USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 911 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 71 THR OG1 : rot 120:sc= 0.079 USER MOD Set 1.2: A 80 MET CE :methyl -139:sc= -0.711 (180deg=-1.69) USER MOD Set 2.1: A 50 CYS SG : rot 180:sc= 0 USER MOD Set 2.2: A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 CYS SG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -2.07 K(o=-2.1,f=-8.6!) USER MOD Single : A 14 HIS :FLIP no HD1:sc= -2.2 F(o=-4.9!,f=-2.2) USER MOD Single : A 16 ASN : amide:sc= -0.996! C(o=-1!,f=-0.96!) USER MOD Single : A 18 THR OG1 : rot 180:sc= -0.155 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ -115:sc= 1.07 (180deg=-1.66) USER MOD Single : A 27 SER OG : rot -65:sc= -0.0501 USER MOD Single : A 29 THR OG1 : rot 77:sc= 0.0116 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 130:sc= -0.27 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= -1.06 K(o=-1.1,f=-1.9!) USER MOD Single : A 56 CYS SG : rot 180:sc= 0 USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 165:sc= 0 USER MOD Single : A 65 ASN : amide:sc= -4.14! C(o=-4.1!,f=-18!) USER MOD Single : A 69 LYS NZ :NH3+ 158:sc= 1.12 (180deg=0.521) USER MOD Single : A 73 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= -0.7 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -147:sc= -4.37! (180deg=-8.36!) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= -0.0381 K(o=-0.038,f=-2.3) USER MOD Single : A 98 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 HIS : no HE2:sc= -0.204 K(o=-0.2,f=-0.8) USER MOD Single : A 105 GLN : amide:sc= -4.03! C(o=-4!,f=-4.3!) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot 180:sc= -0.0737 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.264 -0.796 -35.319 1.00 0.00 N ATOM 2 CA GLY A 1 9.995 -1.683 -34.202 1.00 0.00 C ATOM 3 C GLY A 1 8.621 -2.318 -34.284 1.00 0.00 C ATOM 4 O GLY A 1 7.629 -1.637 -34.545 1.00 0.00 O ATOM 0 H1 GLY A 1 11.215 -0.387 -35.217 1.00 0.00 H new ATOM 0 H2 GLY A 1 10.212 -1.332 -36.209 1.00 0.00 H new ATOM 0 H3 GLY A 1 9.559 -0.032 -35.333 1.00 0.00 H new ATOM 0 HA2 GLY A 1 10.753 -2.466 -34.173 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.079 -1.124 -33.270 1.00 0.00 H new ATOM 8 N SER A 2 8.562 -3.627 -34.063 1.00 0.00 N ATOM 9 CA SER A 2 7.300 -4.356 -34.119 1.00 0.00 C ATOM 10 C SER A 2 6.875 -4.813 -32.727 1.00 