USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 842 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 29 LYS NZ :NH3+ 150:sc= -0.072 (180deg=-0.559) USER MOD Set 1.2: A 74 CYS SG : rot -23:sc= -0.318 USER MOD Set 2.1: A 23 ASN : amide:sc= -1.58! C(o=-1.6!,f=-6.4!) USER MOD Set 2.2: B 210 LYS NZ :NH3+ -122:sc= 0 (180deg=-0.0527) USER MOD Single : A 1 SER N :NH3+ 151:sc= 0.00224 (180deg=-0.115) USER MOD Single : A 1 SER OG : rot 180:sc= 0.00425 USER MOD Single : A 6 LYS NZ :NH3+ 162:sc= -0.104 (180deg=-0.446) USER MOD Single : A 7 CYS SG : rot 180:sc= -1.8! USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 MET CE :methyl -136:sc= -4.53! (180deg=-11.9!) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 143:sc= 1.01 (180deg=-0.781) USER MOD Single : A 17 GLN : amide:sc= -0.39 K(o=-0.39,f=-1.1) USER MOD Single : A 19 SER OG : rot 71:sc= 0.833 USER MOD Single : A 24 LYS NZ :NH3+ -141:sc= -3.31! (180deg=-5.58!) USER MOD Single : A 35 HIS : no HD1:sc=-0.00582 X(o=-0.0058,f=0) USER MOD Single : A 38 GLN : amide:sc= -0.402 K(o=-0.4,f=-2!) USER MOD Single : A 39 SER OG : rot -35:sc= 1.19 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 ASN : amide:sc= -0.887 K(o=-0.89,f=-2.2!) USER MOD Single : A 58 THR OG1 : rot -26:sc= 0.0553 USER MOD Single : A 60 LYS NZ :NH3+ -175:sc= 1.46 (180deg=1.43) USER MOD Single : A 62 SER OG : rot 180:sc= -0.602 USER MOD Single : A 63 THR OG1 : rot 162:sc= 0.716 USER MOD Single : A 70 TYR OH : rot -13:sc= 1.24 USER MOD Single : A 72 THR OG1 : rot 180:sc=-0.00563 USER MOD Single : A 73 SER OG : rot -82:sc= 1.27 USER MOD Single : A 77 LYS NZ :NH3+ 167:sc= -0.0182 (180deg=-0.172) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ -165:sc= -0.0635 (180deg=-0.351) USER MOD Single : A 82 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : B 201 LYS NZ :NH3+ 157:sc= -0.275 (180deg=-1.58!) USER MOD Single : B 203 THR OG1 : rot 180:sc= 0.0724 USER MOD Single : B 208 LYS NZ :NH3+ 142:sc= 1.16 (180deg=-0.0628) USER MOD Single : B 211 TYR OH : rot 100:sc= 0.342 USER MOD Single : B 213 ASN :FLIP amide:sc= -0.0147 F(o=-1.1,f=-0.015) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -23.053 6.438 7.474 1.00 0.00 N ATOM 2 CA SER A 1 -21.651 5.974 7.439 1.00 0.00 C ATOM 3 C SER A 1 -21.376 5.149 6.181 1.00 0.00 C ATOM 4 O SER A 1 -20.598 4.193 6.209 1.00 0.00 O ATOM 5 CB SER A 1 -21.364 5.136 8.688 1.00 0.00 C ATOM 6 OG SER A 1 -21.572 5.894 9.869 1.00 0.00 O ATOM 0 H1 SER A 1 -23.359 6.543 8.462 1.00 0.00 H new ATOM 0 H2 SER A 1 -23.127 7.355 6.989 1.00 0.00 H new ATOM 0 H3 SER A 1 -23.661 5.743 6.996 1.00 0.00 H new ATOM 0 HA SER A 1 -20.995 6.845 7.420 1.00 0.00 H new ATOM 0 HB2 SER A 1 -22.010 4.258 8.697 1.00 0.00 H new ATOM 0 HB3 SER A 1 -20.336 4.775 8.660 1.00 0.00 H new ATOM 0 HG SER A 1 -21.384 5.337 10.653 1.00 0.00 H new ATOM 14 N GLU A 2 -22.006 5.524 5.075 1.00 0.00 N ATOM 15 CA GLU A 2 -21.852 4.781 3.829 1.00 0.00 C ATOM 16 C GLU A 2 -20.819 5.422 2.901 1.00 0.00 C ATOM 17 O GLU A 2 -20.632 4.971 1.777 1.00 0.00 O ATOM 18 CB GLU A 2 -23.192 4.649 3.103 1.00 0.00 C ATOM 19 CG GLU A 2 -24.071 3.520 3.624 1.00 0.00 C ATOM 20 CD GLU A 2 -25.282 3.288 2.751 1.00 0.00 C ATOM 21 OE1 GLU A 2 -26.353 3.856 3.045 1.00 0.00 O ATOM 22 OE2 GLU A 2 -25.165 2.534 1.764 1.00 0.00 O ATOM 0 H GLU A 2 -22.625 6.333 5.014 1.00 0.00 H new ATOM 0 HA GLU A 2 -21.491 3.788 4.097 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -23.736 5.589 3.192 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -23.004 4.489 2.041 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -23.485 2.603 3.680 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -24.396 3.754 4.638 1.00 0.00 H new ATOM 29 N GLU A 3 -20.136 6.456 3.372 1.00 0.00 N ATOM 30 CA GLU A 3 -19.182 7.176 2.537 1.00 0.00 C ATOM 31 C GLU A 3 -17.902 6.363 2.381 1.00 0.00 C ATOM 32 O GLU A 3 -17.264 6.371 1.327 1.00 0.00 O ATOM 33 CB GLU A 3 -18.864 8.541 3.165 1.00 0.00 C ATOM 34 CG GLU A 3 -18.052 9.464 2.270 1.00 0.00 C ATOM 35 CD GLU A 3 -18.734 9.741 0.948 1.00 0.00 C ATOM 36 OE1 GLU A 3 -19.878 10.241 0.957 1.00 0.00 O ATOM 37 OE2 GLU A 3 -18.124 9.466 -0.108 1.00 0.00 O ATOM 0 H GLU A 3 -20.223 6.815 4.323 1.00 0.00 H new ATOM 0 HA GLU A 3 -19.622 7.331 1.552 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -19.800 9.036 3.425 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -18.318 8.382 4.095 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -17.878 10.406 2.789 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -17.075 9.017 2.084 1.00 0.00 H new ATOM 44 N GLU A 4 -17.550 5.645 3.432 1.00 0.00 N ATOM 45 CA GLU A 4 -16.300 4.898 3.467 1.00 0.00 C ATOM 46 C GLU A 4 -16.354 3.653 2.590 1.00 0.00 C ATOM 47 O GLU A 4 -15.379 3.329 1.911 1.00 0.00 O ATOM 48 CB GLU A 4 -15.952 4.528 4.907 1.00 0.00 C ATOM 49 CG GLU A 4 -15.742 5.744 5.794 1.00 0.00 C ATOM 50 CD GLU A 4 -15.944 5.439 7.260 1.00 0.00 C ATOM 51 OE1 GLU A 4 -14.946 5.180 7.964 1.00 0.00 O ATOM 52 OE2 GLU A 4 -17.103 5.459 7.719 1.00 0.00 O ATOM 0 H GLU A 4 -18.114 5.562 4.278 1.00 0.00 H new ATOM 0 HA GLU A 4 -15.517 5.540 3.063 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -16.751 3.915 5.323 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -15.048 3.920 4.912 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -14.733 6.129 5.643 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -16.432 6.532 5.493 1.00 0.00 H new ATOM 59 N ASP A 5 -17.489 2.966 2.586 1.00 0.00 N ATOM 60 CA ASP A 5 -17.628 1.749 1.790 1.00 0.00 C ATOM 61 C ASP A 5 -17.976 2.080 0.347 1.00 0.00 C ATOM 62 O ASP A 5 -17.678 1.308 -0.562 1.00 0.00 O ATOM 63 CB ASP A 5 -18.689 0.811 2.377 1.00 0.00 C ATOM 64 CG ASP A 5 -20.082 1.405 2.378 1.00 0.00 C ATOM 65 OD1 ASP A 5 -20.453 2.046 3.385 1.00 0.00 O ATOM 66 OD2 ASP A 5 -20.813 1.225 1.379 1.00 0.00 O ATOM 0 H ASP A 5 -18.320 3.225 3.118 1.00 0.00 H new ATOM 0 HA ASP A 5 -16.666 1.238 1.815 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -18.698 -0.118 1.806 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -18.411 0.554 3.399 1.00 0.00 H new ATOM 71 N LYS A 6 -18.586 3.238 0.135 1.00 0.00 N ATOM 72 CA LYS A 6 -19.009 3.635 -1.200 1.00 0.00 C ATOM 73 C LYS A 6 -17.897 4.422 -1.894 1.00 0.00 C ATOM 74 O LYS A 6 -18.075 4.956 -2.995 1.00 0.00 O ATOM 75 CB LYS A 6 -20.301 4.461 -1.118 1.00 0.00 C ATOM 76 CG LYS A 6 -20.956 4.750 -2.469 1.00 0.00 C ATOM 77 CD LYS A 6 -21.107 3.487 -3.303 1.00 0.00 C ATOM 78 CE LYS A 6 -21.681 3.797 -4.675 1.00 0.00 C ATOM 79 NZ LYS A 6 -20.836 4.763 -5.428 1.00 0.00 N ATOM 0 H LYS A 6 -18.798 3.916 0.867 1.00 0.00 H new ATOM 0 HA LYS A 6 -19.211 2.742 -1.792 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -21.016 3.932 -0.488 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -20.081 5.408 -0.625 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -21.936 5.200 -2.309 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -20.356 5.478 -3.016 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -20.136 3.003 -3.413 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -21.757 2.782 -2.785 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -21.773 2.873 -5.247 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -22.686 4.204 -4.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -21.075 4.719 -6.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -21.009 5.725 -5.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -19.833 4.521 -5.299 1.00 0.00 H new ATOM 93 N CYS A 7 -16.747 4.478 -1.238 1.00 0.00 N ATOM 94 CA CYS A 7 -15.575 5.162 -1.772 1.00 0.00 C ATOM 95 C CYS A 7 -15.239 4.628 -3.163 1.00 0.00 C ATOM 96 O CYS A 7 -15.209 3.414 -3.385 1.00 0.00 O ATOM 97 CB CYS A 7 -14.383 4.970 -0.824 1.00 0.00 C ATOM 98 SG CYS A 7 -13.029 6.135 -1.101 1.00 0.00 S ATOM 0 H CYS A 7 -16.599 4.052 -0.323 1.00 0.00 H new ATOM 0 HA CYS A 7 -15.793 6.227 -1.854 1.00 0.00 H new ATOM 0 HB2 CYS A 7 -14.730 5.070 0.204 1.00 0.00 H new ATOM 0 HB3 CYS A 7 -14.003 3.954 -0.935 1.00 0.00 H new ATOM 0 HG CYS A 7 -12.072 5.897 -0.254 1.00 0.00 H new ATOM 104 N LYS A 8 -15.020 5.545 -4.098 1.00 0.00 N ATOM 105 CA LYS A 8 -14.755 5.195 -5.487 1.00 0.00 C ATOM 106 C LYS A 8 -13.507 4.318 -5.620 1.00 0.00 C ATOM 107 O LYS A 8 -12.546 4.453 -4.858 1.00 0.00 O ATOM 108 CB LYS A 8 -14.603 6.461 -6.327 1.00 0.00 C ATOM 109 CG LYS A 8 -13.433 7.332 -5.929 1.00 0.00 C ATOM 110 CD LYS A 8 -13.032 8.225 -7.077 1.00 0.00 C ATOM 111 CE LYS A 8 -11.823 9.076 -6.728 1.00 0.00 C ATOM 112 NZ LYS A 8 -11.303 9.823 -7.903 1.00 0.00 N ATOM 0 H LYS A 8 -15.021 6.548 -3.915 1.00 0.00 H new ATOM 0 HA LYS A 8 -15.605 4.619 -5.854 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -14.491 6.178 -7.374 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -15.520 7.046 -6.251 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -13.700 7.938 -5.063 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -12.590 6.708 -5.633 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -12.808 7.615 -7.952 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -13.868 8.872 -7.345 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -12.092 9.781 -5.942 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -11.035 8.438 -6.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -10.479 10.389 -7.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -11.021 9.151 -8.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -12.045 10.452 -8.270 1.00 0.00 H new ATOM 126 N PRO A 9 -13.513 3.413 -6.612 1.00 0.00 N ATOM 127 CA PRO A 9 -12.429 2.454 -6.819 1.00 0.00 C ATOM 128 C PRO A 9 -11.149 3.135 -7.268 1.00 0.00 C ATOM 129 O PRO A 9 -11.177 4.132 -7.994 1.00 0.00 O ATOM 130 CB PRO A 9 -12.968 1.525 -7.910 1.00 0.00 C ATOM 131 CG PRO A 9 -13.981 2.336 -8.640 1.00 0.00 C ATOM 132 CD PRO A 9 -14.572 3.281 -7.630 1.00 0.00 C ATOM 0 HA PRO A 9 -12.164 1.927 -5.902 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -12.171 1.195 -8.577 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -13.415 0.629 -7.480 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -13.521 2.884 -9.463 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -14.751 1.698 -9.073 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -14.818 4.243 -8.079 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -15.492 2.884 -7.201 1.00 0.00 H new ATOM 140 N MET A 10 -10.033 2.608 -6.805 1.00 0.00 N ATOM 141 CA MET A 10 -8.739 3.158 -7.134 1.00 0.00 C ATOM 142 C MET A 10 -8.334 2.746 -8.550 1.00 0.00 C ATOM 143 O MET A 10 -8.122 1.563 -8.822 1.00 0.00 O ATOM 144 CB MET A 10 -7.697 2.707 -6.111 1.00 0.00 C ATOM 145 CG MET A 10 -6.405 3.491 -6.212 1.00 0.00 C ATOM 146 SD MET A 10 -6.554 5.157 -5.559 1.00 0.00 S ATOM 147 CE MET A 10 -6.021 4.926 -3.866 1.00 0.00 C ATOM 0 H MET A 10 -10.000 1.792 -6.194 1.00 0.00 H new ATOM 0 HA MET A 10 -8.797 4.246 -7.101 1.00 0.00 H new ATOM 0 HB2 MET A 10 -8.107 2.817 -5.107 1.00 0.00 H new ATOM 0 HB3 MET A 10 -7.487 1.647 -6.255 1.00 0.00 H new ATOM 0 HG2 MET A 10 -5.620 2.962 -5.671 1.00 0.00 H new ATOM 0 HG3 MET A 10 -6.095 3.540 -7.256 1.00 0.00 H new ATOM 0 HE1 MET A 10 -6.694 5.462 -3.196 1.00 0.00 H new ATOM 0 HE2 MET A 10 -6.036 3.864 -3.621 1.00 0.00 H new ATOM 0 HE3 MET A 10 -5.008 5.311 -3.748 1.00 0.00 H new ATOM 157 N SER A 11 -8.248 3.725 -9.448 1.00 0.00 N ATOM 158 CA SER A 11 -7.958 3.468 -10.860 1.00 0.00 C ATOM 159 C SER A 11 -6.529 2.954 -11.053 1.00 0.00 C ATOM 160 O SER A 11 -5.720 3.030 -10.134 1.00 0.00 O ATOM 161 CB SER A 11 -8.163 4.746 -11.676 1.00 0.00 C ATOM 162 OG SER A 11 -9.401 5.364 -11.363 1.00 0.00 O ATOM 0 H SER A 11 -8.376 4.711 -9.222 1.00 0.00 H new ATOM 0 HA SER A 11 -8.645 2.697 -11.208 1.00 0.00 H new ATOM 0 HB2 SER A 11 -7.347 5.441 -11.478 1.00 0.00 H new ATOM 0 HB3 SER A 11 -8.130 4.510 -12.740 1.00 0.00 H new ATOM 0 HG SER A 11 -9.504 6.179 -11.898 1.00 0.00 H new ATOM 168 N TYR A 12 -6.218 2.454 -12.250 1.00 0.00 N ATOM 169 CA TYR A 12 -4.910 1.840 -12.521 1.00 0.00 C ATOM 170 C TYR A 12 -3.754 2.781 -12.203 1.00 0.00 C ATOM 171 O TYR A 12 -2.842 2.427 -11.454 1.00 0.00 O ATOM 172 CB TYR A 12 -4.814 1.383 -13.986 1.00 0.00 C ATOM 