 HG23 VAL A 48 5.786 7.898 -0.210 1.00 0.00 H new ATOM 725 N ASP A 49 2.779 8.382 -4.358 1.00 0.00 N ATOM 726 CA ASP A 49 1.847 9.016 -5.282 1.00 0.00 C ATOM 727 C ASP A 49 0.417 8.555 -5.013 1.00 0.00 C ATOM 728 O ASP A 49 0.064 7.407 -5.283 1.00 0.00 O ATOM 729 CB ASP A 49 2.234 8.700 -6.728 1.00 0.00 C ATOM 730 CG ASP A 49 1.332 9.389 -7.733 1.00 0.00 C ATOM 731 OD1 ASP A 49 1.392 10.633 -7.827 1.00 0.00 O ATOM 732 OD2 ASP A 49 0.567 8.686 -8.424 1.00 0.00 O ATOM 0 H ASP A 49 2.896 7.379 -4.499 1.00 0.00 H new ATOM 0 HA ASP A 49 1.898 10.094 -5.128 1.00 0.00 H new ATOM 0 HB2 ASP A 49 3.266 9.007 -6.900 1.00 0.00 H new ATOM 0 HB3 ASP A 49 2.191 7.622 -6.885 1.00 0.00 H new ATOM 737 N ILE A 50 -0.399 9.457 -4.479 1.00 0.00 N ATOM 738 CA ILE A 50 -1.789 9.143 -4.174 1.00 0.00 C ATOM 739 C ILE A 50 -2.722 9.663 -5.262 1.00 0.00 C ATOM 740 O ILE A 50 -2.695 10.846 -5.603 1.00 0.00 O ATOM 741 CB ILE A 50 -2.217 9.738 -2.820 1.00 0.00 C ATOM 742 CG1 ILE A 50 -1.332 9.193 -1.696 1.00 0.00 C ATOM 743 CG2 ILE A 50 -3.681 9.432 -2.545 1.00 0.00 C ATOM 744 CD1 ILE A 50 -1.365 10.033 -0.439 1.00 0.00 C ATOM 0 H ILE A 50 -0.122 10.411 -4.249 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.863 8.057 -4.124 1.00 0.00 H new ATOM 0 HB ILE A 50 -2.095 10.820 -2.861 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -1.650 8.179 -1.454 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.304 9.128 -2.053 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.968 9.859 -1.584 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.297 9.865 -3.333 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -3.829 8.352 -2.520 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -0.715 9.587 0.314 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.019 11.041 -0.666 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -2.385 10.077 -0.058 1.00 0.00 H new ATOM 756 N GLN A 51 -3.547 8.772 -5.803 1.00 0.00 N ATOM 757 CA GLN A 51 -4.490 9.142 -6.852 1.00 0.00 C ATOM 758 C GLN A 51 -5.910 8.732 -6.477 1.00 0.00 C ATOM 759 O GLN A 51 -6.133 8.105 -5.441 1.00 0.00 O ATOM 760 CB GLN A 51 -4.091 8.492 -8.177 1.00 0.00 C ATOM 761 CG GLN A 51 -3.154 9.346 -9.016 1.00 0.00 C ATOM 762 CD GLN A 51 -3.691 10.744 -9.252 1.00 0.00 C ATOM 763 OE1 GLN A 51 -4.893 10.936 -9.437 1.00 0.00 O ATOM 764 NE2 GLN A 51 -2.801 11.729 -9.246 1.00 0.00 N ATOM 0 H GLN A 51 -3.581 7.789 -5.532 1.00 0.00 H new ATOM 0 HA GLN A 51 -4.463 10.226 -6.965 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -3.611 7.535 -7.973 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -4.991 8.281 -8.754 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -2.186 9.412 -8.519 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -2.987 8.858 -9.976 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -1.814 11.524 -9.089 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -3.104 12.691 -9.399 1.00 0.00 H new ATOM 773 N ARG A 52 -6.868 9.089 -7.327 1.00 0.00 N ATOM 774 CA ARG A 52 -8.267 8.759 -7.084 1.00 0.00 C ATOM 775 C ARG A 52 -8.449 7.253 -6.919 1.00 0.00 C ATOM 776 O ARG A 52 -8.938 6.786 -5.889 1.00 0.00 O ATOM 777 CB ARG A 52 -9.139 9.266 -8.233 1.00 0.00 C ATOM 778 CG ARG A 52 -10.625 9.271 -7.913 1.00 0.00 C ATOM 779 CD ARG A 52 -11.007 10.470 -7.059 1.00 0.00 C ATOM 780 NE ARG A 52 -10.867 11.728 -7.788 1.00 0.00 N ATOM 781 CZ ARG A 52 -11.541 12.832 -7.485 1.00 0.00 C ATOM 782 NH1 ARG A 52 -12.397 12.833 -6.472 1.00 0.00 N ATOM 783 NH2 ARG A 52 -11.359 13.938 -8.195 1.00 0.00 N ATOM 0 H ARG A 52 -6.700 9.607 -8.190 1.00 0.00 H new ATOM 0 HA ARG A 52 -8.575 9.248 -6.160 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -8.829 10.278 -8.494 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -8.967 8.643 -9.111 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -11.198 9.286 -8.840 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -10.889 8.352 -7.390 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -12.037 10.360 -6.720 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -10.379 10.495 -6.168 1.00 0.00 H new ATOM 0 HE ARG A 52 -10.216 11.761 -8.573 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -12.539 11.985 -5.924 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -12.913 13.682 -6.241 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -10.701 13.941 -8.974 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -11.877 14.785 -7.961 1.00 0.00 H new ATOM 797 N ARG A 53 -8.054 6.499 -7.939 1.00 0.00 N ATOM 798 CA ARG A 53 -8.175 5.046 -7.908 1.00 0.00 C ATOM 799 C ARG A 53 -6.815 4.382 -8.101 1.00 0.00 C ATOM 800 O ARG A 53 -6.712 3.320 -8.714 1.00 0.00 O ATOM 801 CB ARG A 53 -9.145 4.571 -8.991 1.00 0.00 C ATOM 802 CG ARG A 53 -9.855 3.272 -8.645 1.00 0.00 C ATOM 803 CD ARG A 53 -11.153 3.123 -9.423 1.00 0.00 C ATOM 804 NE ARG A 53 -11.783 1.825 -9.194 1.00 0.00 N ATOM 805 CZ ARG A 53 -12.798 1.363 -9.915 1.00 0.00 C ATOM 806 NH1 ARG A 53 -13.296 2.089 -10.906 1.00 0.00 N ATOM 807 NH2 ARG A 53 -13.317 0.172 -9.645 1.00 0.00 N ATOM 0 H ARG A 53 -7.647 6.870 -8.798 1.00 0.00 H new ATOM 0 HA ARG A 53 -8.563 4.760 -6.931 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -9.890 5.347 -9.165 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -8.598 4.439 -9.924 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -9.200 2.429 -8.863 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -10.065 3.244 -7.576 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -11.842 3.916 -9.134 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -10.954 3.246 -10.488 1.00 0.00 H new ATOM 0 HE ARG A 53 -11.423 1.241 -8.439 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -12.900 3.005 -11.116 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -14.076 1.732 -11.458 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -12.936 -0.389 -8.883 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -14.097 -0.182 -10.199 1.00 0.00 H new ATOM 821 N HIS A 54 -5.773 5.017 -7.573 1.00 0.00 N ATOM 822 CA HIS A 54 -4.418 4.488 -7.688 1.00 0.00 C ATOM 823 C HIS A 54 -3.527 5.032 -6.575 1.00 0.00 C ATOM 824 O HIS A 54 -3.639 6.196 -6.189 1.00 0.00 O ATOM 825 CB HIS A 54 -3.824 4.840 -9.052 1.00 0.00 C ATOM 826 CG HIS A 54 -2.692 3.948 -9.460 1.00 0.00 C ATOM 827 ND1 HIS A 54 -1.673 4.359 -10.292 1.00 0.00 N ATOM 828 CD2 HIS A 54 -2.423 2.659 -9.145 1.00 0.00 C ATOM 829 CE1 HIS A 54 -0.825 3.361 -10.473 1.00 0.00 C ATOM 830 NE2 HIS A 54 -1.257 2.319 -9.787 1.00 0.00 N ATOM 0 H HIS A 54 -5.841 5.897 -7.062 1.00 0.00 H new ATOM 0 HA HIS A 54 -4.468 3.403 -7.592 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -4.609 4.785 -9.806 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -3.473 5.872 -9.031 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -3.014 2.018 -8.508 1.00 0.00 H new ATOM 0 HE1 HIS A 54 0.069 3.393 -11.079 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -0.799 1.409 -9.741 1.00 0.00 H new ATOM 839 N LEU A 55 -2.642 4.183 -6.064 1.00 0.00 N ATOM 840 CA LEU A 55 -1.731 4.579 -4.995 1.00 0.00 C ATOM 841 C LEU A 55 -0.357 3.946 -5.189 1.00 0.00 C ATOM 842 O LEU A 55 -0.246 2.791 -5.599 1.00 0.00 O ATOM 843 CB LEU A 55 -2.304 4.175 -3.635 1.00 0.00 C ATOM 844 CG LEU A 55 -1.339 4.254 -2.451 1.00 0.00 C ATOM 845 CD1 LEU A 55 -0.972 5.700 -2.158 1.00 0.00 C ATOM 846 CD2 LEU A 55 -1.950 3.597 -1.222 1.00 0.00 C ATOM 0 H LEU A 55 -2.536 3.217 -6.372 1.00 0.00 H new ATOM 0 HA LEU A 55 -1.619 5.663 -5.028 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -3.163 4.811 -3.421 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -2.675 3.153 -3.708 1.00 0.00 H new ATOM 0 HG LEU A 55 -0.428 3.715 -2.712 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -0.285 5.737 -1.313 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -0.494 6.139 -3.034 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -1.874 6.263 -1.917 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -1.250 3.662 -0.389 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -2.876 4.108 -0.959 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -2.162 2.550 -1.437 1.00 0.00 H new ATOM 858 N ARG A 56 0.688 4.711 -4.890 1.00 0.00 N ATOM 859 CA ARG A 56 2.056 4.226 -5.031 1.00 0.00 C ATOM 860 C ARG A 56 2.894 4.600 -3.812 1.00 0.00 C ATOM 861 O ARG A 56 2.815 5.722 -3.312 1.00 0.00 O ATOM 862 CB ARG A 56 2.695 4.798 -6.298 1.00 0.00 C ATOM 863 CG ARG A 56 3.961 4.072 -6.722 1.00 0.00 C ATOM 864 CD ARG A 56 4.862 4.966 -7.560 1.00 0.00 C ATOM 865 NE ARG A 56 6.063 4.267 -8.009 1.00 0.00 N ATOM 866 CZ ARG A 56 6.925 4.774 -8.883 1.00 0.00 C ATOM 867 NH1 ARG A 56 6.719 5.978 -9.399 1.00 0.00 N ATOM 868 NH2 ARG A 56 7.995 