0.00 C ATOM 11 O SER A 2 7.641 -4.716 -31.768 1.00 0.00 O ATOM 12 CB SER A 2 7.425 -5.565 -35.049 1.00 0.00 C ATOM 13 OG SER A 2 8.456 -6.436 -34.617 1.00 0.00 O ATOM 0 H SER A 2 9.373 -4.205 -33.843 1.00 0.00 H new ATOM 0 HA SER A 2 6.537 -3.683 -34.511 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.478 -6.104 -35.079 1.00 0.00 H new ATOM 0 HB3 SER A 2 7.632 -5.227 -36.064 1.00 0.00 H new ATOM 0 HG SER A 2 8.515 -7.201 -35.226 1.00 0.00 H new ATOM 19 N SER A 3 5.647 -5.311 -32.624 1.00 0.00 N ATOM 20 CA SER A 3 5.116 -5.780 -31.349 1.00 0.00 C ATOM 21 C SER A 3 4.168 -6.957 -31.555 1.00 0.00 C ATOM 22 O SER A 3 3.723 -7.222 -32.671 1.00 0.00 O ATOM 23 CB SER A 3 4.389 -4.644 -30.627 1.00 0.00 C ATOM 24 OG SER A 3 5.277 -3.584 -30.319 1.00 0.00 O ATOM 0 H SER A 3 5.001 -5.400 -33.408 1.00 0.00 H new ATOM 0 HA SER A 3 5.953 -6.114 -30.735 1.00 0.00 H new ATOM 0 HB2 SER A 3 3.577 -4.272 -31.252 1.00 0.00 H new ATOM 0 HB3 SER A 3 3.937 -5.022 -29.710 1.00 0.00 H new ATOM 0 HG SER A 3 4.787 -2.870 -29.860 1.00 0.00 H new ATOM 30 N GLY A 4 3.862 -7.660 -30.469 1.00 0.00 N ATOM 31 CA GLY A 4 2.968 -8.800 -30.550 1.00 0.00 C ATOM 32 C GLY A 4 3.105 -9.730 -29.361 1.00 0.00 C ATOM 33 O GLY A 4 3.526 -10.878 -29.507 1.00 0.00 O ATOM 0 H GLY A 4 4.218 -7.460 -29.534 1.00 0.00 H new ATOM 0 HA2 GLY A 4 1.939 -8.447 -30.614 1.00 0.00 H new ATOM 0 HA3 GLY A 4 3.173 -9.354 -31.466 1.00 0.00 H new ATOM 37 N SER A 5 2.750 -9.234 -28.180 1.00 0.00 N ATOM 38 CA SER A 5 2.841 -10.027 -26.960 1.00 0.00 C ATOM 39 C SER A 5 2.034 -9.386 -25.834 1.00 0.00 C ATOM 40 O SER A 5 1.796 -8.178 -25.837 1.00 0.00 O ATOM 41 CB SER A 5 4.302 -10.179 -26.533 1.00 0.00 C ATOM 42 OG SER A 5 4.494 -11.369 -25.787 1.00 0.00 O ATOM 0 H SER A 5 2.397 -8.287 -28.042 1.00 0.00 H new ATOM 0 HA SER A 5 2.426 -11.014 -27.165 1.00 0.00 H new ATOM 0 HB2 SER A 5 4.943 -10.192 -27.415 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.601 -9.318 -25.934 1.00 0.00 H new ATOM 0 HG SER A 5 5.436 -11.444 -25.527 1.00 0.00 H new ATOM 48 N SER A 6 1.617 -10.204 -24.873 1.00 0.00 N ATOM 49 CA SER A 6 0.834 -9.719 -23.743 1.00 0.00 C ATOM 50 C SER A 6 1.510 -10.073 -22.422 1.00 0.00 C ATOM 51 O SER A 6 2.426 -10.893 -22.381 1.00 0.00 O ATOM 52 CB SER A 6 -0.577 -10.309 -23.782 1.00 0.00 C ATOM 53 OG SER A 6 -1.307 -9.811 -24.889 1.00 0.00 O ATOM 0 H SER A 6 