173 CG TYR A 12 -3.393 1.143 -14.468 1.00 0.00 C ATOM 174 CD1 TYR A 12 -2.501 0.384 -13.724 1.00 0.00 C ATOM 175 CD2 TYR A 12 -2.943 1.690 -15.664 1.00 0.00 C ATOM 176 CE1 TYR A 12 -1.207 0.172 -14.149 1.00 0.00 C ATOM 177 CE2 TYR A 12 -1.647 1.481 -16.101 1.00 0.00 C ATOM 178 CZ TYR A 12 -0.783 0.723 -15.338 1.00 0.00 C ATOM 179 OH TYR A 12 0.509 0.516 -15.768 1.00 0.00 O ATOM 0 H TYR A 12 -6.852 2.461 -13.049 1.00 0.00 H new ATOM 0 HA TYR A 12 -4.829 0.974 -11.864 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -5.388 0.464 -14.107 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -5.280 2.136 -14.622 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -2.828 -0.050 -12.791 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -3.616 2.288 -16.262 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -0.530 -0.422 -13.553 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -1.313 1.909 -17.035 1.00 0.00 H new ATOM 0 HH TYR A 12 0.646 0.972 -16.625 1.00 0.00 H new ATOM 189 N GLU A 13 -3.806 3.986 -12.745 1.00 0.00 N ATOM 190 CA GLU A 13 -2.677 4.900 -12.660 1.00 0.00 C ATOM 191 C GLU A 13 -2.521 5.380 -11.235 1.00 0.00 C ATOM 192 O GLU A 13 -1.466 5.868 -10.828 1.00 0.00 O ATOM 193 CB GLU A 13 -2.891 6.085 -13.594 1.00 0.00 C ATOM 194 CG GLU A 13 -3.095 5.683 -15.043 1.00 0.00 C ATOM 195 CD GLU A 13 -3.616 6.827 -15.880 1.00 0.00 C ATOM 196 OE1 GLU A 13 -4.837 7.082 -15.846 1.00 0.00 O ATOM 197 OE2 GLU A 13 -2.809 7.483 -16.569 1.00 0.00 O ATOM 0 H GLU A 13 -4.614 4.354 -13.247 1.00 0.00 H new ATOM 0 HA GLU A 13 -1.769 4.379 -12.963 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -3.759 6.652 -13.257 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -2.030 6.750 -13.527 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -2.150 5.331 -15.458 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -3.795 4.849 -15.093 1.00 0.00 H new ATOM 204 N GLU A 14 -3.584 5.200 -10.482 1.00 0.00 N ATOM 205 CA GLU A 14 -3.649 5.626 -9.128 1.00 0.00 C ATOM 206 C GLU A 14 -3.190 4.493 -8.213 1.00 0.00 C ATOM 207 O GLU A 14 -2.450 4.715 -7.265 1.00 0.00 O ATOM 208 CB GLU A 14 -5.065 6.025 -8.875 1.00 0.00 C ATOM 209 CG GLU A 14 -5.182 7.043 -7.773 1.00 0.00 C ATOM 210 CD GLU A 14 -4.303 8.256 -7.998 1.00 0.00 C ATOM 211 OE1 GLU A 14 -3.245 8.359 -7.349 1.00 0.00 O ATOM 212 OE2 GLU A 14 -4.674 9.117 -8.830 1.00 0.00 O ATOM 0 H GLU A 14 -4.435 4.744 -10.812 1.00 0.00 H new ATOM 0 HA GLU A 14 -2.991 6.472 -8.927 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -5.495 6.432 -9.790 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -5.648 5.142 -8.614 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -6.221 7.363 -7.689 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -4.915 6.577 -6.825 1.00 0.00 H new ATOM 219 N LYS A 15 -3.639 3.273 -8.515 1.00 0.00 N ATOM 220 CA LYS A 15 -3.103 2.068 -7.908 1.00 0.00 C ATOM 221 C LYS A 15 -1.592 1.992 -8.063 1.00 0.00 C ATOM 222 O LYS A 15 -0.869 1.753 -7.095 1.00 0.00 O ATOM 223 CB LYS A 15 -3.724 0.838 -8.556 1.00 0.00 C ATOM 224 CG LYS A 15 -5.121 0.525 -8.060 1.00 0.00 C ATOM 225 CD LYS A 15 -5.513 -0.893 -8.419 1.00 0.00 C ATOM 226 CE LYS A 15 -6.724 -1.378 -7.647 1.00 0.00 C ATOM 227 NZ LYS A 15 -7.310 -2.587 -8.281 1.00 0.00 N ATOM 0 H LYS A 15 -4.385 3.100 -9.189 1.00 0.00 H new ATOM 0 HA LYS A 15 -3.346 2.099 -6.846 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -3.756 0.985 -9.636 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -3.081 -0.023 -8.370 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -5.166 0.657 -6.979 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -5.833 1.226 -8.497 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -5.722 -0.948 -9.487 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -4.672 -1.559 -8.224 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -6.438 -1.604 -6.620 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -7.473 -0.587 -7.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -7.650 -3.236 -7.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -8.105 -2.308 -8.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -6.585 -3.064 -8.854 1.00 0.00 H new ATOM 241 N ARG A 16 -1.125 2.168 -9.294 1.00 0.00 N ATOM 242 CA ARG A 16 0.301 2.175 -9.580 1.00 0.00 C ATOM 243 C ARG A 16 1.000 3.236 -8.757 1.00 0.00 C ATOM 244 O ARG A 16 2.035 2.970 -8.149 1.00 0.00 O ATOM 245 CB ARG A 16 0.547 2.402 -11.080 1.00 0.00 C ATOM 246 CG ARG A 16 1.915 2.997 -11.415 1.00 0.00 C ATOM 247 CD ARG A 16 2.169 3.039 -12.912 1.00 0.00 C ATOM 248 NE ARG A 16 3.372 3.798 -13.243 1.00 0.00 N ATOM 249 CZ ARG A 16 3.847 3.935 -14.479 1.00 0.00 C ATOM 250 NH1 ARG A 16 3.218 3.375 -15.507 1.00 0.00 N ATOM 251 NH2 ARG A 16 4.952 4.636 -14.686 1.00 0.00 N ATOM 0 H ARG A 16 -1.718 2.308 -10.112 1.00 0.00 H new ATOM 0 HA ARG A 16 0.714 1.203 -9.309 1.00 0.00 H new ATOM 0 HB2 ARG A 16 0.441 1.450 -11.601 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -0.228 3.064 -11.466 1.00 0.00 H new ATOM 0 HG2 ARG A 16 1.980 4.006 -11.008 1.00 0.00 H new ATOM 0 HG3 ARG A 16 2.694 2.408 -10.932 1.00 0.00 H new ATOM 0 HD2 ARG A 16 2.266 2.022 -13.292 1.00 0.00 H new ATOM 0 HD3 ARG A 16 1.310 3.485 -13.413 1.00 0.00 H new ATOM 0 HE ARG A 16 3.878 4.250 -12.482 1.00 0.00 H new ATOM 0 HH11 ARG A 16 2.366 2.836 -15.351 1.00 0.00 H new ATOM 0 HH12 ARG A 16 3.587 3.484 -16.452 1.00 0.00 H new ATOM 0 HH21 ARG A 16 5.436 5.069 -13.899 1.00 0.00 H new ATOM 0 HH22 ARG A 16 5.319 4.743 -15.632 1.00 0.00 H new ATOM 265 N GLN A 17 0.425 4.431 -8.714 1.00 0.00 N ATOM 266 CA GLN A 17 1.021 5.497 -7.940 1.00 0.00 C ATOM 267 C GLN A 17 0.983 5.136 -6.463 1.00 0.00 C ATOM 268 O GLN A 17 1.964 5.318 -5.764 1.00 0.00 O ATOM 269 CB GLN A 17 0.350 6.855 -8.228 1.00 0.00 C ATOM 270 CG GLN A 17 1.273 8.040 -7.991 1.00 0.00 C ATOM 271 CD GLN A 17 2.474 8.023 -8.915 1.00 0.00 C ATOM 272 OE1 GLN A 17 2.403 7.522 -10.038 1.00 0.00 O ATOM 273 NE2 GLN A 17 3.582 8.585 -8.465 1.00 0.00 N ATOM 0 H GLN A 17 -0.438 4.678 -9.199 1.00 0.00 H new ATOM 0 HA GLN A 17 2.064 5.609 -8.238 1.00 0.00 H new ATOM 0 HB2 GLN A 17 0.006 6.871 -9.262 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -0.533 6.958 -7.597 1.00 0.00 H new ATOM 0 HG2 GLN A 17 0.717 8.966 -8.137 1.00 0.00 H new ATOM 0 HG3 GLN A 17 1.613 8.032 -6.955 1.00 0.00 H new ATOM 0 HE21 GLN A 17 3.605 8.990 -7.529 1.00 0.00 H new ATOM 0 HE22 GLN A 17 4.415 8.614 -9.053 1.00 0.00 H new ATOM 282 N LEU A 18 -0.119 4.538 -6.028 1.00 0.00 N ATOM 283 CA LEU A 18 -0.293 4.111 -4.648 1.00 0.00 C ATOM 284 C LEU A 18 0.796 3.145 -4.242 1.00 0.00 C ATOM 285 O LEU A 18 1.449 3.330 -3.219 1.00 0.00 O ATOM 286 CB LEU A 18 -1.653 3.444 -4.445 1.00 0.00 C ATOM 287 CG LEU A 18 -2.631 4.181 -3.525 1.00 0.00 C ATOM 288 CD1 LEU A 18 -3.075 3.312 -2.369 1.00 0.00 C ATOM 289 CD2 LEU A 18 -2.036 5.465 -2.989 1.00 0.00 C ATOM 0 H LEU A 18 -0.920 4.335 -6.626 1.00 0.00 H new ATOM 0 HA LEU A 18 -0.236 5.003 -4.024 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -2.125 3.321 -5.420 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -1.489 2.445 -4.042 1.00 0.00 H new ATOM 0 HG LEU A 18 -3.501 4.425 -4.135 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -3.768 3.870 -1.739 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -3.571 2.421 -2.753 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -2.206 3.018 -1.780 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -2.760 5.959 -2.341 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -1.134 5.238 -2.420 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -1.784 6.124 -3.820 1.00 0.00 H new ATOM 301 N SER A 19 0.993 2.121 -5.061 1.00 0.00 N ATOM 302 CA SER A 19 2.027 1.132 -4.818 1.00 0.00 C ATOM 303 C SER A 19 3.382 1.826 -4.688 1.00 0.00 C ATOM 304 O SER A 19 4.247 1.410 -3.917 1.00 0.00 O ATOM 305 CB SER A 19 2.058 0.120 -5.960 1.00 0.00 C ATOM 306 OG SER A 19 0.750 -0.339 -6.272 1.00 0.00 O ATOM 0 H SER A 19 0.444 1.955 -5.905 1.00 0.00 H new ATOM 0 HA SER A 19 1.809 0.604 -3.890 1.00 0.00 H new ATOM 0 HB2 SER A 19 2.507 0.576 -6.842 1.00 0.00 H new ATOM 0 HB3 SER A 19 2.687 -0.726 -5.684 1.00 0.00 H new ATOM 0 HG SER A 19 0.246 0.380 -6.707 1.00 0.00 H new ATOM 312 N LEU A 20 3.532 2.909 -5.443 1.00 0.00 N ATOM 313 CA LEU A 20 4.742 3.723 -5.415 1.00 0.00 C ATOM 314 C LEU A 20 4.816 4.603 -4.156 1.00 0.00 C ATOM 315 O LEU A 20 5.849 4.655 -3.498 1.00 0.00 O ATOM 316 CB LEU A 20 4.811 4.580 -6.685 1.00 0.00 C ATOM 317 CG LEU A 20 4.956 3.780 -7.977 1.00 0.00 C ATOM 318 CD1 LEU A 20 4.812 4.673 -9.199 1.00 0.00 C ATOM 319 CD2 LEU A 20 6.286 3.060 -7.994 1.00 0.00 C ATOM 0 H LEU A 20 2.820 3.247 -6.090 1.00 0.00 H new ATOM 0 HA LEU A 20 5.602 3.054 -5.382 1.00 0.00 H new ATOM 0 HB2 LEU A 20 3.909 5.188 -6.748 1.00 0.00 H new ATOM 0 HB3 LEU A 20 5.653 5.267 -6.600 1.00 0.00 H new ATOM 0 HG LEU A 20 4.155 3.042 -8.013 1.00 0.00 H new ATOM 0 HD11 LEU A 20 4.920 4.073 -10.103 1.00 0.00 H new ATOM 0 HD12 LEU A 20 3.829 5.144 -9.192 1.00 0.00 H new ATOM 0 HD13 LEU A 20 5.583 5.443 -9.180 1.00 0.00 H new ATOM 0 HD21 LEU A 20 6.380 2.492 -8.919 1.00 0.00 H new ATOM 0 HD22 LEU A 20 7.095 3.788 -7.931 1.00 0.00 H new ATOM 0 HD23 LEU A 20 6.343 2.380 -7.144 1.00 0.00 H new ATOM 331 N ASP A 21 3.740 5.324 -3.833 1.00 0.00 N ATOM 332 CA ASP A 21 3.684 6.126 -2.617 1.00 0.00 C ATOM 333 C ASP A 21 3.928 5.254 -1.394 1.00 0.00 C ATOM 334 O ASP A 21 4.615 5.648 -0.448 1.00 0.00 O ATOM 335 CB ASP A 21 2.354 6.838 -2.502 1.00 0.00 C ATOM 336 CG ASP A 21 1.791 7.305 -3.824 1.00 0.00 C ATOM 337 OD1 ASP A 21 2.575 7.859 -4.633 1.00 0.00 O ATOM 338 OD2 ASP A 21 0.567 7.187 -4.036 1.00 0.00 O ATOM 0 H ASP A 21 2.894 5.366 -4.402 1.00 0.00 H new ATOM 0 HA ASP A 21 4.470 6.880 -2.670 1.00 0.00 H new ATOM 0 HB2 ASP A 21 1.635 6.169 -2.029 1.00 0.00 H new ATOM 0 HB3 ASP A 21 2.470 7.699 -1.844 1.00 0.00 H new ATOM 343 N ILE A 22 3.389 4.051 -1.453 1.00 0.00 N ATOM 344 CA ILE A 22 3.552 3.070 -0.391 1.00 0.00 C ATOM 345 C ILE A 22 4.987 2.549 -0.333 1.00 0.00 C ATOM 346 O ILE A 22 5.535 2.343 0.745 1.00 0.00 O ATOM 347 CB ILE A 22 2.559 1.901 -0.565 1.00 0.00 C ATOM 348 CG1 ILE A 22 1.125 2.379 -0.326 1.00 0.00 C ATOM 349 CG2 ILE A 22 2.891 0.769 0.386 1.00 0.00 C ATOM 350 CD1 ILE A 22 0.079 1.423 -0.848 1.00 0.00 C ATOM 0 H ILE A 22 2.825 3.724 -2.238 1.00 0.00 H new ATOM 0 HA ILE A 22 3.336 3.568 0.554 1.00 0.00 H new ATOM 0 HB ILE A 22 2.644 1.533 -1.587 1.00 0.00 H new ATOM 0 HG12 ILE A 22 0.972 2.525 0.743 1.00 0.00 H new ATOM 0 HG13 ILE A 22 0.989 3.350 -0.803 1.00 0.00 H new ATOM 0 HG21 ILE A 22 2.179 -0.044 0.246 1.00 0.00 H new ATOM 0 HG22 ILE A 22 3.899 0.407 0.183 1.00 0.00 H new ATOM 0 HG23 ILE A 22 2.834 1.129 1.413 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -0.914 1.824 -0.645 1.00 0.00 H new ATOM 0 HD12 ILE A 22 0.206 1.296 -1.923 1.00 0.00 H new ATOM 0 HD13 ILE A 22 0.189 0.458 -0.353 1.00 0.00 H new ATOM 362 N ASN A 23 5.605 2.360 -1.489 1.00 0.00 N ATOM 363 CA ASN A 23 6.971 1.846 -1.536 1.00 0.00 C ATOM 364 C ASN A 23 7.980 2.941 -1.204 1.00 0.00 C ATOM 365 O ASN A 23 9.126 2.651 -0.857 1.00 0.00 O ATOM 366 CB ASN A 23 7.275 1.214 -2.902 1.00 0.00 C ATOM 367 CG ASN A 23 8.115 2.089 -3.821 1.00 0.00 C ATOM 368 OD1 ASN A 23 7.598 2.882 -4.601 1.00 0.00 O ATOM 369 ND2 ASN A 23 9.427 1.931 -3.749 1.00 0.00 N ATOM 0 H ASN A 23 5.190 2.552 -2.401 1.00 0.00 H new ATOM 0 HA ASN A 23 7.061 1.067 -0.779 1.00 0.00 H new ATOM 0 HB2 ASN A 23 7.794 0.268 -2.745 1.00 0.00 H new ATOM 0 HB3 ASN A 23 6.334 0.982 -3.400 1.00 0.00 H new ATOM 0 HD21 ASN A 23 10.040 2.478 -4.353 1.00 0.00 H new ATOM 0 HD22 ASN A 23 9.825 1.263 -3.089 1.00 0.00 H new ATOM 376 N LYS A 24 7.557 4.200 -1.323 1.00 0.00 N ATOM 377 CA LYS A 24 8.382 5.326 -0.902 1.00 0.00 C ATOM 378 C LYS A 24 8.681 5.228 0.577 1.00 0.00 C ATOM 379 O LYS A 24 9.768 5.597 1.034 1.00 0.00 O ATOM 380 CB LYS A 24 7.678 6.650 -1.137 1.00 0.00 C ATOM 381 CG LYS A 24 7.614 7.099 -2.582 1.00 0.00 C ATOM 382 CD LYS A 24 6.799 8.381 -2.663 1.00 0.00 C ATOM 383 CE LYS A 24 6.271 8.693 -4.056 1.00 0.00 C ATOM 384 NZ LYS A 24 5.512 7.571 -4.667 1.00 0.00 N ATOM 0 H LYS A 24 6.649 4.462 -1.707 1.00 0.00 H new ATOM 0 HA LYS A 24 9.298 5.287 -1.491 1.00 0.00 H new ATOM 0 HB2 LYS A 24 6.661 6.576 -0.751 1.00 0.00 H new ATOM 0 HB3 LYS A 24 8.184 7.421 -0.556 1.00 0.00 H new ATOM 0 HG2 LYS A 24 8.619 7.266 -2.970 1.00 0.00 H new ATOM 0 HG3 LYS A 24 7.159 6.323 -3.198 1.00 0.00 H new ATOM 0 HD2 LYS A 24 5.957 8.308 -1.975 1.00 0.00 H new ATOM 0 HD3 LYS A 24 7.416 9.213 -2.325 1.00 0.00 H new ATOM 0 HE2 LYS A 24 5.627 9.571 -4.004 1.00 0.00 H new ATOM 0 HE3 LYS A 24 7.109 8.950 -4.