USER MOD reduce.3.24.130724 H: found=0, std=0, add=1050, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 884 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 116 THR OG1 : rot 171:sc= -3.19! USER MOD Set 1.2: A 125 LYS NZ :NH3+ 157:sc= -1.48! (180deg=-2.67!) USER MOD Set 2.1: A 115 GLN : amide:sc= -4.85! K(o=-8.5!,f=-7.1) USER MOD Set 2.2: A 117 TYR OH : rot -105:sc= 1.27 USER MOD Set 2.3: A 129 LYS NZ :NH3+ 131:sc= -4.9! (180deg=-7.92!) USER MOD Set 3.1: A 11 ASN : amide:sc= -7.97! C(o=-18!,f=-12!) USER MOD Set 3.2: A 13 ASN : amide:sc= -10.3! C(o=-18!,f=-17!) USER MOD Set 4.1: A 5 THR OG1 : rot 12:sc= 1.88 USER MOD Set 4.2: A 39 THR OG1 : rot -46:sc= 0.602 USER MOD Single : A 7 LYS NZ :NH3+ 157:sc= -0.084 (180deg=-0.467) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ -139:sc= -0.38! (180deg=-1.59!) USER MOD Single : A 18 MET CE :methyl -156:sc= 0 (180deg=-0.359) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl -160:sc= -0.141 (180deg=-0.662) USER MOD Single : A 24 ASN : amide:sc= -0.0471 X(o=-0.047,f=-0.047) USER MOD Single : A 27 LYS NZ :NH3+ 166:sc= -0.0312 (180deg=-0.223) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HE2:sc= -0.17 K(o=-0.17,f=-1.2) USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot 98:sc= 0.847 USER MOD Single : A 42 GLN : amide:sc= -1.88! K(o=-1.9!,f=-0.023) USER MOD Single : A 45 ASN : amide:sc= -6.58! C(o=-6.6!,f=-5.3!) USER MOD Single : A 46 LYS NZ :NH3+ 171:sc= 1.87 (180deg=1.48) USER MOD Single : A 48 THR OG1 : rot -29:sc= -2.77! USER MOD Single : A 50 LYS NZ :NH3+ 150:sc= -0.354 (180deg=-1.02) USER MOD Single : A 52 SER OG : rot 180:sc= -0.209 USER MOD Single : A 53 SER OG : rot 9:sc= 0.863 USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=-0.0049) USER MOD Single : A 57 ASN : amide:sc= -4.84! C(o=-4.8!,f=-5.7!) USER MOD Single : A 70 TYR OH : rot 142:sc= 1.2 USER MOD Single : A 71 SER OG : rot 151:sc= -1.16! USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 178:sc= -1.37 USER MOD Single : A 81 THR OG1 : rot -33:sc= -1.95 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 MET CE :methyl -129:sc= -2.32! (180deg=-4.96!) USER MOD Single : A 87 ASN : amide:sc= -2.69 K(o=-2.7,f=-3.8!) USER MOD Single : A 88 LYS NZ :NH3+ -162:sc= 1.14 (180deg=1.06) USER MOD Single : A 92 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.0145) USER MOD Single : A 94 LYS NZ :NH3+ -143:sc= 2.26 (180deg=0.0354) USER MOD Single : A 98 ASN : amide:sc= -1.55 K(o=-1.6,f=-0.003) USER MOD Single : A 100 LYS NZ :NH3+ 139:sc= 1.18 (180deg=-0.749) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -0.198 K(o=-0.2,f=-3.1!) USER MOD Single : A 118 THR OG1 : rot 180:sc= -0.0319 USER MOD Single : A 119 TYR OH : rot -104:sc= 0.539 USER MOD Single : A 130 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0449) USER MOD ----------------------------------------------------------------- ATOM 13 N PHE A 2 10.910 -12.117 2.552 1.00 0.00 N ATOM 14 CA PHE A 2 10.008 -11.896 3.682 1.00 0.00 C ATOM 15 C PHE A 2 10.800 -11.542 4.932 1.00 0.00 C ATOM 16 O PHE A 2 10.443 -11.928 6.050 1.00 0.00 O ATOM 17 CB PHE A 2 9.116 -13.123 3.938 1.00 0.00 C ATOM 18 CG PHE A 2 8.084 -13.385 2.868 1.00 0.00 C ATOM 19 CD1 PHE A 2 8.445 -13.473 1.529 1.00 0.00 C ATOM 20 CD2 PHE A 2 6.750 -13.549 3.205 1.00 0.00 C ATOM 21 CE1 PHE A 2 7.499 -13.717 0.555 1.00 0.00 C ATOM 22 CE2 PHE A 2 5.798 -13.795 2.233 1.00 0.00 C ATOM 23 CZ PHE A 2 6.172 -13.878 0.907 1.00 0.00 C ATOM 0 HA PHE A 2 9.357 -11.059 3.430 1.00 0.00 H new ATOM 0 HB2 PHE A 2 9.751 -14.003 4.035 1.00 0.00 H new ATOM 0 HB3 PHE A 2 8.606 -12.992 4.892 1.00 0.00 H new ATOM 0 HD1 PHE A 2 9.480 -13.349 1.247 1.00 0.00 H new ATOM 0 HD2 PHE A 2 6.450 -13.484 4.240 1.00 0.00 H new ATOM 0 HE1 PHE A 2 7.795 -13.782 -0.482 1.00 0.00 H new ATOM 0 HE2 PHE A 2 4.762 -13.922 2.511 1.00 0.00 H new ATOM 0 HZ PHE A 2 5.430 -14.068 0.146 1.00 0.00 H new ATOM 32 N ASP A 3 11.868 -10.780 4.727 1.00 0.00 N ATOM 33 CA ASP A 3 12.713 -10.321 5.822 1.00 0.00 C ATOM 34 C ASP A 3 13.674 -9.266 5.318 1.00 0.00 C ATOM 35 O ASP A 3 14.795 -9.129 5.807 1.00 0.00 O ATOM 36 CB ASP A 3 13.504 -11.474 6.417 1.00 0.00 C ATOM 37 CG ASP A 3 13.745 -11.308 7.908 1.00 0.00 C ATOM 38 OD1 ASP A 3 14.379 -10.310 8.311 1.00 0.00 O ATOM 39 OD2 ASP A 3 13.292 -12.173 8.690 1.00 0.00 O ATOM 0 H ASP A 3 12.171 -10.465 3.805 1.00 0.00 H new ATOM 0 HA ASP A 3 12.070 -9.901 6.595 1.00 0.00 H new ATOM 0 HB2 ASP A 3 12.968 -12.407 6.241 1.00 0.00 H new ATOM 0 HB3 ASP A 3 14.463 -11.555 5.904 1.00 0.00 H new ATOM 43 N GLY A 4 13.210 -8.477 4.375 1.00 0.00 N ATOM 44 CA GLY A 4 14.007 -7.384 3.897 1.00 0.00 C ATOM 45 C GLY A 4 13.548 -6.095 4.518 1.00 0.00 C ATOM 46 O GLY A 4 12.382 -5.974 4.890 1.00 0.00 O ATOM 0 H GLY A 4 12.296 -8.574 3.932 1.00 0.00 H new ATOM 0 HA2 GLY A 4 15.056 -7.558 4.136 1.00 0.00 H new ATOM 0 HA3 GLY A 4 13.934 -7.319 2.811 1.00 0.00 H new ATOM 50 N THR A 5 14.391 -5.093 4.506 1.00 0.00 N ATOM 51 CA THR A 5 13.988 -3.799 4.888 1.00 0.00 C ATOM 52 C THR A 5 14.833 -2.884 4.065 1.00 0.00 C ATOM 53 O THR A 5 15.922 -3.281 3.655 1.00 0.00 O ATOM 54 CB THR A 5 14.133 -3.527 6.393 1.00 0.00 C ATOM 55 OG1 THR A 5 13.639 -2.220 6.659 1.00 0.00 O ATOM 56 CG2 THR A 5 15.576 -3.646 6.861 1.00 0.00 C ATOM 0 H THR A 5 15.370 -5.170 4.229 1.00 0.00 H new ATOM 0 HA THR A 5 12.922 -3.654 4.711 1.00 0.00 H new ATOM 0 HB THR A 5 13.561 -4.276 6.941 1.00 0.00 H new ATOM 0 HG1 THR A 5 13.157 -1.887 5.874 1.00 0.00 H new ATOM 0 HG21 THR A 5 15.629 -3.445 7.931 1.00 0.00 H new ATOM 0 HG22 THR A 5 15.941 -4.654 6.662 1.00 0.00 H new ATOM 0 HG23 THR A 5 16.193 -2.924 6.325 1.00 0.00 H new ATOM 64 N TRP A 6 14.210 -1.875 3.525 1.00 0.00 N ATOM 65 CA TRP A 6 14.752 -1.181 2.432 1.00 0.00 C ATOM 66 C TRP A 6 13.971 0.090 2.502 1.00 0.00 C ATOM 67 O TRP A 6 12.822 0.008 2.933 1.00 0.00 O ATOM 68 CB TRP A 6 14.526 -2.001 1.160 1.00 0.00 C ATOM 69 CG TRP A 6 13.513 -3.122 1.257 1.00 0.00 C ATOM 70 CD1 TRP A 6 13.763 -4.461 1.102 1.00 0.00 C ATOM 71 CD2 TRP A 6 12.103 -3.018 1.495 1.00 0.00 C ATOM 72 NE1 TRP A 6 12.600 -5.171 1.187 1.00 0.00 N ATOM 73 CE2 TRP A 6 11.571 -4.311 1.421 1.00 0.00 C ATOM 74 CE3 TRP A 6 11.235 -1.963 1.741 1.00 0.00 C ATOM 75 CZ2 TRP A 6 10.219 -4.563 1.577 1.00 0.00 C ATOM 76 CZ3 TRP A 6 9.892 -2.222 1.899 1.00 0.00 C ATOM 77 CH2 TRP A 6 9.396 -3.511 1.809 1.00 0.00 C ATOM 0 H TRP A 6 13.308 -1.523 3.845 1.00 0.00 H new ATOM 0 HA TRP A 6 15.827 -0.999 2.438 1.00 0.00 H new ATOM 0 HB2 TRP A 6 14.211 -1.323 0.367 1.00 0.00 H new ATOM 0 HB3 TRP A 6 15.481 -2.428 0.854 1.00 0.00 H new ATOM 0 HD1 TRP A 6 14.739 -4.892 0.936 1.00 0.00 H new ATOM 0 HE1 TRP A 6 12.516 -6.183 1.091 1.00 0.00 H new ATOM 0 HE3 TRP A 6 11.608 -0.952 1.808 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 9.831 -5.569 1.516 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 9.214 -1.405 2.097 1.00 0.00 H new ATOM 0 HH2 TRP A 6 8.336 -3.682 1.926 1.00 0.00 H new ATOM 87 N LYS A 7 14.585 1.254 2.517 1.00 0.00 N ATOM 88 CA LYS A 7 13.858 2.285 3.191 1.00 0.00 C ATOM 89 C LYS A 7 14.382 3.651 2.943 1.00 0.00 C ATOM 90 O LYS A 7 15.451 4.010 3.419 1.00 0.00 O ATOM 91 CB LYS A 7 13.877 1.987 4.677 1.00 0.00 C ATOM 92 CG LYS A 7 15.063 1.152 5.170 1.00 0.00 C ATOM 93 CD LYS A 7 16.379 1.919 5.137 1.00 0.00 C ATOM 94 CE LYS A 7 16.585 2.730 6.404 1.00 0.00 C ATOM 95 NZ LYS A 7 16.778 1.857 7.592 1.00 0.00 N ATOM 0 H LYS A 7 15.492 1.490 2.114 1.00 0.00 H new ATOM 0 HA LYS A 7 12.843 2.281 2.794 1.00 0.00 H new ATOM 0 HB2 LYS A 7 13.871 2.933 5.219 1.00 0.00 H new ATOM 0 HB3 LYS A 7 12.956 1.465 4.936 1.00 0.00 H new ATOM 0 HG2 LYS A 7 14.868 0.818 6.189 1.00 0.00 H new ATOM 0 HG3 LYS A 7 15.153 0.258 4.553 1.00 0.00 H new ATOM 0 HD2 LYS A 7 17.206 1.219 5.014 1.00 0.00 H new ATOM 0 HD3 LYS A 7 16.392 2.583 4.273 1.00 0.00 H new ATOM 0 HE2 LYS A 7 17.453 3.378 6.284 1.00 0.00 H new ATOM 0 HE3 LYS A 7 15.724 3.378 6.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 17.286 2.384 8.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 15.851 1.556 7.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 17.332 1.019 7.321 1.00 0.00 H new ATOM 105 N VAL A 8 13.583 4.437 2.269 1.00 0.00 N ATOM 106 CA VAL A 8 13.986 5.763 1.873 1.00 0.00 C ATOM 107 C VAL A 8 12.811 6.513 1.313 1.00 0.00 C ATOM 108 O VAL A 8 12.655 7.718 1.500 1.00 0.00 O ATOM 109 CB VAL A 8 15.053 5.656 0.765 1.00 0.00 C ATOM 110 CG1 VAL A 8 16.436 5.420 1.307 1.00 0.00 C ATOM 111 CG2 VAL A 8 14.721 4.499 -0.151 1.00 0.00 C ATOM 0 H VAL A 8 12.640 4.179 1.980 1.00 0.00 H new ATOM 0 HA VAL A 8 14.381 6.286 2.744 1.00 0.00 H new ATOM 0 HB VAL A 8 15.044 6.609 0.236 1.00 0.00 H new ATOM 0 HG11 VAL A 8 17.144 5.353 0.481 1.00 0.00 H new ATOM 0 HG12 VAL A 8 16.717 6.246 1.960 1.00 0.00 H new ATOM 0 HG13 VAL A 8 16.451 4.489 1.873 1.00 0.00 H new ATOM 0 HG21 VAL A 8 15.477 4.426 -0.933 1.00 0.00 H new ATOM 0 HG22 VAL A 8 14.703 3.573 0.424 1.00 0.00 H new ATOM 0 HG23 VAL A 8 13.744 4.663 -0.605 1.00 0.00 H new ATOM 121 N ASP A 9 12.134 5.796 0.463 1.00 0.00 N ATOM 122 CA ASP A 9 11.060 6.300 -0.338 1.00 0.00 C ATOM 123 C ASP A 9 10.093 7.209 0.353 1.00 0.00 C ATOM 124 O ASP A 9 9.590 6.940 1.425 1.00 0.00 O ATOM 125 CB ASP A 9 10.285 5.149 -0.874 1.00 0.00 C ATOM 126 CG ASP A 9 9.449 4.439 0.178 1.00 0.00 C ATOM 127 OD1 ASP A 9 8.305 4.856 0.424 1.00 0.00 O ATOM 128 OD2 ASP A 9 9.945 3.457 0.761 1.00 0.00 O ATOM 0 H ASP A 9 12.324 4.806 0.304 1.00 0.00 H new ATOM 0 HA ASP A 9 11.545 6.902 -1.106 1.00 0.00 H new ATOM 0 HB2 ASP A 9 9.630 5.502 -1.670 1.00 0.00 H new ATOM 0 HB3 ASP A 9 10.975 4.434 -1.322 1.00 0.00 H new ATOM 132 N ARG A 10 9.593 8.066 -0.468 1.00 0.00 N ATOM 133 CA ARG A 10 8.427 8.873 -0.144 1.00 0.00 C ATOM 134 C ARG A 10 7.982 9.546 -1.417 1.00 0.00 C ATOM 135 O ARG A 10 8.739 10.323 -2.002 1.00 0.00 O ATOM 136 CB ARG A 10 8.781 9.888 0.908 1.00 0.00 C ATOM 137 CG ARG A 10 10.061 10.586 0.567 1.00 0.00 C ATOM 138 CD ARG A 10 10.178 11.883 1.312 1.00 0.00 C ATOM 139 NE ARG A 10 11.570 12.307 1.492 1.00 0.00 N ATOM 140 CZ ARG A 10 12.351 12.798 0.524 1.00 0.00 C ATOM 141 NH1 ARG A 10 11.881 12.986 -0.703 1.00 0.00 N ATOM 142 NH2 ARG A 10 13.609 13.110 0.792 1.00 0.00 N ATOM 0 H ARG A 10 9.973 8.242 -1.398 1.00 0.00 H new ATOM 0 HA ARG A 10 7.621 8.257 0.256 1.00 0.00 H new ATOM 0 HB2 ARG A 10 7.977 10.618 1.000 1.00 0.00 H new ATOM 0 HB3 ARG A 10 8.877 9.396 1.876 1.00 0.00 H new ATOM 0 HG2 ARG A 10 10.907 9.944 0.812 1.00 0.00 H new ATOM 0 HG3 ARG A 10 10.103 10.773 -0.506 1.00 0.00 H new ATOM 0 HD2 ARG A 10 9.633 12.658 0.773 1.00 0.00 H new ATOM 0 HD3 ARG A 10 9.704 11.781 2.288 1.00 0.00 H new ATOM 0 HE ARG A 10 11.973 12.221 2.425 1.00 0.00 H new ATOM 0 HH11 ARG A 10 10.911 12.755 -0.919 1.00 0.00 H new ATOM 0 HH12 ARG A 10 12.490 13.361 -1.430 1.00 0.00 H new ATOM 0 HH21 ARG A 10 13.978 12.976 1.733 1.00 0.00 H new ATOM 0 HH22 ARG A 10 14.209 13.485 0.057 1.00 0.00 H new ATOM 153 N ASN A 11 6.875 9.087 -1.963 1.00 0.00 N ATOM 154 CA ASN A 11 6.623 9.245 -3.399 1.00 0.00 C ATOM 155 C ASN A 11 6.153 10.617 -3.547 1.00 0.00 C ATOM 156 O ASN A 11 5.703 11.215 -2.567 1.00 0.00 O ATOM 157 CB ASN A 11 5.488 8.322 -3.892 1.00 0.00 C ATOM 158 CG ASN A 11 4.092 8.877 -3.589 1.00 0.00 C ATOM 159 OD1 ASN A 11 3.493 8.556 -2.569 1.00 0.00 O ATOM 160 ND2 ASN A 11 3.575 9.727 -4.485 1.00 0.00 N ATOM 0 H ASN A 11 6.137 8.605 -1.450 1.00 0.00 H new ATOM 0 HA ASN A 11 7.523 9.006 -3.966 1.00 0.00 H new ATOM 0 HB2 ASN A 11 5.589 8.174 -4.967 1.00 0.00 H new ATOM 0 HB3 ASN A 11 5.594 7.343 -3.424 1.00 0.00 H new ATOM 0 HD21 ASN A 11 2.652 10.132 -4.330 1.00 0.00 H new ATOM 0 HD22 ASN A 11 4.105 9.970 -5.322 1.00 0.00 H new ATOM 166 N GLU A 12 6.286 11.193 -4.698 1.00 0.00 N ATOM 167 CA GLU A 12 5.959 12.538 -4.714 1.00 0.00 C ATOM 168 C GLU A 12 4.541 12.611 -5.034 1.00 0.00 C ATOM 169 O GLU A 12 4.143 12.945 -6.098 1.00 0.00 O ATOM 170 CB GLU A 12 6.753 13.392 -5.665 1.00 0.00 C ATOM 171 CG GLU A 12 8.208 13.634 -5.291 1.00 0.00 C ATOM 172 CD GLU A 12 9.094 12.408 -5.405 1.00 0.00 C ATOM 173 OE1 GLU A 12 8.634 11.375 -5.933 1.00 0.00 O ATOM 174 OE2 GLU A 12 10.271 12.487 -4.987 1.00 0.00 O ATOM 0 H GLU A 12 6.599 10.770 -5.572 1.00 0.00 H new ATOM 0 HA GLU A 12 6.204 12.950 -3.735 1.00 0.00 H new ATOM 0 HB2 GLU A 12 6.725 12.926 -6.650 1.00 0.00 H new ATOM 0 HB3 GLU A 12 6.256 14.358 -5.755 1.00 0.00 H new ATOM 0 HG2 GLU A 12 8.610 14.419 -5.932 1.00 0.00 H new ATOM 0 HG3 GLU A 12 8.251 14.005 -4.267 1.00 0.00 H new ATOM 179 N ASN A 13 3.895 12.797 -3.957 1.00 0.00 N ATOM 180 CA ASN A 13 2.627 13.368 -3.952 1.00 0.00 C ATOM 181 C ASN A 13 2.895 14.797 -4.119 1.00 0.00 C ATOM 182 O ASN A 13 2.141 15.558 -4.697 1.00 0.00 O ATOM 183 CB ASN A 13 1.957 13.178 -2.632 1.00 0.00 C ATOM 184 CG ASN A 13 1.624 11.756 -2.294 1.00 0.00 C ATOM 185 OD1 ASN A 13 2.299 11.089 -1.530 1.00 0.00 O ATOM 186 ND2 ASN A 13 0.584 11.313 -2.924 1.00 0.00 N ATOM 0 H ASN A 13 4.247 12.548 -3.033 1.00 0.00 H new ATOM 0 HA ASN A 13 1.984 12.931 -4.716 1.00 0.00 H new ATOM 0 HB2 ASN A 13 2.603 13.580 -1.852 1.00 0.00 H new ATOM 0 HB3 ASN A 13 1.038 13.764 -2.619 1.00 0.00 H new ATOM 0 HD21 ASN A 13 0.283 10.347 -2.795 1.00 0.00 H new ATOM 0 HD22 ASN A 13 0.066 11.930 -3.550 1.00 0.00 H new ATOM 192 N TYR A 14 4.103 15.095 -3.716 1.00 0.00 N ATOM 193 CA TYR A 14 4.663 16.353 -3.926 1.00 0.00 C ATOM 194 C TYR A 14 4.893 16.524 -5.403 1.00 0.00 C ATOM 195 O TYR A 14 5.370 17.539 -5.809 1.00 0.00 O ATOM 196 CB TYR A 14 5.967 16.429 -3.122 1.00 0.00 C ATOM 197 CG TYR A 14 7.017 17.403 -3.621 1.00 0.00 C ATOM 198 CD1 TYR A 14 6.749 18.762 -3.709 1.00 0.00 C ATOM 199 CD2 TYR A 14 8.267 16.956 -4.021 1.00 0.00 C ATOM 200 CE1 TYR A 14 7.690 19.645 -4.188 1.00 0.00 C ATOM 201 CE2 TYR A 14 9.218 17.834 -4.500 1.00 0.00 C ATOM 202 CZ TYR A 14 8.924 19.178 -4.584 1.00 0.00 C ATOM 203 OH TYR A 14 9.867 20.057 -5.064 1.00 0.00 O ATOM 0 H TYR A 14 4.714 14.441 -3.227 1.00 0.00 H new ATOM 0 HA TYR A 14 4.009 17.158 -3.592 1.00 0.00 H new ATOM 0 HB2 TYR A 14 5.718 16.693 -2.094 1.00 0.00 H new ATOM 0 HB3 TYR A 14 6.410 15.434 -3.097 1.00 0.00 H new ATOM 0 HD1 TYR A 14 5.784 19.133 -3.396 1.00 0.00 H new ATOM 0 HD2 TYR A 14 8.500 15.903 -3.957 1.00 0.00 H new ATOM 0 HE1 TYR A 14 7.462 20.699 -4.253 1.00 0.00 H new ATOM 0 HE2 TYR A 14 10.187 17.470 -4.807 1.00 0.00 H new ATOM 0 HH TYR A 14 10.682 19.566 -5.298 1.00 0.00 H new ATOM 212 N GLU A 15 4.650 15.476 -6.193 1.00 0.00 N ATOM 213 CA GLU A 15 4.590 15.627 -7.641 1.00 0.00 C ATOM 214 C GLU A 15 3.191 15.388 -8.134 1.00 0.00 C ATOM 215 O GLU A 15 2.722 16.020 -9.038 1.00 0.00 O ATOM 216 CB GLU A 15 5.604 14.737 -8.361 1.00 0.00 C ATOM 217 CG GLU A 15 5.210 13.263 -8.465 1.00 0.00 C ATOM 218 CD GLU A 15 5.874 12.548 -9.625 1.00 0.00 C ATOM 219 OE1 GLU A 15 7.101 12.685 -9.797 1.00 0.00 O ATOM 220 OE2 GLU A 15 5.172 11.829 -10.363 1.00 0.00 O ATOM 0 H GLU A 15 4.494 14.526 -5.856 1.00 0.00 H new ATOM 0 HA GLU A 15 4.866 16.654 -7.878 1.00 0.00 H new ATOM 0 HB2 GLU A 15 5.759 15.128 -9.367 1.00 0.00 H new ATOM 0 HB3 GLU A 15 6.560 14.806 -7.841 1.00 0.00 H new ATOM 0 HG2 GLU A 15 5.473 12.757 -7.536 1.00 0.00 H new ATOM 0 HG3 GLU A 15 4.128 13.190 -8.573 1.00 0.00 H new ATOM 225 N LYS A 16 2.557 14.408 -7.576 1.00 0.00 N ATOM 226 CA LYS A 16 1.230 14.025 -8.026 1.00 0.00 C ATOM 227 C LYS A 16 0.326 15.163 -7.837 1.00 0.00 C ATOM 228 O LYS A 16 -0.696 15.309 -8.466 1.00 0.00 O ATOM 229 CB LYS A 16 0.652 12.924 -7.164 1.00 0.00 C ATOM 230 CG LYS A 16 1.678 12.072 -6.523 1.00 0.00 C ATOM 231 CD LYS A 16 1.061 11.004 -5.708 1.00 0.00 C ATOM 232 CE LYS A 16 0.729 9.774 -6.516 1.00 0.00 C ATOM 233 NZ LYS A 16 -0.029 8.815 -5.694 1.00 0.00 N ATOM 0 H LYS A 16 2.925 13.849 -6.806 1.00 0.00 H new ATOM 0 HA LYS A 16 1.318 13.703 -9.064 1.00 0.00 H new ATOM 0 HB2 LYS A 16 0.027 13.370 -6.390 1.00 0.00 H new ATOM 0 HB3 LYS A 16 0.003 12.298 -7.776 1.00 0.00 H new ATOM 0 HG2 LYS A 16 2.313 11.626 -7.289 1.00 0.00 H new ATOM 0 HG3 LYS A 16 2.321 12.686 -5.893 1.00 0.00 H new ATOM 0 HD2 LYS A 16 1.740 10.731 -4.900 1.00 0.00 H new ATOM 0 HD3 LYS A 16 0.151 11.386 -5.244 1.00 0.00 H new ATOM 0 HE2 LYS A 16 0.146 10.053 -7.393 1.00 0.00 H new ATOM 0 HE3 LYS A 16 1.646 9.309 -6.