1.808 -11.206 -24.855 1.00 0.00 H new ATOM 0 HA SER A 6 0.768 -8.634 -23.818 1.00 0.00 H new ATOM 0 HB2 SER A 6 -0.519 -11.396 -23.840 1.00 0.00 H new ATOM 0 HB3 SER A 6 -1.102 -10.067 -22.858 1.00 0.00 H new ATOM 0 HG SER A 6 -2.205 -10.204 -24.893 1.00 0.00 H new ATOM 59 N GLY A 7 1.049 -9.448 -21.342 1.00 0.00 N ATOM 60 CA GLY A 7 1.620 -9.710 -20.034 1.00 0.00 C ATOM 61 C GLY A 7 2.148 -8.454 -19.369 1.00 0.00 C ATOM 62 O GLY A 7 3.344 -8.341 -19.103 1.00 0.00 O ATOM 0 H GLY A 7 0.291 -8.766 -21.350 1.00 0.00 H new ATOM 0 HA2 GLY A 7 0.863 -10.165 -19.395 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.430 -10.433 -20.133 1.00 0.00 H new ATOM 66 N MET A 8 1.254 -7.508 -19.103 1.00 0.00 N ATOM 67 CA MET A 8 1.637 -6.253 -18.466 1.00 0.00 C ATOM 68 C MET A 8 1.524 -6.357 -16.948 1.00 0.00 C ATOM 69 O MET A 8 0.608 -6.992 -16.426 1.00 0.00 O ATOM 70 CB MET A 8 0.761 -5.108 -18.977 1.00 0.00 C ATOM 71 CG MET A 8 1.254 -3.732 -18.560 1.00 0.00 C ATOM 72 SD MET A 8 -0.062 -2.500 -18.536 1.00 0.00 S ATOM 73 CE MET A 8 0.864 -1.024 -18.120 1.00 0.00 C ATOM 0 H MET A 8 0.260 -7.586 -19.318 1.00 0.00 H new ATOM 0 HA MET A 8 2.676 -6.047 -18.722 1.00 0.00 H new ATOM 0 HB2 MET A 8 0.716 -5.154 -20.065 1.00 0.00 H new ATOM 0 HB3 MET A 8 -0.256 -5.247 -18.609 1.00 0.00 H new ATOM 0 HG2 MET A 8 1.704 -3.797 -17.569 1.00 0.00 H new ATOM 0 HG3 MET A 8 2.037 -3.408 -19.245 1.00 0.00 H new ATOM 0 HE1 MET A 8 0.186 -0.172 -18.067 1.00 0.00 H new ATOM 0 HE2 MET A 8 1.351 -1.160 -17.155 1.00 0.00 H new ATOM 0 HE3 MET A 8 1.619 -0.840 -18.885 1.00 0.00 H new ATOM 83 N VAL A 9 2.461 -5.729 -16.245 1.00 0.00 N ATOM 84 CA VAL A 9 2.466 -5.750 -14.787 1.00 0.00 C ATOM 85 C VAL A 9 2.215 -4.359 -14.216 1.00 0.00 C ATOM 86 O VAL A 9 2.535 -3.342 -14.831 1.00 0.00 O ATOM 87 CB VAL A 9 3.801 -6.286 -14.238 1.00 0.00 C ATOM 88 CG1 VAL A 9 4.031 -7.719 -14.694 1.00 0.00 C ATOM 89 CG2 VAL A 9 4.952 -5.389 -14.669 1.00 0.00 C ATOM 0 H VAL A 9 3.227 -5.199 -16.662 1.00 0.00 H new ATOM 0 HA VAL A 9 1.661 -6.417 -14.477 1.00 0.00 H new ATOM 0 HB VAL A 9 3.754 -6.281 -13.149 1.00 0.00 H new ATOM 0 HG11 VAL A 9 4.979 -8.080 -14.296 1.00 0.00 H new ATOM 0 HG12 VAL A 9 3.221 -8.351 -14.330 1.00 0.00 H new ATOM 0 HG13 VAL A 9 4.058 -7.754 -15.783 1.00 0.00 H new ATOM 0 HG21 VAL A 9 5.888 -5.782 -14.272 1.00 0.00 H new ATOM 0 HG22 VAL A 9 5.003 -5.360 -15.757 1.00 0.00 H new ATOM 0 HG23 VAL A 9 4.791 -4.381 -14.286 1.00 0.00 H new ATOM 99 N PRO A 10 1.629 -4.311 -13.010 1.00 0.00 N ATOM 100 CA PRO A 10 1.323 -3.050 -12.329 1.00 0.00 C ATOM 101 C PRO A 10 2.579 -2.327 -11.855 1.00 0.00 C ATOM 102 O PRO A 10 3.485 -2.942 -11.291 1.00 0.00 O ATOM 103 CB PRO A 10 0.476 -3.490 -11.132 1.00 0.00 C ATOM 104 CG PRO A 10 0.887 -4.899 -10.875 1.00 0.00 C ATOM 105 CD PRO A 10 1.221 -5.484 -12.220 1.00 0.00 C ATOM 0 HA PRO A 10 0.820 -2.343 -12.988 1.00 0.00 H new ATOM 0 HB2 PRO A 10 0.661 -2.859 -10.263 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -0.589 -3.422 -11.354 1.00 0.00 H new ATOM 0 HG2 PRO A 10 1.748 -4.939 -10.207 1.00 0.00 H new ATOM 0 HG3 PRO A 10 0.084 -5.458 -10.394 1.00 0.00 H new ATOM 0 HD2 PRO A 10 2.022 -6.220 -12.150 1.00 0.00 H new ATOM 0 HD3 PRO A 10 0.362 -5.988 -12.663 1.00 0.00 H new ATOM 113 N CYS A 11 2.628 -1.020 -12.089 1.00 0.00 N ATOM 114 CA CYS A 11 3.774 -0.214 -11.686 1.00 0.00 C ATOM 115 C CYS A 11 3.608 0.292 -10.257 1.00 0.00 C ATOM 116 O CYS A 11 4.579 0.387 -9.505 1.00 0.00 O ATOM 117 CB CYS A 11 3.953 0.968 -12.640 1.00 0.00 C ATOM 118 SG CYS A 11 4.293 0.491 -14.351 1.00 0.00 S ATOM 0 H CYS A 11 1.887 -0.496 -12.556 1.00 0.00 H new ATOM 0 HA CYS A 11 4.662 -0.844 -11.728 1.00 0.00 H new ATOM 0 HB2 CYS A 11 3.051 1.579 -12.617 1.00 0.00 H new ATOM 0 HB3 CYS A 11 4.770 1.592 -12.279 1.00 0.00 H new ATOM 0 HG CYS A 11 4.426 1.559 -15.081 1.00 0.00 H new ATOM 124 N TRP A 12 2.374 0.616 -9.889 1.00 0.00 N ATOM 125 CA TRP A 12 2.081 1.114 -8.550 1.00 0.00 C ATOM 126 C TRP A 12 2.401 0.060 -7.495 1.00 0.00 C ATOM 127 O TRP A 12 2.406 0.347 -6.299 1.00 0.00 O ATOM 128 CB TRP A 12 0.612 1.527 -8.447 1.00 0.00 C ATOM 129 CG TRP A 12 -0.316 0.609 -9.183 1.00 0.00 C ATOM 130 CD1 TRP A 12 -0.833 0.796 -10.433 1.00 0.00 C ATOM 131 CD2 TRP A 12 -0.839 -0.639 -8.713 1.00 0.00 C ATOM 132 NE1 TRP A 12 -1.645 -0.260 -10.769 1.00 0.00 N ATOM 133 CE2 TRP A 12 -1.665 -1.154 -9.731 1.00 0.00 C ATOM 134 CE3 TRP A 12 -0.688 -1.371 -7.533 1.00 0.00 C ATOM 135 CZ2 TRP A 12 -2.337 -2.366 -9.602 1.00 0.00 C ATOM 136 CZ3 TRP A 12 -1.356 -2.575 -7.406 1.00 0.00 C ATOM 137 CH2 TRP A 12 -2.171 -3.063 -8.436 1.00 0.00 C ATOM 0 H TRP A 12 1.560 0.543 -10.499 1.00 0.00 H new ATOM 0 HA TRP A 12 2.710 1.986 -8.368 1.00 0.00 H new ATOM 0 HB2 TRP A 12 0.323 