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 5.737 7.511 -5.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 5.775 6.679 -4.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 4.492 7.737 -4.548 1.00 0.00 H new ATOM 398 N LEU A 25 7.686 4.760 1.320 1.00 0.00 N ATOM 399 CA LEU A 25 7.795 4.628 2.755 1.00 0.00 C ATOM 400 C LEU A 25 8.999 3.778 3.131 1.00 0.00 C ATOM 401 O LEU A 25 9.351 2.824 2.435 1.00 0.00 O ATOM 402 CB LEU A 25 6.544 3.977 3.334 1.00 0.00 C ATOM 403 CG LEU A 25 5.206 4.503 2.833 1.00 0.00 C ATOM 404 CD1 LEU A 25 4.098 3.640 3.396 1.00 0.00 C ATOM 405 CD2 LEU A 25 4.996 5.950 3.250 1.00 0.00 C ATOM 0 H LEU A 25 6.787 4.464 0.940 1.00 0.00 H new ATOM 0 HA LEU A 25 7.912 5.631 3.165 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.589 2.908 3.126 1.00 0.00 H new ATOM 0 HB3 LEU A 25 6.571 4.092 4.418 1.00 0.00 H new ATOM 0 HG LEU A 25 5.197 4.463 1.744 1.00 0.00 H new ATOM 0 HD11 LEU A 25 3.135 4.008 3.043 1.00 0.00 H new ATOM 0 HD12 LEU A 25 4.236 2.610 3.066 1.00 0.00 H new ATOM 0 HD13 LEU A 25 4.124 3.679 4.485 1.00 0.00 H new ATOM 0 HD21 LEU A 25 4.033 6.300 2.879 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.013 6.021 4.338 1.00 0.00 H new ATOM 0 HD23 LEU A 25 5.791 6.568 2.833 1.00 0.00 H new ATOM 417 N PRO A 26 9.668 4.152 4.219 1.00 0.00 N ATOM 418 CA PRO A 26 10.685 3.305 4.836 1.00 0.00 C ATOM 419 C PRO A 26 10.084 1.962 5.255 1.00 0.00 C ATOM 420 O PRO A 26 8.875 1.877 5.480 1.00 0.00 O ATOM 421 CB PRO A 26 11.148 4.092 6.066 1.00 0.00 C ATOM 422 CG PRO A 26 10.630 5.487 5.895 1.00 0.00 C ATOM 423 CD PRO A 26 9.499 5.446 4.896 1.00 0.00 C ATOM 0 HA PRO A 26 11.505 3.080 4.154 1.00 0.00 H new ATOM 0 HB2 PRO A 26 10.762 3.644 6.982 1.00 0.00 H new ATOM 0 HB3 PRO A 26 12.235 4.088 6.143 1.00 0.00 H new ATOM 0 HG2 PRO A 26 10.282 5.884 6.849 1.00 0.00 H new ATOM 0 HG3 PRO A 26 11.423 6.148 5.546 1.00 0.00 H new ATOM 0 HD2 PRO A 26 8.529 5.515 5.388 1.00 0.00 H new ATOM 0 HD3 PRO A 26 9.559 6.276 4.192 1.00 0.00 H new ATOM 431 N GLY A 27 10.919 0.929 5.359 1.00 0.00 N ATOM 432 CA GLY A 27 10.431 -0.428 5.601 1.00 0.00 C ATOM 433 C GLY A 27 9.413 -0.521 6.727 1.00 0.00 C ATOM 434 O GLY A 27 8.381 -1.182 6.588 1.00 0.00 O ATOM 0 H GLY A 27 11.933 1.005 5.280 1.00 0.00 H new ATOM 0 HA2 GLY A 27 9.982 -0.812 4.685 1.00 0.00 H new ATOM 0 HA3 GLY A 27 11.278 -1.073 5.835 1.00 0.00 H new ATOM 438 N GLU A 28 9.700 0.161 7.828 1.00 0.00 N ATOM 439 CA GLU A 28 8.819 0.186 8.992 1.00 0.00 C ATOM 440 C GLU A 28 7.410 0.658 8.622 1.00 0.00 C ATOM 441 O GLU A 28 6.408 0.134 9.118 1.00 0.00 O ATOM 442 CB GLU A 28 9.402 1.123 10.047 1.00 0.00 C ATOM 443 CG GLU A 28 8.595 1.178 11.328 1.00 0.00 C ATOM 444 CD GLU A 28 8.625 -0.133 12.083 1.00 0.00 C ATOM 445 OE1 GLU A 28 7.550 -0.738 12.283 1.00 0.00 O ATOM 446 OE2 GLU A 28 9.725 -0.574 12.475 1.00 0.00 O ATOM 0 H GLU A 28 10.550 0.713 7.941 1.00 0.00 H new ATOM 0 HA GLU A 28 8.746 -0.829 9.382 1.00 0.00 H new ATOM 0 HB2 GLU A 28 10.418 0.804 10.282 1.00 0.00 H new ATOM 0 HB3 GLU A 28 9.472 2.127 9.629 1.00 0.00 H new ATOM 0 HG2 GLU A 28 8.984 1.971 11.966 1.00 0.00 H new ATOM 0 HG3 GLU A 28 7.562 1.436 11.093 1.00 0.00 H new ATOM 453 N LYS A 29 7.336 1.639 7.740 1.00 0.00 N ATOM 454 CA LYS A 29 6.067 2.248 7.388 1.00 0.00 C ATOM 455 C LYS A 29 5.254 1.351 6.460 1.00 0.00 C ATOM 456 O LYS A 29 4.027 1.408 6.452 1.00 0.00 O ATOM 457 CB LYS A 29 6.284 3.621 6.753 1.00 0.00 C ATOM 458 CG LYS A 29 6.595 4.762 7.740 1.00 0.00 C ATOM 459 CD LYS A 29 6.002 4.578 9.132 1.00 0.00 C ATOM 460 CE LYS A 29 6.443 5.716 10.036 1.00 0.00 C ATOM 461 NZ LYS A 29 6.371 7.040 9.356 1.00 0.00 N ATOM 0 H LYS A 29 8.142 2.031 7.254 1.00 0.00 H new ATOM 0 HA LYS A 29 5.497 2.377 8.308 1.00 0.00 H new ATOM 0 HB2 LYS A 29 7.104 3.547 6.039 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.391 3.886 6.187 1.00 0.00 H new ATOM 0 HG2 LYS A 29 7.677 4.861 7.831 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.223 5.697 7.322 1.00 0.00 H new ATOM 0 HD2 LYS A 29 4.914 4.550 9.073 1.00 0.00 H new ATOM 0 HD3 LYS A 29 6.323 3.624 9.550 1.00 0.00 H new ATOM 0 HE2 LYS A 29 5.815 5.733 10.927 1.00 0.00 H new ATOM 0 HE3 LYS A 29 7.465 5.537 10.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 6.176 7.781 10.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 7.277 7.238 8.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 5.609 7.026 8.648 1.00 0.00 H new ATOM 475 N LEU A 30 5.915 0.493 5.697 1.00 0.00 N ATOM 476 CA LEU A 30 5.177 -0.477 4.900 1.00 0.00 C ATOM 477 C LEU A 30 4.605 -1.558 5.812 1.00 0.00 C ATOM 478 O LEU A 30 3.741 -2.332 5.410 1.00 0.00 O ATOM 479 CB LEU A 30 6.027 -1.104 3.793 1.00 0.00 C ATOM 480 CG LEU A 30 6.435 -0.179 2.653 1.00 0.00 C ATOM 481 CD1 LEU A 30 7.899 0.177 2.753 1.00 0.00 C ATOM 482 CD2 LEU A 30 6.151 -0.832 1.312 1.00 0.00 C ATOM 0 H LEU A 30 6.930 0.447 5.613 1.00 0.00 H new ATOM 0 HA LEU A 30 4.367 0.056 4.403 1.00 0.00 H new ATOM 0 HB2 LEU A 30 6.932 -1.511 4.245 1.00 0.00 H new ATOM 0 HB3 LEU A 30 5.475 -1.944 3.372 1.00 0.00 H new ATOM 0 HG LEU A 30 5.847 0.736 2.732 1.00 0.00 H new ATOM 0 HD11 LEU A 30 8.170 0.838 1.930 1.00 0.00 H new ATOM 0 HD12 LEU A 30 8.087 0.682 3.701 1.00 0.00 H new ATOM 0 HD13 LEU A 30 8.499 -0.732 2.701 1.00 0.00 H new ATOM 0 HD21 LEU A 30 6.448 -0.158 0.509 1.00 0.00 H new ATOM 0 HD22 LEU A 30 6.715 -1.761 1.233 1.00 0.00 H new ATOM 0 HD23 LEU A 30 5.085 -1.046 1.230 1.00 0.00 H new ATOM 494 N GLY A 31 5.072 -1.581 7.058 1.00 0.00 N ATOM 495 CA GLY A 31 4.512 -2.481 8.050 1.00 0.00 C ATOM 496 C GLY A 31 3.082 -2.119 8.394 1.00 0.00 C ATOM 497 O GLY A 31 2.336 -2.924 8.950 1.00 0.00 O ATOM 0 H GLY A 31 5.831 -0.990 7.398 1.00 0.00 H new ATOM 0 HA2 GLY A 31 4.548 -3.504 7.674 1.00 0.00 H new ATOM 0 HA3 GLY A 31 5.122 -2.452 8.953 1.00 0.00 H new ATOM 501 N ARG A 32 2.706 -0.897 8.063 1.00 0.00 N ATOM 502 CA ARG A 32 1.337 -0.433 8.245 1.00 0.00 C ATOM 503 C ARG A 32 0.435 -0.891 7.097 1.00 0.00 C ATOM 504 O ARG A 32 -0.623 -1.462 7.337 1.00 0.00 O ATOM 505 CB ARG A 32 1.309 1.088 8.354 1.00 0.00 C ATOM 506 CG ARG A 32 -0.071 1.689 8.119 1.00 0.00 C ATOM 507 CD ARG A 32 -0.748 2.093 9.412 1.00 0.00 C ATOM 508 NE ARG A 32 0.029 3.069 10.174 1.00 0.00 N ATOM 509 CZ ARG A 32 -0.406 3.658 11.288 1.00 0.00 C ATOM 510 NH1 ARG A 32 -1.568 3.299 11.826 1.00 0.00 N ATOM 511 NH2 ARG A 32 0.334 4.585 11.881 1.00 0.00 N ATOM 0 H ARG A 32 3.334 -0.200 7.663 1.00 0.00 H new ATOM 0 HA ARG A 32 0.956 -0.869 9.168 1.00 0.00 H new ATOM 0 HB2 ARG A 32 1.660 1.380 9.344 1.00 0.00 H new ATOM 0 HB3 ARG A 32 2.008 1.509 7.631 1.00 0.00 H new ATOM 0 HG2 ARG A 32 0.020 2.561 7.471 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -0.696 0.966 7.595 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -1.730 2.511 9.188 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -0.911 1.206 10.025 1.00 0.00 H new ATOM 0 HE ARG A 32 0.959 3.314 9.833 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -2.130 2.570 11.386 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -1.897 3.752 12.678 1.00 0.00 H new ATOM 0 HH21 ARG A 32 1.236 4.848 11.485 1.00 0.00 H new ATOM 0 HH22 ARG A 32 0.001 5.035 12.733 1.00 0.00 H new ATOM 525 N VAL A 33 0.845 -0.632 5.854 1.00 0.00 N ATOM 526 CA VAL A 33 0.054 -1.036 4.689 1.00 0.00 C ATOM 527 C VAL A 33 -0.129 -2.540 4.643 1.00 0.00 C ATOM 528 O VAL A 33 -1.219 -3.010 4.339 1.00 0.00 O ATOM 529 CB VAL A 33 0.668 -0.557 3.361 1.00 0.00 C ATOM 530 CG1 VAL A 33 0.343 0.905 3.125 1.00 0.00 C ATOM 531 CG2 VAL A 33 2.164 -0.770 3.353 1.00 0.00 C ATOM 0 H VAL A 33 1.714 -0.148 5.628 1.00 0.00 H new ATOM 0 HA VAL A 33 -0.917 -0.555 4.805 1.00 0.00 H new ATOM 0 HB VAL A 33 0.234 -1.147 2.553 1.00 0.00 H new ATOM 0 HG11 VAL A 33 0.784 1.228 2.182 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -0.738 1.035 3.083 1.00 0.00 H new ATOM 0 HG13 VAL A 33 0.749 1.504 3.940 1.00 0.00 H new ATOM 0 HG21 VAL A 33 2.576 -0.424 2.405 1.00 0.00 H new ATOM 0 HG22 VAL A 33 2.616 -0.209 4.171 1.00 0.00 H new ATOM 0 HG23 VAL A 33 2.381 -1.831 3.477 1.00 0.00 H new ATOM 541 N VAL A 34 0.919 -3.299 4.959 1.00 0.00 N ATOM 542 CA VAL A 34 0.782 -4.739 5.020 1.00 0.00 C ATOM 543 C VAL A 34 -0.241 -5.105 6.088 1.00 0.00 C ATOM 544 O VAL A 34 -1.075 -5.971 5.878 1.00 0.00 O ATOM 545 CB VAL A 34 2.123 -5.466 5.282 1.00 0.00 C ATOM 546 CG1 VAL A 34 3.164 -5.073 4.250 1.00 0.00 C ATOM 547 CG2 VAL A 34 2.640 -5.196 6.680 1.00 0.00 C ATOM 0 H VAL A 34 1.851 -2.943 5.172 1.00 0.00 H new ATOM 0 HA VAL A 34 0.440 -5.075 4.041 1.00 0.00 H new ATOM 0 HB VAL A 34 1.933 -6.536 5.195 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.097 -5.597 4.456 1.00 0.00 H new ATOM 0 HG12 VAL A 34 2.809 -5.341 3.255 1.00 0.00 H new ATOM 0 HG13 VAL A 34 3.334 -3.997 4.296 1.00 0.00 H new ATOM 0 HG21 VAL A 34 3.583 -5.723 6.827 1.00 0.00 H new ATOM 0 HG22 VAL A 34 2.799 -4.125 6.809 1.00 0.00 H new ATOM 0 HG23 VAL A 34 1.911 -5.545 7.411 1.00 0.00 H new ATOM 557 N HIS A 35 -0.205 -4.389 7.210 1.00 0.00 N ATOM 558 CA HIS A 35 -1.163 -4.606 8.283 1.00 0.00 C ATOM 559 C HIS A 35 -2.574 -4.265 7.810 1.00 0.00 C ATOM 560 O HIS A 35 -3.502 -5.041 8.026 1.00 0.00 O ATOM 561 CB HIS A 35 -0.782 -3.783 9.521 1.00 0.00 C ATOM 562 CG HIS A 35 -1.798 -3.836 10.625 1.00 0.00 C ATOM 563 ND1 HIS A 35 -1.823 -4.825 11.581 1.00 0.00 N ATOM 564 CD2 HIS A 35 -2.835 -3.013 10.909 1.00 0.00 C ATOM 565 CE1 HIS A 35 -2.834 -4.614 12.403 1.00 0.00 C ATOM 566 NE2 HIS A 35 -3.467 -3.519 12.019 1.00 0.00 N ATOM 0 H HIS A 35 0.478 -3.655 7.396 1.00 0.00 H new ATOM 0 HA HIS A 35 -1.143 -5.659 8.562 1.00 0.00 H new ATOM 0 HB2 HIS A 35 0.174 -4.142 9.903 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -0.637 -2.744 9.224 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -3.114 -2.123 10.364 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -3.099 -5.232 13.248 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -4.288 -3.117 12.471 1.00 0.00 H new ATOM 575 N ILE A 36 -2.729 -3.111 7.162 1.00 0.00 N ATOM 576 CA ILE A 36 -4.016 -2.725 6.599 1.00 0.00 C ATOM 577 C ILE A 36 -4.487 -3.774 5.605 1.00 0.00 C ATOM 578 O ILE A 36 -5.499 -4.430 5.828 1.00 0.00 O ATOM 579 CB ILE A 36 -3.980 -1.351 5.889 1.00 0.00 C ATOM 580 CG1 ILE A 36 -3.674 -0.230 6.872 1.00 0.00 C ATOM 581 CG2 ILE A 36 -5.324 -1.096 5.226 1.00 0.00 C ATOM 582 CD1 ILE A 36 -3.372 1.088 6.199 1.00 0.00 C ATOM 0 H ILE A 36 -1.982 -2.432 7.016 1.00 0.00 H new ATOM 0 HA ILE A 36 -4.706 -2.648 7.439 1.00 0.00 H new ATOM 0 HB ILE A 36 -3.189 -1.369 5.140 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -4.524 -0.102 7.542 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -2.823 -0.519 7.488 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -5.304 -0.129 4.724 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -5.524 -1.880 4.496 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -6.109 -1.096 5.982 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.163 1.844 6.956 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -2.504 0.975 5.550 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -4.231 1.398 5.605 1.00 0.00 H new ATOM 594 N ILE A 37 -3.735 -3.938 4.526 1.00 0.00 N ATOM 595 CA ILE A 37 -4.078 -4.900 3.494 1.00 0.00 C ATOM 596 C ILE A 37 -4.397 -6.283 4.073 1.00 0.00 C ATOM 597 O ILE A 37 -5.460 -6.813 3.813 1.00 0.00 O ATOM 598 CB ILE A 37 -2.968 -5.022 2.446 1.00 0.00 C ATOM 599 CG1 ILE A 37 -3.016 -3.835 1.498 1.00 0.00 C ATOM 600 CG2 ILE A 37 -3.120 -6.312 1.675 1.00 0.00 C ATOM 601 CD1 ILE A 37 -1.688 -3.156 1.313 1.00 0.00 C ATOM 0 H ILE A 37 -2.879 -3.413 4.344 1.00 0.00 H new ATOM 