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 0.310 7.850 -5.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 0.107 9.037 -4.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -1.040 8.880 -5.929 1.00 0.00 H new ATOM 243 N PHE A 17 0.528 15.773 -6.745 1.00 0.00 N ATOM 244 CA PHE A 17 -0.374 16.794 -6.371 1.00 0.00 C ATOM 245 C PHE A 17 0.249 18.076 -6.706 1.00 0.00 C ATOM 246 O PHE A 17 -0.243 19.139 -6.353 1.00 0.00 O ATOM 247 CB PHE A 17 -0.721 16.750 -4.908 1.00 0.00 C ATOM 248 CG PHE A 17 -1.149 15.388 -4.361 1.00 0.00 C ATOM 249 CD1 PHE A 17 -0.533 14.200 -4.734 1.00 0.00 C ATOM 250 CD2 PHE A 17 -2.267 15.298 -3.538 1.00 0.00 C ATOM 251 CE1 PHE A 17 -0.996 13.000 -4.311 1.00 0.00 C ATOM 252 CE2 PHE A 17 -2.727 14.066 -3.091 1.00 0.00 C ATOM 253 CZ PHE A 17 -2.081 12.913 -3.487 1.00 0.00 C ATOM 0 H PHE A 17 1.295 15.594 -6.097 1.00 0.00 H new ATOM 0 HA PHE A 17 -1.311 16.655 -6.910 1.00 0.00 H new ATOM 0 HB2 PHE A 17 0.144 17.092 -4.339 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -1.525 17.462 -4.724 1.00 0.00 H new ATOM 0 HD1 PHE A 17 0.335 14.234 -5.376 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -2.785 16.199 -3.243 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -0.499 12.096 -4.631 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -3.585 14.011 -2.437 1.00 0.00 H new ATOM 0 HZ PHE A 17 -2.431 11.949 -3.148 1.00 0.00 H new ATOM 262 N MET A 18 1.436 17.937 -7.197 1.00 0.00 N ATOM 263 CA MET A 18 2.238 19.047 -7.524 1.00 0.00 C ATOM 264 C MET A 18 2.085 19.370 -8.967 1.00 0.00 C ATOM 265 O MET A 18 2.121 20.523 -9.395 1.00 0.00 O ATOM 266 CB MET A 18 3.650 18.685 -7.279 1.00 0.00 C ATOM 267 CG MET A 18 4.619 19.576 -8.037 1.00 0.00 C ATOM 268 SD MET A 18 6.358 19.134 -7.848 1.00 0.00 S ATOM 269 CE MET A 18 7.132 20.351 -8.909 1.00 0.00 C ATOM 0 H MET A 18 1.873 17.034 -7.381 1.00 0.00 H new ATOM 0 HA MET A 18 1.941 19.905 -6.922 1.00 0.00 H new ATOM 0 HB2 MET A 18 3.859 18.752 -6.211 1.00 0.00 H new ATOM 0 HB3 MET A 18 3.812 17.647 -7.571 1.00 0.00 H new ATOM 0 HG2 MET A 18 4.364 19.547 -9.096 1.00 0.00 H new ATOM 0 HG3 MET A 18 4.482 20.605 -7.704 1.00 0.00 H new ATOM 0 HE1 MET A 18 8.101 19.980 -9.242 1.00 0.00 H new ATOM 0 HE2 MET A 18 6.497 20.535 -9.775 1.00 0.00 H new ATOM 0 HE3 MET A 18 7.270 21.280 -8.356 1.00 0.00 H new ATOM 277 N GLU A 19 2.099 18.322 -9.726 1.00 0.00 N ATOM 278 CA GLU A 19 2.018 18.446 -11.125 1.00 0.00 C ATOM 279 C GLU A 19 0.585 18.556 -11.512 1.00 0.00 C ATOM 280 O GLU A 19 0.276 18.864 -12.663 1.00 0.00 O ATOM 281 CB GLU A 19 2.573 17.215 -11.782 1.00 0.00 C ATOM 282 CG GLU A 19 3.986 16.929 -11.339 1.00 0.00 C ATOM 283 CD GLU A 19 5.001 17.844 -11.992 1.00 0.00 C ATOM 284 OE1 GLU A 19 5.154 17.780 -13.228 1.00 0.00 O ATOM 285 OE2 GLU A 19 5.636 18.643 -11.276 1.00 0.00 O ATOM 0 H GLU A 19 2.167 17.363 -9.384 1.00 0.00 H new ATOM 0 HA GLU A 19 2.582 19.325 -11.438 1.00 0.00 H new ATOM 0 HB2 GLU A 19 1.939 16.360 -11.546 1.00 0.00 H new ATOM 0 HB3 GLU A 19 2.550 17.340 -12.865 1.00 0.00 H new ATOM 0 HG2 GLU A 19 4.051 17.035 -10.256 1.00 0.00 H new ATOM 0 HG3 GLU A 19 4.233 15.894 -11.573 1.00 0.00 H new ATOM 290 N LYS A 20 -0.269 17.966 -10.675 1.00 0.00 N ATOM 291 CA LYS A 20 -1.583 17.674 -11.194 1.00 0.00 C ATOM 292 C LYS A 20 -2.735 17.860 -10.202 1.00 0.00 C ATOM 293 O LYS A 20 -3.808 18.308 -10.598 1.00 0.00 O ATOM 294 CB LYS A 20 -1.590 16.275 -11.813 1.00 0.00 C ATOM 295 CG LYS A 20 -0.715 15.273 -11.083 1.00 0.00 C ATOM 296 CD LYS A 20 -0.392 14.069 -11.951 1.00 0.00 C ATOM 297 CE LYS A 20 0.354 14.460 -13.215 1.00 0.00 C ATOM 298 NZ LYS A 20 0.598 13.290 -14.096 1.00 0.00 N ATOM 0 H LYS A 20 -0.087 17.701 -9.707 1.00 0.00 H new ATOM 0 HA LYS A 20 -1.779 18.424 -11.960 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -2.614 15.902 -11.831 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -1.258 16.345 -12.849 1.00 0.00 H new ATOM 0 HG2 LYS A 20 0.211 15.757 -10.773 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -1.220 14.942 -10.176 1.00 0.00 H new ATOM 0 HD2 LYS A 20 0.209 13.362 -11.380 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -1.316 13.558 -12.220 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -0.220 15.211 -13.758 1.00 0.00 H new ATOM 0 HE3 LYS A 20 1.306 14.919 -12.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 1.109 13.598 -14.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 1.167 12.584 -13.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -0.311 12.867 -14.372 1.00 0.00 H new ATOM 308 N MET A 21 -2.567 17.417 -8.960 1.00 0.00 N ATOM 309 CA MET A 21 -3.671 17.449 -7.994 1.00 0.00 C ATOM 310 C MET A 21 -4.211 18.842 -7.754 1.00 0.00 C ATOM 311 O MET A 21 -5.266 19.222 -8.258 1.00 0.00 O ATOM 312 CB MET A 21 -3.250 16.893 -6.650 1.00 0.00 C ATOM 313 CG MET A 21 -3.234 15.392 -6.590 1.00 0.00 C ATOM 314 SD MET A 21 -4.866 14.652 -6.796 1.00 0.00 S ATOM 315 CE MET A 21 -5.734 15.324 -5.381 1.00 0.00 C ATOM 0 H MET A 21 -1.693 17.036 -8.598 1.00 0.00 H new ATOM 0 HA MET A 21 -4.451 16.834 -8.443 1.00 0.00 H new ATOM 0 HB2 MET A 21 -2.255 17.267 -6.409 1.00 0.00 H new ATOM 0 HB3 MET A 21 -3.927 17.270 -5.884 1.00 0.00 H new ATOM 0 HG2 MET A 21 -2.570 15.011 -7.366 1.00 0.00 H new ATOM 0 HG3 MET A 21 -2.819 15.078 -5.632 1.00 0.00 H new ATOM 0 HE1 MET A 21 -6.607 14.709 -5.164 1.00 0.00 H new ATOM 0 HE2 MET A 21 -5.070 15.330 -4.516 1.00 0.00 H new ATOM 0 HE3 MET A 21 -6.053 16.343 -5.600 1.00 0.00 H new ATOM 323 N GLY A 22 -3.514 19.556 -6.896 1.00 0.00 N ATOM 324 CA GLY A 22 -3.952 20.880 -6.496 1.00 0.00 C ATOM 325 C GLY A 22 -2.879 21.879 -6.784 1.00 0.00 C ATOM 326 O GLY A 22 -3.111 22.873 -7.468 1.00 0.00 O ATOM 0 H GLY A 22 -2.645 19.245 -6.462 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -4.863 21.148 -7.030 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -4.192 20.887 -5.433 1.00 0.00 H new ATOM 330 N ILE A 23 -1.663 21.452 -6.464 1.00 0.00 N ATOM 331 CA ILE A 23 -0.434 22.106 -6.889 1.00 0.00 C ATOM 332 C ILE A 23 -0.406 23.591 -6.512 1.00 0.00 C ATOM 333 O ILE A 23 0.453 24.353 -6.963 1.00 0.00 O ATOM 334 CB ILE A 23 -0.194 21.864 -8.405 1.00 0.00 C ATOM 335 CG1 ILE A 23 -0.754 23.000 -9.273 1.00 0.00 C ATOM 336 CG2 ILE A 23 -0.824 20.525 -8.823 1.00 0.00 C ATOM 337 CD1 ILE A 23 -0.452 22.845 -10.749 1.00 0.00 C ATOM 0 H ILE A 23 -1.502 20.624 -5.890 1.00 0.00 H new ATOM 0 HA ILE A 23 0.397 21.655 -6.347 1.00 0.00 H new ATOM 0 HB ILE A 23 0.884 21.835 -8.566 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -1.834 23.051 -9.136 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -0.343 23.948 -8.925 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -0.654 20.359 -9.887 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -0.370 19.715 -8.252 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -1.896 20.550 -8.627 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -0.879 23.684 -11.298 1.00 0.00 H new ATOM 0 HD12 ILE A 23 0.627 22.824 -10.899 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -0.887 21.914 -11.114 1.00 0.00 H new ATOM 348 N ASN A 24 -1.155 23.895 -5.465 1.00 0.00 N ATOM 349 CA ASN A 24 -1.099 25.187 -4.803 1.00 0.00 C ATOM 350 C ASN A 24 -1.220 24.923 -3.322 1.00 0.00 C ATOM 351 O ASN A 24 -0.248 25.026 -2.577 1.00 0.00 O ATOM 352 CB ASN A 24 -2.246 26.106 -5.240 1.00 0.00 C ATOM 353 CG ASN A 24 -2.357 26.275 -6.745 1.00 0.00 C ATOM 354 OD1 ASN A 24 -1.413 26.697 -7.412 1.00 0.00 O ATOM 355 ND2 ASN A 24 -3.525 25.963 -7.288 1.00 0.00 N ATOM 0 H ASN A 24 -1.824 23.247 -5.048 1.00 0.00 H new ATOM 0 HA ASN A 24 -0.166 25.687 -5.062 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -3.185 25.706 -4.859 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -2.108 27.086 -4.783 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -3.665 26.070 -8.293 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -4.284 25.616 -6.701 1.00 0.00 H new ATOM 361 N VAL A 25 -2.345 24.320 -2.968 1.00 0.00 N ATOM 362 CA VAL A 25 -2.537 23.777 -1.647 1.00 0.00 C ATOM 363 C VAL A 25 -1.899 22.396 -1.565 1.00 0.00 C ATOM 364 O VAL A 25 -2.006 21.593 -2.497 1.00 0.00 O ATOM 365 CB VAL A 25 -4.034 23.687 -1.272 1.00 0.00 C ATOM 366 CG1 VAL A 25 -4.616 25.076 -1.062 1.00 0.00 C ATOM 367 CG2 VAL A 25 -4.820 22.943 -2.345 1.00 0.00 C ATOM 0 H VAL A 25 -3.143 24.198 -3.591 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.060 24.451 -0.936 1.00 0.00 H new ATOM 0 HB VAL A 25 -4.115 23.129 -0.339 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.670 24.993 -0.799 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -4.079 25.577 -0.256 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -4.516 25.655 -1.980 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -5.870 22.893 -2.058 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -4.728 23.470 -3.295 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -4.424 21.933 -2.451 1.00 0.00 H new ATOM 377 N VAL A 26 -1.116 22.193 -0.527 1.00 0.00 N ATOM 378 CA VAL A 26 -0.377 20.944 -0.332 1.00 0.00 C ATOM 379 C VAL A 26 -1.326 19.793 0.013 1.00 0.00 C ATOM 380 O VAL A 26 -1.450 19.402 1.173 1.00 0.00 O ATOM 381 CB VAL A 26 0.690 21.072 0.783 1.00 0.00 C ATOM 382 CG1 VAL A 26 1.577 19.835 0.834 1.00 0.00 C ATOM 383 CG2 VAL A 26 1.530 22.324 0.587 1.00 0.00 C ATOM 0 H VAL A 26 -0.968 22.882 0.210 1.00 0.00 H new ATOM 0 HA VAL A 26 0.128 20.731 -1.274 1.00 0.00 H new ATOM 0 HB VAL A 26 0.169 21.155 1.737 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.318 19.951 1.625 1.00 0.00 H new ATOM 0 HG12 VAL A 26 0.965 18.956 1.036 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.085 19.712 -0.123 1.00 0.00 H new ATOM 0 HG21 VAL A 26 2.272 22.392 1.382 1.00 0.00 H new ATOM 0 HG22 VAL A 26 2.035 22.276 -0.378 1.00 0.00 H new ATOM 0 HG23 VAL A 26 0.886 23.203 0.616 1.00 0.00 H new ATOM 393 N LYS A 27 -2.039 19.297 -0.994 1.00 0.00 N ATOM 394 CA LYS A 27 -3.008 18.219 -0.800 1.00 0.00 C ATOM 395 C LYS A 27 -2.333 16.950 -0.299 1.00 0.00 C ATOM 396 O LYS A 27 -2.931 16.163 0.436 1.00 0.00 O ATOM 397 CB LYS A 27 -3.773 17.936 -2.093 1.00 0.00 C ATOM 398 CG LYS A 27 -4.888 18.929 -2.376 1.00 0.00 C ATOM 399 CD LYS A 27 -5.924 18.928 -1.261 1.00 0.00 C ATOM 400 CE LYS A 27 -7.118 19.807 -1.596 1.00 0.00 C ATOM 401 NZ LYS A 27 -7.889 19.281 -2.754 1.00 0.00 N ATOM 0 H LYS A 27 -1.965 19.625 -1.957 1.00 0.00 H new ATOM 0 HA LYS A 27 -3.717 18.549 -0.040 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -3.072 17.943 -2.928 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -4.197 16.933 -2.041 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -4.468 19.929 -2.485 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -5.368 18.680 -3.322 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -6.263 17.908 -1.082 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -5.463 19.278 -0.337 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -7.772 19.877 -0.727 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -6.774 20.817 -1.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -8.811 19.760 -2.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -7.360 19.456 -3.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -8.036 18.258 -2.637 1.00 0.00 H new ATOM 411 N ARG A 28 -1.054 16.801 -0.607 1.00 0.00 N ATOM 412 CA ARG A 28 -0.291 15.698 -0.062 1.00 0.00 C ATOM 413 C ARG A 28 1.186 16.030 -0.018 1.00 0.00 C ATOM 414 O ARG A 28 1.753 16.116 1.064 1.00 0.00 O ATOM 415 CB ARG A 28 -0.509 14.408 -0.865 1.00 0.00 C ATOM 416 CG ARG A 28 -0.166 13.153 -0.091 1.00 0.00 C ATOM 417 CD ARG A 28 -1.418 12.421 0.329 1.00 0.00 C ATOM 418 NE ARG A 28 -2.452 13.358 0.767 1.00 0.00 N ATOM 419 CZ ARG A 28 -3.584 13.006 1.353 1.00 0.00 C ATOM 420 NH1 ARG A 28 -3.808 11.739 1.670 1.00 0.00 N ATOM 421 NH2 ARG A 28 -4.487 13.933 1.644 1.00 0.00 N ATOM 0 H ARG A 28 -0.531 17.423 -1.224 1.00 0.00 H new ATOM 0 HA ARG A 28 -0.649 15.534 0.954 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -1.551 14.357 -1.181 1.00 0.00 H new ATOM 0 HB3 ARG A 28 0.098 14.445 -1.770 1.00 0.00 H new ATOM 0 HG2 ARG A 28 0.453 12.500 -0.705 1.00 0.00 H new ATOM 0 HG3 ARG A 28 0.421 13.413 0.790 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -1.792 11.825 -0.504 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -1.184 11.728 1.137 1.00 0.00 H new ATOM 0 HE ARG A 28 -2.289 14.352 0.609 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -3.105 11.029 1.462 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -4.683 11.473 2.122 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -4.306 14.911 1.416 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -5.362 13.668 2.096 1.00 0.00 H new ATOM 432 N LYS A 29 1.791 16.178 -1.209 1.00 0.00 N ATOM 433 CA LYS A 29 3.226 16.369 -1.365 1.00 0.00 C ATOM 434 C LYS A 29 4.014 15.750 -0.237 1.00 0.00 C ATOM 435 O LYS A 29 4.950 16.337 0.304 1.00 0.00 O ATOM 436 CB LYS A 29 3.602 17.814 -1.623 1.00 0.00 C ATOM 437 CG LYS A 29 2.489 18.617 -2.281 1.00 0.00 C ATOM 438 CD LYS A 29 2.629 18.715 -3.784 1.00 0.00 C ATOM 439 CE LYS A 29 3.769 19.628 -4.176 1.00 0.00 C ATOM 440 NZ LYS A 29 3.372 21.058 -4.209 1.00 0.00 N ATOM 0 H LYS A 29 1.284 16.167 -2.094 1.00 0.00 H new ATOM 0 HA LYS A 29 3.509 15.826 -2.267 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.872 18.286 -0.678 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.487 17.844 -2.259 1.00 0.00 H new ATOM 0 HG2 LYS A 29 1.530 18.158 -2.042 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.477 19.622 -1.858 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.797 17.722 -4.200 1.00 0.00 H new ATOM 0 HD3 LYS A 29 1.699 19.087 -4.214 1.00 0.00 H new ATOM 0 HE2 LYS A 29 4.591 19.499 -3.472 1.00 0.00 H new ATOM 0 HE3 LYS A 29 4.142 19.336 -5.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 4.190 21.639 -4.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 2.606 21.190 -4.