4.077 -9.242 1.00 0.00 N ATOM 0 H ARG A 56 0.613 5.669 -4.549 1.00 0.00 H new ATOM 0 HA ARG A 56 2.023 3.139 -5.108 1.00 0.00 H new ATOM 0 HB2 ARG A 56 1.971 4.754 -7.112 1.00 0.00 H new ATOM 0 HB3 ARG A 56 2.927 5.850 -6.135 1.00 0.00 H new ATOM 0 HG2 ARG A 56 4.502 3.735 -5.838 1.00 0.00 H new ATOM 0 HG3 ARG A 56 3.697 3.182 -7.293 1.00 0.00 H new ATOM 0 HD2 ARG A 56 4.308 5.328 -8.426 1.00 0.00 H new ATOM 0 HD3 ARG A 56 5.149 5.841 -6.976 1.00 0.00 H new ATOM 0 HE ARG A 56 6.250 3.338 -7.631 1.00 0.00 H new ATOM 0 HH11 ARG A 56 5.897 6.517 -9.125 1.00 0.00 H new ATOM 0 HH12 ARG A 56 7.382 6.366 -10.070 1.00 0.00 H new ATOM 0 HH21 ARG A 56 8.156 3.151 -8.847 1.00 0.00 H new ATOM 0 HH22 ARG A 56 8.656 4.467 -9.913 1.00 0.00 H new ATOM 882 N VAL A 57 3.695 3.652 -3.338 1.00 0.00 N ATOM 883 CA VAL A 57 4.548 3.882 -2.178 1.00 0.00 C ATOM 884 C VAL A 57 5.913 3.226 -2.360 1.00 0.00 C ATOM 885 O VAL A 57 6.021 2.143 -2.934 1.00 0.00 O ATOM 886 CB VAL A 57 3.900 3.343 -0.889 1.00 0.00 C ATOM 887 CG1 VAL A 57 4.785 3.631 0.315 1.00 0.00 C ATOM 888 CG2 VAL A 57 2.515 3.942 -0.698 1.00 0.00 C ATOM 0 H VAL A 57 3.771 2.717 -3.739 1.00 0.00 H new ATOM 0 HA VAL A 57 4.676 4.961 -2.088 1.00 0.00 H new ATOM 0 HB VAL A 57 3.794 2.262 -0.981 1.00 0.00 H new ATOM 0 HG11 VAL A 57 4.311 3.243 1.216 1.00 0.00 H new ATOM 0 HG12 VAL A 57 5.753 3.149 0.178 1.00 0.00 H new ATOM 0 HG13 VAL A 57 4.926 4.707 0.414 1.00 0.00 H new ATOM 0 HG21 VAL A 57 2.072 3.550 0.218 1.00 0.00 H new ATOM 0 HG22 VAL A 57 2.594 5.027 -0.627 1.00 0.00 H new ATOM 0 HG23 VAL A 57 1.885 3.679 -1.547 1.00 0.00 H new ATOM 898 N GLY A 58 6.953 3.890 -1.867 1.00 0.00 N ATOM 899 CA GLY A 58 8.298 3.357 -1.985 1.00 0.00 C ATOM 900 C GLY A 58 9.362 4.413 -1.765 1.00 0.00 C ATOM 901 O GLY A 58 9.081 5.487 -1.231 1.00 0.00 O ATOM 0 H GLY A 58 6.889 4.788 -1.388 1.00 0.00 H new ATOM 0 HA2 GLY A 58 8.432 2.554 -1.260 1.00 0.00 H new ATOM 0 HA3 GLY A 58 8.426 2.918 -2.974 1.00 0.00 H new ATOM 905 N LEU A 59 10.589 4.109 -2.174 1.00 0.00 N ATOM 906 CA LEU A 59 11.701 5.040 -2.018 1.00 0.00 C ATOM 907 C LEU A 59 12.262 5.452 -3.375 1.00 0.00 C ATOM 908 O LEU A 59 12.277 4.661 -4.319 1.00 0.00 O ATOM 909 CB LEU A 59 12.804 4.409 -1.167 1.00 0.00 C ATOM 910 CG LEU A 59 12.363 3.816 0.172 1.00 0.00 C ATOM 911 CD1 LEU A 59 13.376 2.792 0.661 1.00 0.00 C ATOM 912 CD2 LEU A 59 12.172 4.916 1.205 1.00 0.00 C ATOM 0 H LEU A 59 10.839 3.225 -2.616 1.00 0.00 H new ATOM 0 HA LEU A 59 11.328 5.932 -1.515 1.00 0.00 H new ATOM 0 HB2 LEU A 59 13.280 3.621 -1.751 1.00 0.00 H new ATOM 0 HB3 LEU A 59 13.564 5.166 -0.974 1.00 0.00 H new ATOM 0 HG LEU A 59 11.408 3.311 0.028 1.00 0.00 H new ATOM 0 HD11 LEU A 59 13.046 2.381 1.615 1.00 0.00 H new ATOM 0 HD12 LEU A 59 13.463 1.988 -0.070 1.00 0.00 H new ATOM 0 HD13 LEU A 59 14.346 3.272 0.789 1.00 0.00 H new ATOM 0 HD21 LEU A 59 11.858 4.476 2.151 1.00 0.00 H new ATOM 0 HD22 LEU A 59 13.112 5.449 1.347 1.00 0.00 H new ATOM 0 HD23 LEU A 59 11.409 5.612 0.858 1.00 0.00 H new ATOM 924 N LYS A 60 12.725 6.694 -3.466 1.00 0.00 N ATOM 925 CA LYS A 60 13.291 7.211 -4.706 1.00 0.00 C ATOM 926 C LYS A 60 14.296 6.227 -5.298 1.00 0.00 C ATOM 927 O LYS A 60 15.153 5.700 -4.591 1.00 0.00 O ATOM 928 CB LYS A 60 13.969 8.560 -4.458 1.00 0.00 C ATOM 929 CG LYS A 60 13.881 9.512 -5.639 1.00 0.00 C ATOM 930 CD LYS A 60 14.925 9.189 -6.694 1.00 0.00 C ATOM 931 CE LYS A 60 14.669 9.954 -7.984 1.00 0.00 C ATOM 932 NZ LYS A 60 15.476 9.419 -9.115 1.00 0.00 N ATOM 0 H LYS A 60 12.719 7.362 -2.695 1.00 0.00 H new ATOM 0 HA LYS A 60 12.477 7.345 -5.419 1.00 0.00 H new ATOM 0 HB2 LYS A 60 13.513 9.032 -3.587 1.00 0.00 H new ATOM 0 HB3 LYS A 60 15.018 8.391 -4.216 1.00 0.00 H new ATOM 0 HG2 LYS A 60 12.886 9.454 -6.081 1.00 0.00 H new ATOM 0 HG3 LYS A 60 14.017 10.537 -5.293 1.00 0.00 H new ATOM 0 HD2 LYS A 60 15.916 9.436 -6.314 1.00 0.00 H new ATOM 0 HD3 LYS A 60 14.919 8.118 -6.897 1.00 0.00 H new ATOM 0 HE2 LYS A 60 13.610 9.898 -8.235 1.00 0.00 H new ATOM 0 HE3 LYS A 60 14.906 11.007 -7.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 15.273 9.967 -9.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 16.488 9.495 -8.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 15.231 8.421 -9.274 1.00 0.00 H new ATOM 946 N GLY A 61 14.183 5.984 -6.600 1.00 0.00 N ATOM 947 CA GLY A 61 15.089 5.065 -7.265 1.00 0.00 C ATOM 948 C GLY A 61 14.690 3.616 -7.069 1.00 0.00 C ATOM 949 O GLY A 61 14.475 2.889 -8.039 1.00 0.00 O ATOM 0 H GLY A 61 13.480 6.407 -7.206 1.00 0.00 H new ATOM 0 HA2 GLY A 61 15.114 5.291 -8.331 1.00 0.00 H new ATOM 0 HA3 GLY A 61 16.099 5.216 -6.884 1.00 0.00 H new ATOM 953 N GLN A 62 14.594 3.195 -5.812 1.00 0.00 N ATOM 954 CA GLN A 62 14.221 1.822 -5.494 1.00 0.00 C ATOM 955 C GLN A 62 12.807 1.516 -5.976 1.00 0.00 C ATOM 956 O GLN A 62 12.012 2.414 -6.254 1.00 0.00 O ATOM 957 CB GLN A 62 14.322 1.580 -3.987 1.00 0.00 C ATOM 958 CG GLN A 62 15.679 1.056 -3.544 1.00 0.00 C ATOM 959 CD GLN A 62 15.971 1.351 -2.087 1.00 0.00 C ATOM 960 OE1 GLN A 62 15.715 2.453 -1.601 1.00 0.00 O ATOM 961 NE2 GLN A 62 16.510 0.365 -1.379 1.00 0.00 N ATOM 0 H GLN A 62 14.769 3.784 -4.998 1.00 0.00 H new ATOM 0 HA GLN A 62 14.913 1.156 -6.009 1.00 0.00 H new ATOM 0 HB2 GLN A 62 14.113 2.513 -3.463 1.00 0.00 H new ATOM 0 HB3 GLN A 62 13.552 0.868 -3.689 1.00 0.00 H new ATOM 0 HG2 GLN A 62 15.719 -0.021 -3.708 1.00 0.00 H new ATOM 0 HG3 GLN A 62 16.457 1.502 -4.164 1.00 0.00 H new ATOM 0 HE21 GLN A 62 16.706 -0.533 -1.822 1.00 0.00 H new ATOM 0 HE22 GLN A 62 16.728 0.506 -0.393 1.00 0.00 H new ATOM 970 N PRO A 63 12.484 0.218 -6.080 1.00 0.00 N ATOM 971 CA PRO A 63 11.165 -0.236 -6.529 1.00 0.00 C ATOM 972 C PRO A 63 10.072 0.054 -5.506 1.00 0.00 C ATOM 973 O PRO A 63 10.255 -0.119 -4.300 1.00 0.00 O ATOM 974 CB PRO A 63 11.349 -1.746 -6.700 1.00 0.00 C ATOM 975 CG PRO A 63 12.467 -2.098 -5.780 1.00 0.00 C ATOM 976 CD PRO A 63 13.383 -0.906 -5.766 1.00 0.00 C ATOM 0 HA PRO A 63 10.846 0.275 -7.438 1.00 0.00 H new ATOM 0 HB2 PRO A 63 10.439 -2.287 -6.442 1.00 0.00 H new ATOM 0 HB3 PRO A 63 11.590 -2.001 -7.732 1.00 0.00 H new ATOM 0 HG2 PRO A 63 12.095 -2.316 -4.779 1.00 0.00 H new ATOM 0 HG3 PRO A 63 12.991 -2.989 -6.126 1.00 0.00 H new ATOM 0 HD2 PRO A 63 13.862 -0.779 -4.795 1.00 0.00 H new ATOM 0 HD3 PRO A 63 14.179 -1.002 -6.504 1.00 0.00 H new ATOM 984 N PRO A 64 8.908 0.507 -5.994 1.00 0.00 N ATOM 985 CA PRO A 64 7.763 0.830 -5.138 1.00 0.00 C ATOM 986 C PRO A 64 7.132 -0.412 -4.519 1.00 0.00 C ATOM 987 O PRO A 64 6.616 -1.277 -5.228 1.00 0.00 O ATOM 988 CB PRO A 64 6.781 1.506 -6.099 1.00 0.00 C ATOM 989 CG PRO A 64 7.134 0.966 -7.442 1.00 0.00 C ATOM 990 CD PRO A 64 8.620 0.737 -7.420 1.00 0.00 C ATOM 0 HA PRO A 64 8.051 1.454 -4.292 1.00 0.00 H new ATOM 0 HB2 PRO A 64 5.748 1.274 -5.838 1.00 0.00 H new ATOM 0 HB3 PRO A 64 6.881 2.591 -6.069 1.00 0.00 H new ATOM 0 HG2 PRO A 64 6.599 0.037 -7.642 1.00 0.00 H new ATOM 0 HG3 PRO A 64 6.859 1.668 -8.229 1.00 0.00 H new ATOM 0 HD2 PRO A 64 8.904 -0.120 -8.031 1.00 0.00 H new ATOM 0 HD3 PRO A 64 9.165 1.598 -7.806 1.00 0.00 H new ATOM 998 N VAL A 65 7.177 -0.496 -3.193 1.00 0.00 N ATOM 999 CA VAL A 65 6.609 -1.632 -2.479 1.00 0.00 C ATOM 1000 C VAL A 65 5.122 -1.783 -2.780 1.00 0.00 C ATOM 1001 O VAL A 65 4.631 -2.890 -2.999 1.00 0.00 O ATOM 1002 CB VAL A 65 6.802 -1.492 -0.957 1.00 0.00 C ATOM 1003 CG1 VAL A 65 6.269 -2.721 -0.236 1.00 0.00 C ATOM 1004 CG2 VAL A 65 8.268 -1.263 -0.625 1.00 0.00 C ATOM 0 H VAL A 65 7.601 0.210 -2.592 1.00 0.00 H new ATOM 0 HA VAL A 65 7.139 -2.520 -2.825 1.00 0.00 H new ATOM 0 HB VAL A 65 6.236 -0.626 -0.615 1.00 0.00 H new ATOM 0 HG11 VAL A 65 6.414 -2.604 0.838 1.00 0.00 H new ATOM 0 HG12 VAL A 65 5.206 -2.835 -0.448 1.00 0.00 H new ATOM 0 HG13 VAL A 65 6.805 -3.606 -0.580 1.00 0.00 H new ATOM 0 HG21 VAL A 65 8.386 -1.166 0.454 1.00 0.00 H new ATOM 0 HG22 VAL A 65 8.858 -2.108 -0.980 1.00 0.00 H new ATOM 0 HG23 VAL A 65 8.613 -0.350 -1.111 1.00 0.00 H new ATOM 1014 N VAL A 66 4.409 -0.661 -2.790 1.00 0.00 N ATOM 1015 CA VAL A 66 2.977 -0.667 -3.066 1.00 0.00 C ATOM 1016 C VAL A 66 2.675 -0.019 -4.412 1.00 0.00 C ATOM 1017 O VAL A 66 2.923 1.171 -4.610 1.00 0.00 O ATOM 1018 CB VAL A 66 2.191 0.069 -1.966 1.00 0.00 C ATOM 1019 CG1 VAL A 66 0.695 -0.021 -2.228 1.00 0.00 C ATOM 1020 CG2 VAL A 66 2.535 -0.496 -0.596 1.00 0.00 C ATOM 0 H VAL A 66 4.800 0.264 -2.610 1.00 0.00 H new ATOM 0 HA VAL A 66 2.663 -1.710 -3.090 1.00 0.00 H new ATOM 0 HB VAL A 66 2.476 1.121 -1.982 1.00 0.00 H new ATOM 0 HG11 VAL A 66 0.155 0.505 -1.440 1.00 0.00 H new ATOM 0 HG12 VAL A 66 0.466 0.435 -3.191 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.390 -1.067 -2.240 1.00 0.00 H new ATOM 0 HG21 VAL A 66 1.970 0.036 0.169 1.00 0.00 H new ATOM 0 HG22 VAL A 66 2.280 -1.555 -0.565 1.00 0.00 H new ATOM 0 HG23 VAL A 66 3.602 -0.374 -0.410 1.00 0.00 H new ATOM 1030 N ASP A 67 2.136 -0.808 -5.335 1.00 0.00 N ATOM 1031 CA ASP A 67 1.797 -0.311 -6.663 1.00 0.00 C ATOM 1032 C ASP A 67 0.690 -1.152 -7.292 1.00 0.00 C ATOM 1033 O ASP A 67 0.918 -2.287 -7.706 1.00 0.00 O ATOM 1034 CB ASP A 67 3.033 -0.317 -7.564 1.00 0.00 C ATOM 1035 CG ASP A 67 3.482 -1.720 -7.922 1.00 0.00 C ATOM 1036 OD1 ASP A 67 3.836 -2.483 -6.999 1.00 0.00 O ATOM 1037 OD2 ASP A 67 3.479 -2.055 -9.124 1.00 0.00 O ATOM 0 H ASP A 67 1.924 -1.795 -5.188 1.00 0.00 H new ATOM 0 HA ASP A 67 1.437 0.713 -6.560 1.00 0.00 H new ATOM 0 HB2 ASP A 67 2.815 0.236 -8.478 1.00 0.00 H new ATOM 0 HB3 ASP A 67 3.848 0.205 -7.062 1.00 0.00 H new ATOM 1042 N GLY A 68 -0.511 -0.586 -7.359 1.00 0.00 N ATOM 1043 CA GLY A 68 -1.636 -1.298 -7.937 1.00 0.00 C ATOM 1044 C GLY A 68 -2.928 -0.510 -7.850 1.00 0.00 C ATOM 1045 O GLY A 68 -3.147 0.231 -6.892 1.00 0.00 O ATOM 0 H GLY A 68 -0.725 0.353 -7.023 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -1.421 -1.523 -8.982 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -1.761 -2.252 -7.424 1.00 0.00 H new ATOM 1049 N GLU A 69 -3.785 -0.669 -8.854 1.00 0.00 N ATOM 1050 CA GLU A 69 -5.061 0.037 -8.887 1.00 0.00 C ATOM 1051 C GLU A 69 -5.848 -0.202 -7.602 1.00 0.00 C ATOM 1052 O GLU A 69 -6.066 -1.345 -7.197 1.00 0.00 O ATOM 1053 CB GLU A 69 -5.886 -0.413 -10.095 1.00 0.00 C ATOM 1054 CG GLU A 69 -7.210 0.319 -10.233 1.00 0.00 C ATOM 1055 CD GLU A 69 -7.749 0.288 -11.650 1.00 0.00 C ATOM 1056 OE1 GLU A 69 -7.512 -0.716 -12.353 1.00 0.00 O ATOM 1057 OE2 GLU A 69 -8.409 1.268 -12.055 1.00 0.00 O ATOM 0 H GLU A 69 -3.619 -1.279 -9.654 1.00 0.00 H new ATOM 0 HA GLU A 69 -4.855 1.104 -8.973 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -5.300 -0.261 -11.002 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -6.078 -1.483 -10.015 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -7.941 -0.130 -9.560 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -7.082 1.355 -9.919 1.00 0.00 H new ATOM 1064 N LEU A 70 -6.272 0.883 -6.964 1.00 0.00 N ATOM 1065 CA LEU A 70 -7.035 0.793 -5.724 1.00 0.00 C ATOM 1066 C LEU A 70 -8.358 0.069 -5.950 1.00 0.00 C ATOM 1067 O LEU A 70 -8.945 0.150 -7.029 1.00 0.00 O ATOM 1068 CB LEU A 70 -7.295 2.191 -5.160 1.00 0.00 C ATOM 1069 CG LEU A 70 -6.109 2.869 -4.472 1.00 0.00 C ATOM 1070 CD1 LEU A 70 -6.339 4.369 -4.368 1.00 0.00 C ATOM 1071 CD2 LEU A 70 -5.876 2.267 -3.094 1.00 0.00 C ATOM 0 H LEU A 70 -6.100 1.836 -7.285 1.00 0.00 H new ATOM 0 HA LEU A 70 -6.448 0.221 -5.005 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -7.632 2.832 -5.974 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -8.115 2.126 -4.445 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.218 2.699 -5.076 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -5.485 4.835 -3.876 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -6.456 4.789 -5.367 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -7.241 4.559 -3.787 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -5.028 2.762 -2.619 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -6.767 2.405 -2.481 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.666 1.202 -3.193 1.00 0.00 H new ATOM 1083 N TYR A 71 -8.822 -0.637 -4.925 1.00 0.00 N ATOM 1084 CA TYR A 71 -10.076 -1.376 -5.012 1.00 0.00 C ATOM 1085 C TYR A 71 -11.231 -0.448 -5.375 1.00 0.00 C ATOM 1086 O TYR A 71 -12.055 -0.770 -6.230 1.00 0.00 O ATOM 1087 CB TYR A 71 -10.371 -2.080 -3.686 1.00 0.00 C ATOM 1088 CG TYR A 71 -11.820 -2.477 -3.520 1.00 0.00 C ATOM 1089 CD1 TYR A 71 -12.324 -3.615 -4.139 1.00 0.00 C ATOM 1090 CD2 TYR A 71 -12.685 -1.716 -2.744 1.00 0.00 C ATOM 1091 CE1 TYR A 71 -13.648 -3.981 -3.990 1.00 0.00 C ATOM 1092 CE2 TYR A 71 -14.010 -2.075 -2.589 1.00 0.00 C ATOM 1093 CZ TYR A 71 -14.487 -3.208 -3.214 1.00 0.00 C ATOM 1094 OH TYR A 71 -15.805 -3.570 -3.063 1.00 0.00 O ATOM 0 H TYR A 71 -8.349 -0.713 -4.025 1.00 0.00 H new ATOM 0 HA TYR A 71 -9.973 -2.124 -5.798 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -9.748 -2.971 -3.611 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -10.087 -1.423 -2.864 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -11.670 -4.223 -4.746 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -12.315 -0.828 -2.253 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -14.024 -4.868 -4.478 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -14.669 -1.472 -1.982 1.00 0.00 H new ATOM 0 HH TYR A 71 -16.258 -2.921 -2.485 1.00 0.00 H new ATOM 1104 N ASN A 72 -11.283 0.707 -4.719 1.00 0.00 N ATOM 1105 CA ASN A 72 -12.336 1.683 -4.972 1.00 0.00 C ATOM 1106 C ASN A 72 -11.770 3.099 -5.002 1.00 0.00 C ATOM 1107 O ASN A 72 -10.576 3.305 -4.786 1.00 0.00 O ATOM 1108 CB ASN A 72 -13.424 1.580 -3.901 1.00 0.00 C ATOM 1109 CG ASN A 72 -14.725 2.228 -4.334 1.00 0.00 C ATOM 1110 OD1 ASN A 72 -14.916 2.538 -5.510 1.00 0.00 O ATOM 1111 ND2 ASN A 72 -15.627 2.437 -3.382 1.00 0.00 N ATOM 0 H ASN A 72 -10.608 0.990 -4.008 1.00 0.00 H new ATOM 0 HA ASN A 72 -12.772 1.464 -5.947 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -13.604 0.530 -3.669 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -13.073 2.053 -2.984 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -16.521 2.871 -3.613 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -15.426 2.164 -2.420 1.00 0.00 H new ATOM 1118 N GLU A 73 -12.635 4.072 -5.269 1.00 0.00 N ATOM 1119 CA GLU A 73 -12.220 5.469 -5.327 1.00 0.00 C ATOM 1120 C GLU A 73 -11.975 6.022 -3.926 1.00 0.00 C ATOM 1121 O GLU A 73 -12.707 5.711 -2.987 1.00 0.00 O ATOM 1122 CB GLU A 73 -13.281 6.310 -6.041 1.00 0.00 C ATOM 1123 CG GLU A 73 -13.217 6.211 -7.556 1.00 0.00 C ATOM 1124 CD GLU A 73 -13.944 7.349 -8.246 1.00 0.00 C ATOM 1125 OE1 GLU A 73 -13.317 8.404 -8.473 1.00 0.00 O ATOM 1126 OE2 GLU A 73 -15.142 7.183 -8.558 1.00 0.00 O ATOM 0 H GLU A 73 -13.627 3.919 -5.449 1.00 0.00 H new ATOM 0 HA GLU A 73 -11.287 5.522 -5.888 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -14.269 5.994 -5.706 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -13.163 7.353 -5.748 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -12.174 6.206 -7.872 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -13.651 5.263 -7.873 1.00 0.00 H new ATOM 1133 N VAL A 74 -10.939 6.844 -3.794 1.00 0.00 N ATOM 1134 CA VAL A 74 -10.596 7.441 -2.509 1.00 0.00 C ATOM 1135 C VAL A 74 -10.289 8.927 -2.658 1.00 0.00 C ATOM 1136 O VAL A 74 -9.445 9.320 -3.464 1.00 0.00 O ATOM 1137 CB VAL A 74 -9.384 6.739 -1.869 1.00 0.00 C ATOM 1138 CG1 VAL A 74 -9.657 5.253 -1.697 1.00 0.00 C ATOM 1139 CG2 VAL A 74 -8.134 6.967 -2.706 1.00 0.00 C ATOM 0 H VAL A 74 -10.323 7.112 -4.561 1.00 0.00 H new ATOM 0 HA VAL A 74 -11.463 7.315 -1.860 1.00 0.00 H new ATOM 0 HB VAL A 74 -9.216 7.169 -0.882 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -8.789 4.774 -1.243 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -10.526 5.115 -1.053 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -9.852 4.804 -2.671 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -7.287 6.464 -2.239 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -8.288 6.565 -3.707 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -7.930 8.036 -2.772 1.00 0.00 H new ATOM 1149 N LYS A 75 -10.979 9.750 -1.875 1.00 0.00 N ATOM 1150 CA LYS A 75 -10.780 11.194 -1.918 1.00 0.00 C ATOM 1151 C LYS A 75 -9.294 11.538 -1.923 1.00 0.00 C ATOM 1152 O LYS A 75 -8.665 11.637 -0.869 1.00 0.00 O ATOM 1153 CB LYS A 75 -11.464 11.859 -0.722 1.00 0.00 C ATOM 1154 CG LYS A 75 -11.983 13.255 -1.017 1.00 0.00 C ATOM 1155 CD LYS A 75 -13.155 13.616 -0.120 1.00 0.00 C ATOM 1156 CE LYS A 75 -13.621 15.044 -0.359 1.00 0.00 C ATOM 1157 NZ LYS A 75 -12.873 16.020 0.481 1.00 0.00 N ATOM 0 H LYS A 75 -11.681 9.441 -1.203 1.00 0.00 H new ATOM 0 HA LYS A 75 -11.225 11.570 -2.839 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -12.295 11.233 -0.395 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -10.758 11.911 0.107 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -11.181 13.979 -0.878 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -12.290 13.317 -2.061 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -13.980 12.928 -0.303 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -12.866 13.497 0.924 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -13.492 15.297 -1.411 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -14.686 15.119 -0.