0 HA ILE A 37 -4.978 -4.518 3.011 1.00 0.00 H new ATOM 0 HB ILE A 37 -2.003 -5.029 2.953 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -3.381 -4.171 0.527 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -3.736 -3.109 1.875 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -2.325 -6.388 0.933 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -3.057 -7.156 2.362 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -4.088 -6.324 1.173 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -1.800 -2.319 0.624 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -1.330 -2.789 2.275 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -0.969 -3.867 0.906 1.00 0.00 H new ATOM 613 N GLN A 38 -3.495 -6.851 4.872 1.00 0.00 N ATOM 614 CA GLN A 38 -3.702 -8.194 5.430 1.00 0.00 C ATOM 615 C GLN A 38 -5.005 -8.279 6.228 1.00 0.00 C ATOM 616 O GLN A 38 -5.758 -9.242 6.097 1.00 0.00 O ATOM 617 CB GLN A 38 -2.533 -8.591 6.336 1.00 0.00 C ATOM 618 CG GLN A 38 -1.262 -8.957 5.589 1.00 0.00 C ATOM 619 CD GLN A 38 -0.035 -8.930 6.482 1.00 0.00 C ATOM 620 OE1 GLN A 38 0.037 -8.169 7.444 1.00 0.00 O ATOM 621 NE2 GLN A 38 0.943 -9.759 6.170 1.00 0.00 N ATOM 0 H GLN A 38 -2.618 -6.409 5.148 1.00 0.00 H new ATOM 0 HA GLN A 38 -3.763 -8.883 4.587 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -2.317 -7.766 7.014 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -2.836 -9.438 6.951 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -1.372 -9.952 5.158 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -1.119 -8.264 4.760 1.00 0.00 H new ATOM 0 HE21 GLN A 38 0.850 -10.377 5.364 1.00 0.00 H new ATOM 0 HE22 GLN A 38 1.792 -9.781 6.735 1.00 0.00 H new ATOM 630 N SER A 39 -5.265 -7.271 7.058 1.00 0.00 N ATOM 631 CA SER A 39 -6.452 -7.259 7.891 1.00 0.00 C ATOM 632 C SER A 39 -7.716 -7.089 7.054 1.00 0.00 C ATOM 633 O SER A 39 -8.764 -7.664 7.357 1.00 0.00 O ATOM 634 CB SER A 39 -6.358 -6.134 8.923 1.00 0.00 C ATOM 635 OG SER A 39 -6.285 -4.858 8.309 1.00 0.00 O ATOM 0 H SER A 39 -4.665 -6.454 7.167 1.00 0.00 H new ATOM 0 HA SER A 39 -6.511 -8.219 8.404 1.00 0.00 H new ATOM 0 HB2 SER A 39 -7.226 -6.171 9.581 1.00 0.00 H new ATOM 0 HB3 SER A 39 -5.478 -6.287 9.548 1.00 0.00 H new ATOM 0 HG SER A 39 -5.777 -4.926 7.474 1.00 0.00 H new ATOM 641 N ARG A 40 -7.607 -6.287 6.010 1.00 0.00 N ATOM 642 CA ARG A 40 -8.734 -5.999 5.139 1.00 0.00 C ATOM 643 C ARG A 40 -8.921 -7.106 4.108 1.00 0.00 C ATOM 644 O ARG A 40 -10.030 -7.341 3.630 1.00 0.00 O ATOM 645 CB ARG A 40 -8.527 -4.654 4.437 1.00 0.00 C ATOM 646 CG ARG A 40 -8.301 -3.493 5.395 1.00 0.00 C ATOM 647 CD ARG A 40 -9.099 -2.267 4.995 1.00 0.00 C ATOM 648 NE ARG A 40 -10.539 -2.528 4.968 1.00 0.00 N ATOM 649 CZ ARG A 40 -11.469 -1.624 5.279 1.00 0.00 C ATOM 650 NH1 ARG A 40 -11.113 -0.398 5.642 1.00 0.00 N ATOM 651 NH2 ARG A 40 -12.755 -1.949 5.239 1.00 0.00 N ATOM 0 H ARG A 40 -6.741 -5.819 5.743 1.00 0.00 H new ATOM 0 HA ARG A 40 -9.635 -5.946 5.751 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -7.671 -4.732 3.766 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -9.398 -4.439 3.818 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -8.581 -3.795 6.404 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -7.240 -3.244 5.420 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -8.892 -1.457 5.694 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -8.774 -1.930 4.011 1.00 0.00 H new ATOM 0 HE ARG A 40 -10.851 -3.460 4.694 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -10.126 -0.145 5.684 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -11.827 0.291 5.879 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -13.034 -2.892 4.970 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -13.464 -1.255 5.477 1.00 0.00 H new ATOM 665 N GLU A 41 -7.831 -7.779 3.780 1.00 0.00 N ATOM 666 CA GLU A 41 -7.834 -8.842 2.784 1.00 0.00 C ATOM 667 C GLU A 41 -7.409 -10.165 3.424 1.00 0.00 C ATOM 668 O GLU A 41 -6.242 -10.559 3.332 1.00 0.00 O ATOM 669 CB GLU A 41 -6.868 -8.504 1.648 1.00 0.00 C ATOM 670 CG GLU A 41 -7.022 -7.097 1.094 1.00 0.00 C ATOM 671 CD GLU A 41 -8.312 -6.897 0.328 1.00 0.00 C ATOM 672 OE1 GLU A 41 -8.643 -7.739 -0.527 1.00 0.00 O ATOM 673 OE2 GLU A 41 -8.999 -5.884 0.564 1.00 0.00 O ATOM 0 H GLU A 41 -6.916 -7.605 4.197 1.00 0.00 H new ATOM 0 HA GLU A 41 -8.844 -8.937 2.386 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -5.846 -8.631 2.006 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -7.014 -9.219 0.838 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -6.981 -6.383 1.916 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -6.180 -6.877 0.438 1.00 0.00 H new ATOM 680 N PRO A 42 -8.348 -10.871 4.078 1.00 0.00 N ATOM 681 CA PRO A 42 -8.057 -12.126 4.799 1.00 0.00 C ATOM 682 C PRO A 42 -7.434 -13.232 3.933 1.00 0.00 C ATOM 683 O PRO A 42 -7.017 -14.267 4.454 1.00 0.00 O ATOM 684 CB PRO A 42 -9.431 -12.577 5.304 1.00 0.00 C ATOM 685 CG PRO A 42 -10.258 -11.340 5.337 1.00 0.00 C ATOM 686 CD PRO A 42 -9.767 -10.485 4.204 1.00 0.00 C ATOM 0 HA PRO A 42 -7.315 -11.949 5.577 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -9.868 -13.325 4.643 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -9.358 -13.029 6.293 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -11.316 -11.574 5.219 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -10.150 -10.824 6.291 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -10.320 -10.679 3.285 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -9.877 -9.423 4.424 1.00 0.00 H new ATOM 694 N SER A 43 -7.360 -13.024 2.626 1.00 0.00 N ATOM 695 CA SER A 43 -6.854 -14.047 1.721 1.00 0.00 C ATOM 696 C SER A 43 -5.327 -14.029 1.659 1.00 0.00 C ATOM 697 O SER A 43 -4.705 -15.018 1.276 1.00 0.00 O ATOM 698 CB SER A 43 -7.434 -13.844 0.313 1.00 0.00 C ATOM 699 OG SER A 43 -7.086 -14.915 -0.552 1.00 0.00 O ATOM 0 H SER A 43 -7.643 -12.157 2.169 1.00 0.00 H new ATOM 0 HA SER A 43 -7.168 -15.017 2.106 1.00 0.00 H new ATOM 0 HB2 SER A 43 -8.519 -13.762 0.374 1.00 0.00 H new ATOM 0 HB3 SER A 43 -7.066 -12.906 -0.102 1.00 0.00 H new ATOM 0 HG SER A 43 -7.471 -14.757 -1.439 1.00 0.00 H new ATOM 705 N LEU A 44 -4.714 -12.918 2.047 1.00 0.00 N ATOM 706 CA LEU A 44 -3.271 -12.782 1.896 1.00 0.00 C ATOM 707 C LEU A 44 -2.546 -12.744 3.233 1.00 0.00 C ATOM 708 O LEU A 44 -1.402 -12.297 3.316 1.00 0.00 O ATOM 709 CB LEU A 44 -2.934 -11.555 1.047 1.00 0.00 C ATOM 710 CG LEU A 44 -3.533 -10.233 1.500 1.00 0.00 C ATOM 711 CD1 LEU A 44 -2.612 -9.545 2.485 1.00 0.00 C ATOM 712 CD2 LEU A 44 -3.800 -9.349 0.292 1.00 0.00 C ATOM 0 H LEU A 44 -5.182 -12.112 2.461 1.00 0.00 H new ATOM 0 HA LEU A 44 -2.915 -13.672 1.377 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -1.850 -11.447 1.019 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -3.262 -11.746 0.025 1.00 0.00 H new ATOM 0 HG LEU A 44 -4.480 -10.423 2.006 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -3.056 -8.600 2.799 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -2.467 -10.185 3.355 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.649 -9.354 2.011 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -4.229 -8.403 0.621 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -2.864 -9.159 -0.234 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -4.498 -9.850 -0.378 1.00 0.00 H new ATOM 724 N LYS A 45 -3.187 -13.254 4.277 1.00 0.00 N ATOM 725 CA LYS A 45 -2.541 -13.325 5.583 1.00 0.00 C ATOM 726 C LYS A 45 -1.534 -14.474 5.619 1.00 0.00 C ATOM 727 O LYS A 45 -0.884 -14.713 6.637 1.00 0.00 O ATOM 728 CB LYS A 45 -3.566 -13.460 6.715 1.00 0.00 C ATOM 729 CG LYS A 45 -4.464 -14.681 6.608 1.00 0.00 C ATOM 730 CD LYS A 45 -5.739 -14.526 7.428 1.00 0.00 C ATOM 731 CE LYS A 45 -5.509 -14.795 8.908 1.00 0.00 C ATOM 732 NZ LYS A 45 -6.727 -14.526 9.718 1.00 0.00 N ATOM 0 H LYS A 45 -4.139 -13.620 4.248 1.00 0.00 H new ATOM 0 HA LYS A 45 -2.006 -12.389 5.741 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -3.035 -13.497 7.666 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -4.190 -12.566 6.732 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -4.723 -14.850 5.563 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -3.920 -15.562 6.947 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -6.130 -13.516 7.301 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -6.497 -15.211 7.050 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -5.204 -15.832 9.045 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -4.690 -14.172 9.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -6.528 -14.722 10.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -7.004 -13.530 9.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -7.502 -15.139 9.393 1.00 0.00 H new ATOM 746 N ASN A 46 -1.402 -15.173 4.493 1.00 0.00 N ATOM 747 CA ASN A 46 -0.370 -16.195 4.342 1.00 0.00 C ATOM 748 C ASN A 46 0.993 -15.522 4.224 1.00 0.00 C ATOM 749 O ASN A 46 2.015 -16.069 4.639 1.00 0.00 O ATOM 750 CB ASN A 46 -0.621 -17.070 3.104 1.00 0.00 C ATOM 751 CG ASN A 46 -1.967 -17.771 3.123 1.00 0.00 C ATOM 752 OD1 ASN A 46 -2.125 -18.816 3.756 1.00 0.00 O ATOM 753 ND2 ASN A 46 -2.929 -17.233 2.388 1.00 0.00 N ATOM 0 H ASN A 46 -1.996 -15.050 3.673 1.00 0.00 H new ATOM 0 HA ASN A 46 -0.397 -16.839 5.221 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -0.556 -16.449 2.210 1.00 0.00 H new ATOM 0 HB3 ASN A 46 0.169 -17.818 3.031 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -3.841 -17.686 2.331 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -2.757 -16.366 1.879 1.00 0.00 H new ATOM 760 N SER A 47 0.988 -14.318 3.664 1.00 0.00 N ATOM 761 CA SER A 47 2.199 -13.529 3.509 1.00 0.00 C ATOM 762 C SER A 47 2.601 -12.902 4.838 1.00 0.00 C ATOM 763 O SER A 47 1.805 -12.214 5.474 1.00 0.00 O ATOM 764 CB SER A 47 1.963 -12.440 2.461 1.00 0.00 C ATOM 765 OG SER A 47 1.496 -13.003 1.247 1.00 0.00 O ATOM 0 H SER A 47 0.147 -13.865 3.307 1.00 0.00 H new ATOM 0 HA SER A 47 3.009 -14.179 3.180 1.00 0.00 H new ATOM 0 HB2 SER A 47 1.236 -11.719 2.836 1.00 0.00 H new ATOM 0 HB3 SER A 47 2.890 -11.895 2.282 1.00 0.00 H new ATOM 0 HG SER A 47 1.350 -12.290 0.591 1.00 0.00 H new ATOM 771 N ASN A 48 3.825 -13.167 5.263 1.00 0.00 N ATOM 772 CA ASN A 48 4.367 -12.550 6.470 1.00 0.00 C ATOM 773 C ASN A 48 4.751 -11.114 6.141 1.00 0.00 C ATOM 774 O ASN A 48 5.207 -10.847 5.040 1.00 0.00 O ATOM 775 CB ASN A 48 5.613 -13.301 6.945 1.00 0.00 C ATOM 776 CG ASN A 48 5.613 -13.574 8.432 1.00 0.00 C ATOM 777 OD1 ASN A 48 5.971 -12.716 9.239 1.00 0.00 O ATOM 778 ND2 ASN A 48 5.252 -14.788 8.793 1.00 0.00 N ATOM 0 H ASN A 48 4.466 -13.806 4.792 1.00 0.00 H new ATOM 0 HA ASN A 48 3.617 -12.582 7.260 1.00 0.00 H new ATOM 0 HB2 ASN A 48 5.686 -14.247 6.408 1.00 0.00 H new ATOM 0 HB3 ASN A 48 6.499 -12.720 6.689 1.00 0.00 H new ATOM 0 HD21 ASN A 48 5.262 -15.051 9.778 1.00 0.00 H new ATOM 0 HD22 ASN A 48 4.963 -15.465 8.087 1.00 0.00 H new ATOM 785 N PRO A 49 4.572 -10.167 7.077 1.00 0.00 N ATOM 786 CA PRO A 49 4.887 -8.745 6.835 1.00 0.00 C ATOM 787 C PRO A 49 6.346 -8.496 6.433 1.00 0.00 C ATOM 788 O PRO A 49 6.645 -7.490 5.799 1.00 0.00 O ATOM 789 CB PRO A 49 4.580 -8.077 8.180 1.00 0.00 C ATOM 790 CG PRO A 49 3.628 -9.002 8.860 1.00 0.00 C ATOM 791 CD PRO A 49 4.029 -10.385 8.435 1.00 0.00 C ATOM 0 HA PRO A 49 4.309 -8.353 5.998 1.00 0.00 H new ATOM 0 HB2 PRO A 49 5.487 -7.940 8.769 1.00 0.00 H new ATOM 0 HB3 PRO A 49 4.139 -7.090 8.039 1.00 0.00 H new ATOM 0 HG2 PRO A 49 3.684 -8.894 9.943 1.00 0.00 H new ATOM 0 HG3 PRO A 49 2.599 -8.787 8.571 1.00 0.00 H new ATOM 0 HD2 PRO A 49 4.775 -10.813 9.105 1.00 0.00 H new ATOM 0 HD3 PRO A 49 3.179 -11.068 8.426 1.00 0.00 H new ATOM 799 N ASP A 50 7.242 -9.415 6.786 1.00 0.00 N ATOM 800 CA ASP A 50 8.669 -9.265 6.479 1.00 0.00 C ATOM 801 C ASP A 50 9.005 -9.853 5.111 1.00 0.00 C ATOM 802 O ASP A 50 10.075 -9.606 4.556 1.00 0.00 O ATOM 803 CB ASP A 50 9.522 -9.956 7.545 1.00 0.00 C ATOM 804 CG ASP A 50 9.342 -9.363 8.925 1.00 0.00 C ATOM 805 OD1 ASP A 50 9.902 -8.279 9.194 1.00 0.00 O ATOM 806 OD2 ASP A 50 8.650 -9.986 9.756 1.00 0.00 O ATOM 0 H ASP A 50 7.008 -10.273 