1.558 -7.396 1.00 0.00 H new ATOM 0 HB3 TRP A 12 0.498 2.538 -8.839 1.00 0.00 H new ATOM 0 HD1 TRP A 12 -0.633 1.649 -11.065 1.00 0.00 H new ATOM 0 HE1 TRP A 12 -2.151 -0.362 -11.649 1.00 0.00 H new ATOM 0 HE3 TRP A 12 -0.061 -1.003 -6.734 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 -2.967 -2.743 -10.394 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 -1.248 -3.149 -6.498 1.00 0.00 H new ATOM 0 HH2 TRP A 12 -2.678 -4.008 -8.307 1.00 0.00 H new ATOM 148 N ASN A 13 2.668 -1.161 -7.947 1.00 0.00 N ATOM 149 CA ASN A 13 2.989 -2.258 -7.041 1.00 0.00 C ATOM 150 C ASN A 13 4.435 -2.710 -7.224 1.00 0.00 C ATOM 151 O ASN A 13 4.824 -3.162 -8.302 1.00 0.00 O ATOM 152 CB ASN A 13 2.041 -3.436 -7.277 1.00 0.00 C ATOM 153 CG ASN A 13 2.300 -4.587 -6.324 1.00 0.00 C ATOM 154 OD1 ASN A 13 3.335 -4.636 -5.660 1.00 0.00 O ATOM 155 ND2 ASN A 13 1.357 -5.519 -6.253 1.00 0.00 N ATOM 0 H ASN A 13 2.668 -1.416 -8.935 1.00 0.00 H new ATOM 0 HA ASN A 13 2.866 -1.900 -6.019 1.00 0.00 H new ATOM 0 HB2 ASN A 13 1.011 -3.098 -7.163 1.00 0.00 H new ATOM 0 HB3 ASN A 13 2.150 -3.786 -8.303 1.00 0.00 H new ATOM 0 HD21 ASN A 13 1.475 -6.317 -5.629 1.00 0.00 H new ATOM 0 HD22 ASN A 13 0.515 -5.437 -6.823 1.00 0.00 H new ATOM 162 N HIS A 14 5.227 -2.585 -6.164 1.00 0.00 N ATOM 163 CA HIS A 14 6.630 -2.982 -6.207 1.00 0.00 C ATOM 164 C HIS A 14 6.801 -4.424 -5.742 1.00 0.00 C ATOM 165 O HIS A 14 7.485 -5.218 -6.386 1.00 0.00 O ATOM 166 CB HIS A 14 7.472 -2.049 -5.336 1.00 0.00 C ATOM 167 CG HIS A 14 7.420 -0.616 -5.768 1.00 0.00 C ATOM 168 ND1 HIS A 14 6.367 0.185 -6.054 1.00 0.00 N flip ATOM 169 CD2 HIS A 14 8.548 0.156 -5.952 1.00 0.00 C flip ATOM 170 CE1 HIS A 14 6.872 1.413 -6.402 1.00 0.00 C flip ATOM 171 NE2 HIS A 14 8.191 1.370 -6.332 1.00 0.00 N flip ATOM 0 H HIS A 14 4.921 -2.212 -5.265 1.00 0.00 H new ATOM 0 HA HIS A 14 6.971 -2.910 -7.240 1.00 0.00 H new ATOM 0 HB2 HIS A 14 7.129 -2.121 -4.304 1.00 0.00 H new ATOM 0 HB3 HIS A 14 8.508 -2.387 -5.352 1.00 0.00 H new ATOM 0 HD2 HIS A 14 9.564 -0.179 -5.808 1.00 0.00 H new ATOM 0 HE1 HIS A 14 6.286 2.275 -6.687 1.00 0.00 H new ATOM 0 HE2 HIS A 14 8.825 2.142 -6.536 1.00 0.00 H new ATOM 180 N GLY A 15 6.174 -4.757 -4.617 1.00 0.00 N ATOM 181 CA GLY A 15 6.271 -6.104 -4.084 1.00 0.00 C ATOM 182 C GLY A 15 7.696 -6.491 -3.742 1.00 0.00 C ATOM 183 O GLY A 15 8.632 -6.132 -4.454 