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -13.243 16.977 0.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -12.989 15.774 1.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -11.864 15.991 0.232 1.00 0.00 H new ATOM 1171 N VAL A 76 -8.737 11.721 -3.116 1.00 0.00 N ATOM 1172 CA VAL A 76 -7.326 12.057 -3.258 1.00 0.00 C ATOM 1173 C VAL A 76 -7.055 13.491 -2.815 1.00 0.00 C ATOM 1174 O VAL A 76 -5.979 13.799 -2.303 1.00 0.00 O ATOM 1175 CB VAL A 76 -6.851 11.883 -4.713 1.00 0.00 C ATOM 1176 CG1 VAL A 76 -7.654 12.775 -5.648 1.00 0.00 C ATOM 1177 CG2 VAL A 76 -5.363 12.181 -4.827 1.00 0.00 C ATOM 0 H VAL A 76 -9.242 11.642 -3.999 1.00 0.00 H new ATOM 0 HA VAL A 76 -6.772 11.371 -2.618 1.00 0.00 H new ATOM 0 HB VAL A 76 -7.015 10.847 -5.008 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -7.304 12.638 -6.671 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -8.709 12.509 -5.587 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -7.525 13.817 -5.357 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -5.045 12.053 -5.862 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -5.172 13.207 -4.513 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -4.805 11.496 -4.188 1.00 0.00 H new ATOM 1187 N GLU A 77 -8.038 14.362 -3.016 1.00 0.00 N ATOM 1188 CA GLU A 77 -7.905 15.764 -2.636 1.00 0.00 C ATOM 1189 C GLU A 77 -7.695 15.903 -1.131 1.00 0.00 C ATOM 1190 O GLU A 77 -7.107 16.878 -0.664 1.00 0.00 O ATOM 1191 CB GLU A 77 -9.145 16.551 -3.064 1.00 0.00 C ATOM 1192 CG GLU A 77 -9.407 16.509 -4.560 1.00 0.00 C ATOM 1193 CD GLU A 77 -10.257 17.671 -5.036 1.00 0.00 C ATOM 1194 OE1 GLU A 77 -9.842 18.832 -4.833 1.00 0.00 O ATOM 1195 OE2 GLU A 77 -11.336 17.421 -5.612 1.00 0.00 O ATOM 0 H GLU A 77 -8.935 14.122 -3.439 1.00 0.00 H new ATOM 0 HA GLU A 77 -7.032 16.170 -3.146 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -10.015 16.155 -2.540 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -9.031 17.589 -2.753 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -8.456 16.518 -5.092 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -9.905 15.572 -4.812 1.00 0.00 H new ATOM 1202 N GLU A 78 -8.180 14.920 -0.379 1.00 0.00 N ATOM 1203 CA GLU A 78 -8.047 14.934 1.073 1.00 0.00 C ATOM 1204 C GLU A 78 -6.967 13.957 1.529 1.00 0.00 C ATOM 1205 O GLU A 78 -6.204 14.245 2.452 1.00 0.00 O ATOM 1206 CB GLU A 78 -9.381 14.581 1.734 1.00 0.00 C ATOM 1207 CG GLU A 78 -10.253 15.790 2.029 1.00 0.00 C ATOM 1208 CD GLU A 78 -9.780 16.569 3.240 1.00 0.00 C ATOM 1209 OE1 GLU A 78 -9.287 15.935 4.197 1.00 0.00 O ATOM 1210 OE2 GLU A 78 -9.901 17.811 3.232 1.00 0.00 O ATOM 0 H GLU A 78 -8.668 14.105 -0.751 1.00 0.00 H new ATOM 0 HA GLU A 78 -7.755 15.940 1.376 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -9.929 13.898 1.085 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -9.186 14.048 2.665 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -10.262 16.447 1.160 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -11.280 15.462 2.191 1.00 0.00 H new ATOM 1217 N SER A 79 -6.909 12.801 0.876 1.00 0.00 N ATOM 1218 CA SER A 79 -5.926 11.779 1.217 1.00 0.00 C ATOM 1219 C SER A 79 -4.553 12.402 1.449 1.00 0.00 C ATOM 1220 O SER A 79 -4.207 13.413 0.838 1.00 0.00 O ATOM 1221 CB SER A 79 -5.842 10.731 0.105 1.00 0.00 C ATOM 1222 OG SER A 79 -6.895 9.789 0.212 1.00 0.00 O ATOM 0 H SER A 79 -7.531 12.549 0.108 1.00 0.00 H new ATOM 0 HA SER A 79 -6.247 11.295 2.139 1.00 0.00 H new ATOM 0 HB2 SER A 79 -5.887 11.223 -0.867 1.00 0.00 H new ATOM 0 HB3 SER A 79 -4.883 10.216 0.158 1.00 0.00 H new ATOM 0 HG SER A 79 -7.722 10.182 -0.136 1.00 0.00 H new ATOM 1228 N SER A 80 -3.774 11.790 2.336 1.00 0.00 N ATOM 1229 CA SER A 80 -2.440 12.286 2.652 1.00 0.00 C ATOM 1230 C SER A 80 -1.635 11.234 3.410 1.00 0.00 C ATOM 1231 O SER A 80 -2.199 10.368 4.078 1.00 0.00 O ATOM 1232 CB SER A 80 -2.533 13.568 3.482 1.00 0.00 C ATOM 1233 OG SER A 80 -2.919 13.286 4.816 1.00 0.00 O ATOM 0 H SER A 80 -4.044 10.950 2.848 1.00 0.00 H new ATOM 0 HA SER A 80 -1.929 12.504 1.714 1.00 0.00 H new ATOM 0 HB2 SER A 80 -1.569 14.077 3.479 1.00 0.00 H new ATOM 0 HB3 SER A 80 -3.254 14.247 3.028 1.00 0.00 H new ATOM 0 HG SER A 80 -2.969 14.122 5.326 1.00 0.00 H new ATOM 1239 N TRP A 81 -0.314 11.317 3.299 1.00 0.00 N ATOM 1240 CA TRP A 81 0.569 10.372 3.973 1.00 0.00 C ATOM 1241 C TRP A 81 1.597 11.104 4.829 1.00 0.00 C ATOM 1242 O TRP A 81 1.771 12.317 4.706 1.00 0.00 O ATOM 1243 CB TRP A 81 1.279 9.486 2.948 1.00 0.00 C ATOM 1244 CG TRP A 81 2.176 10.250 2.022 1.00 0.00 C ATOM 1245 CD1 TRP A 81 1.803 10.936 0.901 1.00 0.00 C ATOM 1246 CD2 TRP A 81 3.595 10.404 2.136 1.00 0.00 C ATOM 1247 NE1 TRP A 81 2.905 11.508 0.311 1.00 0.00 N ATOM 1248 CE2 TRP A 81 4.016 11.197 1.050 1.00 0.00 C ATOM 1249 CE3 TRP A 81 4.550 9.952 3.050 1.00 0.00 C ATOM 1250 CZ2 TRP A 81 5.351 11.544 0.856 1.00 0.00 C ATOM 1251 CZ3 TRP A 81 5.874 10.297 2.856 1.00 0.00 C ATOM 1252 CH2 TRP A 81 6.264 11.087 1.766 1.00 0.00 C ATOM 0 H TRP A 81 0.169 12.028 2.749 1.00 0.00 H new ATOM 0 HA TRP A 81 -0.040 9.745 4.625 1.00 0.00 H new ATOM 0 HB2 TRP A 81 1.867 8.734 3.474 1.00 0.00 H new ATOM 0 HB3 TRP A 81 0.532 8.952 2.360 1.00 0.00 H new ATOM 0 HD1 TRP A 81 0.791 11.017 0.532 1.00 0.00 H new ATOM 0 HE1 TRP A 81 2.897 12.072 -0.539 1.00 0.00 H new ATOM 0 HE3 TRP A 81 4.259 9.344 3.893 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 5.654 12.152 0.017 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 6.621 9.952 3.556 1.00 0.00 H new ATOM 0 HH2 TRP A 81 7.307 11.340 1.642 1.00 0.00 H new ATOM 1263 N LEU A 82 2.276 10.360 5.695 1.00 0.00 N ATOM 1264 CA LEU A 82 3.288 10.939 6.573 1.00 0.00 C ATOM 1265 C LEU A 82 4.337 9.900 6.953 1.00 0.00 C ATOM 1266 O LEU A 82 4.120 8.698 6.797 1.00 0.00 O ATOM 1267 CB LEU A 82 2.634 11.506 7.834 1.00 0.00 C ATOM 1268 CG LEU A 82 2.286 10.491 8.924 1.00 0.00 C ATOM 1269 CD1 LEU A 82 3.480 10.260 9.837 1.00 0.00 C ATOM 1270 CD2 LEU A 82 1.082 10.961 9.726 1.00 0.00 C ATOM 0 H LEU A 82 2.145 9.355 5.808 1.00 0.00 H new ATOM 0 HA LEU A 82 3.782 11.747 6.034 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.303 12.253 8.261 1.00 0.00 H new ATOM 0 HB3 LEU A 82 1.720 12.025 7.543 1.00 0.00 H new ATOM 0 HG LEU A 82 2.031 9.545 8.446 1.00 0.00 H new ATOM 0 HD11 LEU A 82 3.215 9.535 10.607 1.00 0.00 H new ATOM 0 HD12 LEU A 82 4.317 9.878 9.252 1.00 0.00 H new ATOM 0 HD13 LEU A 82 3.766 11.201 10.308 1.00 0.00 H new ATOM 0 HD21 LEU A 82 0.849 10.226 10.497 1.00 0.00 H new ATOM 0 HD22 LEU A 82 1.308 11.919 10.194 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.225 11.075 9.062 1.00 0.00 H new ATOM 1282 N ILE A 83 5.474 10.371 7.455 1.00 0.00 N ATOM 1283 CA ILE A 83 6.555 9.482 7.861 1.00 0.00 C ATOM 1284 C ILE A 83 6.488 9.181 9.355 1.00 0.00 C ATOM 1285 O ILE A 83 6.386 10.091 10.176 1.00 0.00 O ATOM 1286 CB ILE A 83 7.934 10.086 7.532 1.00 0.00 C ATOM 1287 CG1 ILE A 83 8.107 10.220 6.018 1.00 0.00 C ATOM 1288 CG2 ILE A 83 9.042 9.228 8.124 1.00 0.00 C ATOM 1289 CD1 ILE A 83 9.205 11.181 5.618 1.00 0.00 C ATOM 0 H ILE A 83 5.670 11.363 7.590 1.00 0.00 H new ATOM 0 HA ILE A 83 6.429 8.556 7.300 1.00 0.00 H new ATOM 0 HB ILE A 83 7.995 11.080 7.975 1.00 0.00 H new ATOM 0 HG12 ILE A 83 8.323 9.238 5.597 1.00 0.00 H new ATOM 0 HG13 ILE A 83 7.166 10.554 5.581 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.010 9.667 7.883 1.00 0.00 H new ATOM 0 HG22 ILE A 83 8.925 9.179 9.207 1.00 0.00 H new ATOM 0 HG23 ILE A 83 8.986 8.223 7.707 1.00 0.00 H new ATOM 0 HD11 ILE A 83 9.271 11.226 4.531 1.00 0.00 H new ATOM 0 HD12 ILE A 83 8.980 12.173 6.009 1.00 0.00 H new ATOM 0 HD13 ILE A 83 10.156 10.837 6.025 1.00 0.00 H new ATOM 1301 N GLU A 84 6.548 7.898 9.698 1.00 0.00 N ATOM 1302 CA GLU A 84 6.495 7.478 11.093 1.00 0.00 C ATOM 1303 C GLU A 84 7.875 7.050 11.585 1.00 0.00 C ATOM 1304 O GLU A 84 8.483 6.130 11.038 1.00 0.00 O ATOM 1305 CB GLU A 84 5.501 6.328 11.265 1.00 0.00 C ATOM 1306 CG GLU A 84 4.082 6.788 11.555 1.00 0.00 C ATOM 1307 CD GLU A 84 3.980 7.591 12.837 1.00 0.00 C ATOM 1308 OE1 GLU A 84 3.989 6.977 13.924 1.00 0.00 O ATOM 1309 OE2 GLU A 84 3.890 8.834 12.753 1.00 0.00 O ATOM 0 H GLU A 84 6.633 7.132 9.029 1.00 0.00 H new ATOM 0 HA GLU A 84 6.163 8.328 11.689 1.00 0.00 H new ATOM 0 HB2 GLU A 84 5.499 5.722 10.359 1.00 0.00 H new ATOM 0 HB3 GLU A 84 5.839 5.685 12.078 1.00 0.00 H new ATOM 0 HG2 GLU A 84 3.723 7.393 10.722 1.00 0.00 H new ATOM 0 HG3 GLU A 84 3.429 5.918 11.623 1.00 0.00 H new ATOM 1316 N ASP A 85 8.362 7.724 12.621 1.00 0.00 N ATOM 1317 CA ASP A 85 9.669 7.414 13.188 1.00 0.00 C ATOM 1318 C ASP A 85 10.717 7.267 12.089 1.00 0.00 C ATOM 1319 O ASP A 85 11.604 