7.285 1.00 0.00 H new ATOM 0 HA ASP A 50 8.891 -8.198 6.468 1.00 0.00 H new ATOM 0 HB2 ASP A 50 9.267 -11.015 7.575 1.00 0.00 H new ATOM 0 HB3 ASP A 50 10.572 -9.889 7.261 1.00 0.00 H new ATOM 811 N GLU A 51 8.074 -10.618 4.580 1.00 0.00 N ATOM 812 CA GLU A 51 8.241 -11.323 3.316 1.00 0.00 C ATOM 813 C GLU A 51 6.980 -11.128 2.490 1.00 0.00 C ATOM 814 O GLU A 51 6.570 -11.992 1.718 1.00 0.00 O ATOM 815 CB GLU A 51 8.517 -12.810 3.567 1.00 0.00 C ATOM 816 CG GLU A 51 9.996 -13.159 3.645 1.00 0.00 C ATOM 817 CD GLU A 51 10.679 -13.137 2.291 1.00 0.00 C ATOM 818 OE1 GLU A 51 10.621 -14.161 1.576 1.00 0.00 O ATOM 819 OE2 GLU A 51 11.286 -12.107 1.932 1.00 0.00 O ATOM 0 H GLU A 51 7.165 -10.773 5.017 1.00 0.00 H new ATOM 0 HA GLU A 51 9.096 -10.923 2.770 1.00 0.00 H new ATOM 0 HB2 GLU A 51 8.034 -13.107 4.498 1.00 0.00 H new ATOM 0 HB3 GLU A 51 8.058 -13.394 2.770 1.00 0.00 H new ATOM 0 HG2 GLU A 51 10.496 -12.455 4.310 1.00 0.00 H new ATOM 0 HG3 GLU A 51 10.108 -14.149 4.087 1.00 0.00 H new ATOM 826 N ILE A 52 6.361 -9.980 2.714 1.00 0.00 N ATOM 827 CA ILE A 52 5.046 -9.666 2.181 1.00 0.00 C ATOM 828 C ILE A 52 5.021 -9.638 0.652 1.00 0.00 C ATOM 829 O ILE A 52 6.009 -9.303 -0.005 1.00 0.00 O ATOM 830 CB ILE A 52 4.570 -8.295 2.714 1.00 0.00 C ATOM 831 CG1 ILE A 52 3.097 -8.060 2.404 1.00 0.00 C ATOM 832 CG2 ILE A 52 5.385 -7.192 2.088 1.00 0.00 C ATOM 833 CD1 ILE A 52 2.160 -9.099 2.969 1.00 0.00 C ATOM 0 H ILE A 52 6.763 -9.231 3.278 1.00 0.00 H new ATOM 0 HA ILE A 52 4.377 -10.460 2.513 1.00 0.00 H new ATOM 0 HB ILE A 52 4.703 -8.294 3.796 1.00 0.00 H new ATOM 0 HG12 ILE A 52 2.810 -7.082 2.791 1.00 0.00 H new ATOM 0 HG13 ILE A 52 2.969 -8.025 1.322 1.00 0.00 H new ATOM 0 HG21 ILE A 52 5.045 -6.228 2.467 1.00 0.00 H new ATOM 0 HG22 ILE A 52 6.437 -7.330 2.338 1.00 0.00 H new ATOM 0 HG23 ILE A 52 5.263 -7.219 1.005 1.00 0.00 H new ATOM 0 HD11 ILE A 52 1.134 -8.850 2.698 1.00 0.00 H new ATOM 0 HD12 ILE A 52 2.415 -10.078 2.563 1.00 0.00 H new ATOM 0 HD13 ILE A 52 2.253 -9.121 4.055 1.00 0.00 H new ATOM 845 N GLU A 53 3.878 -10.010 0.100 1.00 0.00 N ATOM 846 CA GLU A 53 3.616 -9.846 -1.312 1.00 0.00 C ATOM 847 C GLU A 53 2.171 -9.376 -1.479 1.00 0.00 C ATOM 848 O GLU A 53 1.236 -10.177 -1.427 1.00 0.00 O ATOM 849 CB GLU A 53 3.850 -11.169 -2.043 1.00 0.00 C ATOM 850 CG GLU A 53 4.147 -11.005 -3.519 1.00 0.00 C ATOM 851 CD GLU A 53 4.248 -12.331 -4.243 1.00 0.00 C ATOM 852 OE1 GLU A 53 3.781 -12.418 -5.393 1.00 0.00 O ATOM 853 OE2 GLU A 53 4.793 -13.294 -3.662 1.00 0.00 O ATOM 0 H GLU A 53 3.110 -10.433 0.621 1.00 0.00 H new ATOM 0 HA GLU A 53 4.290 -9.105 -1.742 1.00 0.00 H new ATOM 0 HB2 GLU A 53 4.681 -11.693 -1.570 1.00 0.00 H new ATOM 0 HB3 GLU A 53 2.968 -11.799 -1.927 1.00 0.00 H new ATOM 0 HG2 GLU A 53 3.363 -10.403 -3.979 1.00 0.00 H new ATOM 0 HG3 GLU A 53 5.082 -10.457 -3.639 1.00 0.00 H new ATOM 860 N ILE A 54 1.990 -8.071 -1.645 1.00 0.00 N ATOM 861 CA ILE A 54 0.656 -7.493 -1.745 1.00 0.00 C ATOM 862 C ILE A 54 0.245 -7.384 -3.201 1.00 0.00 C ATOM 863 O ILE A 54 1.001 -6.890 -4.030 1.00 0.00 O ATOM 864 CB ILE A 54 0.568 -6.082 -1.103 1.00 0.00 C ATOM 865 CG1 ILE A 54 0.980 -6.129 0.368 1.00 0.00 C ATOM 866 CG2 ILE A 54 -0.853 -5.530 -1.236 1.00 0.00 C ATOM 867 CD1 ILE A 54 1.194 -4.763 0.979 1.00 0.00 C ATOM 0 H ILE A 54 2.750 -7.394 -1.713 1.00 0.00 H new ATOM 0 HA ILE A 54 -0.014 -8.159 -1.200 1.00 0.00 H new ATOM 0 HB ILE A 54 1.256 -5.421 -1.631 1.00 0.00 H new ATOM 0 HG12 ILE A 54 0.213 -6.656 0.935 1.00 0.00 H new ATOM 0 HG13 ILE A 54 1.899 -6.708 0.461 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -0.903 -4.540 -0.782 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -1.119 -5.459 -2.291 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -1.551 -6.197 -0.730 1.00 0.00 H new ATOM 0 HD11 ILE A 54 1.484 -4.873 2.024 1.00 0.00 H new ATOM 0 HD12 ILE A 54 1.982 -4.241 0.436 1.00 0.00 H new ATOM 0 HD13 ILE A 54 0.270 -4.188 0.918 1.00 0.00 H new ATOM 879 N ASP A 55 -0.950 -7.847 -3.504 1.00 0.00 N ATOM 880 CA ASP A 55 -1.477 -7.733 -4.851 1.00 0.00 C ATOM 881 C ASP A 55 -2.499 -6.611 -4.891 1.00 0.00 C ATOM 882 O ASP A 55 -3.626 -6.757 -4.398 1.00 0.00 O ATOM 883 CB ASP A 55 -2.114 -9.044 -5.310 1.00 0.00 C ATOM 884 CG ASP A 55 -2.469 -9.022 -6.780 1.00 0.00 C ATOM 885 OD1 ASP A 55 -1.749 -9.651 -7.582 1.00 0.00 O ATOM 886 OD2 ASP A 55 -3.468 -8.376 -7.142 1.00 0.00 O ATOM 0 H ASP A 55 -1.574 -8.305 -2.839 1.00 0.00 H new ATOM 0 HA ASP A 55 -0.655 -7.510 -5.531 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -1.427 -9.867 -5.116 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -3.013 -9.234 -4.724 1.00 0.00 H new ATOM 891 N PHE A 56 -2.105 -5.491 -5.481 1.00 0.00 N ATOM 892 CA PHE A 56 -2.939 -4.297 -5.491 1.00 0.00 C ATOM 893 C PHE A 56 -4.228 -4.530 -6.272 1.00 0.00 C ATOM 894 O PHE A 56 -5.177 -3.750 -6.180 1.00 0.00 O ATOM 895 CB PHE A 56 -2.179 -3.110 -6.083 1.00 0.00 C ATOM 896 CG PHE A 56 -2.422 -1.856 -5.304 1.00 0.00 C ATOM 897 CD1 PHE A 56 -1.910 -1.732 -4.038 1.00 0.00 C ATOM 898 CD2 PHE A 56 -3.183 -0.824 -5.812 1.00 0.00 C ATOM 899 CE1 PHE A 56 -2.149 -0.611 -3.292 1.00 0.00 C ATOM 900 CE2 PHE A 56 -3.421 0.312 -5.059 1.00 0.00 C ATOM 901 CZ PHE A 56 -2.898 0.401 -3.798 1.00 0.00 C ATOM 0 H PHE A 56 -1.211 -5.384 -5.960 1.00 0.00 H new ATOM 0 HA PHE A 56 -3.199 -4.070 -4.457 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -1.112 -3.330 -6.095 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -2.485 -2.961 -7.118 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -1.310 -2.530 -3.625 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -3.597 -0.903 -6.806 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -1.740 -0.531 -2.296 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -4.013 1.120 -5.462 1.00 0.00 H new ATOM 0 HZ PHE A 56 -3.082 1.282 -3.202 1.00 0.00 H new ATOM 911 N GLU A 57 -4.264 -5.618 -7.021 1.00 0.00 N ATOM 912 CA GLU A 57 -5.403 -5.932 -7.853 1.00 0.00 C ATOM 913 C GLU A 57 -6.400 -6.823 -7.129 1.00 0.00 C ATOM 914 O GLU A 57 -7.510 -7.045 -7.609 1.00 0.00 O ATOM 915 CB GLU A 57 -4.923 -6.594 -9.139 1.00 0.00 C ATOM 916 CG GLU A 57 -4.027 -5.695 -9.966 1.00 0.00 C ATOM 917 CD GLU A 57 -4.753 -4.471 -10.475 1.00 0.00 C ATOM 918 OE1 GLU A 57 -5.007 -3.548 -9.679 1.00 0.00 O ATOM 919 OE2 GLU A 57 -5.064 -4.418 -11.680 1.00 0.00 O ATOM 0 H GLU A 57 -3.508 -6.302 -7.067 1.00 0.00 H new ATOM 0 HA GLU A 57 -5.920 -5.003 -8.094 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -4.383 -7.508 -8.892 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -5.787 -6.886 -9.736 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -3.173 -5.384 -9.364 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -3.632 -6.258 -10.812 1.00 0.00 H new ATOM 926 N THR A 58 -6.014 -7.320 -5.970 1.00 0.00 N ATOM 927 CA THR A 58 -6.891 -8.179 -5.201 1.00 0.00 C ATOM 928 C THR A 58 -7.511 -7.409 -4.055 1.00 0.00 C ATOM 929 O THR A 58 -8.547 -7.800 -3.515 1.00 0.00 O ATOM 930 CB THR A 58 -6.140 -9.408 -4.658 1.00 0.00 C ATOM 931 OG1 THR A 58 -5.059 -9.002 -3.806 1.00 0.00 O ATOM 932 CG2 THR A 58 -5.597 -10.233 -5.805 1.00 0.00 C ATOM 0 H THR A 58 -5.104 -7.145 -5.543 1.00 0.00 H new ATOM 0 HA THR A 58 -7.679 -8.529 -5.868 1.00 0.00 H new ATOM 0 HB THR A 58 -6.840 -10.010 -4.078 1.00 0.00 H new ATOM 0 HG1 THR A 58 -4.757 -8.106 -4.065 1.00 0.00 H new ATOM 0 HG21 THR A 58 -5.067 -11.100 -5.411 1.00 0.00 H new ATOM 0 HG22 THR A 58 -6.421 -10.567 -6.435 1.00 0.00 H new ATOM 0 HG23 THR A 58 -4.911 -9.627 -6.396 1.00 0.00 H new ATOM 940 N LEU A 59 -6.878 -6.296 -3.704 1.00 0.00 N ATOM 941 CA LEU A 59 -7.350 -5.468 -2.607 1.00 0.00 C ATOM 942 C LEU A 59 -8.696 -4.860 -2.947 1.00 0.00 C ATOM 943 O LEU A 59 -8.922 -4.419 -4.075 1.00 0.00 O ATOM 944 CB LEU A 59 -6.357 -4.348 -2.311 1.00 0.00 C ATOM 945 CG LEU A 59 -4.894 -4.775 -2.258 1.00 0.00 C ATOM 946 CD1 LEU A 59 -3.998 -3.583 -1.985 1.00 0.00 C ATOM 947 CD2 LEU A 59 -4.697 -5.835 -1.198 1.00 0.00 C ATOM 0 H LEU A 59 -6.037 -5.948 -4.165 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.448 -6.102 -1.726 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.466 -3.576 -3.073 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -6.621 -3.893 -1.356 1.00 0.00 H new ATOM 0 HG LEU A 59 -4.621 -5.193 -3.227 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -2.959 -3.909 -1.951 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.121 -2.846 -2.778 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.269 -3.135 -1.029 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -3.648 -6.131 -1.170 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -4.987 -5.436 -0.226 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -5.313 -6.703 -1.432 1.00 0.00 H new ATOM 959 N LYS A 60 -9.592 -4.852 -1.980 1.00 0.00 N ATOM 960 CA LYS A 60 -10.879 -4.214 -2.151 1.00 0.00 C ATOM 961 C LYS A 60 -10.713 -2.690 -2.060 1.00 0.00 C ATOM 962 O LYS A 60 -9.859 -2.213 -1.305 1.00 0.00 O ATOM 963 CB LYS A 60 -11.855 -4.751 -1.100 1.00 0.00 C ATOM 964 CG LYS A 60 -11.598 -4.266 0.311 1.00 0.00 C ATOM 965 CD LYS A 60 -12.606 -4.858 1.285 1.00 0.00 C ATOM 966 CE LYS A 60 -12.649 -6.390 1.194 1.00 0.00 C ATOM 967 NZ LYS A 60 -11.305 -6.999 1.364 1.00 0.00 N ATOM 0 H LYS A 60 -9.450 -5.282 -1.066 1.00 0.00 H new ATOM 0 HA LYS A 60 -11.290 -4.443 -3.135 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -12.868 -4.469 -1.387 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -11.813 -5.840 -1.108 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -10.588 -4.541 0.615 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -11.654 -3.178 0.341 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -12.348 -4.561 2.301 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -13.596 -4.453 1.076 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -13.322 -6.779 1.958 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -13.060 -6.684 0.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -11.367 -8.026 1.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -10.647 -6.586 0.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -10.959 -6.813 2.327 1.00 0.00 H new ATOM 981 N PRO A 61 -11.475 -1.912 -2.875 1.00 0.00 N ATOM 982 CA PRO A 61 -11.407 -0.444 -2.913 1.00 0.00 C ATOM 983 C PRO A 61 -11.098 0.214 -1.567 1.00 0.00 C ATOM 984 O PRO A 61 -10.205 1.058 -1.481 1.00 0.00 O ATOM 985 CB PRO A 61 -12.806 -0.057 -3.374 1.00 0.00 C ATOM 986 CG PRO A 61 -13.269 -1.187 -4.230 1.00 0.00 C ATOM 987 CD PRO A 61 -12.444 -2.406 -3.872 1.00 0.00 C ATOM 0 HA PRO A 61 -10.593 -0.109 -3.556 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -13.473 0.091 -2.524 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -12.790 0.878 -3.933 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -14.329 -1.381 -4.066 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -13.150 -0.941 -5.285 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -13.067 -3.201 -3.461 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -11.940 -2.816 -4.747 1.00 0.00 H new ATOM 995 N SER A 62 -11.825 -0.181 -0.526 1.00 0.00 N ATOM 996 CA SER A 62 -11.666 0.425 0.795 1.00 0.00 C ATOM 997 C SER A 62 -10.231 0.305 1.314 1.00 0.00 C ATOM 998 O SER A 62 -9.691 1.265 1.864 1.00 0.00 O ATOM 999 CB SER A 62 -12.659 -0.189 1.786 1.00 0.00 C ATOM 1000 OG SER A 62 -12.709 -1.597 1.655 1.00 0.00 O ATOM 0 H SER A 62 -12.530 -0.917 -0.570 1.00 0.00 H new ATOM 0 HA SER A 62 -11.881 1.489 0.697 1.00 0.00 H new ATOM 0 HB2 SER A 62 -12.371 0.074 2.804 1.00 0.00 H new ATOM 0 HB3 SER A 62 -13.651 0.230 1.617 1.00 0.00 H new ATOM 0 HG SER A 62 -13.349 -1.963 2.300 1.00 0.00 H new ATOM 1006 N THR A 63 -9.607 -0.854 1.116 1.00 0.00 N ATOM 1007 CA THR A 63 -8.219 -1.054 1.530 1.00 0.00 C ATOM 1008 C THR A 63 -7.320 -0.093 0.780 1.00 0.00 C ATOM 1009 O THR A 63 -6.567 0.655 1.388 1.00 0.00 O ATOM 1010 CB THR A 63 -7.740 -2.499 1.272 1.00 0.00 C ATOM 1011 OG1 THR A 63 -8.789 -3.417 1.602 1.00 0.00 O ATOM 1012 CG2 THR A 63 -6.508 -2.825 2.103 1.00 0.00 C ATOM 0 H THR A 63 -10.038 -1.666 0.674 1.00 0.00 H new ATOM 0 HA THR A 63 -8.167 -0.867 