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 3.041 21.348 -3.267 1.00 0.00 H new ATOM 450 N LEU A 30 3.797 14.453 -0.122 1.00 0.00 N ATOM 451 CA LEU A 30 4.605 13.611 0.729 1.00 0.00 C ATOM 452 C LEU A 30 5.871 13.298 -0.015 1.00 0.00 C ATOM 453 O LEU A 30 6.746 12.583 0.480 1.00 0.00 O ATOM 454 CB LEU A 30 3.865 12.320 1.074 1.00 0.00 C ATOM 455 CG LEU A 30 2.672 12.481 2.012 1.00 0.00 C ATOM 456 CD1 LEU A 30 2.053 11.129 2.317 1.00 0.00 C ATOM 457 CD2 LEU A 30 3.096 13.175 3.296 1.00 0.00 C ATOM 0 H LEU A 30 3.055 13.957 -0.617 1.00 0.00 H new ATOM 0 HA LEU A 30 4.824 14.124 1.665 1.00 0.00 H new ATOM 0 HB2 LEU A 30 3.518 11.861 0.148 1.00 0.00 H new ATOM 0 HB3 LEU A 30 4.572 11.626 1.528 1.00 0.00 H new ATOM 0 HG LEU A 30 1.923 13.100 1.518 1.00 0.00 H new ATOM 0 HD11 LEU A 30 1.203 11.261 2.987 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.715 10.666 1.390 1.00 0.00 H new ATOM 0 HD13 LEU A 30 2.795 10.488 2.793 1.00 0.00 H new ATOM 0 HD21 LEU A 30 2.233 13.282 3.954 1.00 0.00 H new ATOM 0 HD22 LEU A 30 3.861 12.581 3.795 1.00 0.00 H new ATOM 0 HD23 LEU A 30 3.498 14.161 3.061 1.00 0.00 H new ATOM 468 N GLY A 31 5.936 13.865 -1.224 1.00 0.00 N ATOM 469 CA GLY A 31 7.068 13.678 -2.095 1.00 0.00 C ATOM 470 C GLY A 31 8.382 13.840 -1.370 1.00 0.00 C ATOM 471 O GLY A 31 9.291 13.030 -1.500 1.00 0.00 O ATOM 0 H GLY A 31 5.204 14.460 -1.611 1.00 0.00 H new ATOM 0 HA2 GLY A 31 7.021 12.684 -2.540 1.00 0.00 H new ATOM 0 HA3 GLY A 31 7.016 14.396 -2.913 1.00 0.00 H new ATOM 475 N ALA A 32 8.417 14.850 -0.521 1.00 0.00 N ATOM 476 CA ALA A 32 9.563 15.106 0.338 1.00 0.00 C ATOM 477 C ALA A 32 9.090 15.484 1.738 1.00 0.00 C ATOM 478 O ALA A 32 8.158 16.278 1.877 1.00 0.00 O ATOM 479 CB ALA A 32 10.425 16.211 -0.250 1.00 0.00 C ATOM 0 H ALA A 32 7.654 15.517 -0.406 1.00 0.00 H new ATOM 0 HA ALA A 32 10.165 14.200 0.405 1.00 0.00 H new ATOM 0 HB1 ALA A 32 11.279 16.393 0.403 1.00 0.00 H new ATOM 0 HB2 ALA A 32 10.779 15.910 -1.236 1.00 0.00 H new ATOM 0 HB3 ALA A 32 9.836 17.124 -0.339 1.00 0.00 H new ATOM 485 N HIS A 33 9.762 14.958 2.767 1.00 0.00 N ATOM 486 CA HIS A 33 9.454 15.334 4.150 1.00 0.00 C ATOM 487 C HIS A 33 10.442 14.729 5.160 1.00 0.00 C ATOM 488 O HIS A 33 10.890 15.433 6.064 1.00 0.00 O ATOM 489 CB HIS A 33 8.003 14.982 4.542 1.00 0.00 C ATOM 490 CG HIS A 33 7.659 13.522 4.533 1.00 0.00 C ATOM 491 ND1 HIS A 33 7.581 12.767 3.384 1.00 0.00 N ATOM 492 CD2 HIS A 33 7.347 12.686 5.549 1.00 0.00 C ATOM 493 CE1 HIS A 33 7.232 11.532 3.695 1.00 0.00 C ATOM 494 NE2 HIS A 33 7.085 11.455 5.003 1.00 0.00 N ATOM 0 H HIS A 33 10.515 14.277 2.670 1.00 0.00 H new ATOM 0 HA HIS A 33 9.561 16.418 4.190 1.00 0.00 H new ATOM 0 HB2 HIS A 33 7.811 15.375 5.541 1.00 0.00 H new ATOM 0 HB3 HIS A 33 7.327 15.499 3.861 1.00 0.00 H new ATOM 0 HD1 HIS A 33 7.764 13.108 2.440 1.00 0.00 H new ATOM 0 HD2 HIS A 33 7.311 12.941 6.598 1.00 0.00 H new ATOM 0 HE1 HIS A 33 7.091 10.721 2.996 1.00 0.00 H new ATOM 502 N ALA A 34 10.757 13.432 5.043 1.00 0.00 N ATOM 503 CA ALA A 34 11.631 12.786 6.034 1.00 0.00 C ATOM 504 C ALA A 34 12.114 11.400 5.602 1.00 0.00 C ATOM 505 O ALA A 34 11.758 10.914 4.526 1.00 0.00 O ATOM 506 CB ALA A 34 10.906 12.677 7.366 1.00 0.00 C ATOM 0 H ALA A 34 10.430 12.822 4.293 1.00 0.00 H new ATOM 0 HA ALA A 34 12.515 13.416 6.128 1.00 0.00 H new ATOM 0 HB1 ALA A 34 11.558 12.198 8.097 1.00 0.00 H new ATOM 0 HB2 ALA A 34 10.638 13.674 7.717 1.00 0.00 H new ATOM 0 HB3 ALA A 34 10.002 12.081 7.240 1.00 0.00 H new ATOM 512 N ASN A 35 12.894 10.765 6.491 1.00 0.00 N ATOM 513 CA ASN A 35 13.427 9.413 6.281 1.00 0.00 C ATOM 514 C ASN A 35 12.466 8.367 6.846 1.00 0.00 C ATOM 515 O ASN A 35 11.428 8.728 7.412 1.00 0.00 O ATOM 516 CB ASN A 35 14.802 9.263 6.942 1.00 0.00 C ATOM 517 CG ASN A 35 15.835 10.215 6.370 1.00 0.00 C ATOM 518 OD1 ASN A 35 16.186 10.141 5.191 1.00 0.00 O ATOM 519 ND2 ASN A 35 16.332 11.114 7.204 1.00 0.00 N ATOM 0 H ASN A 35 13.173 11.179 7.380 1.00 0.00 H new ATOM 0 HA ASN A 35 13.535 9.255 5.208 1.00 0.00 H new ATOM 0 HB2 ASN A 35 14.706 9.439 8.013 1.00 0.00 H new ATOM 0 HB3 ASN A 35 15.150 8.238 6.817 1.00 0.00 H new ATOM 0 HD21 ASN A 35 17.033 11.780 6.878 1.00 0.00 H new ATOM 0 HD22 ASN A 35 16.014 11.142 8.173 1.00 0.00 H new ATOM 525 N LEU A 36 12.726 7.081 6.563 1.00 0.00 N ATOM 526 CA LEU A 36 11.766 6.035 6.870 1.00 0.00 C ATOM 527 C LEU A 36 12.377 4.663 6.746 1.00 0.00 C ATOM 528 O LEU A 36 13.412 4.508 6.101 1.00 0.00 O ATOM 529 CB LEU A 36 10.609 6.164 5.908 1.00 0.00 C ATOM 530 CG LEU A 36 11.044 6.490 4.496 1.00 0.00 C ATOM 531 CD1 LEU A 36 10.921 5.259 3.614 1.00 0.00 C ATOM 532 CD2 LEU A 36 10.245 7.676 3.982 1.00 0.00 C ATOM 0 H LEU A 36 13.587 6.753 6.126 1.00 0.00 H new ATOM 0 HA LEU A 36 11.433 6.151 7.901 1.00 0.00 H new ATOM 0 HB2 LEU A 36 10.044 5.232 5.902 1.00 0.00 H new ATOM 0 HB3 LEU A 36 9.934 6.943 6.263 1.00 0.00 H new ATOM 0 HG LEU A 36 12.095 6.778 4.479 1.00 0.00 H new ATOM 0 HD11 LEU A 36 11.237 5.505 2.600 1.00 0.00 H new ATOM 0 HD12 LEU A 36 11.554 4.464 4.008 1.00 0.00 H new ATOM 0 HD13 LEU A 36 9.884 4.924 3.600 1.00 0.00 H new ATOM 0 HD21 LEU A 36 10.558 7.912 2.965 1.00 0.00 H new ATOM 0 HD22 LEU A 36 9.183 7.429 3.987 1.00 0.00 H new ATOM 0 HD23 LEU A 36 10.420 8.539 4.625 1.00 0.00 H new ATOM 543 N LYS A 37 11.699 3.648 7.279 1.00 0.00 N ATOM 544 CA LYS A 37 12.158 2.304 7.055 1.00 0.00 C ATOM 545 C LYS A 37 11.008 1.392 6.672 1.00 0.00 C ATOM 546 O LYS A 37 9.938 1.444 7.280 1.00 0.00 O ATOM 547 CB LYS A 37 12.896 1.763 8.269 1.00 0.00 C ATOM 548 CG LYS A 37 11.984 1.472 9.442 1.00 0.00 C ATOM 549 CD LYS A 37 12.774 1.306 10.727 1.00 0.00 C ATOM 550 CE LYS A 37 13.747 0.139 10.650 1.00 0.00 C ATOM 551 NZ LYS A 37 14.412 -0.113 11.954 1.00 0.00 N ATOM 0 H LYS A 37 10.858 3.737 7.849 1.00 0.00 H new ATOM 0 HA LYS A 37 12.861 2.330 6.222 1.00 0.00 H new ATOM 0 HB2 LYS A 37 13.420 0.849 7.990 1.00 0.00 H new ATOM 0 HB3 LYS A 37 13.654 2.484 8.576 1.00 0.00 H new ATOM 0 HG2 LYS A 37 11.265 2.284 9.557 1.00 0.00 H new ATOM 0 HG3 LYS A 37 11.412 0.565 9.245 1.00 0.00 H new ATOM 0 HD2 LYS A 37 13.324 2.224 10.936 1.00 0.00 H new ATOM 0 HD3 LYS A 37 12.086 1.151 11.558 1.00 0.00 H new ATOM 0 HE2 LYS A 37 13.214 -0.758 10.335 1.00 0.00 H new ATOM 0 HE3 LYS A 37 14.502 0.345 9.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 15.067 -0.915 11.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 14.941 0.734 12.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 13.694 -0.334 12.673 1.00 0.00 H new ATOM 561 N LEU A 38 11.201 0.624 5.601 1.00 0.00 N ATOM 562 CA LEU A 38 10.169 -0.207 5.064 1.00 0.00 C ATOM 563 C LEU A 38 10.650 -1.650 5.084 1.00 0.00 C ATOM 564 O LEU A 38 11.837 -1.897 4.949 1.00 0.00 O ATOM 565 CB LEU A 38 9.875 0.235 3.645 1.00 0.00 C ATOM 566 CG LEU A 38 9.180 1.603 3.441 1.00 0.00 C ATOM 567 CD1 LEU A 38 8.077 1.483 2.409 1.00 0.00 C ATOM 568 CD2 LEU A 38 8.603 2.171 4.724 1.00 0.00 C ATOM 0 H LEU A 38 12.084 0.573 5.094 1.00 0.00 H new ATOM 0 HA LEU A 38 9.257 -0.125 5.656 1.00 0.00 H new ATOM 0 HB2 LEU A 38 10.818 0.254 3.099 1.00 0.00 H new ATOM 0 HB3 LEU A 38 9.253 -0.529 3.179 1.00 0.00 H new ATOM 0 HG LEU A 38 9.951 2.291 3.094 1.00 0.00 H new ATOM 0 HD11 LEU A 38 7.597 2.452 2.275 1.00 0.00 H new ATOM 0 HD12 LEU A 38 8.501 1.154 1.460 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.339 0.756 2.748 1.00 0.00 H new ATOM 0 HD21 LEU A 38 8.129 3.130 4.516 1.00 0.00 H new ATOM 0 HD22 LEU A 38 7.862 1.480 5.127 1.00 0.00 H new ATOM 0 HD23 LEU A 38 9.402 2.311 5.452 1.00 0.00 H new ATOM 579 N THR A 39 9.773 -2.538 5.475 1.00 0.00 N ATOM 580 CA THR A 39 10.124 -3.897 5.870 1.00 0.00 C ATOM 581 C THR A 39 8.961 -4.832 5.419 1.00 0.00 C ATOM 582 O THR A 39 7.982 -4.300 4.896 1.00 0.00 O ATOM 583 CB THR A 39 10.289 -3.893 7.399 1.00 0.00 C ATOM 584 OG1 THR A 39 11.131 -2.800 7.801 1.00 0.00 O ATOM 585 CG2 THR A 39 10.892 -5.192 7.908 1.00 0.00 C ATOM 0 H THR A 39 8.773 -2.343 5.532 1.00 0.00 H new ATOM 0 HA THR A 39 11.049 -4.249 5.413 1.00 0.00 H new ATOM 0 HB THR A 39 9.294 -3.783 7.830 1.00 0.00 H new ATOM 0 HG1 THR A 39 11.920 -2.764 7.220 1.00 0.00 H new ATOM 0 HG21 THR A 39 10.991 -5.147 8.993 1.00 0.00 H new ATOM 0 HG22 THR A 39 10.243 -6.025 7.637 1.00 0.00 H new ATOM 0 HG23 THR A 39 11.875 -5.337 7.460 1.00 0.00 H new ATOM 593 N ILE A 40 9.003 -6.184 5.538 1.00 0.00 N ATOM 594 CA ILE A 40 7.840 -6.966 5.148 1.00 0.00 C ATOM 595 C ILE A 40 7.898 -8.333 5.815 1.00 0.00 C ATOM 596 O ILE A 40 8.703 -9.185 5.448 1.00 0.00 O ATOM 597 CB ILE A 40 7.742 -7.234 3.611 1.00 0.00 C ATOM 598 CG1 ILE A 40 8.969 -8.001 3.105 1.00 0.00 C ATOM 599 CG2 ILE A 40 7.499 -5.985 2.783 1.00 0.00 C ATOM 600 CD1 ILE A 40 10.244 -7.207 2.994 1.00 0.00 C ATOM 0 H ILE A 40 9.798 -6.720 5.886 1.00 0.00 H new ATOM 0 HA ILE A 40 6.978 -6.374 5.456 1.00 0.00 H new ATOM 0 HB ILE A 40 6.857 -7.856 3.475 1.00 0.00 H new ATOM 0 HG12 ILE A 40 9.146 -8.844 3.772 1.00 0.00 H new ATOM 0 HG13 ILE A 40 8.735 -8.415 2.124 1.00 0.00 H new ATOM 0 HG21 ILE A 40 7.443 -6.253 1.728 1.00 0.00 H new ATOM 0 HG22 ILE A 40 6.561 -5.522 3.090 1.00 0.00 H new ATOM 0 HG23 ILE A 40 8.318 -5.282 2.936 1.00 0.00 H new ATOM 0 HD11 ILE A 40 11.043 -7.851 2.627 1.00 0.00 H new ATOM 0 HD12 ILE A 40 10.098 -6.379 2.300 1.00 0.00 H new ATOM 0 HD13 ILE A 40 10.515 -6.815 3.974 1.00 0.00 H new ATOM 611 N THR A 41 7.139 -8.541 6.853 1.00 0.00 N ATOM 612 CA THR A 41 7.270 -9.817 7.524 1.00 0.00 C ATOM 613 C THR A 41 6.162 -10.071 8.562 1.00 0.00 C ATOM 614 O THR A 41 5.982 -9.292 9.501 1.00 0.00 O ATOM 615 CB THR A 41 8.709 -9.917 8.101 1.00 0.00 C ATOM 616 OG1 THR A 41 9.037 -11.270 8.428 1.00 0.00 O ATOM 617 CG2 THR A 41 8.939 -9.028 9.301 1.00 0.00 C ATOM 0 H THR A 41 6.457 -7.890 7.242 1.00 0.00 H new ATOM 0 HA THR A 41 7.127 -10.623 6.804 1.00 0.00 H new ATOM 0 HB THR A 41 9.370 -9.561 7.311 1.00 0.00 H new ATOM 0 HG1 THR A 41 9.556 -11.667 7.697 1.00 0.00 H new ATOM 0 HG21 THR A 41 9.964 -9.148 9.652 1.00 0.00 H new ATOM 0 HG22 THR A 41 8.771 -7.988 9.021 1.00 0.00 H new ATOM 0 HG23 THR A 41 8.248 -9.305 10.097 1.00 0.00 H new ATOM 625 N GLN A 42 5.405 -11.169 8.383 1.00 0.00 N ATOM 626 CA GLN A 42 4.355 -11.542 9.318 1.00 0.00 C ATOM 627 C GLN A 42 3.744 -12.884 8.961 1.00 0.00 C ATOM 628 O GLN A 42 3.969 -13.875 9.650 1.00 0.00 O ATOM 629 CB GLN A 42 3.229 -10.516 9.365 1.00 0.00 C ATOM 630 CG GLN A 42 2.033 -11.035 10.140 1.00 0.00 C ATOM 631 CD GLN A 42 2.204 -10.979 11.650 1.00 0.00 C ATOM 632 OE1 GLN A 42 1.368 -11.493 12.394 1.00 0.00 O ATOM 633 NE2 GLN A 42 3.270 -10.340 12.113 1.00 0.00 N ATOM 0 H GLN A 42 5.510 -11.807 7.594 1.00 0.00 H new ATOM 0 HA GLN A 42 4.838 -11.594 10.294 1.00 0.00 H new ATOM 0 HB2 GLN A 42 3.592 -9.598 9.827 1.00 0.00 H new ATOM 0 HB3 GLN A 42 2.924 -10.263 8.350 1.00 0.00 H new ATOM 0 HG2 GLN A 42 1.153 -10.455 9.862 1.00 0.00 H new ATOM 0 HG3 GLN A 42 1.841 -12.066 9.844 1.00 0.00 H new ATOM 0 HE21 GLN A 42 3.940 -9.928 11.463 1.00 0.00 H new ATOM 0 HE22 GLN A 42 3.420 -10.261 13.119 1.00 0.00 H new ATOM 640 N GLU A 43 2.906 -12.898 7.931 1.00 0.00 N ATOM 641 CA GLU A 43 2.199 -14.100 7.575 1.00 0.00 C ATOM 642 C GLU A 43 2.668 -14.541 6.216 1.00 0.00 C ATOM 643 O GLU A 43 3.230 -13.717 5.489 1.00 0.00 O ATOM 644 CB GLU A 43 0.687 -13.884 7.567 1.00 0.00 C ATOM 645 CG GLU A 43 0.173 -13.214 8.824 1.00 0.00 C ATOM 646 CD GLU A 43 -1.333 -13.189 8.910 1.00 0.00 C ATOM 647 OE1 GLU A 43 -1.981 -12.670 7.979 1.00 0.00 O ATOM 648 OE2 GLU A 43 -1.873 -13.676 9.922 1.00 0.00 O ATOM 0 H GLU A 43 2.707 -12.092 7.338 1.00 0.00 H new ATOM 0 HA GLU A 43 2.409 -14.868 8.319 1.00 0.00 H new ATOM 0 HB2 GLU A 43 0.418 -13.276 6.703 1.00 0.00 H new ATOM 0 HB3 GLU A 43 0.190 -14.846 7.447 1.00 0.00 H new ATOM 0 HG2 GLU A 43 0.572 -13.735 9.695 1.00 0.00 H new ATOM 0 HG3 GLU A 43 0.550 -12.192 8.863 1.00 0.00 H new ATOM 653 N GLY A 44 2.370 -15.758 5.770 1.00 0.00 N ATOM 654 CA GLY A 44 2.774 -16.009 4.429 1.00 0.00 C ATOM 655 C GLY A 44 1.628 -16.017 3.452 1.00 0.00 C ATOM 656 O GLY A 44 1.462 -16.958 2.678 1.00 0.00 O ATOM 0 H GLY A 44 1.896 -16.508 6.273 1.00 0.00 H new ATOM 0 HA2 GLY A 44 3.495 -15.250 4.126 1.00 0.00 H new ATOM 0 HA3 GLY A 44 3.286 -16.970 4.385 1.00 0.00 H new ATOM 660 N ASN A 45 1.322 -14.781 3.155 1.00 0.00 N ATOM 661 CA ASN A 45 0.762 -14.298 1.910 1.00 0.00 C ATOM 662 C ASN A 45 0.746 -12.822 2.137 1.00 0.00 C ATOM 663 O ASN A 45 -0.147 -12.309 2.810 1.00 0.00 O ATOM 664 CB ASN A 45 -0.665 -14.798 1.590 1.00 0.00 C ATOM 665 CG ASN A 45 -1.654 -14.798 2.767 1.00 0.00 C ATOM 666 OD1 ASN A 45 -2.860 -14.689 2.551 1.00 0.00 O ATOM 667 ND2 ASN A 45 -1.181 -14.982 3.999 1.00 0.00 N ATOM 0 H ASN A 45 1.467 -14.025 3.825 1.00 0.00 H new ATOM 0 HA ASN A 45 1.342 -14.649 1.057 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -1.077 -14.178 0.794 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -0.595 -15.813 1.199 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -1.824 -15.035 4.789 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -0.176 -15.069 4.152 1.00 0.00 H new ATOM 673 N LYS A 46 1.871 -12.217 1.884 1.00 0.00 N ATOM 674 CA LYS A 46 2.086 -10.920 2.467 1.00 0.00 C ATOM 675 C LYS A 46 3.378 -10.303 1.988 1.00 0.00 C ATOM 676 O LYS A 46 4.380 -11.005 1.877 1.00 0.00 O ATOM 677 CB LYS A 46 2.196 -11.065 3.998 1.00 0.00 C ATOM 678 CG LYS A 46 1.184 -10.276 4.804 1.00 0.00 C ATOM 679 CD LYS A 46 1.406 -10.536 6.282 1.00 0.00 C ATOM 680 CE LYS A 46 0.422 -9.799 7.166 1.00 0.00 C ATOM 681 NZ LYS A 46 -0.972 -10.281 6.991 1.00 0.00 N ATOM 0 H LYS A 46 2.627 -12.580 1.303 1.00 0.00 H new ATOM 0 HA LYS A 46 1.248 -10.287 2.176 1.00 0.00 H new ATOM 0 HB2 LYS A 46 2.095 -12.120 4.253 1.00 0.00 H new ATOM 0 HB3 LYS A 46 3.196 -10.758 4.303 1.00 0.00 H new ATOM 0 HG2 LYS A 46 1.283 -9.212 4.592 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.172 -10.565 4.520 1.00 0.00 H new ATOM 0 HD2 LYS A 46 1.327 -11.606 6.473 1.00 0.00 H new ATOM 0 HD3 LYS A 46 2.420 -10.239 6.549 1.00 0.00 H new ATOM 0 HE2 LYS A 46 0.716 -9.918 8.209 1.00 0.00 H new ATOM 0 HE3 LYS A 46 0.465 -8.733 6.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -1.580 -9.857 7.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -1.318 -10.007 6.