6.418 12.172 1.00 0.00 O ATOM 1320 CB ASP A 85 9.598 6.131 14.017 1.00 0.00 C ATOM 1321 CG ASP A 85 9.036 6.369 15.405 1.00 0.00 C ATOM 1322 OD1 ASP A 85 9.817 6.737 16.307 1.00 0.00 O ATOM 1323 OD2 ASP A 85 7.814 6.189 15.588 1.00 0.00 O ATOM 0 H ASP A 85 7.871 8.488 13.085 1.00 0.00 H new ATOM 0 HA ASP A 85 9.962 8.240 13.836 1.00 0.00 H new ATOM 0 HB2 ASP A 85 8.978 5.400 13.498 1.00 0.00 H new ATOM 0 HB3 ASP A 85 10.596 5.700 14.101 1.00 0.00 H new ATOM 1328 N GLY A 86 10.608 8.100 11.058 1.00 0.00 N ATOM 1329 CA GLY A 86 11.552 8.045 9.957 1.00 0.00 C ATOM 1330 C GLY A 86 11.945 6.626 9.601 1.00 0.00 C ATOM 1331 O GLY A 86 13.027 6.389 9.064 1.00 0.00 O ATOM 0 H GLY A 86 9.883 8.812 10.966 1.00 0.00 H new ATOM 0 HA2 GLY A 86 11.115 8.528 9.083 1.00 0.00 H new ATOM 0 HA3 GLY A 86 12.446 8.611 10.220 1.00 0.00 H new ATOM 1335 N LYS A 87 11.065 5.676 9.901 1.00 0.00 N ATOM 1336 CA LYS A 87 11.325 4.272 9.610 1.00 0.00 C ATOM 1337 C LYS A 87 10.166 3.653 8.835 1.00 0.00 C ATOM 1338 O LYS A 87 10.352 2.706 8.071 1.00 0.00 O ATOM 1339 CB LYS A 87 11.556 3.495 10.908 1.00 0.00 C ATOM 1340 CG LYS A 87 10.375 3.540 11.863 1.00 0.00 C ATOM 1341 CD LYS A 87 10.279 2.270 12.691 1.00 0.00 C ATOM 1342 CE LYS A 87 11.215 2.314 13.889 1.00 0.00 C ATOM 1343 NZ LYS A 87 11.455 0.957 14.455 1.00 0.00 N ATOM 0 H LYS A 87 10.165 5.854 10.346 1.00 0.00 H new ATOM 0 HA LYS A 87 12.223 4.215 8.994 1.00 0.00 H new ATOM 0 HB2 LYS A 87 11.776 2.456 10.665 1.00 0.00 H new ATOM 0 HB3 LYS A 87 12.435 3.898 11.411 1.00 0.00 H new ATOM 0 HG2 LYS A 87 10.474 4.400 12.525 1.00 0.00 H new ATOM 0 HG3 LYS A 87 9.453 3.677 11.297 1.00 0.00 H new ATOM 0 HD2 LYS A 87 9.253 2.135 13.034 1.00 0.00 H new ATOM 0 HD3 LYS A 87 10.523 1.409 12.069 1.00 0.00 H new ATOM 0 HE2 LYS A 87 12.166 2.757 13.591 1.00 0.00 H new ATOM 0 HE3 LYS A 87 10.790 2.959 14.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 12.098 1.029 15.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 10.551 0.544 14.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 11.884 0.349 13.729 1.00 0.00 H new ATOM 1357 N VAL A 88 8.969 4.197 9.035 1.00 0.00 N ATOM 1358 CA VAL A 88 7.780 3.700 8.352 1.00 0.00 C ATOM 1359 C VAL A 88 7.084 4.815 7.580 1.00 0.00 C ATOM 1360 O VAL A 88 7.281 5.997 7.862 1.00 0.00 O ATOM 1361 CB VAL A 88 6.782 3.077 9.346 1.00 0.00 C ATOM 1362 CG1 VAL A 88 5.571 2.524 8.610 1.00 0.00 C ATOM 1363 CG2 VAL A 88 7.458 1.991 10.169 1.00 0.00 C ATOM 0 H VAL A 88 8.797 4.981 9.664 1.00 0.00 H new ATOM 0 HA VAL A 88 8.113 2.932 7.654 1.00 0.00 H new ATOM 0 HB VAL A 88 6.439 3.856 10.027 1.00 0.00 H new ATOM 0 HG11 VAL A 88 4.877 2.088 9.328 1.00 0.00 H new ATOM 0 HG12 VAL A 88 5.075 3.330 8.069 1.00 0.00 H new ATOM 0 HG13 VAL A 88 5.893 1.758 7.905 1.00 0.00 H new ATOM 0 HG21 VAL A 88 6.738 1.562 10.866 1.00 0.00 H new ATOM 0 HG22 VAL A 88 7.831 1.211 9.506 1.00 0.00 H new ATOM 0 HG23 VAL A 88 8.290 2.422 10.726 1.00 0.00 H new ATOM 1373 N VAL A 89 6.266 4.431 6.605 1.00 0.00 N ATOM 1374 CA VAL A 89 5.538 5.398 5.792 1.00 0.00 C ATOM 1375 C VAL A 89 4.046 5.085 5.772 1.00 0.00 C ATOM 1376 O VAL A 89 3.599 4.179 5.068 1.00 0.00 O ATOM 1377 CB VAL A 89 6.066 5.426 4.346 1.00 0.00 C ATOM 1378 CG1 VAL A 89 5.139 6.239 3.455 1.00 0.00 C ATOM 1379 CG2 VAL A 89 7.481 5.983 4.306 1.00 0.00 C ATOM 0 H VAL A 89 6.091 3.457 6.359 1.00 0.00 H new ATOM 0 HA VAL A 89 5.695 6.376 6.246 1.00 0.00 H new ATOM 0 HB VAL A 89 6.092 4.404 3.967 1.00 0.00 H new ATOM 0 HG11 VAL A 89 5.528 6.248 2.437 1.00 0.00 H new ATOM 0 HG12 VAL A 89 4.145 5.792 3.460 1.00 0.00 H new ATOM 0 HG13 VAL A 89 5.079 7.261 3.829 1.00 0.00 H new ATOM 0 HG21 VAL A 89 7.838 5.995 3.276 1.00 0.00 H new ATOM 0 HG22 VAL A 89 7.484 6.998 4.703 1.00 0.00 H new ATOM 0 HG23 VAL A 89 8.136 5.355 4.910 1.00 0.00 H new ATOM 1389 N THR A 90 3.277 5.843 6.548 1.00 0.00 N ATOM 1390 CA THR A 90 1.835 5.647 6.620 1.00 0.00 C ATOM 1391 C THR A 90 1.111 6.507 5.591 1.00 0.00 C ATOM 1392 O THR A 90 1.500 7.647 5.336 1.00 0.00 O ATOM 1393 CB THR A 90 1.292 5.979 8.023 1.00 0.00 C ATOM 1394 OG1 THR A 90 1.554 7.351 8.337 1.00 0.00 O ATOM 1395 CG2 THR A 90 1.926 5.082 9.075 1.00 0.00 C ATOM 0 H THR A 90 3.630 6.599 7.136 1.00 0.00 H new ATOM 0 HA THR A 90 1.648 4.595 6.406 1.00 0.00 H new ATOM 0 HB THR A 90 0.216 5.806 8.023 1.00 0.00 H new ATOM 0 HG1 THR A 90 1.205 7.555 9.230 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.527 5.335 10.057 1.00 0.00 H new ATOM 0 HG22 THR A 90 1.700 4.040 8.849 1.00 0.00 H new ATOM 0 HG23 THR A 90 3.006 5.227 9.074 1.00 0.00 H new ATOM 1403 N VAL A 91 0.056 5.954 5.001 1.00 0.00 N ATOM 1404 CA VAL A 91 -0.723 6.672 3.999 1.00 0.00 C ATOM 1405 C VAL A 91 -2.214 6.602 4.310 1.00 0.00 C ATOM 1406 O VAL A 91 -2.823 5.533 4.247 1.00 0.00 O ATOM 1407 CB VAL A 91 -0.477 6.109 2.587 1.00 0.00 C ATOM 1408 CG1 VAL A 91 -1.227 6.929 1.547 1.00 0.00 C ATOM 1409 CG2 VAL A 91 1.012 6.077 2.279 1.00 0.00 C ATOM 0 H VAL A 91 -0.279 5.011 5.200 1.00 0.00 H new ATOM 0 HA VAL A 91 -0.396 7.712 4.029 1.00 0.00 H new ATOM 0 HB VAL A 91 -0.855 5.087 2.551 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -1.041 6.516 0.555 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -2.296 6.896 1.759 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -0.882 7.962 1.580 1.00 0.00 H new ATOM 0 HG21 VAL A 91 1.168 5.676 1.277 1.00 0.00 H new ATOM 0 HG22 VAL A 91 1.416 7.088 2.333 1.00 0.00 H new ATOM 0 HG23 VAL A 91 1.520 5.444 3.006 1.00 0.00 H new ATOM 1419 N HIS A 92 -2.798 7.748 4.645 1.00 0.00 N ATOM 1420 CA HIS A 92 -4.220 7.818 4.965 1.00 0.00 C ATOM 1421 C HIS A 92 -5.054 7.975 3.697 1.00 0.00 C ATOM 1422 O HIS A 92 -4.860 8.915 2.926 1.00 0.00 O ATOM 1423 CB HIS A 92 -4.494 8.982 5.917 1.00 0.00 C ATOM 1424 CG HIS A 92 -5.940 9.362 5.998 1.00 0.00 C ATOM 1425 ND1 HIS A 92 -6.708 9.165 7.127 1.00 0.00 N ATOM 1426 CD2 HIS A 92 -6.759 9.931 5.083 1.00 0.00 C ATOM 1427 CE1 HIS A 92 -7.936 9.595 6.902 1.00 0.00 C ATOM 1428 NE2 HIS A 92 -7.993 10.066 5.669 1.00 0.00 N ATOM 0 H HIS A 92 -2.309 8.641 4.702 1.00 0.00 H new ATOM 0 HA HIS A 92 -4.504 6.886 5.453 1.00 0.00 H new ATOM 0 HB2 HIS A 92 -4.140 8.717 6.913 1.00 0.00 H new ATOM 0 HB3 HIS A 92 -3.917 9.848 5.594 1.00 0.00 H new ATOM 0 HD2 HIS A 92 -6.491 10.224 4.079 1.00 0.00 H new ATOM 0 HE1 HIS A 92 -8.754 9.567 7.606 1.00 0.00 H new ATOM 0 HE2 HIS A 92 -8.820 10.465 5.225 1.00 0.00 H new ATOM 1437 N LEU A 93 -5.983 7.048 3.488 1.00 0.00 N ATOM 1438 CA LEU A 93 -6.847 7.083 2.313 1.00 0.00 C ATOM 1439 C LEU A 93 -8.306 7.278 2.716 1.00 0.00 C ATOM 1440 O LEU A 93 -8.874 6.462 3.440 1.00 0.00 O ATOM 1441 CB LEU A 93 -6.698 5.792 1.507 1.00 0.00 C ATOM 1442 CG LEU A 93 -5.385 5.628 0.739 1.00 0.00 C ATOM 1443 CD1 LEU A 93 -5.198 4.183 0.304 1.00 0.00 C ATOM 1444 CD2 LEU A 93 -5.352 6.558 -0.465 1.00 0.00 C ATOM 0 H LEU A 93 -6.157 6.264 4.116 1.00 0.00 H new ATOM 0 HA LEU A 93 -6.543 7.927 1.694 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -6.805 4.948 2.188 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -7.522 5.734 0.795 1.00 0.00 H new ATOM 0 HG LEU A 93 -4.562 5.895 1.402 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -4.259 4.086 -0.241 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -5.176 3.538 1.183 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -6.025 3.888 -0.342 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -4.411 6.428 -1.000 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -6.183 6.322 -1.130 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -5.439 7.591 -0.129 1.00 0.00 H new ATOM 1456 N GLU A 94 -8.905 8.365 2.239 1.00 0.00 N ATOM 1457 CA GLU A 94 -10.298 8.666 2.549 1.00 0.00 C ATOM 1458 C GLU A 94 -11.239 7.919 1.608 1.00 0.00 C ATOM 1459 O GLU A 94 -11.171 8.078 0.389 1.00 0.00 O ATOM 1460 CB GLU A 94 -10.552 10.172 2.452 1.00 0.00 C ATOM 1461 CG GLU A 94 -11.954 10.581 2.871 1.00 0.00 C ATOM 1462 CD GLU A 94 -12.396 9.916 4.159 1.00 0.00 C ATOM 1463 OE1 GLU A 94 -11.615 9.932 5.134 1.00 0.00 O ATOM 1464 OE2 GLU A 94 -13.523 9.379 4.193 1.00 0.00 O ATOM 0 H GLU A 94 -8.448 9.051 1.638 1.00 0.00 H new ATOM 0 HA GLU A 94 -10.495 8.337 3.569 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -9.828 10.695 3.077 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -10.380 10.496 1.426 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -11.991 11.663 2.994 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -12.655 10.327 2.076 1.00 0.00 H new ATOM 1471 N LYS A 95 -12.115 7.102 2.182 1.00 0.00 N ATOM 1472 CA LYS A 95 -13.071 6.330 1.397 1.00 0.00 C ATOM 1473 C LYS A 95 -14.219 7.211 0.917 1.00 0.00 C ATOM 1474 O LYS A 95 -14.989 7.736 1.723 1.00 0.00 O ATOM 1475 CB LYS A 95 -13.619 5.165 2.224 1.00 0.00 C ATOM 1476 CG LYS A 95 -12.696 3.959 2.263 1.00 0.00 C ATOM 1477 CD LYS A 95 -13.399 2.736 2.828 1.00 0.00 C ATOM 1478 CE LYS A 95 -12.405 1.726 3.378 1.00 0.00 C ATOM 1479 NZ LYS A 95 -13.087 0.563 4.010 1.00 0.00 N ATOM 0 H LYS A 95 -12.183 6.957 3.189 1.00 0.00 H new ATOM 0 HA LYS A 95 -12.551 5.935 0.524 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -13.799 5.507 3.243 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -14.583 4.861 1.815 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -12.338 3.741 1.257 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -11.821 4.189 2.870 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -14.084 3.042 3.619 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -14.001 2.268 2.049 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -11.761 1.375 2.572 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -11.762 2.212 4.