2.603 1.00 0.00 H new ATOM 0 HB THR A 63 -7.480 -2.589 0.217 1.00 0.00 H new ATOM 0 HG1 THR A 63 -8.611 -4.283 1.179 1.00 0.00 H new ATOM 0 HG21 THR A 63 -6.193 -3.849 1.901 1.00 0.00 H new ATOM 0 HG22 THR A 63 -5.702 -2.139 1.843 1.00 0.00 H new ATOM 0 HG23 THR A 63 -6.745 -2.721 3.162 1.00 0.00 H new ATOM 1020 N LEU A 64 -7.455 -0.086 -0.540 1.00 0.00 N ATOM 1021 CA LEU A 64 -6.626 0.753 -1.404 1.00 0.00 C ATOM 1022 C LEU A 64 -6.753 2.220 -1.018 1.00 0.00 C ATOM 1023 O LEU A 64 -5.792 2.979 -1.088 1.00 0.00 O ATOM 1024 CB LEU A 64 -7.042 0.548 -2.864 1.00 0.00 C ATOM 1025 CG LEU A 64 -7.094 -0.905 -3.293 1.00 0.00 C ATOM 1026 CD1 LEU A 64 -8.257 -1.111 -4.214 1.00 0.00 C ATOM 1027 CD2 LEU A 64 -5.820 -1.298 -3.993 1.00 0.00 C ATOM 0 H LEU A 64 -8.136 -0.656 -1.041 1.00 0.00 H new ATOM 0 HA LEU A 64 -5.582 0.463 -1.281 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -8.023 0.997 -3.018 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -6.343 1.081 -3.508 1.00 0.00 H new ATOM 0 HG LEU A 64 -7.210 -1.528 -2.406 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -8.296 -2.155 -4.523 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -9.181 -0.851 -3.697 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -8.142 -0.476 -5.093 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -5.877 -2.344 -4.293 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -5.683 -0.674 -4.876 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -4.976 -1.160 -3.317 1.00 0.00 H new ATOM 1039 N ARG A 65 -7.937 2.609 -0.588 1.00 0.00 N ATOM 1040 CA ARG A 65 -8.181 3.987 -0.199 1.00 0.00 C ATOM 1041 C ARG A 65 -7.671 4.266 1.215 1.00 0.00 C ATOM 1042 O ARG A 65 -7.348 5.407 1.549 1.00 0.00 O ATOM 1043 CB ARG A 65 -9.665 4.318 -0.334 1.00 0.00 C ATOM 1044 CG ARG A 65 -10.165 4.196 -1.769 1.00 0.00 C ATOM 1045 CD ARG A 65 -9.285 4.982 -2.726 1.00 0.00 C ATOM 1046 NE ARG A 65 -9.932 5.225 -4.011 1.00 0.00 N ATOM 1047 CZ ARG A 65 -9.591 6.219 -4.830 1.00 0.00 C ATOM 1048 NH1 ARG A 65 -8.719 7.143 -4.433 1.00 0.00 N ATOM 1049 NH2 ARG A 65 -10.141 6.308 -6.035 1.00 0.00 N ATOM 0 H ARG A 65 -8.745 1.993 -0.499 1.00 0.00 H new ATOM 0 HA ARG A 65 -7.623 4.638 -0.873 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -10.242 3.650 0.306 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -9.841 5.333 0.023 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -10.180 3.147 -2.064 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -11.191 4.560 -1.832 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -9.020 5.936 -2.270 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -8.355 4.438 -2.889 1.00 0.00 H new ATOM 0 HE ARG A 65 -10.686 4.600 -4.298 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -8.310 7.091 -3.500 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -8.460 7.903 -5.062 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -10.826 5.615 -6.335 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -9.879 7.070 -6.660 1.00 0.00 H new ATOM 1063 N GLU A 66 -7.565 3.222 2.034 1.00 0.00 N ATOM 1064 CA GLU A 66 -6.963 3.352 3.353 1.00 0.00 C ATOM 1065 C GLU A 66 -5.462 3.498 3.196 1.00 0.00 C ATOM 1066 O GLU A 66 -4.834 4.354 3.823 1.00 0.00 O ATOM 1067 CB GLU A 66 -7.262 2.113 4.199 1.00 0.00 C ATOM 1068 CG GLU A 66 -8.683 2.031 4.728 1.00 0.00 C ATOM 1069 CD GLU A 66 -9.019 3.163 5.663 1.00 0.00 C ATOM 1070 OE1 GLU A 66 -8.519 3.159 6.807 1.00 0.00 O ATOM 1071 OE2 GLU A 66 -9.781 4.062 5.269 1.00 0.00 O ATOM 0 H GLU A 66 -7.888 2.282 1.806 1.00 0.00 H new ATOM 0 HA GLU A 66 -7.379 4.228 3.851 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -7.060 1.224 3.601 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -6.573 2.092 5.043 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -9.380 2.038 3.890 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -8.819 1.083 5.248 1.00 0.00 H new ATOM 1078 N LEU A 67 -4.909 2.651 2.335 1.00 0.00 N ATOM 1079 CA LEU A 67 -3.489 2.654 2.027 1.00 0.00 C ATOM 1080 C LEU A 67 -3.049 4.054 1.576 1.00 0.00 C ATOM 1081 O LEU A 67 -2.009 4.566 1.994 1.00 0.00 O ATOM 1082 CB LEU A 67 -3.211 1.644 0.911 1.00 0.00 C ATOM 1083 CG LEU A 67 -3.839 0.281 1.124 1.00 0.00 C ATOM 1084 CD1 LEU A 67 -3.478 -0.664 -0.002 1.00 0.00 C ATOM 1085 CD2 LEU A 67 -3.435 -0.280 2.474 1.00 0.00 C ATOM 0 H LEU A 67 -5.438 1.940 1.830 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.928 2.379 2.920 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -3.575 2.054 -0.031 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -2.133 1.521 0.810 1.00 0.00 H new ATOM 0 HG LEU A 67 -4.923 0.393 1.117 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -3.941 -1.635 0.175 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.837 -0.258 -0.947 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -2.395 -0.781 -0.046 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -3.893 -1.259 2.613 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -2.350 -0.378 2.518 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -3.771 0.393 3.263 1.00 0.00 H new ATOM 1097 N GLU A 68 -3.883 4.660 0.726 1.00 0.00 N ATOM 1098 CA GLU A 68 -3.616 5.967 0.134 1.00 0.00 C ATOM 1099 C GLU A 68 -3.532 7.080 1.181 1.00 0.00 C ATOM 1100 O GLU A 68 -2.487 7.717 1.338 1.00 0.00 O ATOM 1101 CB GLU A 68 -4.713 6.315 -0.864 1.00 0.00 C ATOM 1102 CG GLU A 68 -4.479 7.643 -1.550 1.00 0.00 C ATOM 1103 CD GLU A 68 -5.492 7.949 -2.630 1.00 0.00 C ATOM 1104 OE1 GLU A 68 -6.695 8.071 -2.305 1.00 0.00 O ATOM 1105 OE2 GLU A 68 -5.096 8.095 -3.801 1.00 0.00 O ATOM 0 H GLU A 68 -4.769 4.251 0.429 1.00 0.00 H new ATOM 0 HA GLU A 68 -2.648 5.898 -0.362 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -4.777 5.529 -1.616 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -5.673 6.341 -0.348 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -4.503 8.438 -0.804 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -3.481 7.646 -1.987 1.00 0.00 H new ATOM 1112 N ARG A 69 -4.649 7.311 1.881 1.00 0.00 N ATOM 1113 CA ARG A 69 -4.743 8.354 2.917 1.00 0.00 C ATOM 1114 C ARG A 69 -3.659 8.167 3.953 1.00 0.00 C ATOM 1115 O ARG A 69 -3.217 9.114 4.604 1.00 0.00 O ATOM 1116 CB ARG A 69 -6.112 8.292 3.582 1.00 0.00 C ATOM 1117 CG ARG A 69 -6.305 9.346 4.649 1.00 0.00 C ATOM 1118 CD ARG A 69 -7.228 8.854 5.744 1.00 0.00 C ATOM 1119 NE ARG A 69 -6.756 7.602 6.333 1.00 0.00 N ATOM 1120 CZ ARG A 69 -7.424 6.454 6.269 1.00 0.00 C ATOM 1121 NH1 ARG A 69 -8.577 6.388 5.611 1.00 0.00 N ATOM 1122 NH2 ARG A 69 -6.927 5.367 6.847 1.00 0.00 N ATOM 0 H ARG A 69 -5.512 6.784 1.748 1.00 0.00 H new ATOM 0 HA ARG A 69 -4.612 9.329 2.449 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -6.884 8.409 2.821 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -6.249 7.306 4.026 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -5.339 9.615 5.077 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -6.718 10.250 4.201 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -7.307 9.614 6.521 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -8.229 8.709 5.337 1.00 0.00 H new ATOM 0 HE ARG A 69 -5.861 7.609 6.822 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -8.951 7.219 5.154 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -9.087 5.506 5.563 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -6.035 5.414 7.339 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -7.438 4.485 6.799 1.00 0.00 H new ATOM 1136 N TYR A 70 -3.202 6.948 4.064 1.00 0.00 N ATOM 1137 CA TYR A 70 -2.177 6.629 5.020 1.00 0.00 C ATOM 1138 C TYR A 70 -0.814 7.134 4.551 1.00 0.00 C ATOM 1139 O TYR A 70 -0.169 7.915 5.240 1.00 0.00 O ATOM 1140 CB TYR A 70 -2.111 5.128 5.269 1.00 0.00 C ATOM 1141 CG TYR A 70 -0.780 4.720 5.787 1.00 0.00 C ATOM 1142 CD1 TYR A 70 0.018 3.901 5.034 1.00 0.00 C ATOM 1143 CD2 TYR A 70 -0.297 5.206 6.996 1.00 0.00 C ATOM 1144 CE1 TYR A 70 1.264 3.565 5.453 1.00 0.00 C ATOM 1145 CE2 TYR A 70 0.960 4.868 7.436 1.00 0.00 C ATOM 1146 CZ TYR A 70 1.742 4.048 6.659 1.00 0.00 C ATOM 1147 OH TYR A 70 3.001 3.720 7.085 1.00 0.00 O ATOM 0 H TYR A 70 -3.524 6.159 3.503 1.00 0.00 H new ATOM 0 HA TYR A 70 -2.434 7.129 5.954 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -2.884 4.842 5.983 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -2.321 4.595 4.342 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -0.349 3.517 4.094 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -0.916 5.856 7.596 1.00 0.00 H new ATOM 0 HE1 TYR A 70 1.883 2.921 4.846 1.00 0.00 H new ATOM 0 HE2 TYR A 70 1.328 5.242 8.380 1.00 0.00 H new ATOM 0 HH TYR A 70 3.349 2.984 6.540 1.00 0.00 H new ATOM 1157 N VAL A 71 -0.367 6.685 3.391 1.00 0.00 N ATOM 1158 CA VAL A 71 0.968 7.038 2.928 1.00 0.00 C ATOM 1159 C VAL A 71 1.069 8.509 2.635 1.00 0.00 C ATOM 1160 O VAL A 71 2.094 9.121 2.894 1.00 0.00 O ATOM 1161 CB VAL A 71 1.390 6.249 1.689 1.00 0.00 C ATOM 1162 CG1 VAL A 71 1.366 4.782 1.997 1.00 0.00 C ATOM 1163 CG2 VAL A 71 0.489 6.531 0.506 1.00 0.00 C ATOM 0 H VAL A 71 -0.897 6.085 2.760 1.00 0.00 H new ATOM 0 HA VAL A 71 1.646 6.778 3.741 1.00 0.00 H new ATOM 0 HB VAL A 71 2.399 6.563 1.422 1.00 0.00 H new ATOM 0 HG11 VAL A 71 1.667 4.220 1.113 1.00 0.00 H new ATOM 0 HG12 VAL A 71 2.056 4.570 2.814 1.00 0.00 H new ATOM 0 HG13 VAL A 71 0.358 4.488 2.288 1.00 0.00 H new ATOM 0 HG21 VAL A 71 0.824 5.950 -0.353 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -0.535 6.253 0.754 1.00 0.00 H new ATOM 0 HG23 VAL A 71 0.528 7.593 0.264 1.00 0.00 H new ATOM 1173 N THR A 72 -0.002 9.088 2.127 1.00 0.00 N ATOM 1174 CA THR A 72 -0.006 10.502 1.863 1.00 0.00 C ATOM 1175 C THR A 72 0.139 11.261 3.184 1.00 0.00 C ATOM 1176 O THR A 72 0.671 12.358 3.217 1.00 0.00 O ATOM 1177 CB THR A 72 -1.281 10.939 1.103 1.00 0.00 C ATOM 1178 OG1 THR A 72 -1.085 12.228 0.508 1.00 0.00 O ATOM 1179 CG2 THR A 72 -2.482 10.996 2.029 1.00 0.00 C ATOM 0 H THR A 72 -0.868 8.602 1.893 1.00 0.00 H new ATOM 0 HA THR A 72 0.839 10.740 1.217 1.00 0.00 H new ATOM 0 HB THR A 72 -1.473 10.198 0.327 1.00 0.00 H new ATOM 0 HG1 THR A 72 -1.897 12.494 0.029 1.00 0.00 H new ATOM 0 HG21 THR A 72 -3.362 11.306 1.465 1.00 0.00 H new ATOM 0 HG22 THR A 72 -2.656 10.010 2.460 1.00 0.00 H new ATOM 0 HG23 THR A 72 -2.292 11.713 2.828 1.00 0.00 H new ATOM 1187 N SER A 73 -0.277 10.638 4.287 1.00 0.00 N ATOM 1188 CA SER A 73 -0.139 11.260 5.589 1.00 0.00 C ATOM 1189 C SER A 73 1.329 11.237 6.018 1.00 0.00 C ATOM 1190 O SER A 73 1.799 12.127 6.724 1.00 0.00 O ATOM 1191 CB SER A 73 -1.027 10.548 6.617 1.00 0.00 C ATOM 1192 OG SER A 73 -0.360 9.463 7.241 1.00 0.00 O ATOM 0 H SER A 73 -0.707 9.713 4.298 1.00 0.00 H new ATOM 0 HA SER A 73 -0.465 12.298 5.529 1.00 0.00 H new ATOM 0 HB2 SER A 73 -1.345 11.262 7.377 1.00 0.00 H new ATOM 0 HB3 SER A 73 -1.929 10.183 6.125 1.00 0.00 H new ATOM 0 HG SER A 73 -0.402 8.675 6.660 1.00 0.00 H new ATOM 1198 N CYS A 74 2.050 10.218 5.552 1.00 0.00 N ATOM 1199 CA CYS A 74 3.459 10.041 5.879 1.00 0.00 C ATOM 1200 C CYS A 74 4.343 10.848 4.928 1.00 0.00 C ATOM 1201 O CYS A 74 5.324 11.468 5.336 1.00 0.00 O ATOM 1202 CB CYS A 74 3.809 8.555 5.801 1.00 0.00 C ATOM 1203 SG CYS A 74 5.500 8.156 6.297 1.00 0.00 S ATOM 0 H CYS A 74 1.673 9.495 4.939 1.00 0.00 H new ATOM 0 HA CYS A 74 3.639 10.405 6.891 1.00 0.00 H new ATOM 0 HB2 CYS A 74 3.117 7.998 6.433 1.00 0.00 H new ATOM 0 HB3 CYS A 74 3.653 8.211 4.778 1.00 0.00 H new ATOM 0 HG CYS A 74 6.249 9.211 6.172 1.00 0.00 H new ATOM 1209 N LEU A 75 3.978 10.825 3.659 1.00 0.00 N ATOM 1210 CA LEU A 75 4.742 11.501 2.614 1.00 0.00 C ATOM 1211 C LEU A 75 4.505 13.012 2.625 1.00 0.00 C ATOM 1212 O LEU A 75 5.438 13.786 2.408 1.00 0.00 O ATOM 1213 CB LEU A 75 4.379 10.899 1.256 1.00 0.00 C ATOM 1214 CG LEU A 75 4.445 9.375 1.222 1.00 0.00 C ATOM 1215 CD1 LEU A 75 3.829 8.837 -0.066 1.00 0.00 C ATOM 1216 CD2 LEU A 75 5.876 8.887 1.382 1.00 0.00 C ATOM 0 H LEU A 75 3.147 10.340 3.320 1.00 0.00 H new ATOM 0 HA LEU A 75 5.804 11.349 2.806 1.00 0.00 H new ATOM 0 HB2 LEU A 75 3.372 11.216 0.986 1.00 0.00 H new ATOM 0 HB3 LEU A 75 5.053 11.300 0.499 1.00 0.00 H new ATOM 0 HG LEU A 75 3.865 8.994 2.063 1.00 