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -0.995 -11.317 7.081 1.00 0.00 H new ATOM 691 N PHE A 47 3.441 -9.027 2.240 1.00 0.00 N ATOM 692 CA PHE A 47 4.706 -8.325 2.378 1.00 0.00 C ATOM 693 C PHE A 47 4.433 -7.197 3.341 1.00 0.00 C ATOM 694 O PHE A 47 3.707 -6.286 2.990 1.00 0.00 O ATOM 695 CB PHE A 47 5.202 -7.756 1.045 1.00 0.00 C ATOM 696 CG PHE A 47 5.867 -8.750 0.140 1.00 0.00 C ATOM 697 CD1 PHE A 47 5.118 -9.593 -0.655 1.00 0.00 C ATOM 698 CD2 PHE A 47 7.249 -8.829 0.076 1.00 0.00 C ATOM 699 CE1 PHE A 47 5.728 -10.492 -1.500 1.00 0.00 C ATOM 700 CE2 PHE A 47 7.865 -9.730 -0.766 1.00 0.00 C ATOM 701 CZ PHE A 47 7.100 -10.562 -1.558 1.00 0.00 C ATOM 0 H PHE A 47 2.620 -8.433 2.358 1.00 0.00 H new ATOM 0 HA PHE A 47 5.483 -9.005 2.727 1.00 0.00 H new ATOM 0 HB2 PHE A 47 4.356 -7.316 0.517 1.00 0.00 H new ATOM 0 HB3 PHE A 47 5.904 -6.948 1.251 1.00 0.00 H new ATOM 0 HD1 PHE A 47 4.040 -9.547 -0.614 1.00 0.00 H new ATOM 0 HD2 PHE A 47 7.850 -8.177 0.693 1.00 0.00 H new ATOM 0 HE1 PHE A 47 5.128 -11.143 -2.118 1.00 0.00 H new ATOM 0 HE2 PHE A 47 8.943 -9.785 -0.806 1.00 0.00 H new ATOM 0 HZ PHE A 47 7.578 -11.267 -2.222 1.00 0.00 H new ATOM 710 N THR A 48 4.822 -7.333 4.602 1.00 0.00 N ATOM 711 CA THR A 48 4.264 -6.427 5.585 1.00 0.00 C ATOM 712 C THR A 48 5.137 -6.146 6.748 1.00 0.00 C ATOM 713 O THR A 48 5.030 -6.863 7.733 1.00 0.00 O ATOM 714 CB THR A 48 2.987 -7.010 6.189 1.00 0.00 C ATOM 715 OG1 THR A 48 2.019 -7.169 5.202 1.00 0.00 O ATOM 716 CG2 THR A 48 2.472 -6.089 7.270 1.00 0.00 C ATOM 0 H THR A 48 5.486 -8.024 4.952 1.00 0.00 H new ATOM 0 HA THR A 48 4.108 -5.508 5.020 1.00 0.00 H new ATOM 0 HB THR A 48 3.210 -7.985 6.622 1.00 0.00 H new ATOM 0 HG1 THR A 48 2.149 -6.493 4.505 1.00 0.00 H new ATOM 0 HG21 THR A 48 1.561 -6.506 7.700 1.00 0.00 H new ATOM 0 HG22 THR A 48 3.227 -5.985 8.050 1.00 0.00 H new ATOM 0 HG23 THR A 48 2.256 -5.110 6.842 1.00 0.00 H new ATOM 724 N VAL A 49 5.732 -4.960 6.744 1.00 0.00 N ATOM 725 CA VAL A 49 6.293 -4.381 7.938 1.00 0.00 C ATOM 726 C VAL A 49 6.783 -2.991 7.601 1.00 0.00 C ATOM 727 O VAL A 49 7.664 -2.905 6.810 1.00 0.00 O ATOM 728 CB VAL A 49 7.538 -5.126 8.445 1.00 0.00 C ATOM 729 CG1 VAL A 49 8.212 -4.323 9.538 1.00 0.00 C ATOM 730 CG2 VAL A 49 7.264 -6.494 8.956 1.00 0.00 C ATOM 0 H VAL A 49 5.834 -4.381 5.911 1.00 0.00 H new ATOM 0 HA VAL A 49 5.511 -4.415 8.696 1.00 0.00 H new ATOM 0 HB VAL A 49 8.187 -5.237 7.576 1.00 0.00 H new ATOM 0 HG11 VAL A 49 9.093 -4.858 9.892 1.00 0.00 H new ATOM 0 HG12 VAL A 49 8.511 -3.352 9.144 1.00 0.00 H new ATOM 0 HG13 VAL A 49 7.517 -4.181 10.366 1.00 0.00 H new ATOM 0 HG21 VAL A 49 8.195 -6.949 9.294 1.00 0.00 H new ATOM 0 HG22 VAL A 49 6.564 -6.438 9.790 1.00 0.00 H new ATOM 0 HG23 VAL A 49 6.832 -7.100 8.160 1.00 0.00 H new ATOM 740 N LYS A 50 6.498 -1.939 8.313 1.00 0.00 N ATOM 741 CA LYS A 50 7.353 -0.771 8.086 1.00 0.00 C ATOM 742 C LYS A 50 7.129 0.285 9.124 1.00 0.00 C ATOM 743 O LYS A 50 6.207 1.068 9.015 1.00 0.00 O ATOM 744 CB LYS A 50 7.172 -0.172 6.679 1.00 0.00 C ATOM 745 CG LYS A 50 6.027 -0.756 5.877 1.00 0.00 C ATOM 746 CD LYS A 50 6.170 -0.495 4.398 1.00 0.00 C ATOM 747 CE LYS A 50 5.133 -1.277 3.613 1.00 0.00 C ATOM 748 NZ LYS A 50 5.089 -0.869 2.179 1.00 0.00 N ATOM 0 H LYS A 50 5.752 -1.846 9.002 1.00 0.00 H new ATOM 0 HA LYS A 50 8.379 -1.129 8.165 1.00 0.00 H new ATOM 0 HB2 LYS A 50 7.017 0.903 6.775 1.00 0.00 H new ATOM 0 HB3 LYS A 50 8.097 -0.312 6.119 1.00 0.00 H new ATOM 0 HG2 LYS A 50 5.976 -1.831 6.050 1.00 0.00 H new ATOM 0 HG3 LYS A 50 5.087 -0.332 6.229 1.00 0.00 H new ATOM 0 HD2 LYS A 50 6.057 0.571 4.199 1.00 0.00 H new ATOM 0 HD3 LYS A 50 7.170 -0.776 4.069 1.00 0.00 H new ATOM 0 HE2 LYS A 50 5.356 -2.342 3.680 1.00 0.00 H new ATOM 0 HE3 LYS A 50 4.151 -1.128 4.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 4.800 -1.680 1.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 4.405 -0.095 2.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 6.032 -0.547 1.881 1.00 0.00 H new ATOM 758 N GLU A 51 8.000 0.371 10.099 1.00 0.00 N ATOM 759 CA GLU A 51 7.776 1.331 11.143 1.00 0.00 C ATOM 760 C GLU A 51 8.952 2.304 11.289 1.00 0.00 C ATOM 761 O GLU A 51 9.653 2.271 12.303 1.00 0.00 O ATOM 762 CB GLU A 51 7.666 0.508 12.432 1.00 0.00 C ATOM 763 CG GLU A 51 6.838 -0.760 12.269 1.00 0.00 C ATOM 764 CD GLU A 51 7.017 -1.733 13.417 1.00 0.00 C ATOM 765 OE1 GLU A 51 6.933 -1.303 14.587 1.00 0.00 O ATOM 766 OE2 GLU A 51 7.232 -2.937 13.152 1.00 0.00 O ATOM 0 H GLU A 51 8.844 -0.194 10.189 1.00 0.00 H new ATOM 0 HA GLU A 51 6.889 1.926 10.925 1.00 0.00 H new ATOM 0 HB2 GLU A 51 8.667 0.239 12.770 1.00 0.00 H new ATOM 0 HB3 GLU A 51 7.222 1.126 13.212 1.00 0.00 H new ATOM 0 HG2 GLU A 51 5.785 -0.492 12.187 1.00 0.00 H new ATOM 0 HG3 GLU A 51 7.115 -1.251 11.336 1.00 0.00 H new ATOM 771 N SER A 52 8.964 3.344 10.455 1.00 0.00 N ATOM 772 CA SER A 52 9.776 4.520 10.677 1.00 0.00 C ATOM 773 C SER A 52 9.461 5.557 9.613 1.00 0.00 C ATOM 774 O SER A 52 9.533 5.250 8.433 1.00 0.00 O ATOM 775 CB SER A 52 11.251 4.149 10.687 1.00 0.00 C ATOM 776 OG SER A 52 12.064 5.035 9.954 1.00 0.00 O ATOM 0 H SER A 52 8.404 3.385 9.604 1.00 0.00 H new ATOM 0 HA SER A 52 9.545 4.950 11.651 1.00 0.00 H new ATOM 0 HB2 SER A 52 11.601 4.118 11.719 1.00 0.00 H new ATOM 0 HB3 SER A 52 11.366 3.144 10.281 1.00 0.00 H new ATOM 0 HG SER A 52 12.997 4.740 10.003 1.00 0.00 H new ATOM 781 N SER A 53 9.128 6.765 10.030 1.00 0.00 N ATOM 782 CA SER A 53 8.952 7.890 9.125 1.00 0.00 C ATOM 783 C SER A 53 8.944 9.152 9.960 1.00 0.00 C ATOM 784 O SER A 53 8.241 9.207 10.970 1.00 0.00 O ATOM 785 CB SER A 53 7.665 7.801 8.289 1.00 0.00 C ATOM 786 OG SER A 53 7.709 6.736 7.355 1.00 0.00 O ATOM 0 H SER A 53 8.971 6.996 11.011 1.00 0.00 H new ATOM 0 HA SER A 53 9.773 7.887 8.408 1.00 0.00 H new ATOM 0 HB2 SER A 53 6.811 7.666 8.952 1.00 0.00 H new ATOM 0 HB3 SER A 53 7.511 8.741 7.759 1.00 0.00 H new ATOM 0 HG SER A 53 8.497 6.180 7.529 1.00 0.00 H new ATOM 791 N ASN A 54 9.879 10.050 9.657 1.00 0.00 N ATOM 792 CA ASN A 54 10.130 11.249 10.467 1.00 0.00 C ATOM 793 C ASN A 54 10.862 10.883 11.762 1.00 0.00 C ATOM 794 O ASN A 54 11.954 11.383 12.021 1.00 0.00 O ATOM 795 CB ASN A 54 8.830 12.005 10.774 1.00 0.00 C ATOM 796 CG ASN A 54 9.079 13.325 11.474 1.00 0.00 C ATOM 797 OD1 ASN A 54 9.804 14.183 10.967 1.00 0.00 O ATOM 798 ND2 ASN A 54 8.474 13.499 12.637 1.00 0.00 N ATOM 0 H ASN A 54 10.487 9.970 8.842 1.00 0.00 H new ATOM 0 HA ASN A 54 10.768 11.913 9.884 1.00 0.00 H new ATOM 0 HB2 ASN A 54 8.291 12.186 9.844 1.00 0.00 H new ATOM 0 HB3 ASN A 54 8.189 11.382 11.398 1.00 0.00 H new ATOM 0 HD21 ASN A 54 8.599 14.371 13.151 1.00 0.00 H new ATOM 0 HD22 ASN A 54 7.882 12.761 13.020 1.00 0.00 H new ATOM 804 N PHE A 55 10.326 9.912 12.496 1.00 0.00 N ATOM 805 CA PHE A 55 10.989 9.377 13.681 1.00 0.00 C ATOM 806 C PHE A 55 10.305 8.086 14.134 1.00 0.00 C ATOM 807 O PHE A 55 10.867 6.998 14.007 1.00 0.00 O ATOM 808 CB PHE A 55 10.978 10.402 14.822 1.00 0.00 C ATOM 809 CG PHE A 55 11.745 9.962 16.037 1.00 0.00 C ATOM 810 CD1 PHE A 55 13.054 9.519 15.921 1.00 0.00 C ATOM 811 CD2 PHE A 55 11.160 9.989 17.292 1.00 0.00 C ATOM 812 CE1 PHE A 55 13.763 9.109 17.033 1.00 0.00 C ATOM 813 CE2 PHE A 55 11.865 9.582 18.408 1.00 0.00 C ATOM 814 CZ PHE A 55 13.168 9.141 18.279 1.00 0.00 C ATOM 0 H PHE A 55 9.427 9.477 12.288 1.00 0.00 H new ATOM 0 HA PHE A 55 12.025 9.159 13.421 1.00 0.00 H new ATOM 0 HB2 PHE A 55 11.397 11.341 14.459 1.00 0.00 H new ATOM 0 HB3 PHE A 55 9.946 10.603 15.108 1.00 0.00 H new ATOM 0 HD1 PHE A 55 13.525 9.494 14.949 1.00 0.00 H new ATOM 0 HD2 PHE A 55 10.142 10.332 17.399 1.00 0.00 H new ATOM 0 HE1 PHE A 55 14.781 8.764 16.928 1.00 0.00 H new ATOM 0 HE2 PHE A 55 11.398 9.609 19.381 1.00 0.00 H new ATOM 0 HZ PHE A 55 13.720 8.822 19.151 1.00 0.00 H new ATOM 823 N ARG A 56 9.056 8.206 14.566 1.00 0.00 N ATOM 824 CA ARG A 56 8.260 7.051 14.967 1.00 0.00 C ATOM 825 C ARG A 56 7.207 6.774 13.906 1.00 0.00 C ATOM 826 O ARG A 56 6.604 7.710 13.381 1.00 0.00 O ATOM 827 CB ARG A 56 7.589 7.320 16.319 1.00 0.00 C ATOM 828 CG ARG A 56 6.868 6.115 16.908 1.00 0.00 C ATOM 829 CD ARG A 56 7.846 5.031 17.341 1.00 0.00 C ATOM 830 NE ARG A 56 8.796 5.513 18.346 1.00 0.00 N ATOM 831 CZ ARG A 56 8.470 5.832 19.602 1.00 0.00 C ATOM 832 NH1 ARG A 56 7.252 5.576 20.067 1.00 0.00 N ATOM 833 NH2 ARG A 56 9.380 6.364 20.405 1.00 0.00 N ATOM 0 H ARG A 56 8.569 9.098 14.648 1.00 0.00 H new ATOM 0 HA ARG A 56 8.908 6.181 15.068 1.00 0.00 H new ATOM 0 HB2 ARG A 56 8.346 7.658 17.027 1.00 0.00 H new ATOM 0 HB3 ARG A 56 6.875 8.135 16.202 1.00 0.00 H new ATOM 0 HG2 ARG A 56 6.271 6.430 17.764 1.00 0.00 H new ATOM 0 HG3 ARG A 56 6.177 5.708 16.170 1.00 0.00 H new ATOM 0 HD2 ARG A 56 7.291 4.184 17.744 1.00 0.00 H new ATOM 0 HD3 ARG A 56 8.393 4.669 16.471 1.00 0.00 H new ATOM 0 HE ARG A 56 9.773 5.612 18.068 1.00 0.00 H new ATOM 0 HH11 ARG A 56 6.559 5.133 19.464 1.00 0.00 H new ATOM 0 HH12 ARG A 56 7.010 5.822 21.027 1.00 0.00 H new ATOM 0 HH21 ARG A 56 10.327 6.529 20.064 1.00 0.00 H new ATOM 0 HH22 ARG A 56 9.133 6.608 21.364 1.00 0.00 H new ATOM 844 N ASN A 57 7.027 5.511 13.530 1.00 0.00 N ATOM 845 CA ASN A 57 6.081 5.164 12.502 1.00 0.00 C ATOM 846 C ASN A 57 5.875 3.693 12.492 1.00 0.00 C ATOM 847 O ASN A 57 6.568 2.972 13.197 1.00 0.00 O ATOM 848 CB ASN A 57 6.528 5.621 11.125 1.00 0.00 C ATOM 849 CG ASN A 57 5.450 6.432 10.447 1.00 0.00 C ATOM 850 OD1 ASN A 57 4.441 5.895 9.989 1.00 0.00 O ATOM 851 ND2 ASN A 57 5.644 7.739 10.421 1.00 0.00 N ATOM 0 H ASN A 57 7.530 4.718 13.929 1.00 0.00 H new ATOM 0 HA ASN A 57 5.148 5.679 12.731 1.00 0.00 H new ATOM 0 HB2 ASN A 57 7.436 6.218 11.213 1.00 0.00 H new ATOM 0 HB3 ASN A 57 6.775 4.754 10.513 1.00 0.00 H new ATOM 0 HD21 ASN A 57 4.940 8.351 10.008 1.00 0.00 H new ATOM 0 HD22 ASN A 57 6.498 8.136 10.814 1.00 0.00 H new ATOM 857 N ILE A 58 4.882 3.268 11.746 1.00 0.00 N ATOM 858 CA ILE A 58 4.595 1.892 11.563 1.00 0.00 C ATOM 859 C ILE A 58 3.544 1.737 10.515 1.00 0.00 C ATOM 860 O ILE A 58 2.481 2.357 10.578 1.00 0.00 O ATOM 861 CB ILE A 58 4.193 1.192 12.853 1.00 0.00 C ATOM 862 CG1 ILE A 58 3.471 -0.143 12.543 1.00 0.00 C ATOM 863 CG2 ILE A 58 3.343 2.119 13.721 1.00 0.00 C ATOM 864 CD1 ILE A 58 3.505 -1.138 13.680 1.00 0.00 C ATOM 0 H ILE A 58 4.248 3.892 11.247 1.00 0.00 H new ATOM 0 HA ILE A 58 5.513 1.405 11.234 1.00 0.00 H new ATOM 0 HB ILE A 58 5.091 0.949 13.421 1.00 0.00 H new ATOM 0 HG12 ILE A 58 2.432 0.068 12.289 1.00 0.00 H new ATOM 0 HG13 ILE A 58 3.928 -0.596 11.663 1.00 0.00 H new ATOM 0 HG21 ILE A 58 3.064 1.603 14.640 1.00 0.00 H new ATOM 0 HG22 ILE A 58 3.915 3.013 13.967 1.00 0.00 H new ATOM 0 HG23 ILE A 58 2.442 2.403 13.177 1.00 0.00 H new ATOM 0 HD11 ILE A 58 2.979 -2.046 13.385 1.00 0.00 H new ATOM 0 HD12 ILE A 58 4.540 -1.380 13.920 1.00 0.00 H new ATOM 0 HD13 ILE A 58 3.021 -0.706 14.556 1.00 0.00 H new ATOM 875 N ASP A 59 3.801 0.843 9.619 1.00 0.00 N ATOM 876 CA ASP A 59 2.830 0.506 8.644 1.00 0.00 C ATOM 877 C ASP A 59 2.944 -0.969 8.363 1.00 0.00 C ATOM 878 O ASP A 59 3.729 -1.422 7.535 1.00 0.00 O ATOM 879 CB ASP A 59 3.068 1.321 7.374 1.00 0.00 C ATOM 880 CG ASP A 59 2.035 1.055 6.291 1.00 0.00 C ATOM 881 OD1 ASP A 59 0.834 1.300 6.543 1.00 0.00 O ATOM 882 OD2 ASP A 59 2.422 0.626 5.178 1.00 0.00 O ATOM 0 H ASP A 59 4.681 0.333 9.545 1.00 0.00 H new ATOM 0 HA ASP A 59 1.827 0.734 9.005 1.00 0.00 H new ATOM 0 HB2 ASP A 59 3.059 2.382 7.624 1.00 0.00 H new ATOM 0 HB3 ASP A 59 4.060 1.094 6.985 1.00 0.00 H new ATOM 886 N VAL A 60 2.172 -1.715 9.093 1.00 0.00 N ATOM 887 CA VAL A 60 2.154 -3.145 8.955 1.00 0.00 C ATOM 888 C VAL A 60 0.703 -3.611 8.708 1.00 0.00 C ATOM 889 O VAL A 60 -0.087 -3.785 9.635 1.00 0.00 O ATOM 890 CB VAL A 60 2.779 -3.808 10.225 1.00 0.00 C ATOM 891 CG1 VAL A 60 4.136 -3.187 10.516 1.00 0.00 C ATOM 892 CG2 VAL A 60 1.910 -3.663 11.467 1.00 0.00 C ATOM 0 H VAL A 60 1.535 -1.352 9.802 1.00 0.00 H new ATOM 0 HA VAL A 60 2.756 -3.453 8.100 1.00 0.00 H new ATOM 0 HB VAL A 60 2.868 -4.871 10.002 1.00 0.00 H new ATOM 0 HG11 VAL A 60 4.567 -3.653 11.402 1.00 0.00 H new ATOM 0 HG12 VAL A 60 4.798 -3.345 9.665 1.00 0.00 H new ATOM 0 HG13 VAL A 60 4.017 -2.118 10.690 1.00 0.00 H new ATOM 0 HG21 VAL A 60 2.401 -4.145 12.313 1.00 0.00 H new ATOM 0 HG22 VAL A 60 1.763 -2.606 11.687 1.00 0.00 H new ATOM 0 HG23 VAL A 60 0.943 -4.135 11.292 1.00 0.00 H new ATOM 902 N VAL A 61 0.362 -3.823 7.439 1.00 0.00 N ATOM 903 CA VAL A 61 -0.980 -4.287 7.058 1.00 0.00 C ATOM 904 C VAL A 61 -1.008 -4.726 5.602 1.00 0.00 C ATOM 905 O VAL A 61 -1.261 -3.920 4.720 1.00 0.00 O ATOM 906 CB VAL A 61 -2.072 -3.190 7.234 1.00 0.00 C ATOM 907 CG1 VAL A 61 -2.744 -3.278 8.595 1.00 0.00 C ATOM 908 CG2 VAL A 61 -1.499 -1.793 7.014 1.00 0.00 C ATOM 0 H VAL A 61 0.995 -3.682 6.652 1.00 0.00 H new ATOM 0 HA VAL A 61 -1.200 -5.120 7.725 1.00 0.00 H new ATOM 0 HB VAL A 61 -2.830 -3.373 6.472 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -3.499 -2.496 8.679 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -3.218 -4.254 8.705 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -1.998 -3.147 9.378 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -2.287 -1.052 7.144 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -0.704 -1.608 7.736 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -1.096 -1.720 6.004 1.00 0.00 H new ATOM 918 N PHE A 62 -0.952 -6.022 5.362 1.00 0.00 N ATOM 919 CA PHE A 62 -1.145 -6.551 4.014 1.00 0.00 C ATOM 920 C PHE A 62 -1.776 -7.921 4.108 1.00 0.00 C ATOM 921 O PHE A 62 -1.829 -8.524 5.180 1.00 0.00 O ATOM 922 CB PHE A 62 0.150 -6.693 3.190 1.00 0.00 C ATOM 923 CG PHE A 62 0.953 -5.440 2.929 1.00 0.00 C ATOM 924 CD1 PHE A 62 1.458 -4.687 3.970 1.00 0.00 C ATOM 925 CD2 PHE A 62 1.280 -5.073 1.637 1.00 0.00 C ATOM 926 CE1 PHE A 62 2.248 -3.592 3.742 1.00 0.00 C ATOM 927 CE2 PHE A 62 2.087 -3.976 1.395 1.00 0.00 C ATOM 928 CZ PHE A 62 2.571 -3.234 2.449 1.00 0.00 C ATOM 0 H PHE A 62 -0.776 -6.730 6.075 1.00 0.00 H new ATOM 0 HA PHE A 62 -1.777 -5.826 3.501 1.00 0.00 H new ATOM 0 HB2 PHE A 62 0.797 -7.406 3.701 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -0.111 -7.132 2.227 1.00 0.00 H new ATOM 0 HD1 PHE A 62 1.225 -4.968 4.987 1.00 0.00 H new ATOM 0 HD2 PHE A 62 0.901 -5.650 0.806 1.00 0.00 H new ATOM 0 HE1 PHE A 62 2.618 -3.009 4.573 1.00 0.00 H new ATOM 0 HE2 PHE A 62 2.337 -3.702 0.381 1.00 0.00 H new ATOM 0 HZ PHE A 62 3.200 -2.376 2.265 1.00 0.00 H new ATOM 937 N GLU A 63 -2.271 -8.382 2.987 1.00 0.00 N ATOM 938 CA GLU A 63 -2.925 -9.653 2.875 1.00 0.00 C ATOM 939 C GLU A 63 -2.694 -10.084 1.469 1.00 0.00 C ATOM 940 O GLU A 63 -2.306 -9.248 0.655 1.00 0.00 O ATOM 941 CB GLU A 63 -4.413 -9.481 3.148 1.00 0.00 C ATOM 942 CG GLU A 63 -5.179 -10.783 3.313 1.00 0.00 C ATOM 943 CD GLU A 63 -4.781 -11.529 4.565 1.00 0.00 C ATOM 944 OE1 GLU A 63 -5.041 -11.021 5.671 1.00 0.00 O ATOM 945 OE2 GLU A 63 -4.200 -12.625 4.447 1.00 0.00 O ATOM 0 H GLU A 63 -2.227 -7.868 2.107 1.00 0.00 H new ATOM 0 HA GLU A 63 -2.546 -10.387 3.586 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -4.537 -8.884 4.052 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -4.857 -8.915 2.329 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -6.248 -10.572 3.343 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -5.004 -11.417 2.444 1.00 0.00 H new ATOM 950 N LEU A 64 -2.948 -11.338 1.157 1.00 0.00 N ATOM 951 CA LEU A 64 -2.829 -11.770 -0.214 1.00 0.00 C ATOM 952 C LEU A 64 -3.734 -10.878 -1.053 1.00 0.00 C ATOM 953 O LEU A 64 -3.352 -10.406 -2.102 1.00 0.00 O ATOM 954 CB LEU A 64 -3.222 -13.225 -0.361 1.00 0.00 C ATOM 955 CG LEU A 64 -2.711 -13.927 -1.622 1.00 0.00 C ATOM 956 CD1 LEU A 64 -2.563 -15.416 -1.375 1.00 0.00 C ATOM 957 CD2 LEU A 64 -3.654 -13.695 -2.791 1.00 0.00 C ATOM 0 H LEU A 64 -3.232 -12.060 1.820 1.00 0.00 H new ATOM 0 HA LEU A 64 -1.795 -11.687 -0.548 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -2.857 -13.770 0.509 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -4.310 -13.292 -0.346 1.00 0.00 H new ATOM 0 HG LEU A 64 -1.737 -13.505 -1.869 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -2.199 -15.901 -2.281 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -1.853 -15.582 -0.565 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -3.530 -15.837 -1.102 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -3.269 -14.204 -3.675 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -4.641 -14.089 -2.546 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -3.729 -12.626 -2.991 1.00 0.00 H new ATOM 968 N GLY A 65 -4.788 -10.410 -0.397 1.00 0.00 N ATOM 969 CA GLY A 65 -5.548 -9.297 -0.914 1.00 0.00 C ATOM 970 C GLY A 65 -6.069 -8.447 0.222 1.00 0.00 C ATOM 971 O GLY A 65 -7.047 -8.798 0.877 1.00 0.00 O ATOM 0 H GLY A 65 -5.129 -10.786 0.488 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -4.922 -8.694 -1.571 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -6.380 -9.664 -1.515 1.00 0.00 H new ATOM 975 N VAL A 66 -5.301 -7.425 0.554 1.00 0.00 N ATOM 976 CA VAL A 66 -5.562 -6.588 