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -12.578 -0.311 3.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -13.095 0.685 5.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -14.065 0.502 3.661 1.00 0.00 H new ATOM 1493 N ILE A 96 -14.329 7.369 -0.397 1.00 0.00 N ATOM 1494 CA ILE A 96 -15.386 8.185 -0.983 1.00 0.00 C ATOM 1495 C ILE A 96 -16.729 7.904 -0.318 1.00 0.00 C ATOM 1496 O ILE A 96 -17.501 8.822 -0.044 1.00 0.00 O ATOM 1497 CB ILE A 96 -15.514 7.937 -2.497 1.00 0.00 C ATOM 1498 CG1 ILE A 96 -14.229 8.355 -3.215 1.00 0.00 C ATOM 1499 CG2 ILE A 96 -16.710 8.693 -3.058 1.00 0.00 C ATOM 1500 CD1 ILE A 96 -14.032 9.853 -3.279 1.00 0.00 C ATOM 0 H ILE A 96 -13.699 6.943 -1.077 1.00 0.00 H new ATOM 0 HA ILE A 96 -15.111 9.226 -0.816 1.00 0.00 H new ATOM 0 HB ILE A 96 -15.671 6.871 -2.664 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -13.376 7.906 -2.706 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -14.242 7.955 -4.229 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -16.788 8.508 -4.129 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -17.620 8.352 -2.564 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -16.580 9.761 -2.883 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -13.102 10.076 -3.801 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -14.866 10.307 -3.814 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -13.986 10.257 -2.268 1.00 0.00 H new ATOM 1512 N ASN A 97 -17.001 6.629 -0.059 1.00 0.00 N ATOM 1513 CA ASN A 97 -18.251 6.227 0.576 1.00 0.00 C ATOM 1514 C ASN A 97 -17.989 5.586 1.935 1.00 0.00 C ATOM 1515 O ASN A 97 -17.959 4.361 2.061 1.00 0.00 O ATOM 1516 CB ASN A 97 -19.013 5.251 -0.323 1.00 0.00 C ATOM 1517 CG ASN A 97 -19.882 5.962 -1.342 1.00 0.00 C ATOM 1518 OD1 ASN A 97 -20.390 7.054 -1.087 1.00 0.00 O ATOM 1519 ND2 ASN A 97 -20.057 5.344 -2.504 1.00 0.00 N ATOM 0 H ASN A 97 -16.372 5.856 -0.279 1.00 0.00 H new ATOM 0 HA ASN A 97 -18.857 7.120 0.727 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -18.302 4.608 -0.842 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -19.637 4.604 0.294 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -20.632 5.774 -3.229 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -19.617 4.439 -2.672 1.00 0.00 H new ATOM 1526 N LYS A 98 -17.801 6.421 2.951 1.00 0.00 N ATOM 1527 CA LYS A 98 -17.543 5.937 4.302 1.00 0.00 C ATOM 1528 C LYS A 98 -18.465 4.772 4.648 1.00 0.00 C ATOM 1529 O LYS A 98 -18.110 3.903 5.443 1.00 0.00 O ATOM 1530 CB LYS A 98 -17.732 7.069 5.316 1.00 0.00 C ATOM 1531 CG LYS A 98 -16.811 8.254 5.082 1.00 0.00 C ATOM 1532 CD LYS A 98 -16.911 9.268 6.209 1.00 0.00 C ATOM 1533 CE LYS A 98 -15.839 10.340 6.091 1.00 0.00 C ATOM 1534 NZ LYS A 98 -15.665 11.094 7.364 1.00 0.00 N ATOM 0 H LYS A 98 -17.822 7.437 2.864 1.00 0.00 H new ATOM 0 HA LYS A 98 -16.512 5.587 4.345 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -18.766 7.410 5.278 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -17.561 6.679 6.319 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -15.782 7.905 4.996 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -17.066 8.733 4.137 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -17.896 9.734 6.194 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -16.814 8.759 7.168 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -14.893 9.878 5.811 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -16.104 11.033 5.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -14.926 11.815 7.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -16.561 11.556 7.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -15.387 10.437 8.121 1.00 0.00 H new ATOM 1548 N MET A 99 -19.649 4.761 4.044 1.00 0.00 N ATOM 1549 CA MET A 99 -20.620 3.700 4.287 1.00 0.00 C ATOM 1550 C MET A 99 -20.336 2.490 3.403 1.00 0.00 C ATOM 1551 O MET A 99 -21.245 1.739 3.054 1.00 0.00 O ATOM 1552 CB MET A 99 -22.039 4.211 4.031 1.00 0.00 C ATOM 1553 CG MET A 99 -22.601 5.042 5.173 1.00 0.00 C ATOM 1554 SD MET A 99 -21.572 6.470 5.565 1.00 0.00 S ATOM 1555 CE MET A 99 -20.632 5.840 6.952 1.00 0.00 C ATOM 0 H MET A 99 -19.959 5.474 3.384 1.00 0.00 H new ATOM 0 HA MET A 99 -20.534 3.394 5.330 1.00 0.00 H new ATOM 0 HB2 MET A 99 -22.042 4.811 3.121 1.00 0.00 H new ATOM 0 HB3 MET A 99 -22.696 3.360 3.854 1.00 0.00 H new ATOM 0 HG2 MET A 99 -23.603 5.382 4.911 1.00 0.00 H new ATOM 0 HG3 MET A 99 -22.699 4.415 6.059 1.00 0.00 H new ATOM 0 HE1 MET A 99 -19.778 6.491 7.138 1.00 0.00 H new ATOM 0 HE2 MET A 99 -21.266 5.811 7.838 1.00 0.00 H new ATOM 0 HE3 MET A 99 -20.279 4.834 6.725 1.00 0.00 H new ATOM 1565 N GLU A 100 -19.068 2.309 3.046 1.00 0.00 N ATOM 1566 CA GLU A 100 -18.666 1.190 2.202 1.00 0.00 C ATOM 1567 C GLU A 100 -17.423 0.504 2.762 1.00 0.00 C ATOM 1568 O GLU A 100 -16.547 1.154 3.333 1.00 0.00 O ATOM 1569 CB GLU A 100 -18.396 1.670 0.774 1.00 0.00 C ATOM 1570 CG GLU A 100 -17.872 0.580 -0.146 1.00 0.00 C ATOM 1571 CD GLU A 100 -18.985 -0.209 -0.808 1.00 0.00 C ATOM 1572 OE1 GLU A 100 -19.627 0.332 -1.733 1.00 0.00 O ATOM 1573 OE2 GLU A 100 -19.213 -1.367 -0.402 1.00 0.00 O ATOM 0 H GLU A 100 -18.303 2.922 3.328 1.00 0.00 H new ATOM 0 HA GLU A 100 -19.483 0.469 2.187 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -19.317 2.075 0.356 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -17.674 2.486 0.804 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -17.243 1.030 -0.915 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -17.240 -0.100 0.425 1.00 0.00 H new ATOM 1580 N TRP A 101 -17.356 -0.812 2.597 1.00 0.00 N ATOM 1581 CA TRP A 101 -16.221 -1.586 3.087 1.00 0.00 C ATOM 1582 C TRP A 101 -15.269 -1.937 1.949 1.00 0.00 C ATOM 1583 O TRP A 101 -15.604 -1.775 0.775 1.00 0.00 O ATOM 1584 CB TRP A 101 -16.707 -2.863 3.773 1.00 0.00 C ATOM 1585 CG TRP A 101 -17.147 -2.646 5.189 1.00 0.00 C ATOM 1586 CD1 TRP A 101 -18.431 -2.593 5.650 1.00 0.00 C ATOM 1587 CD2 TRP A 101 -16.302 -2.451 6.328 1.00 0.00 C ATOM 1588 NE1 TRP A 101 -18.436 -2.377 7.007 1.00 0.00 N ATOM 1589 CE2 TRP A 101 -17.142 -2.287 7.447 1.00 0.00 C ATOM 1590 CE3 TRP A 101 -14.917 -2.401 6.513 1.00 0.00 C ATOM 1591 CZ2 TRP A 101 -16.641 -2.075 8.729 1.00 0.00 C ATOM 1592 CZ3 TRP A 101 -14.422 -2.190 7.785 1.00 0.00 C ATOM 1593 CH2 TRP A 101 -15.282 -2.030 8.880 1.00 0.00 C ATOM 0 H TRP A 101 -18.073 -1.365 2.128 1.00 0.00 H new ATOM 0 HA TRP A 101 -15.682 -0.975 3.811 1.00 0.00 H new ATOM 0 HB2 TRP A 101 -17.537 -3.280 3.202 1.00 0.00 H new ATOM 0 HB3 TRP A 101 -15.906 -3.602 3.758 1.00 0.00 H new ATOM 0 HD1 TRP A 101 -19.314 -2.705 5.038 1.00 0.00 H new ATOM 0 HE1 TRP A 101 -19.268 -2.297 7.592 1.00 0.00 H new ATOM 0 HE3 TRP A 101 -14.246 -2.525 5.676 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 -17.302 -1.951 9.574 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 -13.354 -2.148 7.939 1.00 0.00 H new ATOM 0 HH2 TRP A 101 -14.864 -1.868 9.862 1.00 0.00 H new ATOM 1604 N TRP A 102 -14.083 -2.418 2.302 1.00 0.00 N ATOM 1605 CA TRP A 102 -13.082 -2.792 1.309 1.00 0.00 C ATOM 1606 C TRP A 102 -12.674 -4.251 1.471 1.00 0.00 C ATOM 1607 O TRP A 102 -12.537 -4.747 2.589 1.00 0.00 O ATOM 1608 CB TRP A 102 -11.854 -1.889 1.428 1.00 0.00 C ATOM 1609 CG TRP A 102 -12.012 -0.574 0.725 1.00 0.00 C ATOM 1610 CD1 TRP A 102 -13.140 0.193 0.668 1.00 0.00 C ATOM 1611 CD2 TRP A 102 -11.010 0.125 -0.021 1.00 0.00 C ATOM 1612 NE1 TRP A 102 -12.900 1.328 -0.069 1.00 0.00 N ATOM 1613 CE2 TRP A 102 -11.600 1.310 -0.502 1.00 0.00 C ATOM 1614 CE3 TRP A 102 -9.672 -0.133 -0.328 1.00 0.00 C ATOM 1615 CZ2 TRP A 102 -10.897 2.231 -1.274 1.00 0.00 C ATOM 1616 CZ3 TRP A 102 -8.975 0.782 -1.094 1.00 0.00 C ATOM 1617 CH2 TRP A 