1.00 0.00 O ATOM 0 H GLY A 15 5.601 -4.118 -4.066 1.00 0.00 H new ATOM 0 HA2 GLY A 15 5.652 -6.183 -3.190 1.00 0.00 H new ATOM 0 HA3 GLY A 15 5.871 -6.809 -4.812 1.00 0.00 H new ATOM 187 N ASN A 16 7.861 -7.224 -2.646 1.00 0.00 N ATOM 188 CA ASN A 16 9.183 -7.658 -2.208 1.00 0.00 C ATOM 189 C ASN A 16 10.082 -6.459 -1.922 1.00 0.00 C ATOM 190 O ASN A 16 11.211 -6.388 -2.406 1.00 0.00 O ATOM 191 CB ASN A 16 9.827 -8.551 -3.271 1.00 0.00 C ATOM 192 CG ASN A 16 11.246 -8.946 -2.911 1.00 0.00 C ATOM 193 OD1 ASN A 16 11.493 -9.514 -1.847 1.00 0.00 O ATOM 194 ND2 ASN A 16 12.187 -8.647 -3.799 1.00 0.00 N ATOM 0 H ASN A 16 7.096 -7.530 -2.045 1.00 0.00 H new ATOM 0 HA ASN A 16 9.065 -8.228 -1.287 1.00 0.00 H new ATOM 0 HB2 ASN A 16 9.224 -9.450 -3.400 1.00 0.00 H new ATOM 0 HB3 ASN A 16 9.830 -8.029 -4.228 1.00 0.00 H new ATOM 0 HD21 ASN A 16 13.160 -8.889 -3.612 1.00 0.00 H new ATOM 0 HD22 ASN A 16 11.937 -8.176 -4.668 1.00 0.00 H new ATOM 201 N ILE A 17 9.573 -5.521 -1.131 1.00 0.00 N ATOM 202 CA ILE A 17 10.330 -4.326 -0.778 1.00 0.00 C ATOM 203 C ILE A 17 10.289 -4.073 0.725 1.00 0.00 C ATOM 204 O ILE A 17 9.292 -4.361 1.388 1.00 0.00 O ATOM 205 CB ILE A 17 9.794 -3.083 -1.512 1.00 0.00 C ATOM 206 CG1 ILE A 17 8.384 -2.745 -1.024 1.00 0.00 C ATOM 207 CG2 ILE A 17 9.799 -3.312 -3.016 1.00 0.00 C ATOM 208 CD1 ILE A 17 7.956 -1.330 -1.346 1.00 0.00 C ATOM 0 H ILE A 17 8.640 -5.565 -0.722 1.00 0.00 H new ATOM 0 HA ILE A 17 11.361 -4.503 -1.086 1.00 0.00 H new ATOM 0 HB ILE A 17 10.447 -2.239 -1.291 1.00 0.00 H new ATOM 0 HG12 ILE A 17 7.676 -3.441 -1.474 1.00 0.00 H new ATOM 0 HG13 ILE A 17 8.336 -2.894 0.055 1.00 0.00 H new ATOM 0 HG21 ILE A 17 9.417 -2.424 -3.520 1.00 0.00 H new ATOM 0 HG22 ILE A 17 10.817 -3.510 -3.351 1.00 0.00 H new ATOM 0 HG23 ILE A 17 9.166 -4.166 -3.256 1.00 0.00 H new ATOM 0 HD11 ILE A 17 6.947 -1.161 -0.971 1.00 0.00 H new ATOM 0 HD12 ILE A 17 8.641 -0.626 -0.874 1.00 0.00 H new ATOM 0 HD13 ILE A 17 7.971 -1.182 -2.426 1.00 0.00 H new ATOM 220 N THR A 18 11.379 -3.529 1.258 1.00 0.00 N ATOM 221 CA THR A 18 11.468 -3.236 2.683 1.00 0.00 C ATOM 222 C THR A 18 10.785 -1.914 3.015 1.00 0.00 C ATOM 223 O THR A 18 10.610 -1.059 2.147 1.00 0.00 O ATOM 224 CB THR A 18 12.933 -3.176 3.154 1.00 0.00 C ATOM 225 OG1 THR A 18 13.006 -2.581 4.454 1.00 0.00 O ATOM 226 CG2 THR A 18 13.783 -2.377 2.177 1.00 