1.712 1.00 0.00 C ATOM 977 C VAL A 66 -6.318 -5.348 1.293 1.00 0.00 C ATOM 978 O VAL A 66 -6.482 -5.119 0.117 1.00 0.00 O ATOM 979 CB VAL A 66 -4.241 -6.134 2.368 1.00 0.00 C ATOM 980 CG1 VAL A 66 -3.654 -4.898 1.676 1.00 0.00 C ATOM 981 CG2 VAL A 66 -4.452 -5.889 3.851 1.00 0.00 C ATOM 0 H VAL A 66 -4.473 -7.150 0.025 1.00 0.00 H new ATOM 0 HA VAL A 66 -6.146 -7.175 2.420 1.00 0.00 H new ATOM 0 HB VAL A 66 -3.512 -6.936 2.248 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.725 -4.612 2.169 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.454 -5.128 0.629 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -4.366 -4.075 1.737 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -3.514 -5.569 4.304 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -5.204 -5.112 3.988 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -4.790 -6.809 4.327 1.00 0.00 H new ATOM 991 N ASP A 67 -6.735 -4.539 2.248 1.00 0.00 N ATOM 992 CA ASP A 67 -7.186 -3.199 1.920 1.00 0.00 C ATOM 993 C ASP A 67 -6.639 -2.193 2.912 1.00 0.00 C ATOM 994 O ASP A 67 -6.710 -2.366 4.128 1.00 0.00 O ATOM 995 CB ASP A 67 -8.705 -3.037 1.782 1.00 0.00 C ATOM 996 CG ASP A 67 -9.456 -3.181 3.095 1.00 0.00 C ATOM 997 OD1 ASP A 67 -9.447 -4.287 3.674 1.00 0.00 O ATOM 998 OD2 ASP A 67 -10.068 -2.188 3.549 1.00 0.00 O ATOM 0 H ASP A 67 -6.771 -4.779 3.239 1.00 0.00 H new ATOM 0 HA ASP A 67 -6.785 -3.006 0.925 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -8.920 -2.057 1.356 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -9.078 -3.780 1.077 1.00 0.00 H new ATOM 1002 N PHE A 68 -6.155 -1.112 2.353 1.00 0.00 N ATOM 1003 CA PHE A 68 -5.700 0.032 3.094 1.00 0.00 C ATOM 1004 C PHE A 68 -6.761 1.072 2.985 1.00 0.00 C ATOM 1005 O PHE A 68 -7.370 1.214 1.930 1.00 0.00 O ATOM 1006 CB PHE A 68 -4.433 0.639 2.483 1.00 0.00 C ATOM 1007 CG PHE A 68 -3.144 -0.051 2.808 1.00 0.00 C ATOM 1008 CD1 PHE A 68 -2.905 -1.349 2.403 1.00 0.00 C ATOM 1009 CD2 PHE A 68 -2.148 0.628 3.490 1.00 0.00 C ATOM 1010 CE1 PHE A 68 -1.702 -1.960 2.679 1.00 0.00 C ATOM 1011 CE2 PHE A 68 -0.939 0.024 3.766 1.00 0.00 C ATOM 1012 CZ PHE A 68 -0.716 -1.274 3.360 1.00 0.00 C ATOM 0 H PHE A 68 -6.065 -1.003 1.343 1.00 0.00 H new ATOM 0 HA PHE A 68 -5.491 -0.277 4.118 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -4.549 0.654 1.399 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -4.358 1.676 2.810 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -3.669 -1.890 1.865 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -2.320 1.645 3.810 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -1.529 -2.978 2.362 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.171 0.566 4.298 1.00 0.00 H new ATOM 0 HZ PHE A 68 0.228 -1.753 3.574 1.00 0.00 H new ATOM 1021 N ALA A 69 -6.882 1.893 3.977 1.00 0.00 N ATOM 1022 CA ALA A 69 -7.689 3.058 3.819 1.00 0.00 C ATOM 1023 C ALA A 69 -7.491 4.026 4.975 1.00 0.00 C ATOM 1024 O ALA A 69 -8.100 3.903 6.036 1.00 0.00 O ATOM 1025 CB ALA A 69 -9.136 2.644 3.635 1.00 0.00 C ATOM 0 H ALA A 69 -6.441 1.782 4.890 1.00 0.00 H new ATOM 0 HA ALA A 69 -7.381 3.599 2.924 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -9.756 3.532 3.514 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -9.225 2.016 2.749 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -9.469 2.086 4.510 1.00 0.00 H new ATOM 1031 N TYR A 70 -6.668 5.023 4.708 1.00 0.00 N ATOM 1032 CA TYR A 70 -6.360 6.085 5.629 1.00 0.00 C ATOM 1033 C TYR A 70 -5.691 7.174 4.840 1.00 0.00 C ATOM 1034 O TYR A 70 -5.257 6.934 3.737 1.00 0.00 O ATOM 1035 CB TYR A 70 -5.471 5.584 6.764 1.00 0.00 C ATOM 1036 CG TYR A 70 -4.136 4.981 6.356 1.00 0.00 C ATOM 1037 CD1 TYR A 70 -3.084 5.784 5.930 1.00 0.00 C ATOM 1038 CD2 TYR A 70 -3.921 3.609 6.426 1.00 0.00 C ATOM 1039 CE1 TYR A 70 -1.861 5.240 5.586 1.00 0.00 C ATOM 1040 CE2 TYR A 70 -2.699 3.057 6.080 1.00 0.00 C ATOM 1041 CZ TYR A 70 -1.673 3.875 5.663 1.00 0.00 C ATOM 1042 OH TYR A 70 -0.453 3.334 5.322 1.00 0.00 O ATOM 0 H TYR A 70 -6.184 5.113 3.815 1.00 0.00 H new ATOM 0 HA TYR A 70 -7.267 6.465 6.099 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -5.278 6.416 7.441 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -6.026 4.836 7.329 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -3.225 6.853 5.867 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -4.721 2.963 6.756 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -1.056 5.881 5.258 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -2.551 1.989 6.137 1.00 0.00 H new ATOM 0 HH TYR A 70 -0.240 2.597 5.932 1.00 0.00 H new ATOM 1051 N SER A 71 -5.726 8.392 5.286 1.00 0.00 N ATOM 1052 CA SER A 71 -5.280 9.424 4.412 1.00 0.00 C ATOM 1053 C SER A 71 -3.866 9.801 4.737 1.00 0.00 C ATOM 1054 O SER A 71 -3.554 10.259 5.838 1.00 0.00 O ATOM 1055 CB SER A 71 -6.205 10.615 4.441 1.00 0.00 C ATOM 1056 OG SER A 71 -5.796 11.640 3.559 1.00 0.00 O ATOM 0 H SER A 71 -6.044 8.685 6.210 1.00 0.00 H new ATOM 0 HA SER A 71 -5.300 9.044 3.391 1.00 0.00 H new ATOM 0 HB2 SER A 71 -7.213 10.294 4.178 1.00 0.00 H new ATOM 0 HB3 SER A 71 -6.251 11.010 5.456 1.00 0.00 H new ATOM 0 HG SER A 71 -6.581 12.138 3.250 1.00 0.00 H new ATOM 1061 N LEU A 72 -3.012 9.383 3.825 1.00 0.00 N ATOM 1062 CA LEU A 72 -1.562 9.465 3.972 1.00 0.00 C ATOM 1063 C LEU A 72 -1.109 10.849 4.468 1.00 0.00 C ATOM 1064 O LEU A 72 -0.051 10.973 5.086 1.00 0.00 O ATOM 1065 CB LEU A 72 -0.883 9.121 2.638 1.00 0.00 C ATOM 1066 CG LEU A 72 -1.383 7.828 1.964 1.00 0.00 C ATOM 1067 CD1 LEU A 72 -2.452 8.142 0.925 1.00 0.00 C ATOM 1068 CD2 LEU A 72 -0.236 7.041 1.328 1.00 0.00 C ATOM 0 H LEU A 72 -3.306 8.968 2.941 1.00 0.00 H new ATOM 0 HA LEU A 72 -1.262 8.740 4.729 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -1.030 9.952 1.948 1.00 0.00 H new ATOM 0 HB3 LEU A 72 0.190 9.033 2.807 1.00 0.00 H new ATOM 0 HG LEU A 72 -1.822 7.203 2.742 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.792 7.216 0.461 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -3.295 8.636 1.408 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -2.035 8.799 0.161 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -0.629 6.137 0.863 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.251 7.656 0.571 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.488 6.769 2.096 1.00 0.00 H new ATOM 1079 N ALA A 73 -1.929 11.879 4.236 1.00 0.00 N ATOM 1080 CA ALA A 73 -1.607 13.220 4.715 1.00 0.00 C ATOM 1081 C ALA A 73 -2.851 14.104 4.905 1.00 0.00 C ATOM 1082 O ALA A 73 -2.770 15.316 4.703 1.00 0.00 O ATOM 1083 CB ALA A 73 -0.633 13.893 3.758 1.00 0.00 C ATOM 0 H ALA A 73 -2.809 11.809 3.726 1.00 0.00 H new ATOM 0 HA ALA A 73 -1.148 13.104 5.697 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -0.398 14.893 4.122 1.00 0.00 H new ATOM 0 HB2 ALA A 73 0.282 13.304 3.697 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -1.085 13.964 2.769 1.00 0.00 H new ATOM 1089 N ASP A 74 -3.947 13.529 5.427 1.00 0.00 N ATOM 1090 CA ASP A 74 -5.145 14.317 5.781 1.00 0.00 C ATOM 1091 C ASP A 74 -6.257 13.409 6.333 1.00 0.00 C ATOM 1092 O ASP A 74 -5.967 12.390 6.967 1.00 0.00 O ATOM 1093 CB ASP A 74 -5.668 15.106 4.572 1.00 0.00 C ATOM 1094 CG ASP A 74 -6.559 16.264 4.980 1.00 0.00 C ATOM 1095 OD1 ASP A 74 -6.055 17.227 5.594 1.00 0.00 O ATOM 1096 OD2 ASP A 74 -7.778 16.203 4.713 1.00 0.00 O ATOM 0 H ASP A 74 -4.031 12.530 5.613 1.00 0.00 H new ATOM 0 HA ASP A 74 -4.852 15.025 6.556 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -4.824 15.486 3.996 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -6.225 14.436 3.917 1.00 0.00 H new ATOM 1100 N GLY A 75 -7.519 13.743 6.034 1.00 0.00 N ATOM 1101 CA GLY A 75 -8.645 12.915 6.443 1.00 0.00 C ATOM 1102 C GLY A 75 -8.821 11.730 5.520 1.00 0.00 C ATOM 1103 O GLY A 75 -8.802 11.905 4.301 1.00 0.00 O ATOM 0 H GLY A 75 -7.779 14.580 5.512 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -8.489 12.564 7.463 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -9.556 13.513 6.448 1.00 0.00 H new ATOM 1107 N THR A 76 -8.832 10.532 6.123 1.00 0.00 N ATOM 1108 CA THR A 76 -8.800 9.228 5.431 1.00 0.00 C ATOM 1109 C THR A 76 -9.083 9.275 3.936 1.00 0.00 C ATOM 1110 O THR A 76 -10.149 9.698 3.485 1.00 0.00 O ATOM 1111 CB THR A 76 -9.762 8.236 6.109 1.00 0.00 C ATOM 1112 OG1 THR A 76 -10.836 8.946 6.747 1.00 0.00 O ATOM 1113 CG2 THR A 76 -9.034 7.385 7.133 1.00 0.00 C ATOM 0 H THR A 76 -8.864 10.437 7.138 1.00 0.00 H new ATOM 0 HA THR A 76 -7.767 8.893 5.522 1.00 0.00 H new ATOM 0 HB THR A 76 -10.168 7.580 5.339 1.00 0.00 H new ATOM 0 HG1 THR A 76 -11.443 8.306 7.174 1.00 0.00 H new ATOM 0 HG21 THR A 76 -9.737 6.693 7.597 1.00 0.00 H new ATOM 0 HG22 THR A 76 -8.242 6.821 6.640 1.00 0.00 H new ATOM 0 HG23 THR A 76 -8.600 8.028 7.898 1.00 0.00 H new ATOM 1121 N GLU A 77 -8.120 8.743 3.181 1.00 0.00 N ATOM 1122 CA GLU A 77 -8.217 8.653 1.743 1.00 0.00 C ATOM 1123 C GLU A 77 -7.120 7.740 1.220 1.00 0.00 C ATOM 1124 O GLU A 77 -5.968 8.127 1.040 1.00 0.00 O ATOM 1125 CB GLU A 77 -8.172 10.060 1.178 1.00 0.00 C ATOM 1126 CG GLU A 77 -6.798 10.658 1.011 1.00 0.00 C ATOM 1127 CD GLU A 77 -6.823 12.106 0.596 1.00 0.00 C ATOM 1128 OE1 GLU A 77 -7.106 12.961 1.456 1.00 0.00 O ATOM 1129 OE2 GLU A 77 -6.527 12.388 -0.581 1.00 0.00 O ATOM 0 H GLU A 77 -7.253 8.364 3.561 1.00 0.00 H new ATOM 0 HA GLU A 77 -9.158 8.206 1.422 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -8.666 10.057 0.207 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -8.754 10.711 1.830 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -6.253 10.566 1.951 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -6.248 10.083 0.266 1.00 0.00 H new ATOM 1134 N LEU A 78 -7.478 6.488 1.045 1.00 0.00 N ATOM 1135 CA LEU A 78 -6.536 5.514 0.586 1.00 0.00 C ATOM 1136 C LEU A 78 -7.189 4.198 0.281 1.00 0.00 C ATOM 1137 O LEU A 78 -8.303 3.904 0.700 1.00 0.00 O ATOM 1138 CB LEU A 78 -5.410 5.335 1.600 1.00 0.00 C ATOM 1139 CG LEU A 78 -4.386 4.236 1.340 1.00 0.00 C ATOM 1140 CD1 LEU A 78 -3.584 4.527 0.080 1.00 0.00 C ATOM 1141 CD2 LEU A 78 -3.457 4.090 2.533 1.00 0.00 C ATOM 0 H LEU A 78 -8.417 6.128 1.216 1.00 0.00 H new ATOM 0 HA LEU A 78 -6.112 5.888 -0.346 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -4.874 6.281 1.675 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -5.863 5.147 2.573 1.00 0.00 H new ATOM 0 HG LEU A 78 -4.922 3.299 1.193 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -2.860 3.728 -0.083 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -4.258 4.586 -0.775 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -3.058 5.475 0.194 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -2.731 3.302 2.334 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -2.934 5.031 2.704 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -4.039 3.832 3.418 1.00 0.00 H new ATOM 1152 N THR A 79 -6.441 3.440 -0.443 1.00 0.00 N ATOM 1153 CA THR A 79 -6.785 2.128 -0.870 1.00 0.00 C ATOM 1154 C THR A 79 -5.834 1.159 -0.307 1.00 0.00 C ATOM 1155 O THR A 79 -4.638 1.449 -0.230 1.00 0.00 O ATOM 1156 CB THR A 79 -6.605 1.998 -2.378 1.00 0.00 C ATOM 1157 OG1 THR A 79 -5.379 1.322 -2.690 1.00 0.00 O ATOM 1158 CG2 THR A 79 -6.590 3.360 -3.009 1.00 0.00 C ATOM 0 H THR A 79 -5.522 3.735 -0.771 1.00 0.00 H new ATOM 0 HA THR A 79 -7.813 1.946 -0.558 1.00 0.00 H new ATOM 0 HB THR A 79 -7.439 1.416 -2.770 1.00 0.00 H new ATOM 0 HG1 THR A 79 -5.300 1.220 -3.661 1.00 0.00 H new ATOM 0 HG21 THR A 79 -6.461 3.260 -4.087 1.00 0.00 H new ATOM 0 HG22 THR A 79 -7.532 3.867 -2.802 1.00 0.00 H new ATOM 0 HG23 THR A 79 -5.766 3.943 -2.597 1.00 0.00 H new ATOM 1166 N GLY A 80 -6.243 -0.059 -0.401 1.00 0.00 N ATOM 1167 CA GLY A 80 -5.266 -1.040 -0.422 1.00 0.00 C ATOM 1168 C GLY A 80 -5.704 -2.334 -0.979 1.00 0.00 C ATOM 1169 O GLY A 80 -6.802 -2.782 -0.725 1.00 0.00 O ATOM 0 H GLY A 80 -7.212 -0.372 -0.461 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -4.419 -0.677 -1.004 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -4.909 -1.200 0.595 1.00 0.00 H new ATOM 1173 N THR A 81 -4.714 -2.997 -1.473 1.00 0.00 N ATOM 1174 CA THR A 81 -4.714 -4.398 -1.734 1.00 0.00 C ATOM 1175 C THR A 81 -3.312 -4.691 -2.074 1.00 0.00 C ATOM 1176 O THR A 81 -2.618 -3.801 -2.541 1.00 0.00 O ATOM 1177 CB THR A 81 -5.611 -4.911 -2.875 1.00 0.00 C ATOM 1178 OG1 THR A 81 -6.879 -4.283 -2.839 1.00 0.00 O ATOM 1179 CG2 THR A 81 -5.847 -6.395 -2.726 1.00 0.00 C ATOM 0 H THR A 81 -3.831 -2.550 -1.720 1.00 0.00 H new ATOM 0 HA THR A 81 -5.125 -4.899 -0.857 1.00 0.00 H new ATOM 0 HB THR A 81 -5.102 -4.688 -3.813 1.00 0.00 H new ATOM 0 HG1 THR A 81 -7.127 -4.100 -1.909 1.00 0.00 H new ATOM 0 HG21 THR A 81 -6.483 -6.746 -3.539 1.00 0.00 H new ATOM 0 HG22 THR A 81 -4.893 -6.920 -2.759 1.00 0.00 H new ATOM 0 HG23 THR A 81 -6.336 -6.592 -1.772 1.00 0.00 H new ATOM 1187 N TRP A 82 -2.898 -5.895 -1.914 1.00 0.00 N ATOM 1188 CA TRP A 82 -1.588 -6.266 -2.361 1.00 0.00 C ATOM 1189 C TRP A 82 -1.604 -7.728 -2.726 1.00 0.00 C ATOM 1190 O TRP A 82 -1.505 -8.582 -1.860 1.00 0.00 O ATOM 1191 CB TRP A 82 -0.560 -5.982 -1.255 1.00 0.00 C ATOM 1192 CG TRP A 82 -0.429 -4.525 -0.993 1.00 0.00 C ATOM 1193 CD1 TRP A 82 -1.183 -3.769 -0.151 1.00 0.00 C ATOM 1194 CD2 TRP A 82 0.447 -3.637 -1.660 1.00 0.00 C ATOM 1195 NE1 TRP A 82 -0.833 -2.454 -0.260 1.00 0.00 N ATOM 1196 CE2 TRP A 82 0.193 -2.342 -1.171 1.00 0.00 C ATOM 1197 CE3 TRP A 82 1.428 -3.824 -2.614 1.00 0.00 C ATOM 1198 CZ2 TRP A 82 0.902 -1.228 -1.627 1.00 0.00 C ATOM 1199 CZ3 TRP A 82 2.129 -2.737 -3.062 1.00 0.00 C ATOM 1200 CH2 TRP A 82 1.872 -1.455 -2.576 1.00 0.00 C ATOM 0 H TRP A 82 -3.438 -6.644 -1.480 1.00 0.00 H new ATOM 0 HA TRP A 82 -1.304 -5.682 -3.237 1.00 0.00 H new ATOM 0 HB2 TRP A 82 -0.859 -6.492 -0.339 1.00 0.00 H new ATOM 0 HB3 TRP A 82 0.409 -6.389 -1.544 1.00 0.00 H new ATOM 0 HD1 TRP A 82 -1.948 -4.153 0.508 1.00 0.00 H new ATOM 0 HE1 TRP A 82 -1.261 -1.681 0.250 1.00 0.00 H new ATOM 0 HE3 TRP A 82 1.638 -4.811 -3.000 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 0.698 -0.236 -1.252 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 2.898 -2.875 -3.808 1.00 0.00 H new ATOM 0 HH2 TRP A 82 2.447 -0.622 -2.953 1.00 0.00 H new ATOM 1210 N THR A 83 -1.732 -8.014 -4.007 1.00 0.00 N ATOM 1211 CA THR A 83 -1.853 -9.387 -4.435 1.00 0.00 C ATOM 1212 C THR A 83 -0.776 -9.751 -5.429 1.00 0.00 C ATOM 1213 O THR A 83 -0.963 -9.654 -6.636 1.00 0.00 O ATOM 1214 CB THR A 83 -3.204 -9.615 -5.115 1.00 0.00 C ATOM 1215 OG1 THR A 83 -4.185 -8.679 -4.611 1.00 0.00 O ATOM 1216 CG2 THR A 83 -3.674 -11.048 -4.878 1.00 0.00 C ATOM 0 H THR A 83 -1.754 -7.323 -4.757 1.00 0.00 H new ATOM 0 HA THR A 83 -1.758 -10.007 -3.544 1.00 0.00 H new ATOM 0 HB THR A 83 -3.088 -9.454 -6.187 1.00 0.00 H new ATOM 0 HG1 THR A 83 -5.044 -8.835 -5.055 1.00 0.00 H new ATOM 0 HG21 THR A 83 -4.637 -11.201 -5.366 1.00 0.00 H new ATOM 0 HG22 THR A 83 -2.943 -11.744 -5.291 1.00 0.00 H new ATOM 0 HG23 THR A 83 -3.778 -11.224 -3.807 1.00 0.00 H new ATOM 1224 N MET A 84 0.266 -10.335 -4.929 1.00 0.00 N ATOM 1225 CA MET A 84 1.358 -10.762 -5.754 1.00 0.00 C ATOM 1226 C MET A 84 1.939 -12.050 -5.256 1.00 0.00 C ATOM 1227 O MET A 84 1.716 -12.465 -4.117 1.00 0.00 O ATOM 1228 CB MET A 84 2.449 -9.706 -5.852 1.00 0.00 C ATOM 1229 CG MET A 84 2.765 -8.967 -4.570 1.00 0.00 C ATOM 1230 SD MET A 84 3.111 -10.020 -3.152 1.00 0.00 S ATOM 