0.00 H new ATOM 0 HD11 LEU A 75 3.886 7.749 -0.070 1.00 0.00 H new ATOM 0 HD12 LEU A 75 2.785 9.146 -0.127 1.00 0.00 H new ATOM 0 HD13 LEU A 75 4.375 9.232 -0.923 1.00 0.00 H new ATOM 0 HD21 LEU A 75 5.894 7.798 1.354 1.00 0.00 H new ATOM 0 HD22 LEU A 75 6.488 9.281 0.570 1.00 0.00 H new ATOM 0 HD23 LEU A 75 6.274 9.232 2.336 1.00 0.00 H new ATOM 1228 N ARG A 76 3.264 13.440 2.867 1.00 0.00 N ATOM 1229 CA ARG A 76 2.970 14.864 2.967 1.00 0.00 C ATOM 1230 C ARG A 76 3.552 15.441 4.252 1.00 0.00 C ATOM 1231 O ARG A 76 4.170 16.504 4.244 1.00 0.00 O ATOM 1232 CB ARG A 76 1.467 15.155 2.925 1.00 0.00 C ATOM 1233 CG ARG A 76 0.784 14.788 1.617 1.00 0.00 C ATOM 1234 CD ARG A 76 -0.604 15.399 1.540 1.00 0.00 C ATOM 1235 NE ARG A 76 -0.571 16.860 1.632 1.00 0.00 N ATOM 1236 CZ ARG A 76 -1.649 17.614 1.841 1.00 0.00 C ATOM 1237 NH1 ARG A 76 -2.845 17.049 1.951 1.00 0.00 N ATOM 1238 NH2 ARG A 76 -1.532 18.933 1.935 1.00 0.00 N ATOM 0 H ARG A 76 2.459 12.827 2.995 1.00 0.00 H new ATOM 0 HA ARG A 76 3.431 15.338 2.101 1.00 0.00 H new ATOM 0 HB2 ARG A 76 0.983 14.612 3.737 1.00 0.00 H new ATOM 0 HB3 ARG A 76 1.311 16.217 3.115 1.00 0.00 H new ATOM 0 HG2 ARG A 76 1.386 15.136 0.778 1.00 0.00 H new ATOM 0 HG3 ARG A 76 0.714 13.704 1.531 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -1.076 15.106 0.602 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -1.220 15.000 2.346 1.00 0.00 H new ATOM 0 HE ARG A 76 0.330 17.328 1.530 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -2.939 16.036 1.876 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -3.670 17.628 2.111 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -0.615 19.371 1.847 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -2.359 19.508 2.095 1.00 0.00 H new ATOM 1252 N LYS A 77 3.348 14.733 5.356 1.00 0.00 N ATOM 1253 CA LYS A 77 3.825 15.184 6.654 1.00 0.00 C ATOM 1254 C LYS A 77 4.803 14.183 7.254 1.00 0.00 C ATOM 1255 O LYS A 77 4.399 13.202 7.883 1.00 0.00 O ATOM 1256 CB LYS A 77 2.650 15.404 7.603 1.00 0.00 C ATOM 1257 CG LYS A 77 1.826 16.619 7.243 1.00 0.00 C ATOM 1258 CD LYS A 77 0.519 16.659 8.014 1.00 0.00 C ATOM 1259 CE LYS A 77 -0.308 17.880 7.646 1.00 0.00 C ATOM 1260 NZ LYS A 77 -0.727 17.860 6.221 1.00 0.00 N ATOM 0 H LYS A 77 2.853 13.841 5.376 1.00 0.00 H new ATOM 0 HA LYS A 77 4.348 16.130 6.512 1.00 0.00 H new ATOM 0 HB2 LYS A 77 2.011 14.521 7.593 1.00 0.00 H new ATOM 0 HB3 LYS A 77 3.026 15.514 8.620 1.00 0.00 H new ATOM 0 HG2 LYS A 77 2.399 17.522 7.451 1.00 0.00 H new ATOM 0 HG3 LYS A 77 1.617 16.613 6.173 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -0.054 15.755 7.808 1.00 0.00 H new ATOM 0 HD3 LYS A 77 0.727 16.668 9.084 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -1.191 17.925 8.283 1.00 0.00 H new ATOM 0 HE3 LYS A 77 0.271 18.782 7.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -1.461 18.580 6.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 0.093 18.064 5.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -1.107 16.921 5.984 1.00 0.00 H new ATOM 1274 N LYS A 78 6.088 14.433 7.057 1.00 0.00 N ATOM 1275 CA LYS A 78 7.120 13.554 7.572 1.00 0.00 C ATOM 1276 C LYS A 78 7.206 13.674 9.091 1.00 0.00 C ATOM 1277 O LYS A 78 6.813 14.689 9.671 1.00 0.00 O ATOM 1278 CB LYS A 78 8.472 13.906 6.948 1.00 0.00 C ATOM 1279 CG LYS A 78 9.529 12.833 7.129 1.00 0.00 C ATOM 1280 CD LYS A 78 9.217 11.582 6.322 1.00 0.00 C ATOM 1281 CE LYS A 78 9.246 11.855 4.825 1.00 0.00 C ATOM 1282 NZ LYS A 78 9.071 10.615 4.026 1.00 0.00 N ATOM 0 H LYS A 78 6.439 15.240 6.542 1.00 0.00 H new ATOM 0 HA LYS A 78 6.864 12.527 7.311 1.00 0.00 H new ATOM 0 HB2 LYS A 78 8.333 14.090 5.883 1.00 0.00 H new ATOM 0 HB3 LYS A 78 8.833 14.836 7.387 1.00 0.00 H new ATOM 0 HG2 LYS A 78 10.500 13.226 6.827 1.00 0.00 H new ATOM 0 HG3 LYS A 78 9.605 12.573 8.185 1.00 0.00 H new ATOM 0 HD2 LYS A 78 9.940 10.803 6.564 1.00 0.00 H new ATOM 0 HD3 LYS A 78 8.235 11.203 6.604 1.00 0.00 H new ATOM 0 HE2 LYS A 78 8.457 12.563 4.571 1.00 0.00 H new ATOM 0 HE3 LYS A 78 10.194 12.325 4.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 9.097 10.848 3.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 9.838 9.948 4.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 8.155 10.179 4.257 1.00 0.00 H new ATOM 1296 N ARG A 79 7.723 12.639 9.726 1.00 0.00 N ATOM 1297 CA ARG A 79 7.924 12.656 11.170 1.00 0.00 C ATOM 1298 C ARG A 79 9.339 12.209 11.488 1.00 0.00 C ATOM 1299 O ARG A 79 9.634 11.012 11.497 1.00 0.00 O ATOM 1300 CB ARG A 79 6.893 11.786 11.911 1.00 0.00 C ATOM 1301 CG ARG A 79 6.970 11.902 13.430 1.00 0.00 C ATOM 1302 CD ARG A 79 6.824 13.345 13.895 1.00 0.00 C ATOM 1303 NE ARG A 79 6.937 13.470 15.347 1.00 0.00 N ATOM 1304 CZ ARG A 79 7.448 14.534 15.962 1.00 0.00 C ATOM 1305 NH1 ARG A 79 7.943 15.541 15.249 1.00 0.00 N ATOM 1306 NH2 ARG A 79 7.474 14.587 17.287 1.00 0.00 N ATOM 0 H ARG A 79 8.013 11.775 9.269 1.00 0.00 H new ATOM 0 HA ARG A 79 7.778 13.678 11.521 1.00 0.00 H new ATOM 0 HB2 ARG A 79 5.892 12.067 11.584 1.00 0.00 H new ATOM 0 HB3 ARG A 79 7.040 10.744 11.627 1.00 0.00 H new ATOM 0 HG2 ARG A 79 6.186 11.294 13.881 1.00 0.00 H new ATOM 0 HG3 ARG A 79 7.923 11.503 13.777 1.00 0.00 H new ATOM 0 HD2 ARG A 79 7.589 13.958 13.418 1.00 0.00 H new ATOM 0 HD3 ARG A 79 5.858 13.733 13.572 1.00 0.00 H new ATOM 0 HE ARG A 79 6.605 12.696 15.923 1.00 0.00 H new ATOM 0 HH11 ARG A 79 7.931 15.499 14.230 1.00 0.00 H new ATOM 0 HH12 ARG A 79 8.334 16.356 15.721 1.00 0.00 H new ATOM 0 HH21 ARG A 79 7.102 13.812 17.836 1.00 0.00 H new ATOM 0 HH22 ARG A 79 7.866 15.403 17.757 1.00 0.00 H new ATOM 1320 N LYS A 80 10.214 13.184 11.709 1.00 0.00 N ATOM 1321 CA LYS A 80 11.615 12.911 11.994 1.00 0.00 C ATOM 1322 C LYS A 80 11.757 12.033 13.229 1.00 0.00 C ATOM 1323 O LYS A 80 11.173 12.321 14.277 1.00 0.00 O ATOM 1324 CB LYS A 80 12.392 14.213 12.203 1.00 0.00 C ATOM 1325 CG LYS A 80 12.412 15.119 10.986 1.00 0.00 C ATOM 1326 CD LYS A 80 13.312 16.325 11.207 1.00 0.00 C ATOM 1327 CE LYS A 80 13.375 17.212 9.975 1.00 0.00 C ATOM 1328 NZ LYS A 80 13.845 16.466 8.777 1.00 0.00 N ATOM 0 H LYS A 80 9.974 14.175 11.696 1.00 0.00 H new ATOM 0 HA LYS A 80 12.028 12.384 11.134 1.00 0.00 H new ATOM 0 HB2 LYS A 80 11.954 14.756 13.041 1.00 0.00 H new ATOM 0 HB3 LYS A 80 13.418 13.972 12.481 1.00 0.00 H new ATOM 0 HG2 LYS A 80 12.759 14.558 10.118 1.00 0.00 H new ATOM 0 HG3 LYS A 80 11.399 15.455 10.764 1.00 0.00 H new ATOM 0 HD2 LYS A 80 12.943 16.904 12.054 1.00 0.00 H new ATOM 0 HD3 LYS A 80 14.316 15.988 11.464 1.00 0.00 H new ATOM 0 HE2 LYS A 80 12.388 17.630 9.778 1.00 0.00 H new ATOM 0 HE3 LYS A 80 14.044 18.051 10.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 14.117 17.140 8.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 14.667 15.882 9.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 13.081 15.854 8.427 1.00 0.00 H new ATOM 1342 N PRO A 81 12.539 10.951 13.119 1.00 0.00 N ATOM 1343 CA PRO A 81 12.789 10.041 14.236 1.00 0.00 C ATOM 1344 C PRO A 81 13.772 10.637 15.245 1.00 0.00 C ATOM 1345 O PRO A 81 14.851 10.094 15.487 1.00 0.00 O ATOM 1346 CB PRO A 81 13.376 8.801 13.557 1.00 0.00 C ATOM 1347 CG PRO A 81 14.003 9.301 12.298 1.00 0.00 C ATOM 1348 CD PRO A 81 13.243 10.537 11.888 1.00 0.00 C ATOM 0 HA PRO A 81 11.889 9.828 14.813 1.00 0.00 H new ATOM 0 HB2 PRO A 81 14.112 8.314 14.196 1.00 0.00 H new ATOM 0 HB3 PRO A 81 12.601 8.065 13.345 1.00 0.00 H new ATOM 0 HG2 PRO A 81 15.057 9.531 12.457 1.00 0.00 H new ATOM 0 HG3 PRO A 81 13.957 8.543 11.516 1.00 0.00 H new ATOM 0 HD2 PRO A 81 13.914 11.318 11.531 1.00 0.00 H new ATOM 0 HD3 PRO A 81 12.543 10.325 11.080 1.00 0.00 H new ATOM 1356 N GLN A 82 13.392 11.768 15.821 1.00 0.00 N ATOM 1357 CA GLN A 82 14.222 12.460 16.797 1.00 0.00 C ATOM 1358 C GLN A 82 13.957 11.921 18.197 1.00 0.00 C ATOM 1359 O GLN A 82 13.494 12.647 19.079 1.00 0.00 O ATOM 1360 CB GLN A 82 13.942 13.964 16.756 1.00 0.00 C ATOM 1361 CG GLN A 82 14.187 14.589 15.393 1.00 0.00 C ATOM 1362 CD GLN A 82 13.780 16.050 15.338 1.00 0.00 C ATOM 1363 OE1 GLN A 82 12.862 16.483 16.036 1.00 0.00 O ATOM 1364 NE2 GLN A 82 14.452 16.818 14.499 1.00 0.00 N ATOM 0 H GLN A 82 12.504 12.230 15.627 1.00 0.00 H new ATOM 0 HA GLN A 82 15.269 12.286 16.546 1.00 0.00 H new ATOM 0 HB2 GLN A 82 12.907 14.141 17.047 1.00 0.00 H new ATOM 0 HB3 GLN A 82 14.570 14.463 17.494 1.00 0.00 H new ATOM 0 HG2 GLN A 82 15.244 14.501 15.142 1.00 0.00 H new ATOM 0 HG3 GLN A 82 13.632 14.033 14.637 1.00 0.00 H new ATOM 0 HE21 GLN A 82 15.206 16.422 13.938 1.00 0.00 H new ATOM 0 HE22 GLN A 82 14.217 17.807 14.413 1.00 0.00 H new ATOM 1373 N ALA A 83 14.245 10.646 18.395 1.00 0.00 N ATOM 1374 CA ALA A 83 14.025 10.003 19.681 1.00 0.00 C ATOM 1375 C ALA A 83 15.199 9.104 20.035 1.00 0.00 C ATOM 1376 O ALA A 83 15.189 7.918 19.639 1.00 0.00 O ATOM 1377 CB ALA A 83 12.722 9.213 19.673 1.00 0.00 C ATOM 1378 OXT ALA A 83 16.136 9.587 20.700 1.00 0.00 O ATOM 0 H ALA A 83 14.633 10.033 17.679 1.00 0.00 H new ATOM 0 HA ALA A 83 13.946 10.778 20.443 1.00 0.00 H new ATOM 0 HB1 ALA A 83 12.577 8.740 20.644 1.00 0.00 H new ATOM 0 HB2 ALA A 83 11.889 9.886 19.469 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.766 8.446 18.899 1.00 0.00 H new TER 1384 ALA A 83 ATOM 1385 N LYS B 201 1.922 -6.898 -11.064 1.00 0.00 N ATOM 1386 CA LYS B 201 0.858 -6.308 -10.216 1.00 0.00 C ATOM 1387 C LYS B 201 1.388 -5.972 -8.826 1.00 0.00 C ATOM 1388 O LYS B 201 0.761 -6.315 -7.823 1.00 0.00 O ATOM 1389 CB LYS B 201 -0.329 -7.274 -10.095 1.00 0.00 C ATOM 1390 CG LYS B 201 -1.044 -7.544 -11.412 1.00 0.00 C ATOM 1391 CD LYS B 201 -2.259 -8.454 -11.235 1.00 0.00 C ATOM 1392 CE LYS B 201 -1.895 -9.936 -11.181 1.00 0.00 C ATOM 1393 NZ LYS B 201 -1.041 -10.284 -10.014 1.00 0.00 N ATOM 0 HA LYS B 201 0.525 -5.387 -10.694 1.00 0.00 H new ATOM 0 HB2 LYS B 201 0.026 -8.220 -9.685 1.00 0.00 H new ATOM 0 HB3 LYS B 201 -1.045 -6.866 -9.382 1.00 0.00 H new ATOM 0 HG2 LYS B 201 -1.362 -6.598 -11.851 1.00 0.00 H new ATOM 0 HG3 LYS B 201 -0.348 -8.003 -12.114 1.00 0.00 H new ATOM 0 HD2 LYS B 201 -2.780 -8.180 -10.317 1.00 0.00 H new ATOM 0 HD3 LYS B 201 -2.954 -8.286 -12.058 1.00 0.00 H new ATOM 0 HE2 LYS B 201 -2.810 -10.528 -11.144 1.00 0.00 H new ATOM 0 HE3 LYS B 201 -1.375 -10.210 -12.099 1.00 0.00 H new ATOM 0 HZ1 LYS B 201 -1.142 -11.297 -9.800 1.00 0.00 H new ATOM 0 HZ2 LYS B 201 -0.047 -10.075 -10.237 1.00 0.00 H new ATOM 0 HZ3 LYS B 201 -1.336 -9.724 -9.189 1.00 0.00 H new ATOM 1409 N TRP B 202 2.547 -5.304 -8.779 1.00 0.00 N ATOM 1410 CA TRP B 202 3.163 -4.886 -7.517 1.00 0.00 C ATOM 1411 C TRP B 202 3.475 -6.110 -6.650 1.00 0.00 C ATOM 1412 O TRP B 202 3.400 -6.075 -5.424 1.00 0.00 O ATOM 1413 CB TRP B 202 2.242 -3.896 -6.793 1.00 0.00 C ATOM 1414 CG TRP B 202 2.850 -3.237 -5.593 1.00 0.00 C ATOM 1415 CD1 TRP B 202 4.104 -2.706 -5.480 1.00 0.00 C ATOM 1416 CD2 TRP B 202 2.207 -3.019 -4.338 1.00 0.00 C ATOM 1417 NE1 TRP B 202 4.277 -2.176 -4.225 1.00 0.00 N ATOM 1418 CE2 TRP B 202 3.126 -2.357 -3.504 1.00 0.00 C ATOM 1419 CE3 TRP B 202 0.941 -3.325 -3.838 1.00 0.00 C ATOM 1420 CZ2 TRP B 202 2.815 -1.990 -2.198 1.00 0.00 C ATOM 1421 CZ3 TRP B 202 0.637 -2.957 -2.542 1.00 0.00 C ATOM 1422 CH2 TRP B 202 1.568 -2.299 -1.735 1.00 0.00 C ATOM 0 H TRP B 202 3.079 -5.040 -9.608 1.00 0.00 H new ATOM 0 HA TRP B 202 4.106 -4.380 -7.721 1.00 0.00 H new ATOM 0 HB2 TRP B 202 1.936 -3.124 -7.498 1.00 0.00 H new ATOM 0 HB3 TRP B 202 1.339 -4.421 -6.483 1.00 0.00 H new ATOM 0 HD1 TRP B 202 4.849 -2.704 -6.262 1.00 0.00 H new ATOM 0 HE1 TRP B 202 5.124 -1.722 -3.885 1.00 0.00 H new ATOM 0 HE3 TRP B 202 0.215 -3.838 -4.451 1.00 0.00 H new ATOM 0 HZ2 TRP B 202 3.533 -1.480 -1.574 1.00 0.00 H new ATOM 0 HZ3 TRP B 202 -0.341 -3.183 -2.144 1.00 0.00 H new ATOM 0 HH2 TRP B 202 1.296 -2.029 -0.725 1.00 0.00 H new ATOM 1433 N THR B 203 3.857 -7.185 -7.316 1.00 0.00 N ATOM 1434 CA THR B 203 4.118 -8.452 -6.663 1.00 0.00 C ATOM 1435 C THR B 203 5.495 -8.480 -6.000 1.00 0.00 C ATOM 1436 O THR B 203 6.126 -7.432 -5.826 1.00 0.00 O ATOM 1437 CB THR B 203 3.985 -9.602 -7.669 1.00 0.00 C ATOM 1438 OG1 THR B 203 4.508 -9.194 -8.941 1.00 