102 -9.588 1.953 -1.559 1.00 0.00 C ATOM 0 H TRP A 102 -13.790 -2.558 3.269 1.00 0.00 H new ATOM 0 HA TRP A 102 -13.522 -2.666 0.320 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -11.647 -1.706 2.483 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -10.988 -2.410 1.019 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -14.082 -0.056 1.134 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -13.579 2.064 -0.262 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -9.190 -1.032 0.027 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -11.368 3.133 -1.635 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -7.940 0.591 -1.338 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -9.016 2.650 -2.154 1.00 0.00 H new ATOM 1628 N ASN A 103 -12.479 -4.935 0.348 1.00 0.00 N ATOM 1629 CA ASN A 103 -12.085 -6.339 0.366 1.00 0.00 C ATOM 1630 C ASN A 103 -10.568 -6.480 0.302 1.00 0.00 C ATOM 1631 O ASN A 103 -10.020 -7.545 0.588 1.00 0.00 O ATOM 1632 CB ASN A 103 -12.728 -7.086 -0.804 1.00 0.00 C ATOM 1633 CG ASN A 103 -12.633 -8.592 -0.652 1.00 0.00 C ATOM 1634 OD1 ASN A 103 -12.341 -9.100 0.431 1.00 0.00 O ATOM 1635 ND2 ASN A 103 -12.880 -9.313 -1.739 1.00 0.00 N ATOM 0 H ASN A 103 -12.587 -4.540 -0.586 1.00 0.00 H new ATOM 0 HA ASN A 103 -12.433 -6.776 1.302 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -13.776 -6.797 -0.884 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -12.243 -6.786 -1.733 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -12.831 -10.331 -1.698 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -13.118 -8.849 -2.616 1.00 0.00 H new ATOM 1642 N ARG A 104 -9.894 -5.398 -0.074 1.00 0.00 N ATOM 1643 CA ARG A 104 -8.440 -5.400 -0.176 1.00 0.00 C ATOM 1644 C ARG A 104 -7.908 -3.988 -0.399 1.00 0.00 C ATOM 1645 O ARG A 104 -8.674 -3.057 -0.655 1.00 0.00 O ATOM 1646 CB ARG A 104 -7.989 -6.313 -1.318 1.00 0.00 C ATOM 1647 CG ARG A 104 -8.308 -5.763 -2.699 1.00 0.00 C ATOM 1648 CD ARG A 104 -8.209 -6.843 -3.765 1.00 0.00 C ATOM 1649 NE ARG A 104 -8.677 -6.373 -5.066 1.00 0.00 N ATOM 1650 CZ ARG A 104 -8.960 -7.181 -6.081 1.00 0.00 C ATOM 1651 NH1 ARG A 104 -8.823 -8.493 -5.946 1.00 0.00 N ATOM 1652 NH2 ARG A 104 -9.380 -6.678 -7.234 1.00 0.00 N ATOM 0 H ARG A 104 -10.332 -4.508 -0.313 1.00 0.00 H new ATOM 0 HA ARG A 104 -8.036 -5.777 0.763 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -6.914 -6.475 -1.240 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -8.467 -7.286 -1.204 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -9.313 -5.340 -2.700 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -7.620 -4.952 -2.937 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -7.174 -7.174 -3.850 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -8.797 -7.709 -3.460 1.00 0.00 H new ATOM 0 HE ARG A 104 -8.793 -5.369 -5.203 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -8.500 -8.884 -5.061 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -9.041 -9.112 -6.727 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -9.486 -5.669 -7.342 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -9.597 -7.300 -8.013 1.00 0.00 H new ATOM 1666 N LEU A 105 -6.592 -3.834 -0.300 1.00 0.00 N ATOM 1667 CA LEU A 105 -5.957 -2.534 -0.490 1.00 0.00 C ATOM 1668 C LEU A 105 -5.828 -2.204 -1.974 1.00 0.00 C ATOM 1669 O LEU A 105 -6.210 -1.120 -2.415 1.00 0.00 O ATOM 1670 CB LEU A 105 -4.577 -2.517 0.170 1.00 0.00 C ATOM 1671 CG LEU A 105 -3.724 -1.275 -0.090 1.00 0.00 C ATOM 1672 CD1 LEU A 105 -4.363 -0.047 0.539 1.00 0.00 C ATOM 1673 CD2 LEU A 105 -2.313 -1.477 0.442 1.00 0.00 C ATOM 0 H LEU A 105 -5.944 -4.593 -0.089 1.00 0.00 H new ATOM 0 HA LEU A 105 -6.586 -1.777 -0.021 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -4.710 -2.623 1.247 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -4.023 -3.392 -0.170 1.00 0.00 H new ATOM 0 HG LEU A 105 -3.665 -1.116 -1.167 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -3.742 0.827 0.343 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -5.353 0.108 0.110 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -4.453 -0.195 1.615 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -1.720 -0.583 0.248 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -2.352 -1.661 1.516 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -1.855 -2.331 -0.056 1.00 0.00 H new ATOM 1685 N VAL A 106 -5.288 -3.146 -2.740 1.00 0.00 N ATOM 1686 CA VAL A 106 -5.111 -2.957 -4.175 1.00 0.00 C ATOM 1687 C VAL A 106 -5.510 -4.209 -4.948 1.00 0.00 C ATOM 1688 O VAL A 106 -5.940 -5.204 -4.363 1.00 0.00 O ATOM 1689 CB VAL A 106 -3.654 -2.597 -4.518 1.00 0.00 C ATOM 1690 CG1 VAL A 106 -3.322 -1.194 -4.035 1.00 0.00 C ATOM 1691 CG2 VAL A 106 -2.698 -3.617 -3.917 1.00 0.00 C ATOM 0 H VAL A 106 -4.965 -4.048 -2.391 1.00 0.00 H new ATOM 0 HA VAL A 106 -5.760 -2.131 -4.468 1.00 0.00 H new ATOM 0 HB VAL A 106 -3.538 -2.619 -5.602 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -2.288 -0.958 -4.287 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -3.986 -0.477 -4.517 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -3.454 -1.141 -2.954 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -1.672 -3.347 -4.169 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -2.814 -3.630 -2.833 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -2.922 -4.606 -4.317 1.00 0.00 H new ATOM 1701 N THR A 107 -5.364 -4.155 -6.268 1.00 0.00 N ATOM 1702 CA THR A 107 -5.709 -5.284 -7.123 1.00 0.00 C ATOM 1703 C THR A 107 -4.575 -6.301 -7.174 1.00 0.00 C ATOM 1704 O THR A 107 -4.414 -7.015 -8.164 1.00 0.00 O ATOM 1705 CB THR A 107 -6.037 -4.824 -8.556 1.00 0.00 C ATOM 1706 OG1 THR A 107 -4.949 -4.058 -9.086 1.00 0.00 O ATOM 1707 CG2 THR A 107 -7.309 -3.991 -8.580 1.00 0.00 C ATOM 0 H THR A 107 -5.009 -3.340 -6.769 1.00 0.00 H new ATOM 0 HA THR A 107 -6.593 -5.751 -6.689 1.00 0.00 H new ATOM 0 HB THR A 107 -6.191 -5.710 -9.172 1.00 0.00 H new ATOM 0 HG1 THR A 107 -5.165 -3.771 -9.998 1.00 0.00 H new ATOM 0 HG21 THR A 107 -7.520 -3.678 -9.603 1.00 0.00 H new ATOM 0 HG22 THR A 107 -8.141 -4.586 -8.204 1.00 0.00 H new ATOM 0 HG23 THR A 107 -7.179 -3.111 -7.951 1.00 0.00 H new ATOM 1715 N SER A 108 -3.793 -6.363 -6.102 1.00 0.00 N ATOM 1716 CA SER A 108 -2.671 -7.292 -6.026 1.00 0.00 C ATOM 1717 C SER A 108 -2.692 -8.063 -4.710 1.00 0.00 C ATOM 1718 O SER A 108 -2.477 -9.274 -4.684 1.00 0.00 O ATOM 1719 CB SER A 108 -1.347 -6.538 -6.168 1.00 0.00 C ATOM 1720 OG SER A 108 -0.243 -7.407 -5.984 1.00 0.00 O ATOM 0 H SER A 108 -3.915 -5.781 -5.273 1.00 0.00 H new ATOM 0 HA SER A 108 -2.765 -8.005 -6.845 1.00 0.00 H new ATOM 0 HB2 SER A 108 -1.291 -6.078 -7.154 1.00 0.00 H new ATOM 0 HB3 SER A 108 -1.304 -5.731 -5.437 1.00 0.00 H new ATOM 0 HG SER A 108 0.591 -6.902 -6.081 1.00 0.00 H new ATOM 1726 N ASP A 109 -2.952 -7.351 -3.619 1.00 0.00 N ATOM 1727 CA ASP A 109 -3.002 -7.967 -2.298 1.00 0.00 C ATOM 1728 C ASP A 109 -4.162 -8.953 -2.202 1.00 0.00 C ATOM 1729 O ASP A 109 -5.162 -8.844 -2.912 1.00 0.00 O ATOM 1730 CB ASP A 109 -3.139 -6.894 -1.216 1.00 0.00 C ATOM 1731 CG ASP A 109 -1.928 -5.984 -1.147 1.00 0.00 C ATOM 1732 OD1 ASP A 109 -0.802 -6.478 -1.365 1.00 0.00 O ATOM 1733 OD2 ASP A 109 -2.106 -4.778 -0.874 1.00 0.00 O ATOM 0 H ASP A 109 -3.131 -6.347 -3.623 1.00 0.00 H new ATOM 0 HA ASP A 109 -2.071 -8.512 -2.143 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -4.029 -6.296 -1.412 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -3.285 -7.374 -0.248 1.00 0.00 H new ATOM 1738 N PRO A 110 -4.026 -9.941 -1.305 1.00 0.00 N ATOM 1739 CA PRO A 110 -5.052 -10.967 -1.096 1.00 0.00 C ATOM 1740 C PRO A 110 -6.306 -10.406 -0.434 1.00 0.00 C ATOM 1741 O PRO A 110 -6.223 -9.587 0.480 1.00 0.00 O ATOM 1742 CB PRO A 110 -4.364 -11.973 -0.170 1.00 0.00 C ATOM 1743 CG PRO A 110 -3.326 -11.181 0.547 1.00 0.00 C ATOM 1744 CD PRO A 110 -2.861 -10.133 -0.425 1.00 0.00 C ATOM 0 HA PRO A 110 -5.395 -11.398 -2.037 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -5.074 -12.418 0.527 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -3.917 -12.790 -0.736 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -3.737 -10.724 1.447 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -2.498 -11.817 0.861 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -2.585 -9.209 0.083 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -1.986 -10.464 -0.984 1.00 0.00 H new ATOM 1752 N GLU A 111 -7.467 -10.853 -0.902 1.00 0.00 N ATOM 1753 CA GLU A 111 -8.739 -10.394 -0.355 1.00 0.00 C ATOM 1754 C GLU A 111 -8.924 -10.887 1.078 1.00 0.00 C ATOM 1755 O GLU A 111 -8.251 -11.820 1.516 1.00 0.00 O ATOM 1756 CB GLU A 111 -9.899 -10.879 -1.226 1.00 0.00 C ATOM 1757 CG GLU A 111 -9.730 -10.554 -2.701 1.00 0.00 C ATOM 1758 CD GLU A 111 -8.926 -11.605 -3.441 1.00 0.00 C ATOM 1759 OE1 GLU A 111 -9.498 -12.660 -3.783 1.00 0.00 O ATOM 1760 OE2 GLU A 111 -7.722 -11.370 -3.679 1.00 0.00 O ATOM 0 H GLU A 111 -7.553 -11.532 -1.658 1.00 0.00 H new ATOM 0 HA GLU A 111 -8.730 -9.304 -0.348 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -10.003 -11.958 -1.110 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -10.825 -10.429 -0.867 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -10.713 -10.461 -3.164 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -9.237 -9.587 -2.802 1.00 0.00 H new ATOM 1767 N ILE A 112 -9.839 -10.251 1.802 1.00 0.00 N ATOM 1768 CA ILE A 112 -10.113 -10.624 3.184 1.00 0.00 C ATOM 1769 C ILE A 112 -11.613 -10.689 3.449 1.00 0.00 C ATOM 1770 O ILE A 112 -12.361 -9.792 3.064 1.00 0.00 O ATOM 1771 CB ILE A 112 -9.470 -9.633 4.172 1.00 0.00 C ATOM 1772 CG1 ILE A 112 -9.708 -8.193 3.711 1.00 0.00 C ATOM 1773 CG2 ILE A 112 -7.981 -9.912 4.310 1.00 0.00 C ATOM 1774 CD1 ILE A 112 -9.491 -7.166 4.800 1.00 0.00 C ATOM 0 H ILE A 112 -10.403 -9.475 1.454 1.00 0.00 H new ATOM 0 HA ILE A 112 -9.677 -11.611 3.337 1.00 0.00 H new ATOM 0 HB ILE A 112 -9.935 -9.764 5.149 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -9.042 -7.972 2.877 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -10.728 -8.104 3.337 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -7.541 -9.203 5.012 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -7.834 -10.927 4.679 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -7.499 -9.806 3.338 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -9.677 -6.169 4.402 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -10.176 -7.361 5.626 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -8.463 -7.227 5.159 1.00 0.00 H new ATOM 1786 N ASN A 113 -12.045 -11.757 4.112 1.00 0.00 N ATOM 1787 CA ASN A 113 -13.457 -11.939 4.430 1.00 0.00 C ATOM 1788 C ASN A 113 -14.018 -10.710 5.139 1.00 0.00 C ATOM 1789 O ASN A 113 -13.673 -10.430 6.288 1.00 0.00 O ATOM 1790 CB ASN A 113 -13.648 -13.178 5.306 1.00 0.00 C ATOM 1791 CG ASN A 113 -15.088 -13.653 5.330 1.00 0.00 C ATOM 1792 OD1 ASN A 113 -15.918 -13.115 6.064 1.00 0.00 O ATOM 1793 ND2 ASN A 113 -15.391 -14.666 4.526 1.00 0.00 N ATOM 0 H ASN A 113 -11.438 -12.509 4.439 1.00 0.00 H new ATOM 0 HA ASN A 113 -14.000 -12.076 3.495 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -13.009 -13.981 4.939 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -13.325 -12.954 6.323 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -16.344 -15.029 4.500 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -14.671 -15.081 3.935 1.00 0.00 H new ATOM 1800 N THR A 114 -14.885 -9.978 4.446 1.00 0.00 N ATOM 1801 CA THR A 114 -15.493 -8.779 5.008 1.00 0.00 C ATOM 1802 C THR A 114 -16.757 -9.118 5.790 1.00 0.00 C ATOM 1803 O THR A 114 -16.947 -8.655 6.915 1.00 0.00 O ATOM 1804 CB THR A 114 -15.842 -7.757 3.909 1.00 0.00 C ATOM 1805 OG1 THR A 114 -16.708 -8.358 2.939 1.00 0.00 O ATOM 1806 CG2 THR A 114 -14.582 -7.248 3.225 1.00 0.00 C ATOM 0 H THR A 114 -15.182 -10.195 3.495 1.00 0.00 H new ATOM 0 HA THR A 114 -14.758 -8.339 5.683 1.00 0.00 H new ATOM 0 HB THR A 114 -16.350 -6.913 4.375 1.00 0.00 H new ATOM 0 HG1 THR A 114 -16.927 -7.702 2.245 1.00 0.00 H new ATOM 0 HG21 THR A 114 -14.853 -6.528 2.453 1.00 0.00 H new ATOM 0 HG22 THR A 114 -13.938 -6.766 3.961 1.00 0.00 H new ATOM 0 HG23 THR A 114 -14.051 -8.085 2.771 1.00 0.00 H new ATOM 1814 N LYS A 115 -17.620 -9.929 5.188 1.00 0.00 N ATOM 1815 CA LYS A 115 -18.866 -10.333 5.828 1.00 0.00 C ATOM 1816 C LYS A 115 -19.618 -9.121 6.367 1.00 0.00 C ATOM 1817 O LYS A 115 -20.148 -9.151 7.478 1.00 0.00 O ATOM 1818 CB LYS A 115 -18.584 -11.318 6.964 1.00 0.00 C ATOM 1819 CG LYS A 115 -19.815 -12.072 7.436 1.00 0.00 C ATOM 1820 CD LYS A 115 -19.672 -12.526 8.879 1.00 0.00 C ATOM 1821 CE LYS A 115 -20.588 -13.701 9.186 1.00 0.00 C ATOM 1822 NZ LYS A 115 -21.940 -13.252 9.618 1.00 0.00 N ATOM 0 H LYS A 115 -17.479 -10.320 4.256 1.00 0.00 H new ATOM 0 HA LYS A 115 -19.489 -10.821 5.078 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -17.833 -12.036 6.633 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -18.156 -10.775 7.806 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -20.693 -11.433 7.340 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -19.980 -12.939 6.796 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -18.637 -12.810 9.072 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -19.905 -11.697 9.547 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -20.680 -14.331 8.301 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -20.142 -14.315 9.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -22.534 -14.082 9.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -21.855 -12.672 10.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -22.377 -12.688 8.861 1.00 0.00 H new ATOM 1836 N SER A 116 -19.663 -8.056 5.573 1.00 0.00 N ATOM 1837 CA SER A 116 -20.349 -6.832 5.972 1.00 0.00 C ATOM 1838 C SER A 116 -21.281 -6.346 4.867 1.00 0.00 C ATOM 1839 O SER A 116 -20.876 -6.212 3.713 1.00 0.00 O ATOM 1840 CB SER A 116 -19.332 -5.741 6.315 1.00 0.00 C ATOM 1841 OG SER A 116 -19.880 -4.801 7.222 1.00 0.00 O ATOM 0 H SER A 116 -19.232 -8.016 4.649 1.00 0.00 H new ATOM 0 HA SER A 116 -20.947 -7.052 6.856 1.00 0.00 H new ATOM 0 HB2 SER A 116 -18.441 -6.194 6.750 1.00 0.00 H new ATOM 0 HB3 SER A 116 -19.019 -5.232 5.404 1.00 0.00 H new ATOM 0 HG SER A 116 -19.648 -3.894 6.933 1.00 0.00 H new ATOM 1847 N GLY A 117 -22.533 -6.084 5.229 1.00 0.00 N ATOM 1848 CA GLY A 117 -23.504 -5.616 4.257 1.00 0.00 C ATOM 1849 C GLY A 117 -24.133 -6.751 3.474 1.00 0.00 C ATOM 1850 O GLY A 117 -23.564 -7.255 2.505 1.00 0.00 O ATOM 0 H GLY A 117 -22.892 -6.187 6.178 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -24.286 -5.055 4.770 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -23.019 -4.927 3.566 1.00 0.00 H new ATOM 1854 N PRO A 118 -25.335 -7.171 3.895 1.00 0.00 N ATOM 1855 CA PRO A 118 -26.068 -8.259 3.240 1.00 0.00 C ATOM 1856 C PRO A 118 -26.581 -7.864 1.860 1.00 0.00 C ATOM 1857 O PRO A 118 -26.966 -8.718 1.062 1.00 0.00 O ATOM 1858 CB PRO A 118 -27.238 -8.520 4.191 1.00 0.00 C ATOM 1859 CG PRO A 118 -27.438 -7.231 4.911 1.00 0.00 C ATOM 1860 CD PRO A 118 -26.072 -6.615 5.042 1.00 0.00 C ATOM 0 HA PRO A 118 -25.437 -9.131 3.069 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -28.135 -8.811 3.644 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -27.011 -9.330 4.885 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -28.111 -6.575 4.358 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -27.887 -7.396 5.890 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -26.117 -5.527 5.001 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -25.601 -6.880 5.989 1.00 0.00 H new ATOM 1868 N SER A 119 -26.582 -6.563 1.584 1.00 0.00 N ATOM 1869 CA SER A 119 -27.051 -6.055 0.300 1.00 0.00 C ATOM 1870 C SER A 119 -26.011 -6.292 -0.791 1.00 0.00 C ATOM 1871 O SER A 119 -24.935 -5.696 -0.778 1.00 0.00 O ATOM 1872 CB SER A 119 -27.366 -4.561 0.403 1.00 0.00 C ATOM 1873 OG SER A 119 -26.229 -3.828 0.823 1.00 0.00 O ATOM 0 H SER A 119 -26.264 -5.843 2.232 1.00 0.00 H new ATOM 0 HA SER A 119 -27.960 -6.594 0.035 1.00 0.00 H new ATOM 0 HB2 SER A 119 -27.705 -4.190 -0.564 1.00 0.00 H new ATOM 0 HB3 SER A 119 -28.183 -4.406 1.108 1.00 0.00 H new ATOM 0 HG SER A 119 -25.422 -4.227 0.437 1.00 0.00 H new ATOM 1879 N SER A 120 -26.342 -7.168 -1.734 1.00 0.00 N ATOM 1880 CA SER A 120 -25.436 -7.489 -2.831 1.00 0.00 C ATOM 1881 C SER A 120 -25.694 -6.582 -4.031 1.00 0.00 C ATOM 1882 O SER A 120 -26.800 -6.075 -4.214 1.00 0.00 O ATOM 1883 CB SER A 120 -25.597 -8.954 -3.241 1.00 0.00 C ATOM 1884 OG SER A 120 -24.691 -9.296 -4.277 1.00 0.00 O ATOM 0 H SER A 120 -27.231 -7.668 -1.761 1.00 0.00 H new ATOM 0 HA SER A 120 -24.415 -7.326 -2.486 1.00 0.00 H new ATOM 0 HB2 SER A 120 -25.427 -9.597 -2.378 1.00 0.00 H new ATOM 0 HB3 SER A 120 -26.619 -9.131 -3.574 1.00 0.00 H new ATOM 0 HG SER A 120 -24.812 -10.238 -4.520 1.00 0.00 H new ATOM 1890 N GLY A 121 -24.663 -6.383 -4.847 1.00 0.00 N ATOM 1891 CA GLY A 121 -24.797 -5.537 -6.019 1.00 0.00 C ATOM 1892 C GLY A 121 -23.680 -4.519 -6.130 1.00 0.00 C ATOM 1893 O GLY A 121 -22.855 -4.391 -5.225 1.00 0.00 O ATOM 0 H GLY A 121 -23.738 -6.792 -4.717 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -24.807 -6.160 -6.914 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -25.755 -5.018 -5.981 1.00 0.00 H new TER 1897 GLY A 121