1231 CE MET A 84 1.586 -9.883 -2.224 1.00 0.00 C ATOM 0 H MET A 84 0.387 -10.531 -3.935 1.00 0.00 H new ATOM 0 HA MET A 84 0.951 -10.919 -6.753 1.00 0.00 H new ATOM 0 HB2 MET A 84 3.361 -10.185 -6.208 1.00 0.00 H new ATOM 0 HB3 MET A 84 2.156 -8.977 -6.607 1.00 0.00 H new ATOM 0 HG2 MET A 84 3.626 -8.321 -4.743 1.00 0.00 H new ATOM 0 HG3 MET A 84 1.924 -8.318 -4.325 1.00 0.00 H new ATOM 0 HE1 MET A 84 1.812 -9.623 -1.190 1.00 0.00 H new ATOM 0 HE2 MET A 84 0.960 -9.107 -2.665 1.00 0.00 H new ATOM 0 HE3 MET A 84 1.056 -10.835 -2.252 1.00 0.00 H new ATOM 1239 N GLU A 85 2.810 -12.576 -6.064 1.00 0.00 N ATOM 1240 CA GLU A 85 3.626 -13.701 -5.661 1.00 0.00 C ATOM 1241 C GLU A 85 4.827 -13.640 -6.498 1.00 0.00 C ATOM 1242 O GLU A 85 4.755 -13.908 -7.693 1.00 0.00 O ATOM 1243 CB GLU A 85 3.022 -15.041 -6.005 1.00 0.00 C ATOM 1244 CG GLU A 85 1.507 -15.145 -5.927 1.00 0.00 C ATOM 1245 CD GLU A 85 0.829 -14.772 -7.229 1.00 0.00 C ATOM 1246 OE1 GLU A 85 1.531 -14.379 -8.187 1.00 0.00 O ATOM 1247 OE2 GLU A 85 -0.410 -14.884 -7.308 1.00 0.00 O ATOM 0 H GLU A 85 2.981 -12.247 -7.014 1.00 0.00 H new ATOM 0 HA GLU A 85 3.770 -13.632 -4.583 1.00 0.00 H new ATOM 0 HB2 GLU A 85 3.330 -15.304 -7.017 1.00 0.00 H new ATOM 0 HB3 GLU A 85 3.450 -15.789 -5.337 1.00 0.00 H new ATOM 0 HG2 GLU A 85 1.230 -16.164 -5.657 1.00 0.00 H new ATOM 0 HG3 GLU A 85 1.142 -14.494 -5.132 1.00 0.00 H new ATOM 1252 N GLY A 86 5.815 -13.019 -6.001 1.00 0.00 N ATOM 1253 CA GLY A 86 6.803 -12.670 -6.899 1.00 0.00 C ATOM 1254 C GLY A 86 7.938 -12.035 -6.259 1.00 0.00 C ATOM 1255 O GLY A 86 7.788 -11.369 -5.233 1.00 0.00 O ATOM 0 H GLY A 86 5.952 -12.756 -5.025 1.00 0.00 H new ATOM 0 HA2 GLY A 86 7.140 -13.562 -7.427 1.00 0.00 H new ATOM 0 HA3 GLY A 86 6.387 -11.995 -7.647 1.00 0.00 H new ATOM 1259 N ASN A 87 8.827 -11.803 -7.140 1.00 0.00 N ATOM 1260 CA ASN A 87 9.676 -10.674 -6.993 1.00 0.00 C ATOM 1261 C ASN A 87 8.824 -9.408 -7.283 1.00 0.00 C ATOM 1262 O ASN A 87 9.303 -8.489 -7.936 1.00 0.00 O ATOM 1263 CB ASN A 87 10.816 -10.818 -8.007 1.00 0.00 C ATOM 1264 CG ASN A 87 11.904 -9.773 -7.877 1.00 0.00 C ATOM 1265 OD1 ASN A 87 12.565 -9.670 -6.845 1.00 0.00 O ATOM 1266 ND2 ASN A 87 12.110 -9.005 -8.936 1.00 0.00 N ATOM 0 H ASN A 87 8.993 -12.372 -7.970 1.00 0.00 H new ATOM 0 HA ASN A 87 10.099 -10.596 -5.992 1.00 0.00 H new ATOM 0 HB2 ASN A 87 11.263 -11.806 -7.895 1.00 0.00 H new ATOM 0 HB3 ASN A 87 10.400 -10.768 -9.013 1.00 0.00 H new ATOM 0 HD21 ASN A 87 12.841 -8.294 -8.916 1.00 0.00 H new ATOM 0 HD22 ASN A 87 11.538 -9.125 -9.772 1.00 0.00 H new ATOM 1272 N LYS A 88 7.506 -9.390 -6.902 1.00 0.00 N ATOM 1273 CA LYS A 88 6.663 -8.280 -7.269 1.00 0.00 C ATOM 1274 C LYS A 88 5.613 -8.009 -6.222 1.00 0.00 C ATOM 1275 O LYS A 88 5.274 -8.883 -5.448 1.00 0.00 O ATOM 1276 CB LYS A 88 5.929 -8.555 -8.589 1.00 0.00 C ATOM 1277 CG LYS A 88 4.486 -9.048 -8.397 1.00 0.00 C ATOM 1278 CD LYS A 88 4.369 -10.562 -8.418 1.00 0.00 C ATOM 1279 CE LYS A 88 4.843 -11.138 -9.746 1.00 0.00 C ATOM 1280 NZ LYS A 88 4.513 -12.582 -9.893 1.00 0.00 N ATOM 0 H LYS A 88 7.048 -10.122 -6.359 1.00 0.00 H new ATOM 0 HA LYS A 88 7.323 -7.419 -7.369 1.00 0.00 H new ATOM 0 HB2 LYS A 88 5.917 -7.643 -9.185 1.00 0.00 H new ATOM 0 HB3 LYS A 88 6.486 -9.300 -9.157 1.00 0.00 H new ATOM 0 HG2 LYS A 88 4.103 -8.673 -7.448 1.00 0.00 H new ATOM 0 HG3 LYS A 88 3.857 -8.629 -9.183 1.00 0.00 H new ATOM 0 HD2 LYS A 88 4.959 -10.985 -7.605 1.00 0.00 H new ATOM 0 HD3 LYS A 88 3.332 -10.851 -8.244 1.00 0.00 H new ATOM 0 HE2 LYS A 88 4.387 -10.580 -10.564 1.00 0.00 H new ATOM 0 HE3 LYS A 88 5.921 -11.005 -9.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 5.102 -12.998 -10.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 4.698 -13.073 -8.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 3.509 -12.685 -10.144 1.00 0.00 H new ATOM 1290 N LEU A 89 5.111 -6.788 -6.278 1.00 0.00 N ATOM 1291 CA LEU A 89 3.916 -6.326 -5.598 1.00 0.00 C ATOM 1292 C LEU A 89 2.823 -6.037 -6.626 1.00 0.00 C ATOM 1293 O LEU A 89 3.118 -5.444 -7.654 1.00 0.00 O ATOM 1294 CB LEU A 89 4.223 -5.029 -4.878 1.00 0.00 C ATOM 1295 CG LEU A 89 4.690 -5.178 -3.468 1.00 0.00 C ATOM 1296 CD1 LEU A 89 4.915 -3.823 -2.805 1.00 0.00 C ATOM 1297 CD2 LEU A 89 3.718 -6.065 -2.691 1.00 0.00 C ATOM 0 H LEU A 89 5.552 -6.052 -6.830 1.00 0.00 H new ATOM 0 HA LEU A 89 3.588 -7.092 -4.896 1.00 0.00 H new ATOM 0 HB2 LEU A 89 4.986 -4.492 -5.441 1.00 0.00 H new ATOM 0 HB3 LEU A 89 3.327 -4.409 -4.883 1.00 0.00 H new ATOM 0 HG LEU A 89 5.661 -5.672 -3.466 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.254 -3.971 -1.780 1.00 0.00 H new ATOM 0 HD12 LEU A 89 5.670 -3.267 -3.360 1.00 0.00 H new ATOM 0 HD13 LEU A 89 3.981 -3.261 -2.800 1.00 0.00 H new ATOM 0 HD21 LEU A 89 4.064 -6.170 -1.663 1.00 0.00 H new ATOM 0 HD22 LEU A 89 2.727 -5.610 -2.696 1.00 0.00 H new ATOM 0 HD23 LEU A 89 3.668 -7.048 -3.159 1.00 0.00 H new ATOM 1308 N VAL A 90 1.557 -6.338 -6.335 1.00 0.00 N ATOM 1309 CA VAL A 90 0.499 -5.868 -7.211 1.00 0.00 C ATOM 1310 C VAL A 90 -0.866 -6.066 -6.572 1.00 0.00 C ATOM 1311 O VAL A 90 -1.382 -7.162 -6.497 1.00 0.00 O ATOM 1312 CB VAL A 90 0.551 -6.548 -8.592 1.00 0.00 C ATOM 1313 CG1 VAL A 90 0.617 -8.067 -8.483 1.00 0.00 C ATOM 1314 CG2 VAL A 90 -0.619 -6.090 -9.441 1.00 0.00 C ATOM 0 H VAL A 90 1.252 -6.885 -5.530 1.00 0.00 H new ATOM 0 HA VAL A 90 0.660 -4.801 -7.363 1.00 0.00 H new ATOM 0 HB VAL A 90 1.473 -6.242 -9.086 1.00 0.00 H new ATOM 0 HG11 VAL A 90 0.652 -8.502 -9.482 1.00 0.00 H new ATOM 0 HG12 VAL A 90 1.512 -8.354 -7.931 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -0.266 -8.433 -7.959 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -0.574 -6.576 -10.416 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -1.553 -6.355 -8.946 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -0.572 -5.009 -9.572 1.00 0.00 H new ATOM 1324 N GLY A 91 -1.424 -5.007 -6.068 1.00 0.00 N ATOM 1325 CA GLY A 91 -2.661 -5.117 -5.340 1.00 0.00 C ATOM 1326 C GLY A 91 -3.256 -3.784 -5.123 1.00 0.00 C ATOM 1327 O GLY A 91 -2.524 -2.812 -5.035 1.00 0.00 O ATOM 0 H GLY A 91 -1.049 -4.061 -6.144 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -3.359 -5.747 -5.891 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -2.483 -5.602 -4.380 1.00 0.00 H new ATOM 1331 N LYS A 92 -4.571 -3.688 -5.153 1.00 0.00 N ATOM 1332 CA LYS A 92 -5.139 -2.387 -5.191 1.00 0.00 C ATOM 1333 C LYS A 92 -6.556 -2.263 -4.735 1.00 0.00 C ATOM 1334 O LYS A 92 -7.416 -3.105 -5.007 1.00 0.00 O ATOM 1335 CB LYS A 92 -5.008 -1.914 -6.588 1.00 0.00 C ATOM 1336 CG LYS A 92 -6.006 -0.839 -7.018 1.00 0.00 C ATOM 1337 CD LYS A 92 -5.772 -0.393 -8.426 1.00 0.00 C ATOM 1338 CE LYS A 92 -6.490 -1.242 -9.398 1.00 0.00 C ATOM 1339 NZ LYS A 92 -5.550 -2.151 -10.080 1.00 0.00 N ATOM 0 H LYS A 92 -5.229 -4.468 -5.152 1.00 0.00 H new ATOM 0 HA LYS A 92 -4.595 -1.780 -4.468 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -4.000 -1.525 -6.728 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -5.114 -2.770 -7.254 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -7.020 -1.227 -6.924 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -5.928 0.017 -6.348 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -6.097 0.642 -8.538 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -4.704 -0.417 -8.642 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -7.259 -1.821 -8.886 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -6.998 -0.616 -10.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -6.079 -2.931 -10.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -5.032 -1.627 -10.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -4.876 -2.536 -9.388 1.00 0.00 H new ATOM 1349 N PHE A 93 -6.796 -1.081 -4.226 1.00 0.00 N ATOM 1350 CA PHE A 93 -8.083 -0.649 -3.809 1.00 0.00 C ATOM 1351 C PHE A 93 -8.297 0.721 -4.265 1.00 0.00 C ATOM 1352 O PHE A 93 -7.420 1.318 -4.878 1.00 0.00 O ATOM 1353 CB PHE A 93 -8.270 -0.700 -2.326 1.00 0.00 C ATOM 1354 CG PHE A 93 -9.337 -1.670 -1.949 1.00 0.00 C ATOM 1355 CD1 PHE A 93 -9.352 -2.909 -2.539 1.00 0.00 C ATOM 1356 CD2 PHE A 93 -10.324 -1.343 -1.041 1.00 0.00 C ATOM 1357 CE1 PHE A 93 -10.332 -3.828 -2.230 1.00 0.00 C ATOM 1358 CE2 PHE A 93 -11.310 -2.255 -0.719 1.00 0.00 C ATOM 1359 CZ PHE A 93 -11.314 -3.501 -1.314 1.00 0.00 C ATOM 0 H PHE A 93 -6.069 -0.378 -4.091 1.00 0.00 H new ATOM 0 HA PHE A 93 -8.807 -1.334 -4.249 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -7.332 -0.984 -1.848 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -8.529 0.292 -1.955 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -8.586 -3.168 -3.255 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -10.325 -0.367 -0.579 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -10.332 -4.800 -2.702 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -12.076 -1.994 -0.004 1.00 0.00 H new ATOM 0 HZ PHE A 93 -12.082 -4.218 -1.064 1.00 0.00 H new ATOM 1368 N LYS A 94 -9.457 1.208 -3.983 1.00 0.00 N ATOM 1369 CA LYS A 94 -9.771 2.545 -4.255 1.00 0.00 C ATOM 1370 C LYS A 94 -9.675 3.344 -2.971 1.00 0.00 C ATOM 1371 O LYS A 94 -9.616 2.768 -1.889 1.00 0.00 O ATOM 1372 CB LYS A 94 -11.164 2.641 -4.794 1.00 0.00 C ATOM 1373 CG LYS A 94 -12.176 2.824 -3.684 1.00 0.00 C ATOM 1374 CD LYS A 94 -12.401 1.536 -2.885 1.00 0.00 C ATOM 1375 CE LYS A 94 -12.901 1.811 -1.470 1.00 0.00 C ATOM 1376 NZ LYS A 94 -11.850 2.422 -0.603 1.00 0.00 N ATOM 0 H LYS A 94 -10.212 0.674 -3.553 1.00 0.00 H new ATOM 0 HA LYS A 94 -9.074 2.939 -4.994 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -11.229 3.478 -5.489 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -11.400 1.739 -5.358 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -11.836 3.612 -3.011 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -13.123 3.155 -4.110 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -13.123 0.909 -3.407 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -11.468 0.974 -2.835 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -13.763 2.477 -1.515 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -13.242 0.878 -1.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -11.935 2.046 0.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -10.910 2.191 -0.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -11.972 3.455 -0.585 1.00 0.00 H new ATOM 1386 N ARG A 95 -9.410 4.618 -3.105 1.00 0.00 N ATOM 1387 CA ARG A 95 -9.120 5.440 -1.940 1.00 0.00 C ATOM 1388 C ARG A 95 -10.288 5.536 -0.970 1.00 0.00 C ATOM 1389 O ARG A 95 -11.389 5.057 -1.232 1.00 0.00 O ATOM 1390 CB ARG A 95 -8.764 6.858 -2.327 1.00 0.00 C ATOM 1391 CG ARG A 95 -9.961 7.728 -2.639 1.00 0.00 C ATOM 1392 CD ARG A 95 -9.634 9.195 -2.426 1.00 0.00 C ATOM 1393 NE ARG A 95 -8.470 9.688 -3.171 1.00 0.00 N ATOM 1394 CZ ARG A 95 -7.208 9.661 -2.739 1.00 0.00 C ATOM 1395 NH1 ARG A 95 -6.892 9.073 -1.595 1.00 0.00 N ATOM 1396 NH2 ARG A 95 -6.260 10.225 -3.471 1.00 0.00 N ATOM 0 H ARG A 95 -9.387 5.113 -3.997 1.00 0.00 H new ATOM 0 HA ARG A 95 -8.280 4.940 -1.459 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -8.198 7.314 -1.515 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -8.109 6.833 -3.198 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -10.274 7.567 -3.671 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -10.799 7.442 -2.004 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -10.504 9.789 -2.706 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -9.463 9.362 -1.363 1.00 0.00 H new ATOM 0 HE ARG A 95 -8.640 10.084 -4.096 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -7.618 8.632 -1.030 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -5.922 9.061 -1.279 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -6.498 10.674 -4.355 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -5.292 10.210 -3.151 1.00 0.00 H new ATOM 1407 N VAL A 96 -10.055 6.332 0.065 1.00 0.00 N ATOM 1408 CA VAL A 96 -11.102 6.641 1.055 1.00 0.00 C ATOM 1409 C VAL A 96 -11.873 7.903 0.704 1.00 0.00 C ATOM 1410 O VAL A 96 -13.067 7.978 0.981 1.00 0.00 O ATOM 1411 CB VAL A 96 -10.559 6.840 2.486 1.00 0.00 C ATOM 1412 CG1 VAL A 96 -11.704 6.986 3.479 1.00 0.00 C ATOM 1413 CG2 VAL A 96 -9.670 5.695 2.901 1.00 0.00 C ATOM 0 H VAL A 96 -9.157 6.779 0.249 1.00 0.00 H new ATOM 0 HA VAL A 96 -11.750 5.765 1.026 1.00 0.00 H new ATOM 0 HB VAL A 96 -9.966 7.754 2.486 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -11.300 7.125 4.482 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -12.312 7.850 3.209 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -12.321 6.088 3.458 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -9.305 5.867 3.913 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -10.238 4.765 2.873 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -8.824 5.625 2.217 1.00 0.00 H new ATOM 1423 N ASP A 97 -11.165 8.943 0.236 1.00 0.00 N ATOM 1424 CA ASP A 97 -11.807 10.261 0.042 1.00 0.00 C ATOM 1425 C ASP A 97 -13.088 10.098 -0.749 1.00 0.00 C ATOM 1426 O ASP A 97 -14.147 10.568 -0.334 1.00 0.00 O ATOM 1427 CB ASP A 97 -10.889 11.249 -0.670 1.00 0.00 C ATOM 1428 CG ASP A 97 -11.468 12.643 -0.740 1.00 0.00 C ATOM 1429 OD1 ASP A 97 -11.740 13.232 0.325 1.00 0.00 O ATOM 1430 OD2 ASP A 97 -11.649 13.153 -1.861 1.00 0.00 O ATOM 0 H ASP A 97 -10.176 8.905 -0.010 1.00 0.00 H new ATOM 0 HA ASP A 97 -12.026 10.665 1.030 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -9.930 11.285 -0.152 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -10.692 10.891 -1.681 1.00 0.00 H new ATOM 1434 N ASN A 98 -13.029 9.194 -1.713 1.00 0.00 N ATOM 1435 CA ASN A 98 -14.236 8.698 -2.337 1.00 0.00 C ATOM 1436 C ASN A 98 -13.960 7.290 -2.810 1.00 0.00 C ATOM 1437 O ASN A 98 -14.118 6.333 -2.056 1.00 0.00 O ATOM 1438 CB ASN A 98 -14.674 9.593 -3.502 1.00 0.00 C ATOM 1439 CG ASN A 98 -16.039 9.215 -4.065 1.00 0.00 C ATOM 1440 OD1 ASN A 98 -16.425 9.674 -5.139 1.00 0.00 O ATOM 1441 ND2 ASN A 98 -16.799 8.411 -3.332 1.00 0.00 N ATOM 0 H ASN A 98 -12.164 8.794 -2.076 1.00 0.00 H new ATOM 0 HA ASN A 98 -15.055 8.704 -1.618 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -14.700 10.630 -3.166 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -13.931 9.534 -4.297 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -17.733 8.157 -3.655 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -16.450 8.047 -2.446 1.00 0.00 H new ATOM 1447 N GLY A 99 -13.309 7.198 -3.947 1.00 0.00 N ATOM 1448 CA GLY A 99 -12.805 5.929 -4.400 1.00 0.00 C ATOM 1449 C GLY A 99 -11.903 6.075 -5.583 1.00 0.00 C ATOM 1450 O GLY A 99 -12.363 6.180 -6.715 1.00 0.00 O ATOM 0 H GLY A 99 -13.119 7.983 -4.569 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -12.263 5.444 -3.588 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -13.640 5.279 -4.659 1.00 0.00 H new ATOM 1454 N LYS A 100 -10.614 5.970 -5.342 1.00 0.00 N ATOM 1455 CA LYS A 100 -9.668 5.957 -6.448 1.00 0.00 C ATOM 1456 C LYS A 100 -8.785 4.738 -6.346 1.00 0.00 C ATOM 1457 O LYS A 100 -7.915 4.670 -5.483 1.00 0.00 O ATOM 1458 CB LYS A 100 -8.765 7.204 -6.501 1.00 0.00 C ATOM 1459 CG LYS A 100 -9.249 8.442 -5.747 1.00 0.00 C ATOM 1460 CD LYS A 100 -10.635 8.909 -6.121 1.00 0.00 C ATOM 1461 CE LYS A 100 -11.138 9.934 -5.112 1.00 0.00 C ATOM 1462 NZ LYS A 100 -11.172 11.316 -5.662 1.00 0.00 N ATOM 0 H LYS A 100 -10.199 5.894 -4.413 1.00 0.00 H new ATOM 0 HA LYS A 100 -10.267 5.945 -7.359 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -7.785 6.930 -6.109 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -8.625 7.477 -7.547 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -9.228 8.230 -4.678 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -8.546 9.256 -5.924 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -10.621 9.347 -7.119 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -11.316 8.058 -6.156 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -12.139 9.654 -4.784 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -10.497 9.914 -4.