0.00 O ATOM 1439 CG2 THR B 203 2.530 -10.018 -7.814 1.00 0.00 C ATOM 0 H THR B 203 3.995 -7.202 -8.327 1.00 0.00 H new ATOM 0 HA THR B 203 3.375 -8.576 -5.875 1.00 0.00 H new ATOM 0 HB THR B 203 4.553 -10.457 -7.302 1.00 0.00 H new ATOM 0 HG1 THR B 203 4.423 -9.931 -9.581 1.00 0.00 H new ATOM 0 HG21 THR B 203 2.455 -10.835 -8.532 1.00 0.00 H new ATOM 0 HG22 THR B 203 2.148 -10.347 -6.848 1.00 0.00 H new ATOM 0 HG23 THR B 203 1.943 -9.170 -8.167 1.00 0.00 H new ATOM 1447 N LEU B 204 5.933 -9.685 -5.616 1.00 0.00 N ATOM 1448 CA LEU B 204 7.181 -9.891 -4.872 1.00 0.00 C ATOM 1449 C LEU B 204 8.329 -9.046 -5.406 1.00 0.00 C ATOM 1450 O LEU B 204 9.129 -8.529 -4.626 1.00 0.00 O ATOM 1451 CB LEU B 204 7.557 -11.386 -4.867 1.00 0.00 C ATOM 1452 CG LEU B 204 7.592 -12.088 -6.236 1.00 0.00 C ATOM 1453 CD1 LEU B 204 8.948 -11.933 -6.907 1.00 0.00 C ATOM 1454 CD2 LEU B 204 7.249 -13.562 -6.088 1.00 0.00 C ATOM 0 H LEU B 204 5.429 -10.549 -5.814 1.00 0.00 H new ATOM 0 HA LEU B 204 7.004 -9.562 -3.848 1.00 0.00 H new ATOM 0 HB2 LEU B 204 8.539 -11.490 -4.405 1.00 0.00 H new ATOM 0 HB3 LEU B 204 6.848 -11.914 -4.230 1.00 0.00 H new ATOM 0 HG LEU B 204 6.845 -11.610 -6.870 1.00 0.00 H new ATOM 0 HD11 LEU B 204 8.937 -12.441 -7.871 1.00 0.00 H new ATOM 0 HD12 LEU B 204 9.161 -10.875 -7.057 1.00 0.00 H new ATOM 0 HD13 LEU B 204 9.719 -12.372 -6.274 1.00 0.00 H new ATOM 0 HD21 LEU B 204 7.279 -14.042 -7.066 1.00 0.00 H new ATOM 0 HD22 LEU B 204 7.973 -14.039 -5.427 1.00 0.00 H new ATOM 0 HD23 LEU B 204 6.250 -13.662 -5.665 1.00 0.00 H new ATOM 1466 N GLU B 205 8.389 -8.894 -6.723 1.00 0.00 N ATOM 1467 CA GLU B 205 9.425 -8.100 -7.363 1.00 0.00 C ATOM 1468 C GLU B 205 9.415 -6.676 -6.817 1.00 0.00 C ATOM 1469 O GLU B 205 10.293 -6.284 -6.050 1.00 0.00 O ATOM 1470 CB GLU B 205 9.195 -8.072 -8.875 1.00 0.00 C ATOM 1471 CG GLU B 205 9.041 -9.449 -9.495 1.00 0.00 C ATOM 1472 CD GLU B 205 8.630 -9.389 -10.950 1.00 0.00 C ATOM 1473 OE1 GLU B 205 9.491 -9.601 -11.829 1.00 0.00 O ATOM 1474 OE2 GLU B 205 7.439 -9.135 -11.220 1.00 0.00 O ATOM 0 H GLU B 205 7.725 -9.315 -7.372 1.00 0.00 H new ATOM 0 HA GLU B 205 10.394 -8.552 -7.151 1.00 0.00 H new ATOM 0 HB2 GLU B 205 8.301 -7.486 -9.087 1.00 0.00 H new ATOM 0 HB3 GLU B 205 10.031 -7.560 -9.351 1.00 0.00 H new ATOM 0 HG2 GLU B 205 9.984 -9.989 -9.410 1.00 0.00 H new ATOM 0 HG3 GLU B 205 8.297 -10.015 -8.934 1.00 0.00 H new ATOM 1481 N ARG B 206 8.382 -5.931 -7.176 1.00 0.00 N ATOM 1482 CA ARG B 206 8.296 -4.519 -6.835 1.00 0.00 C ATOM 1483 C ARG B 206 8.270 -4.320 -5.322 1.00 0.00 C ATOM 1484 O ARG B 206 9.141 -3.655 -4.756 1.00 0.00 O ATOM 1485 CB ARG B 206 7.043 -3.898 -7.460 1.00 0.00 C ATOM 1486 CG ARG B 206 6.878 -4.200 -8.943 1.00 0.00 C ATOM 1487 CD ARG B 206 8.062 -3.714 -9.764 1.00 0.00 C ATOM 1488 NE ARG B 206 7.895 -4.016 -11.185 1.00 0.00 N ATOM 1489 CZ ARG B 206 8.834 -3.819 -12.110 1.00 0.00 C ATOM 1490 NH1 ARG B 206 10.025 -3.339 -11.766 1.00 0.00 N ATOM 1491 NH2 ARG B 206 8.582 -4.108 -13.380 1.00 0.00 N ATOM 0 H ARG B 206 7.586 -6.283 -7.707 1.00 0.00 H new ATOM 0 HA ARG B 206 9.181 -4.023 -7.233 1.00 0.00 H new ATOM 0 HB2 ARG B 206 6.165 -4.260 -6.926 1.00 0.00 H new ATOM 0 HB3 ARG B 206 7.077 -2.817 -7.321 1.00 0.00 H new ATOM 0 HG2 ARG B 206 6.758 -5.274 -9.082 1.00 0.00 H new ATOM 0 HG3 ARG B 206 5.966 -3.728 -9.309 1.00 0.00 H new ATOM 0 HD2 ARG B 206 8.179 -2.638 -9.632 1.00 0.00 H new ATOM 0 HD3 ARG B 206 8.976 -4.182 -9.397 1.00 0.00 H new ATOM 0 HE ARG B 206 7.001 -4.403 -11.488 1.00 0.00 H new ATOM 0 HH11 ARG B 206 10.224 -3.120 -10.790 1.00 0.00 H new ATOM 0 HH12 ARG B 206 10.740 -3.190 -12.478 1.00 0.00 H new ATOM 0 HH21 ARG B 206 7.671 -4.480 -13.647 1.00 0.00 H new ATOM 0 HH22 ARG B 206 9.299 -3.958 -14.089 1.00 0.00 H new ATOM 1505 N LEU B 207 7.285 -4.924 -4.667 1.00 0.00 N ATOM 1506 CA LEU B 207 7.074 -4.700 -3.245 1.00 0.00 C ATOM 1507 C LEU B 207 8.192 -5.289 -2.401 1.00 0.00 C ATOM 1508 O LEU B 207 8.919 -4.554 -1.747 1.00 0.00 O ATOM 1509 CB LEU B 207 5.733 -5.279 -2.791 1.00 0.00 C ATOM 1510 CG LEU B 207 5.459 -5.200 -1.280 1.00 0.00 C ATOM 1511 CD1 LEU B 207 5.596 -3.776 -0.762 1.00 0.00 C ATOM 1512 CD2 LEU B 207 4.077 -5.727 -0.986 1.00 0.00 C ATOM 0 H LEU B 207 6.623 -5.570 -5.097 1.00 0.00 H new ATOM 0 HA LEU B 207 7.069 -3.620 -3.098 1.00 0.00 H new ATOM 0 HB2 LEU B 207 4.934 -4.756 -3.316 1.00 0.00 H new ATOM 0 HB3 LEU B 207 5.685 -6.324 -3.098 1.00 0.00 H new ATOM 0 HG LEU B 207 6.201 -5.813 -0.768 1.00 0.00 H new ATOM 0 HD11 LEU B 207 5.395 -3.758 0.309 1.00 0.00 H new ATOM 0 HD12 LEU B 207 6.608 -3.417 -0.948 1.00 0.00 H new ATOM 0 HD13 LEU B 207 4.882 -3.132 -1.276 1.00 0.00 H new ATOM 0 HD21 LEU B 207 3.886 -5.670 0.086 1.00 0.00 H new ATOM 0 HD22 LEU B 207 3.338 -5.128 -1.519 1.00 0.00 H new ATOM 0 HD23 LEU B 207 4.006 -6.765 -1.312 1.00 0.00 H new ATOM 1524 N LYS B 208 8.347 -6.605 -2.436 1.00 0.00 N ATOM 1525 CA LYS B 208 9.186 -7.278 -1.456 1.00 0.00 C ATOM 1526 C LYS B 208 10.652 -6.901 -1.628 1.00 0.00 C ATOM 1527 O LYS B 208 11.406 -6.883 -0.656 1.00 0.00 O ATOM 1528 CB LYS B 208 8.999 -8.794 -1.530 1.00 0.00 C ATOM 1529 CG LYS B 208 9.464 -9.515 -0.274 1.00 0.00 C ATOM 1530 CD LYS B 208 8.970 -10.952 -0.233 1.00 0.00 C ATOM 1531 CE LYS B 208 9.743 -11.852 -1.175 1.00 0.00 C ATOM 1532 NZ LYS B 208 11.162 -11.993 -0.759 1.00 0.00 N ATOM 0 H LYS B 208 7.910 -7.220 -3.122 1.00 0.00 H new ATOM 0 HA LYS B 208 8.874 -6.944 -0.466 1.00 0.00 H new ATOM 0 HB2 LYS B 208 7.946 -9.016 -1.700 1.00 0.00 H new ATOM 0 HB3 LYS B 208 9.549 -9.180 -2.388 1.00 0.00 H new ATOM 0 HG2 LYS B 208 10.553 -9.504 -0.230 1.00 0.00 H new ATOM 0 HG3 LYS B 208 9.104 -8.982 0.606 1.00 0.00 H new ATOM 0 HD2 LYS B 208 9.056 -11.335 0.784 1.00 0.00 H new ATOM 0 HD3 LYS B 208 7.912 -10.978 -0.495 1.00 0.00 H new ATOM 0 HE2 LYS B 208 9.273 -12.835 -1.206 1.00 0.00 H new ATOM 0 HE3 LYS B 208 9.699 -11.445 -2.185 1.00 0.00 H new ATOM 0 HZ1 LYS B 208 11.478 -12.969 -0.928 1.00 0.00 H new ATOM 0 HZ2 LYS B 208 11.752 -11.338 -1.311 1.00 0.00 H new ATOM 0 HZ3 LYS B 208 11.251 -11.770 0.253 1.00 0.00 H new ATOM 1546 N ARG B 209 11.054 -6.571 -2.850 1.00 0.00 N ATOM 1547 CA ARG B 209 12.429 -6.163 -3.095 1.00 0.00 C ATOM 1548 C ARG B 209 12.689 -4.770 -2.525 1.00 0.00 C ATOM 1549 O ARG B 209 13.697 -4.549 -1.855 1.00 0.00 O ATOM 1550 CB ARG B 209 12.751 -6.192 -4.587 1.00 0.00 C ATOM 1551 CG ARG B 209 13.173 -7.555 -5.129 1.00 0.00 C ATOM 1552 CD ARG B 209 12.175 -8.660 -4.804 1.00 0.00 C ATOM 1553 NE ARG B 209 12.508 -9.904 -5.496 1.00 0.00 N ATOM 1554 CZ ARG B 209 11.984 -11.089 -5.197 1.00 0.00 C ATOM 1555 NH1 ARG B 209 11.092 -11.198 -4.222 1.00 0.00 N ATOM 1556 NH2 ARG B 209 12.348 -12.168 -5.879 1.00 0.00 N ATOM 0 H ARG B 209 10.455 -6.578 -3.676 1.00 0.00 H new ATOM 0 HA ARG B 209 13.083 -6.874 -2.590 1.00 0.00 H new ATOM 0 HB2 ARG B 209 11.874 -5.854 -5.139 1.00 0.00 H new ATOM 0 HB3 ARG B 209 13.549 -5.476 -4.785 1.00 0.00 H new ATOM 0 HG2 ARG B 209 13.294 -7.488 -6.210 1.00 0.00 H new ATOM 0 HG3 ARG B 209 14.146 -7.819 -4.715 1.00 0.00 H new ATOM 0 HD2 ARG B 209 12.161 -8.834 -3.728 1.00 0.00 H new ATOM 0 HD3 ARG B 209 11.172 -8.341 -5.089 1.00 0.00 H new ATOM 0 HE ARG B 209 13.186 -9.860 -6.257 1.00 0.00 H new ATOM 0 HH11 ARG B 209 10.805 -10.371 -3.698 1.00 0.00 H new ATOM 0 HH12 ARG B 209 10.692 -12.109 -3.996 1.00 0.00 H new ATOM 0 HH21 ARG B 209 13.030 -12.089 -6.633 1.00 0.00 H new ATOM 0 HH22 ARG B 209 11.946 -13.077 -5.649 1.00 0.00 H new ATOM 1570 N LYS B 210 11.771 -3.833 -2.763 1.00 0.00 N ATOM 1571 CA LYS B 210 11.942 -2.466 -2.271 1.00 0.00 C ATOM 1572 C LYS B 210 11.567 -2.366 -0.791 1.00 0.00 C ATOM 1573 O LYS B 210 11.894 -1.388 -0.117 1.00 0.00 O ATOM 1574 CB LYS B 210 11.104 -1.479 -3.096 1.00 0.00 C ATOM 1575 CG LYS B 210 11.454 -1.460 -4.581 1.00 0.00 C ATOM 1576 CD LYS B 210 12.905 -1.061 -4.827 1.00 0.00 C ATOM 1577 CE LYS B 210 13.153 0.407 -4.516 1.00 0.00 C ATOM 1578 NZ LYS B 210 12.527 1.306 -5.520 1.00 0.00 N ATOM 0 H LYS B 210 10.911 -3.992 -3.287 1.00 0.00 H new ATOM 0 HA LYS B 210 12.994 -2.204 -2.380 1.00 0.00 H new ATOM 0 HB2 LYS B 210 10.050 -1.732 -2.985 1.00 0.00 H new ATOM 0 HB3 LYS B 210 11.236 -0.477 -2.689 1.00 0.00 H new ATOM 0 HG2 LYS B 210 11.273 -2.447 -5.008 1.00 0.00 H new ATOM 0 HG3 LYS B 210 10.795 -0.763 -5.099 1.00 0.00 H new ATOM 0 HD2 LYS B 210 13.560 -1.678 -4.211 1.00 0.00 H new ATOM 0 HD3 LYS B 210 13.164 -1.260 -5.867 1.00 0.00 H new ATOM 0 HE2 LYS B 210 12.758 0.639 -3.527 1.00 0.00 H new ATOM 0 HE3 LYS B 210 14.226 0.593 -4.483 1.00 0.00 H new ATOM 0 HZ1 LYS B 210 13.258 1.908 -5.951 1.00 0.00 H new ATOM 0 HZ2 LYS B 210 12.069 0.735 -6.259 1.00 0.00 H new ATOM 0 HZ3 LYS B 210 11.816 1.905 -5.054 1.00 0.00 H new ATOM 1592 N TYR B 211 10.873 -3.381 -0.300 1.00 0.00 N ATOM 1593 CA TYR B 211 10.489 -3.453 1.103 1.00 0.00 C ATOM 1594 C TYR B 211 11.656 -3.972 1.934 1.00 0.00 C ATOM 1595 O TYR B 211 12.088 -3.332 2.894 1.00 0.00 O ATOM 1596 CB TYR B 211 9.274 -4.384 1.255 1.00 0.00 C ATOM 1597 CG TYR B 211 8.671 -4.452 2.643 1.00 0.00 C ATOM 1598 CD1 TYR B 211 7.357 -4.063 2.853 1.00 0.00 C ATOM 1599 CD2 TYR B 211 9.397 -4.918 3.735 1.00 0.00 C ATOM 1600 CE1 TYR B 211 6.786 -4.133 4.110 1.00 0.00 C ATOM 1601 CE2 TYR B 211 8.833 -4.985 4.993 1.00 0.00 C ATOM 1602 CZ TYR B 211 7.526 -4.591 5.175 1.00 0.00 C ATOM 1603 OH TYR B 211 6.958 -4.655 6.429 1.00 0.00 O ATOM 0 H TYR B 211 10.561 -4.175 -0.859 1.00 0.00 H new ATOM 0 HA TYR B 211 10.223 -2.457 1.458 1.00 0.00 H new ATOM 0 HB2 TYR B 211 8.501 -4.060 0.558 1.00 0.00 H new ATOM 0 HB3 TYR B 211 9.570 -5.390 0.957 1.00 0.00 H new ATOM 0 HD1 TYR B 211 6.771 -3.700 2.022 1.00 0.00 H new ATOM 0 HD2 TYR B 211 10.421 -5.233 3.596 1.00 0.00 H new ATOM 0 HE1 TYR B 211 5.760 -3.828 4.256 1.00 0.00 H new ATOM 0 HE2 TYR B 211 9.413 -5.344 5.830 1.00 0.00 H new ATOM 0 HH TYR B 211 6.682 -5.576 6.616 1.00 0.00 H new ATOM 1613 N ARG B 212 12.168 -5.130 1.545 1.00 0.00 N ATOM 1614 CA ARG B 212 13.173 -5.827 2.331 1.00 0.00 C ATOM 1615 C ARG B 212 14.566 -5.239 2.115 1.00 0.00 C ATOM 1616 O ARG B 212 15.356 -5.139 3.057 1.00 0.00 O ATOM 1617 CB ARG B 212 13.149 -7.317 1.982 1.00 0.00 C ATOM 1618 CG ARG B 212 14.152 -8.155 2.753 1.00 0.00 C ATOM 1619 CD ARG B 212 13.928 -9.637 2.507 1.00 0.00 C ATOM 1620 NE ARG B 212 14.991 -10.454 3.084 1.00 0.00 N ATOM 1621 CZ ARG B 212 14.984 -11.787 3.098 1.00 0.00 C ATOM 1622 NH1 ARG B 212 13.927 -12.460 2.658 1.00 0.00 N ATOM 1623 NH2 ARG B 212 16.029 -12.448 3.577 1.00 0.00 N ATOM 0 H ARG B 212 11.902 -5.609 0.685 1.00 0.00 H new ATOM 0 HA ARG B 212 12.935 -5.700 3.387 1.00 0.00 H new ATOM 0 HB2 ARG B 212 12.148 -7.706 2.169 1.00 0.00 H new ATOM 0 HB3 ARG B 212 13.341 -7.432 0.915 1.00 0.00 H new ATOM 0 HG2 ARG B 212 15.164 -7.882 2.455 1.00 0.00 H new ATOM 0 HG3 ARG B 212 14.066 -7.943 3.819 1.00 0.00 H new ATOM 0 HD2 ARG B 212 12.970 -9.935 2.934 1.00 0.00 H new ATOM 0 HD3 ARG B 212 13.870 -9.822 1.434 1.00 0.00 H new ATOM 0 HE ARG B 212 15.789 -9.975 3.502 1.00 0.00 H new ATOM 0 HH11 ARG B 212 13.113 -11.957 2.306 1.00 0.00 H new ATOM 0 HH12 ARG B 212 13.930 -13.480 2.672 1.00 0.00 H new ATOM 0 HH21 ARG B 212 16.836 -11.937 3.934 1.00 0.00 H new ATOM 0 HH22 ARG B 212 16.026 -13.468 3.589 1.00 0.00 H new ATOM 1637 N ASN B 213 14.868 -4.845 0.885 1.00 0.00 N ATOM 1638 CA ASN B 213 16.177 -4.283 0.574 1.00 0.00 C ATOM 1639 C ASN B 213 16.035 -2.879 0.004 1.00 0.00 C ATOM 1640 O ASN B 213 16.222 -2.699 -1.217 1.00 0.00 O ATOM 1641 CB ASN B 213 16.935 -5.176 -0.415 1.00 0.00 C ATOM 1642 CG ASN B 213 17.265 -6.546 0.151 1.00 0.00 C ATOM 1643 OD1 ASN B 213 17.474 -6.624 1.457 1.00 0.00 O flip ATOM 1644 ND2 ASN B 213 17.333 -7.530 -0.585 1.00 0.00 N flip ATOM 1645 OXT ASN B 213 15.722 -1.954 0.784 1.00 0.00 O ATOM 0 H ASN B 213 14.230 -4.903 0.091 1.00 0.00 H new ATOM 0 HA ASN B 213 16.748 -4.231 1.501 1.00 0.00 H new ATOM 0 HB2 ASN B 213 16.337 -5.297 -1.318 1.00 0.00 H new ATOM 0 HB3 ASN B 213 17.859 -4.679 -0.709 1.00 0.00 H new ATOM 0 HD21 ASN B 213 17.166 -7.431 -1.586 1.00 0.00 H new ATOM 0 HD22 ASN B 213 17.557 -8.445 -0.194 1.00 0.00 H new TER 1652 ASN B 213