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -12.040 11.794 -5.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -10.343 11.845 -5.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -11.156 11.277 -6.701 1.00 0.00 H new ATOM 1472 N GLU A 101 -9.069 3.752 -7.170 1.00 0.00 N ATOM 1473 CA GLU A 101 -8.355 2.498 -7.130 1.00 0.00 C ATOM 1474 C GLU A 101 -7.333 2.437 -8.266 1.00 0.00 C ATOM 1475 O GLU A 101 -7.684 2.308 -9.434 1.00 0.00 O ATOM 1476 CB GLU A 101 -9.351 1.307 -7.164 1.00 0.00 C ATOM 1477 CG GLU A 101 -9.662 0.734 -8.528 1.00 0.00 C ATOM 1478 CD GLU A 101 -10.823 -0.240 -8.517 1.00 0.00 C ATOM 1479 OE1 GLU A 101 -11.323 -0.572 -7.424 1.00 0.00 O ATOM 1480 OE2 GLU A 101 -11.233 -0.690 -9.604 1.00 0.00 O ATOM 0 H GLU A 101 -9.798 3.798 -7.882 1.00 0.00 H new ATOM 0 HA GLU A 101 -7.802 2.425 -6.193 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -8.950 0.508 -6.540 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -10.286 1.630 -6.707 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -9.887 1.550 -9.215 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -8.776 0.229 -8.913 1.00 0.00 H new ATOM 1485 N LEU A 102 -6.060 2.524 -7.897 1.00 0.00 N ATOM 1486 CA LEU A 102 -4.939 2.351 -8.830 1.00 0.00 C ATOM 1487 C LEU A 102 -3.655 2.215 -8.041 1.00 0.00 C ATOM 1488 O LEU A 102 -3.128 3.165 -7.548 1.00 0.00 O ATOM 1489 CB LEU A 102 -4.810 3.511 -9.810 1.00 0.00 C ATOM 1490 CG LEU A 102 -5.720 3.448 -11.029 1.00 0.00 C ATOM 1491 CD1 LEU A 102 -5.296 4.474 -12.060 1.00 0.00 C ATOM 1492 CD2 LEU A 102 -5.712 2.044 -11.631 1.00 0.00 C ATOM 0 H LEU A 102 -5.769 2.717 -6.939 1.00 0.00 H new ATOM 0 HA LEU A 102 -5.133 1.452 -9.415 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -5.013 4.439 -9.275 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -3.776 3.560 -10.153 1.00 0.00 H new ATOM 0 HG LEU A 102 -6.737 3.679 -10.713 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -5.957 4.415 -12.925 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -5.354 5.472 -11.626 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -4.271 4.274 -12.372 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -6.368 2.018 -12.501 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -4.698 1.783 -11.933 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -6.065 1.328 -10.889 1.00 0.00 H new ATOM 1503 N ILE A 103 -3.179 1.024 -7.905 1.00 0.00 N ATOM 1504 CA ILE A 103 -1.984 0.755 -7.130 1.00 0.00 C ATOM 1505 C ILE A 103 -1.485 -0.641 -7.469 1.00 0.00 C ATOM 1506 O ILE A 103 -2.185 -1.608 -7.215 1.00 0.00 O ATOM 1507 CB ILE A 103 -2.278 0.862 -5.594 1.00 0.00 C ATOM 1508 CG1 ILE A 103 -2.064 2.295 -5.085 1.00 0.00 C ATOM 1509 CG2 ILE A 103 -1.392 -0.085 -4.793 1.00 0.00 C ATOM 1510 CD1 ILE A 103 -2.635 2.533 -3.707 1.00 0.00 C ATOM 0 H ILE A 103 -3.600 0.195 -8.325 1.00 0.00 H new ATOM 0 HA ILE A 103 -1.222 1.495 -7.378 1.00 0.00 H new ATOM 0 HB ILE A 103 -3.322 0.582 -5.453 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -0.996 2.512 -5.070 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -2.521 2.994 -5.786 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -1.620 0.013 -3.732 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -1.576 -1.111 -5.110 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -0.345 0.165 -4.963 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -2.449 3.565 -3.409 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -3.709 2.348 -3.721 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -2.160 1.858 -2.995 1.00 0.00 H new ATOM 1521 N ALA A 104 -0.351 -0.761 -8.146 1.00 0.00 N ATOM 1522 CA ALA A 104 0.159 -2.089 -8.461 1.00 0.00 C ATOM 1523 C ALA A 104 1.567 -2.081 -9.018 1.00 0.00 C ATOM 1524 O ALA A 104 1.768 -1.899 -10.223 1.00 0.00 O ATOM 1525 CB ALA A 104 -0.773 -2.791 -9.414 1.00 0.00 C ATOM 0 H ALA A 104 0.218 0.017 -8.479 1.00 0.00 H new ATOM 0 HA ALA A 104 0.206 -2.632 -7.517 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -0.381 -3.782 -9.642 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -1.758 -2.886 -8.956 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -0.855 -2.213 -10.334 1.00 0.00 H new ATOM 1531 N VAL A 105 2.523 -2.400 -8.170 1.00 0.00 N ATOM 1532 CA VAL A 105 3.893 -2.570 -8.598 1.00 0.00 C ATOM 1533 C VAL A 105 4.656 -3.118 -7.436 1.00 0.00 C ATOM 1534 O VAL A 105 4.341 -2.731 -6.310 1.00 0.00 O ATOM 1535 CB VAL A 105 4.502 -1.220 -9.020 1.00 0.00 C ATOM 1536 CG1 VAL A 105 4.746 -0.372 -7.795 1.00 0.00 C ATOM 1537 CG2 VAL A 105 5.770 -1.408 -9.835 1.00 0.00 C ATOM 0 H VAL A 105 2.372 -2.547 -7.172 1.00 0.00 H new ATOM 0 HA VAL A 105 3.938 -3.242 -9.455 1.00 0.00 H new ATOM 0 HB VAL A 105 3.794 -0.703 -9.667 1.00 0.00 H new ATOM 0 HG11 VAL A 105 5.177 0.583 -8.094 1.00 0.00 H new ATOM 0 HG12 VAL A 105 3.802 -0.198 -7.279 1.00 0.00 H new ATOM 0 HG13 VAL A 105 5.435 -0.888 -7.127 1.00 0.00 H new ATOM 0 HG21 VAL A 105 6.171 -0.434 -10.115 1.00 0.00 H new ATOM 0 HG22 VAL A 105 6.508 -1.947 -9.241 1.00 0.00 H new ATOM 0 HG23 VAL A 105 5.543 -1.979 -10.735 1.00 0.00 H new ATOM 1547 N ARG A 106 5.812 -3.723 -7.651 1.00 0.00 N ATOM 1548 CA ARG A 106 6.634 -3.817 -6.500 1.00 0.00 C ATOM 1549 C ARG A 106 7.654 -2.755 -6.537 1.00 0.00 C ATOM 1550 O ARG A 106 8.187 -2.378 -7.581 1.00 0.00 O ATOM 1551 CB ARG A 106 7.393 -5.116 -6.191 1.00 0.00 C ATOM 1552 CG ARG A 106 7.588 -5.175 -4.685 1.00 0.00 C ATOM 1553 CD ARG A 106 7.878 -6.524 -4.114 1.00 0.00 C ATOM 1554 NE ARG A 106 8.394 -6.334 -2.734 1.00 0.00 N ATOM 1555 CZ ARG A 106 7.643 -5.882 -1.709 1.00 0.00 C ATOM 1556 NH1 ARG A 106 6.387 -6.229 -1.620 1.00 0.00 N ATOM 1557 NH2 ARG A 106 8.160 -5.169 -0.705 1.00 0.00 N ATOM 0 H ARG A 106 6.162 -4.115 -8.525 1.00 0.00 H new ATOM 0 HA ARG A 106 5.883 -3.745 -5.713 1.00 0.00 H new ATOM 0 HB2 ARG A 106 6.831 -5.982 -6.540 1.00 0.00 H new ATOM 0 HB3 ARG A 106 8.354 -5.131 -6.704 1.00 0.00 H new ATOM 0 HG2 ARG A 106 8.406 -4.506 -4.418 1.00 0.00 H new ATOM 0 HG3 ARG A 106 6.689 -4.786 -4.207 1.00 0.00 H new ATOM 0 HD2 ARG A 106 6.976 -7.136 -4.103 1.00 0.00 H new ATOM 0 HD3 ARG A 106 8.611 -7.048 -4.727 1.00 0.00 H new ATOM 0 HE ARG A 106 9.372 -6.558 -2.551 1.00 0.00 H new ATOM 0 HH11 ARG A 106 5.976 -6.841 -2.325 1.00 0.00 H new ATOM 0 HH12 ARG A 106 5.817 -5.888 -0.846 1.00 0.00 H new ATOM 0 HH21 ARG A 106 9.156 -4.949 -0.696 1.00 0.00 H new ATOM 0 HH22 ARG A 106 7.559 -4.845 0.053 1.00 0.00 H new ATOM 1568 N GLU A 107 8.165 -2.641 -5.385 1.00 0.00 N ATOM 1569 CA GLU A 107 9.369 -1.981 -5.152 1.00 0.00 C ATOM 1570 C GLU A 107 10.459 -3.017 -5.175 1.00 0.00 C ATOM 1571 O GLU A 107 10.697 -3.694 -4.180 1.00 0.00 O ATOM 1572 CB GLU A 107 9.260 -1.350 -3.769 1.00 0.00 C ATOM 1573 CG GLU A 107 8.312 -2.140 -2.888 1.00 0.00 C ATOM 1574 CD GLU A 107 8.191 -1.617 -1.472 1.00 0.00 C ATOM 1575 OE1 GLU A 107 8.891 -0.643 -1.138 1.00 0.00 O ATOM 1576 OE2 GLU A 107 7.414 -2.198 -0.681 1.00 0.00 O ATOM 0 H GLU A 107 7.735 -3.023 -4.542 1.00 0.00 H new ATOM 0 HA GLU A 107 9.586 -1.213 -5.895 1.00 0.00 H new ATOM 0 HB2 GLU A 107 10.245 -1.309 -3.305 1.00 0.00 H new ATOM 0 HB3 GLU A 107 8.907 -0.323 -3.860 1.00 0.00 H new ATOM 0 HG2 GLU A 107 7.324 -2.141 -3.348 1.00 0.00 H new ATOM 0 HG3 GLU A 107 8.647 -3.176 -2.852 1.00 0.00 H new ATOM 1581 N ILE A 108 11.082 -3.147 -6.342 1.00 0.00 N ATOM 1582 CA ILE A 108 12.128 -4.111 -6.599 1.00 0.00 C ATOM 1583 C ILE A 108 12.799 -3.784 -7.941 1.00 0.00 C ATOM 1584 O ILE A 108 12.104 -3.683 -8.951 1.00 0.00 O ATOM 1585 CB ILE A 108 11.615 -5.574 -6.699 1.00 0.00 C ATOM 1586 CG1 ILE A 108 10.900 -6.040 -5.421 1.00 0.00 C ATOM 1587 CG2 ILE A 108 12.784 -6.474 -7.023 1.00 0.00 C ATOM 1588 CD1 ILE A 108 10.904 -7.537 -5.194 1.00 0.00 C ATOM 0 H ILE A 108 10.862 -2.566 -7.151 1.00 0.00 H new ATOM 0 HA ILE A 108 12.813 -4.042 -5.754 1.00 0.00 H new ATOM 0 HB ILE A 108 10.870 -5.624 -7.493 1.00 0.00 H new ATOM 0 HG12 ILE A 108 11.369 -5.557 -4.564 1.00 0.00 H new ATOM 0 HG13 ILE A 108 9.866 -5.696 -5.455 1.00 0.00 H new ATOM 0 HG21 ILE A 108 12.440 -7.506 -7.097 1.00 0.00 H new ATOM 0 HG22 ILE A 108 13.225 -6.170 -7.972 1.00 0.00 H new ATOM 0 HG23 ILE A 108 13.532 -6.397 -6.234 1.00 0.00 H new ATOM 0 HD11 ILE A 108 10.376 -7.766 -4.268 1.00 0.00 H new ATOM 0 HD12 ILE A 108 10.407 -8.033 -6.028 1.00 0.00 H new ATOM 0 HD13 ILE A 108 11.932 -7.891 -5.122 1.00 0.00 H new ATOM 1599 N SER A 109 14.130 -3.736 -7.990 1.00 0.00 N ATOM 1600 CA SER A 109 14.832 -3.603 -9.272 1.00 0.00 C ATOM 1601 C SER A 109 16.314 -3.852 -9.058 1.00 0.00 C ATOM 1602 O SER A 109 16.989 -3.012 -8.468 1.00 0.00 O ATOM 1603 CB SER A 109 14.608 -2.211 -9.877 1.00 0.00 C ATOM 1604 OG SER A 109 15.149 -2.126 -11.189 1.00 0.00 O ATOM 0 H SER A 109 14.738 -3.786 -7.173 1.00 0.00 H new ATOM 0 HA SER A 109 14.435 -4.339 -9.971 1.00 0.00 H new ATOM 0 HB2 SER A 109 13.541 -1.992 -9.906 1.00 0.00 H new ATOM 0 HB3 SER A 109 15.071 -1.457 -9.241 1.00 0.00 H new ATOM 0 HG SER A 109 14.990 -1.229 -11.551 1.00 0.00 H new ATOM 1609 N GLY A 110 16.794 -5.040 -9.437 1.00 0.00 N ATOM 1610 CA GLY A 110 18.144 -5.441 -9.059 1.00 0.00 C ATOM 1611 C GLY A 110 18.225 -5.507 -7.553 1.00 0.00 C ATOM 1612 O GLY A 110 17.583 -6.368 -6.946 1.00 0.00 O ATOM 0 H GLY A 110 16.279 -5.724 -9.992 1.00 0.00 H new ATOM 0 HA2 GLY A 110 18.386 -6.411 -9.493 1.00 0.00 H new ATOM 0 HA3 GLY A 110 18.872 -4.728 -9.446 1.00 0.00 H new ATOM 1616 N ASN A 111 18.589 -4.375 -6.980 1.00 0.00 N ATOM 1617 CA ASN A 111 18.198 -4.104 -5.617 1.00 0.00 C ATOM 1618 C ASN A 111 18.079 -2.600 -5.412 1.00 0.00 C ATOM 1619 O ASN A 111 19.027 -1.909 -5.036 1.00 0.00 O ATOM 1620 CB ASN A 111 19.186 -4.714 -4.621 1.00 0.00 C ATOM 1621 CG ASN A 111 18.790 -4.455 -3.180 1.00 0.00 C ATOM 1622 OD1 ASN A 111 17.725 -4.875 -2.731 1.00 0.00 O ATOM 1623 ND2 ASN A 111 19.645 -3.764 -2.448 1.00 0.00 N ATOM 0 H ASN A 111 19.143 -3.645 -7.428 1.00 0.00 H new ATOM 0 HA ASN A 111 17.229 -4.568 -5.434 1.00 0.00 H new ATOM 0 HB2 ASN A 111 19.250 -5.789 -4.789 1.00 0.00 H new ATOM 0 HB3 ASN A 111 20.179 -4.303 -4.801 1.00 0.00 H new ATOM 0 HD21 ASN A 111 19.432 -3.561 -1.471 1.00 0.00 H new ATOM 0 HD22 ASN A 111 20.518 -3.434 -2.859 1.00 0.00 H new ATOM 1629 N GLU A 112 16.846 -2.162 -5.547 1.00 0.00 N ATOM 1630 CA GLU A 112 16.405 -0.809 -5.280 1.00 0.00 C ATOM 1631 C GLU A 112 14.896 -0.881 -5.359 1.00 0.00 C ATOM 1632 O GLU A 112 14.380 -1.818 -5.967 1.00 0.00 O ATOM 1633 CB GLU A 112 16.985 0.208 -6.273 1.00 0.00 C ATOM 1634 CG GLU A 112 16.486 0.066 -7.700 1.00 0.00 C ATOM 1635 CD GLU A 112 17.260 0.940 -8.669 1.00 0.00 C ATOM 1636 OE1 GLU A 112 18.298 1.508 -8.267 1.00 0.00 O ATOM 1637 OE2 GLU A 112 16.853 1.042 -9.845 1.00 0.00 O ATOM 0 H GLU A 112 16.088 -2.768 -5.861 1.00 0.00 H new ATOM 0 HA GLU A 112 16.752 -0.457 -4.308 1.00 0.00 H new ATOM 0 HB2 GLU A 112 16.751 1.212 -5.920 1.00 0.00 H new ATOM 0 HB3 GLU A 112 18.071 0.115 -6.273 1.00 0.00 H new ATOM 0 HG2 GLU A 112 16.567 -0.976 -8.009 1.00 0.00 H new ATOM 0 HG3 GLU A 112 15.429 0.329 -7.741 1.00 0.00 H new ATOM 1642 N LEU A 113 14.178 -0.103 -4.587 1.00 0.00 N ATOM 1643 CA LEU A 113 12.761 -0.349 -4.497 1.00 0.00 C ATOM 1644 C LEU A 113 11.956 0.767 -5.138 1.00 0.00 C ATOM 1645 O LEU A 113 12.486 1.825 -5.405 1.00 0.00 O ATOM 1646 CB LEU A 113 12.386 -0.596 -3.048 1.00 0.00 C ATOM 1647 CG LEU A 113 12.287 -2.080 -2.704 1.00 0.00 C ATOM 1648 CD1 LEU A 113 13.633 -2.777 -2.661 1.00 0.00 C ATOM 1649 CD2 LEU A 113 11.518 -2.301 -1.434 1.00 0.00 C ATOM 0 H LEU A 113 14.533 0.676 -4.032 1.00 0.00 H new ATOM 0 HA LEU A 113 12.513 -1.246 -5.065 1.00 0.00 H new ATOM 0 HB2 LEU A 113 13.128 -0.127 -2.401 1.00 0.00 H new ATOM 0 HB3 LEU A 113 11.431 -0.115 -2.838 1.00 0.00 H new ATOM 0 HG LEU A 113 11.732 -2.540 -3.522 1.00 0.00 H new ATOM 0 HD11 LEU A 113 13.490 -3.828 -2.411 1.00 0.00 H new ATOM 0 HD12 LEU A 113 14.115 -2.698 -3.635 1.00 0.00 H new ATOM 0 HD13 LEU A 113 14.262 -2.307 -1.906 1.00 0.00 H new ATOM 0 HD21 LEU A 113 11.468 -3.369 -1.220 1.00 0.00 H new ATOM 0 HD22 LEU A 113 12.019 -1.790 -0.612 1.00 0.00 H new ATOM 0 HD23 LEU A 113 10.509 -1.905 -1.546 1.00 0.00 H new ATOM 1660 N ILE A 114 10.716 0.461 -5.510 1.00 0.00 N ATOM 1661 CA ILE A 114 9.857 1.369 -6.269 1.00 0.00 C ATOM 1662 C ILE A 114 8.428 1.180 -5.856 1.00 0.00 C ATOM 1663 O ILE A 114 7.855 0.124 -6.043 1.00 0.00 O ATOM 1664 CB ILE A 114 9.864 1.071 -7.770 1.00 0.00 C ATOM 1665 CG1 ILE A 114 11.240 0.628 -8.231 1.00 0.00 C ATOM 1666 CG2 ILE A 114 9.391 2.285 -8.557 1.00 0.00 C ATOM 1667 CD1 ILE A 114 12.282 1.735 -8.235 1.00 0.00 C ATOM 0 H ILE A 114 10.274 -0.432 -5.292 1.00 0.00 H new ATOM 0 HA ILE A 114 10.241 2.370 -6.071 1.00 0.00 H new ATOM 0 HB ILE A 114 9.171 0.251 -7.957 1.00 0.00 H new ATOM 0 HG12 ILE A 114 11.585 -0.178 -7.584 1.00 0.00 H new ATOM 0 HG13 ILE A 114 11.159 0.217 -9.237 1.00 0.00 H new ATOM 0 HG21 ILE A 114 9.402 2.055 -9.622 1.00 0.00 H new ATOM 0 HG22 ILE A 114 8.377 2.544 -8.252 1.00 0.00 H new ATOM 0 HG23 ILE A 114 10.055 3.127 -8.361 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.237 1.335 -8.577 1.00 0.00 H new ATOM 0 HD12 ILE A 114 11.962 2.533 -8.905 1.00 0.00 H new ATOM 0 HD13 ILE A 114 12.395 2.132 -7.226 1.00 0.00 H new ATOM 1678 N GLN A 115 7.797 2.224 -5.456 1.00 0.00 N ATOM 1679 CA GLN A 115 6.412 2.102 -5.105 1.00 0.00 C ATOM 1680 C GLN A 115 5.573 3.039 -5.928 1.00 0.00 C ATOM 1681 O GLN A 115 5.512 4.238 -5.673 1.00 0.00 O ATOM 1682 CB GLN A 115 6.242 2.355 -3.626 1.00 0.00 C ATOM 1683 CG GLN A 115 7.096 1.424 -2.783 1.00 0.00 C ATOM 1684 CD GLN A 115 6.832 1.590 -1.309 1.00 0.00 C ATOM 1685 OE1 GLN A 115 5.770 1.230 -0.804 1.00 0.00 O ATOM 1686 NE2 GLN A 115 7.798 2.152 -0.615 1.00 0.00 N ATOM 0 H GLN A 115 8.198 3.157 -5.362 1.00 0.00 H new ATOM 0 HA GLN A 115 6.071 1.090 -5.321 1.00 0.00 H new ATOM 0 HB2 GLN A 115 6.506 3.389 -3.403 1.00 0.00 H new ATOM 0 HB3 GLN A 115 5.194 2.228 -3.356 1.00 0.00 H new ATOM 0 HG2 GLN A 115 6.899 0.392 -3.072 1.00 0.00 H new ATOM 0 HG3 GLN A 115 8.150 1.616 -2.986 1.00 0.00 H new ATOM 0 HE21 GLN A 115 8.662 2.434 -1.079 1.00 0.00 H new ATOM 0 HE22 GLN A 115 7.683 2.306 0.387 1.00 0.00 H new ATOM 1693 N THR A 116 4.914 2.469 -6.903 1.00 0.00 N ATOM 1694 CA THR A 116 4.097 3.213 -7.805 1.00 0.00 C ATOM 1695 C THR A 116 2.650 3.127 -7.364 1.00 0.00 C ATOM 1696 O THR A 116 1.985 2.111 -7.563 1.00 0.00 O ATOM 1697 CB THR A 116 4.212 2.660 -9.240 1.00 0.00 C ATOM 1698 OG1 THR A 116 5.564 2.738 -9.681 1.00 0.00 O ATOM 1699 CG2 THR A 116 3.307 3.419 -10.187 1.00 0.00 C ATOM 0 H THR A 116 4.934 1.466 -7.089 1.00 0.00 H new ATOM 0 HA THR A 116 4.437 4.249 -7.797 1.00 0.00 H new ATOM 0 HB THR A 116 3.896 1.617 -9.235 1.00 0.00 H new ATOM 0 HG1 THR A 116 5.660 2.256 -10.529 1.00 0.00 H new ATOM 0 HG21 THR A 116 3.407 3.010 -11.192 1.00 0.00 H new ATOM 0 HG22 THR A 116 2.273 3.323 -9.857 1.00 0.00 H new ATOM 0 HG23 THR A 116 3.589 4.472 -10.194 1.00 0.00 H new ATOM 1707 N TYR A 117 2.162 4.205 -6.788 1.00 0.00 N ATOM 1708 CA TYR A 117 0.777 4.273 -6.402 1.00 0.00 C ATOM 1709 C TYR A 117 0.062 5.177 -7.383 1.00 0.00 C ATOM 1710 O TYR A 117 0.651 6.138 -7.867 1.00 0.00 O ATOM 1711 CB TYR A 117 0.576 4.883 -5.017 1.00 0.00 C ATOM 1712 CG TYR A 117 1.515 4.413 -3.920 1.00 0.00 C ATOM 1713 CD1 TYR A 117 2.764 5.014 -3.704 1.00 0.00 C ATOM 1714 CD2 TYR A 117 1.124 3.399 -3.049 1.00 0.00 C ATOM 1715 CE1 TYR A 117 3.574 4.603 -2.671 1.00 0.00 C ATOM 1716 CE2 TYR A 117 1.938 2.997 -2.005 1.00 0.00 C ATOM 1717 CZ TYR A 117 3.163 3.603 -1.826 1.00 0.00 C ATOM 1718 OH TYR A 117 3.979 3.225 -0.788 1.00 0.00 O ATOM 0 H TYR A 117 2.706 5.042 -6.579 1.00 0.00 H new ATOM 0 HA TYR A 117 0.392 3.253 -6.392 1.00 0.00 H new ATOM 0 HB2 TYR A 117 0.671 5.965 -5.105 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -0.447 4.678 -4.700 1.00 0.00 H new ATOM 0 HD1 TYR A 117 3.094 5.809 -4.357 1.00 0.00 H new ATOM 0 HD2 TYR A 117 0.168 2.918 -3.191 1.00 0.00 H new ATOM 0 HE1 TYR A 117 4.537 5.069 -2.524 1.00 0.00 H new ATOM 0 HE2 TYR A 117 1.616 2.214 -1.335 1.00 0.00 H new ATOM 0 HH TYR A 117 4.403 2.368 -1.001 1.00 0.00 H new ATOM 1727 N THR A 118 -1.202 4.920 -7.604 1.00 0.00 N ATOM 1728 CA THR A 118 -2.006 5.679 -8.542 1.00 0.00 C ATOM 1729 C THR A 118 -3.411 5.894 -7.947 1.00 0.00 C ATOM 1730 O THR A 118 -3.678 5.416 -6.844 1.00 0.00 O ATOM 1731 CB THR A 118 -2.066 4.918 -9.876 1.00 0.00 C ATOM 1732 OG1 THR A 118 -0.827 4.231 -10.089 1.00 0.00 O ATOM 1733 CG2 THR A 118 -2.280 5.886 -11.028 1.00 0.00 C ATOM 0 H THR A 118 -1.712 4.171 -7.135 1.00 0.00 H new ATOM 0 HA THR A 118 -1.564 6.658 -8.726 1.00 0.00 H new ATOM 0 HB THR A 118 -2.894 4.210 -9.834 1.00 0.00 H new ATOM 0 HG1 THR A 118 -0.865 3.744 -10.939 1.00 0.00 H new ATOM 0 HG21 THR A 118 -2.320 5.332 -11.966 1.00 0.00 H new ATOM 0 HG22 THR A 118 -3.218 6.423 -10.883 1.00 0.00 H new ATOM 0 HG23 THR A 118 -1.456 6.598 -11.062 1.00 0.00 H new ATOM 1741 N TYR A 119 -4.238 6.760 -8.524 1.00 0.00 N ATOM 1742 CA TYR A 119 -5.557 7.014 -7.949 1.00 0.00 C ATOM 1743 C TYR A 119 -6.332 7.862 -8.914 1.00 0.00 C ATOM 1744 O TYR A 119 -5.891 8.967 -9.227 1.00 0.00 O ATOM 1745 CB TYR A 119 -5.439 7.692 -6.580 1.00 0.00 C ATOM 1746 CG TYR A 119 -4.575 8.936 -6.584 1.00 0.00 C ATOM 1747 CD1 TYR A 119 -3.188 8.843 -6.502 1.00 0.00 C ATOM 1748 CD2 TYR A 119 -5.138 10.200 -6.713 1.00 0.00 C ATOM 1749 CE1 TYR A 119 -2.403 9.974 -6.545 1.00 0.00 C ATOM 1750 CE2 TYR A 119 -4.348 11.329 -6.761 1.00 0.00 C ATOM 1751 CZ TYR A 119 -2.983 11.202 -6.676 1.00 0.00 C ATOM 1752 OH TYR A 119 -2.178 12.304 -6.722 1.00 0.00 O ATOM 0 H TYR A 119 -4.027 7.288 -9.371 1.00 0.00 H new ATOM 0 HA TYR A 119 -6.080 6.072 -7.787 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -6.437 7.955 -6.229 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -5.028 6.978 -5.866 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -2.723 7.873 -6.404 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -6.212 10.300 -6.777 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -1.329 9.889 -6.475 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -4.799 12.305 -6.865 1.00 0.00 H new ATOM 0 HH TYR A 119 -2.217 12.774 -5.863 1.00 0.00 H new ATOM 1761 N GLU A 120 -7.317 7.249 -9.564 1.00 0.00 N ATOM 1762 CA GLU A 120 -7.961 7.847 -10.729 1.00 0.00 C ATOM 1763 C GLU A 120 -6.956 7.835 -11.875 1.00 0.00 C ATOM 1764 O GLU A 120 -6.959 6.918 -12.695 1.00 0.00 O ATOM 1765 CB GLU A 120 -8.429 9.273 -10.438 1.00 0.00 C ATOM 1766 CG GLU A 120 -9.312 9.396 -9.208 1.00 0.00 C ATOM 1767 CD GLU A 120 -9.703 10.840 -8.939 1.00 0.00 C ATOM 1768 OE1 GLU A 120 -9.022 11.753 -9.455 1.00 0.00 O ATOM 1769 OE2 GLU A 120 -10.685 11.072 -8.208 1.00 0.00 O ATOM 0 H GLU A 120 -7.688 6.335 -9.302 1.00 0.00 H new ATOM 0 HA GLU A 120 -8.848 7.272 -10.994 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -7.555 9.912 -10.310 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -8.975 9.649 -11.303 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -10.211 8.795 -9.344 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -8.787 8.994 -8.342 1.00 0.00 H new ATOM 1774 N GLY A 121 -5.919 8.645 -11.712 1.00 0.00 N ATOM 1775 CA GLY A 121 -4.720 8.444 -12.460 1.00 0.00 C ATOM 1776 C GLY A 121 -3.630 9.392 -12.020 1.00 0.00 C ATOM 1777 O GLY A 121 -3.463 10.448 -12.625 1.00 0.00 O ATOM 0 H GLY A 121 -5.899 9.437 -11.070 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -4.381 7.415 -12.337 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -4.923 8.588 -13.521 1.00 0.00 H new ATOM 1781 N VAL A 122 -2.740 8.898 -11.171 1.00 0.00 N ATOM 1782 CA VAL A 122 -1.486 9.571 -10.863 1.00 0.00 C ATOM 1783 C VAL A 122 -0.574 8.587 -10.199 1.00 0.00 C ATOM 1784 O VAL A 122 -0.727 8.309 -9.007 1.00 0.00 O ATOM 1785 CB VAL A 122 -1.559 10.778 -9.885 1.00 0.00 C ATOM 1786 CG1 VAL A 122 -0.166 11.349 -9.710 1.00 0.00 C ATOM 1787 CG2 VAL A 122 -2.501 11.881 -10.319 1.00 0.00 C ATOM 0 H VAL A 122 -2.868 8.016 -10.675 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.151 9.955 -11.827 1.00 0.00 H new ATOM 0 HB VAL A 122 -1.962 10.393 -8.948 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -0.204 12.197 -9.026 1.00 0.00 H new ATOM 0 HG12 VAL A 122 0.493 10.582 -9.302 1.00 0.00 H new ATOM 0 HG13 VAL A 122 0.216 11.679 -10.676 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -2.489 12.681 -9.579 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -2.181 12.274 -11.284 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -3.512 11.483 -10.407 1.00 0.00 H new ATOM 1797 N GLU A 123 0.452 8.176 -10.897 1.00 0.00 N ATOM 1798 CA GLU A 123 1.437 7.351 -10.276 1.00 0.00 C ATOM 1799 C GLU A 123 2.660 8.186 -9.955 1.00 0.00 C ATOM 1800 O GLU A 123 2.959 9.158 -10.648 1.00 0.00 O ATOM 1801 CB GLU A 123 1.813 6.138 -11.119 1.00 0.00 C ATOM 1802 CG GLU A 123 2.604 6.430 -12.385 1.00 0.00 C ATOM 1803 CD GLU A 123 1.787 7.097 -13.476 1.00 0.00 C ATOM 1804 OE1 GLU A 123 1.463 8.299 -13.350 1.00 0.00 O ATOM 1805 OE2 GLU A 123 1.457 6.415 -14.465 1.00 0.00 O ATOM 0 H GLU A 123 0.620 8.397 -11.878 1.00 0.00 H new ATOM 0 HA GLU A 123 1.006 6.956 -9.356 1.00 0.00 H new ATOM 0 HB2 GLU A 123 2.394 5.455 -10.500 1.00 0.00 H new ATOM 0 HB3 GLU A 123 0.898 5.615 -11.398 1.00 0.00 H new ATOM 0 HG2 GLU A 123 3.450 7.070 -12.134 1.00 0.00 H new ATOM 0 HG3 GLU A 123 3.014 5.496 -12.770 1.00 0.00 H new ATOM 1810 N ALA A 124 3.310 7.859 -8.858 1.00 0.00 N ATOM 1811 CA ALA A 124 4.454 8.626 -8.396 1.00 0.00 C ATOM 1812 C ALA A 124 5.243 7.822 -7.383 1.00 0.00 C ATOM 1813 O ALA A 124 4.656 7.076 -6.596 1.00 0.00 O ATOM 1814 CB ALA A 124 4.003 9.947 -7.800 1.00 0.00 C ATOM 0 H ALA A 124 3.067 7.065 -8.266 1.00 0.00 H new ATOM 0 HA ALA A 124 5.100 8.842 -9.247 1.00 0.00 H new ATOM 0 HB1 ALA A 124 4.873 10.508 -7.459 1.00 0.00 H new ATOM 0 HB2 ALA A 124 3.472 10.525 -8.556 1.00 0.00 H new ATOM 0 HB3 ALA A 124 3.340 9.758 -6.956 1.00 0.00 H new ATOM 1820 N LYS A 125 6.553 7.758 -7.606 1.00 0.00 N ATOM 1821 CA LYS A 125 7.400 6.794 -6.923 1.00 0.00 C ATOM 1822 C LYS A 125 8.848 7.254 -6.915 1.00 0.00 C ATOM 1823 O LYS A 125 9.177 8.259 -7.537 1.00 0.00 O ATOM 1824 CB LYS A 125 7.298 5.414 -7.587 1.00 0.00 C ATOM 1825 CG LYS A 125 6.329 5.336 -8.763 1.00 0.00 C ATOM 1826 CD LYS A 125 6.694 6.260 -9.902 1.00 0.00 C ATOM 1827 CE LYS A 125 5.728 6.088 -11.039 1.00 0.00 C ATOM 1828 NZ LYS A 125 5.674 4.679 -11.525 1.00 0.00 N ATOM 0 H LYS A 125 7.049 8.366 -8.257 1.00 0.00 H new ATOM 0 HA LYS A 125 7.051 6.717 -5.893 1.00 0.00 H new ATOM 0 HB2 LYS A 125 8.289 5.119 -7.932 1.00 0.00 H new ATOM 0 HB3 LYS A 125 6.993 4.687 -6.835 1.00 0.00 H new ATOM 0 HG2 LYS A 125 6.298 4.311 -9.132 1.00 0.00 H new ATOM 0 HG3 LYS A 125 5.325 5.580 -8.414 1.00 0.00 H new ATOM 0 HD2 LYS A 125 6.682 7.294 -9.559 1.00 0.00 H new ATOM 0 HD3 LYS A 125 7.708 6.048 -10.241 1.00 0.00 H new ATOM 0 HE2 LYS A 125 4.733 6.398 -10.718 1.00 0.00 H new ATOM 0 HE3 LYS A 125 6.017 6.743 -11.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 4.767 4.512 -12.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 6.455 4.511 -12.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 5.762 4.030 -10.717 1.00 0.00 H new ATOM 1838 N ARG A 126 9.556 6.761 -5.910 1.00 0.00 N ATOM 1839 CA ARG A 126 10.763 7.421 -5.443 1.00 0.00 C ATOM 1840 C ARG A 126 11.576 6.575 -4.466 1.00 0.00 C ATOM 1841 O ARG A 126 11.476 6.712 -3.250 1.00 0.00 O ATOM 1842 CB ARG A 126 10.234 8.600 -4.679 1.00 0.00 C ATOM 1843 CG ARG A 126 9.382 8.224 -3.452 1.00 0.00 C ATOM 1844 CD ARG A 126 8.753 6.820 -3.436 1.00 0.00 C ATOM 1845 NE ARG A 126 7.969 6.556 -2.250 1.00 0.00 N ATOM 1846 CZ ARG A 126 6.858 5.821 -2.231 1.00 0.00 C ATOM 1847 NH1 ARG A 126 6.351 5.375 -3.366 1.00 0.00 N ATOM 1848 NH2 ARG A 126 6.242 5.557 -1.086 1.00 0.00 N ATOM 0 H ARG A 126 9.316 5.909 -5.404 1.00 0.00 H new ATOM 0 HA ARG A 126 11.422 7.647 -6.281 1.00 0.00 H new ATOM 0 HB2 ARG A 126 11.074 9.213 -4.351 1.00 0.00 H new ATOM 0 HB3 ARG A 126 9.634 9.214 -5.350 1.00 0.00 H new ATOM 0 HG2 ARG A 126 10.006 8.325 -2.564 1.00 0.00 H new ATOM 0 HG3 ARG A 126 8.579 8.955 -3.362 1.00 0.00 H new ATOM 0 HD2 ARG A 126 8.119 6.704 -4.315 1.00 0.00 H new ATOM 0 HD3 ARG A 126 9.544 6.074 -3.513 1.00 0.00 H new ATOM 0 HE ARG A 126 8.288 6.959 -1.369 1.00 0.00 H new ATOM 0 HH11 ARG A 126 6.810 5.594 -4.250 1.00 0.00 H new ATOM 0 HH12 ARG A 126 5.501 4.812 -3.358 1.00 0.00 H new ATOM 0 HH21 ARG A 126 6.618 5.918 -0.209 1.00 0.00 H new ATOM 0 HH22 ARG A 126 5.392 4.993 -1.082 1.00 0.00 H new ATOM 1859 N ILE A 127 12.467 5.789 -4.911 1.00 0.00 N ATOM 1860 CA ILE A 127 13.108 4.940 -3.939 1.00 0.00 C ATOM 1861 C ILE A 127 14.406 4.363 -4.417 1.00 0.00 C ATOM 1862 O ILE A 127 14.436 3.670 -5.427 1.00 0.00 O ATOM 1863 CB ILE A 127 12.224 3.733 -3.542 1.00 0.00 C ATOM 1864 CG1 ILE A 127 10.716 3.960 -3.737 1.00 0.00 C ATOM 1865 CG2 ILE A 127 12.485 3.352 -2.127 1.00 0.00 C ATOM 1866 CD1 ILE A 127 9.882 2.843 -3.169 1.00 0.00 C ATOM 0 H ILE A 127 12.773 5.698 -5.880 1.00 0.00 H new ATOM 0 HA ILE A 127 13.280 5.602 -3.091 1.00 0.00 H new ATOM 0 HB ILE A 127 12.505 2.929 -4.222 1.00 0.00 H new ATOM 0 HG12 ILE A 127 10.430 4.899 -3.263 1.00 0.00 H new ATOM 0 HG13 ILE A 127 10.503 4.062 -4.801 1.00 0.00 H new ATOM 0 HG21 ILE A 127 11.858 2.502 -1.858 1.00 0.00 H new ATOM 0 HG22 ILE A 127 13.534 3.080 -2.011 1.00 0.00 H new ATOM 0 HG23 ILE A 127 12.254 4.194 -1.475 1.00 0.00 H new ATOM 0 HD11 ILE A 127 8.826 3.057 -3.335 1.00 0.00 H new ATOM 0 HD12 ILE A 127 10.145 1.906 -3.661 1.00 0.00 H new ATOM 0 HD13 ILE A 127 10.071 2.756 -2.099 1.00 0.00 H new ATOM 1877 N PHE A 128 15.367 4.351 -3.515 1.00 0.00 N ATOM 1878 CA PHE A 128 16.501 3.483 -3.687 1.00 0.00 C ATOM 1879 C PHE A 128 16.910 2.949 -2.342 1.00 0.00 C ATOM 1880 O PHE A 128 17.167 3.696 -1.406 1.00 0.00 O ATOM 1881 CB PHE A 128 17.655 4.149 -4.410 1.00 0.00 C ATOM 1882 CG PHE A 128 17.219 4.832 -5.675 1.00 0.00 C ATOM 1883 CD1 PHE A 128 16.752 6.138 -5.651 1.00 0.00 C ATOM 1884 CD2 PHE A 128 17.206 4.143 -6.872 1.00 0.00 C ATOM 1885 CE1 PHE A 128 16.286 6.746 -6.801 1.00 0.00 C ATOM 1886 CE2 PHE A 128 16.750 4.745 -8.028 1.00 0.00 C ATOM 1887 CZ PHE A 128 16.288 6.048 -7.994 1.00 0.00 C ATOM 0 H PHE A 128 15.382 4.924 -2.671 1.00 0.00 H new ATOM 0 HA PHE A 128 16.207 2.656 -4.333 1.00 0.00 H new ATOM 0 HB2 PHE A 128 18.122 4.879 -3.749 1.00 0.00 H new ATOM 0 HB3 PHE A 128 18.412 3.402 -4.646 1.00 0.00 H new ATOM 0 HD1 PHE A 128 16.753 6.687 -4.721 1.00 0.00 H new ATOM 0 HD2 PHE A 128 17.556 3.122 -6.904 1.00 0.00 H new ATOM 0 HE1 PHE A 128 15.922 7.762 -6.768 1.00 0.00 H new ATOM 0 HE2 PHE A 128 16.754 4.198 -8.959 1.00 0.00 H new ATOM 0 HZ PHE A 128 15.930 6.519 -8.897 1.00 0.00 H new ATOM 1896 N LYS A 129 16.559 1.703 -2.203 1.00 0.00 N ATOM 1897 CA LYS A 129 16.354 1.092 -0.900 1.00 0.00 C ATOM 1898 C LYS A 129 17.438 0.172 -0.417 1.00 0.00 C ATOM 1899 O LYS A 129 18.235 -0.365 -1.186 1.00 0.00 O ATOM 1900 CB LYS A 129 15.059 0.316 -0.860 1.00 0.00 C ATOM 1901 CG LYS A 129 13.856 1.181 -0.673 1.00 0.00 C ATOM 1902 CD LYS A 129 12.687 0.412 -0.120 1.00 0.00 C ATOM 1903 CE LYS A 129 11.472 1.294 -0.047 1.00 0.00 C ATOM 1904 NZ LYS A 129 10.300 0.621 0.529 1.00 0.00 N ATOM 0 H LYS A 129 16.404 1.070 -2.988 1.00 0.00 H new ATOM 0 HA LYS A 129 16.347 1.953 -0.232 1.00 0.00 H new ATOM 0 HB2 LYS A 129 14.952 -0.247 -1.787 1.00 0.00 H new ATOM 0 HB3 LYS A 129 15.104 -0.411 -0.049 1.00 0.00 H new ATOM 0 HG2 LYS A 129 14.101 2.002 0.001 1.00 0.00 H new ATOM 0 HG3 LYS A 129 13.578 1.626 -1.628 1.00 0.00 H new ATOM 0 HD2 LYS A 129 12.480 -0.453 -0.751 1.00 0.00 H new ATOM 0 HD3 LYS A 129 12.929 0.032 0.872 1.00 0.00 H new ATOM 0 HE2 LYS A 129 11.706 2.175 0.550 1.00 0.00 H new ATOM 0 HE3 LYS A 129 11.225 1.645 -1.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 9.881 1.224 1.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 9.597 0.448 -0.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 10.591 -0.286 0.947 1.00 0.00 H new ATOM 1914 N LYS A 130 17.225 -0.179 0.847 1.00 0.00 N ATOM 1915 CA LYS A 130 17.931 -1.238 1.527 1.00 0.00 C ATOM 1916 C LYS A 130 19.414 -0.940 1.697 1.00 0.00 C ATOM 1917 O LYS A 130 20.214 -1.138 0.780 1.00 0.00 O ATOM 1918 CB LYS A 130 17.707 -2.518 0.766 1.00 0.00 C ATOM 1919 CG LYS A 130 17.966 -3.766 1.567 1.00 0.00 C ATOM 1920 CD LYS A 130 17.750 -4.993 0.714 1.00 0.00 C ATOM 1921 CE LYS A 130 16.805 -5.947 1.394 1.00 0.00 C ATOM 1922 NZ LYS A 130 17.458 -6.637 2.537 1.00 0.00 N ATOM 0 H LYS A 130 16.534 0.285 1.437 1.00 0.00 H new ATOM 0 HA LYS A 130 17.537 -1.331 2.539 1.00 0.00 H new ATOM 0 HB2 LYS A 130 16.678 -2.538 0.406 1.00 0.00 H new ATOM 0 HB3 LYS A 130 18.353 -2.523 -0.112 1.00 0.00 H new ATOM 0 HG2 LYS A 130 18.987 -3.756 1.948 1.00 0.00 H new ATOM 0 HG3 LYS A 130 17.303 -3.795 2.432 1.00 0.00 H new ATOM 0 HD2 LYS A 130 17.347 -4.702 -0.256 1.00 0.00 H new ATOM 0 HD3 LYS A 130 18.704 -5.487 0.528 1.00 0.00 H new ATOM 0 HE2 LYS A 130 15.929 -5.403 1.748 1.00 0.00 H new ATOM 0 HE3 LYS A 130 16.452 -6.686 0.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 16.829 -7.382 2.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 18.353 -7.063 2.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 17.650 -5.950 3.293 1.00 0.00 H new ATOM 1932 N GLU A 131 19.774 -0.554 2.912 1.00 0.00 N ATOM 1933 CA GLU A 131 21.160 -0.289 3.276 1.00 0.00 C ATOM 1934 C GLU A 131 21.243 0.072 4.753 1.00 0.00 C ATOM 1935 O GLU A 131 20.468 0.947 5.192 1.00 0.00 O ATOM 1936 CB GLU A 131 21.741 0.842 2.422 1.00 0.00 C ATOM 1937 CG GLU A 131 23.217 1.096 2.668 1.00 0.00 C ATOM 1938 CD GLU A 131 23.809 2.054 1.662 1.00 0.00 C ATOM 1939 OE1 GLU A 131 23.785 1.739 0.453 1.00 0.00 O ATOM 1940 OE2 GLU A 131 24.296 3.127 2.067 1.00 0.00 O ATOM 1941 OXT GLU A 131 22.055 -0.539 5.475 1.00 0.00 O ATOM 0 H GLU A 131 19.112 -0.415 3.676 1.00 0.00 H new ATOM 0 HA GLU A 131 21.747 -1.189 3.092 1.00 0.00 H new ATOM 0 HB2 GLU A 131 21.593 0.603 1.369 1.00 0.00 H new ATOM 0 HB3 GLU A 131 21.185 1.758 2.622 1.00 0.00 H new ATOM 0 HG2 GLU A 131 23.352 1.498 3.672 1.00 0.00 H new ATOM 0 HG3 GLU A 131 23.758 0.150 2.628 1.00 0.00 H new