0.00 C ATOM 0 H THR A 18 12.212 -3.283 0.724 1.00 0.00 H new ATOM 0 HA THR A 18 10.960 -4.047 3.205 1.00 0.00 H new ATOM 0 HB THR A 18 13.319 -4.194 3.199 1.00 0.00 H new ATOM 0 HG1 THR A 18 13.941 -2.548 4.747 1.00 0.00 H new ATOM 0 HG21 THR A 18 14.814 -2.348 2.531 1.00 0.00 H new ATOM 0 HG22 THR A 18 13.749 -2.849 1.195 1.00 0.00 H new ATOM 0 HG23 THR A 18 13.396 -1.361 2.105 1.00 0.00 H new ATOM 234 N ARG A 19 10.400 -1.753 4.278 1.00 0.00 N ATOM 235 CA ARG A 19 9.736 -0.535 4.724 1.00 0.00 C ATOM 236 C ARG A 19 10.428 0.701 4.158 1.00 0.00 C ATOM 237 O ARG A 19 9.797 1.537 3.512 1.00 0.00 O ATOM 238 CB ARG A 19 9.719 -0.469 6.253 1.00 0.00 C ATOM 239 CG ARG A 19 8.612 0.410 6.812 1.00 0.00 C ATOM 240 CD ARG A 19 8.650 0.453 8.332 1.00 0.00 C ATOM 241 NE ARG A 19 9.838 1.142 8.830 1.00 0.00 N ATOM 242 CZ ARG A 19 10.292 1.018 10.072 1.00 0.00 C ATOM 243 NH1 ARG A 19 9.662 0.235 10.937 1.00 0.00 N ATOM 244 NH2 ARG A 19 11.379 1.678 10.451 1.00 0.00 N ATOM 0 H ARG A 19 10.537 -2.451 5.009 1.00 0.00 H new ATOM 0 HA ARG A 19 8.710 -0.555 4.356 1.00 0.00 H new ATOM 0 HB2 ARG A 19 9.606 -1.478 6.651 1.00 0.00 H new ATOM 0 HB3 ARG A 19 10.681 -0.094 6.603 1.00 0.00 H new ATOM 0 HG2 ARG A 19 8.713 1.420 6.416 1.00 0.00 H new ATOM 0 HG3 ARG A 19 7.644 0.033 6.481 1.00 0.00 H new ATOM 0 HD2 ARG A 19 7.757 0.956 8.703 1.00 0.00 H new ATOM 0 HD3 ARG A 19 8.629 -0.564 8.724 1.00 0.00 H new ATOM 0 HE ARG A 19 10.346 1.751 8.189 1.00 0.00 H new ATOM 0 HH11 ARG A 19 8.826 -0.274 10.649 1.00 0.00 H new ATOM 0 HH12 ARG A 19 10.013 0.142 11.890 1.00 0.00 H new ATOM 0 HH21 ARG A 19 11.866 2.281 9.788 1.00 0.00 H new ATOM 0 HH22 ARG A 19 11.727 1.582 11.405 1.00 0.00 H new ATOM 258 N SER A 20 11.730 0.810 4.407 1.00 0.00 N ATOM 259 CA SER A 20 12.507 1.946 3.926 1.00 0.00 C ATOM 260 C SER A 20 12.275 2.171 2.435 1.00 0.00 C ATOM 261 O SER A 20 11.794 3.227 2.022 1.00 0.00 O ATOM 262 CB SER A 20 13.997 1.721 4.193 1.00 0.00 C ATOM 263 OG SER A 20 14.678 2.953 4.353 1.00 0.00 O ATOM 0 H SER A 20 12.268 0.126 4.939 1.00 0.00 H new ATOM 0 HA SER A 20 12.178 2.834 4.465 1.00 0.00 H new ATOM 0 HB2 SER A 20 14.121 1.114 5.090 1.00 0.00 H new ATOM 0 HB3 SER A 20 14.438 1.163 3.367 1.00 0.00 H new ATOM 0 HG SER A 20 15.628 2.782 4.524 1.00 0.00 H new ATOM 269 N LYS A 21 12.620 1.172 1.631 1.00 0.00 N ATOM 270 CA LYS A 21 12.449 1.257 0.186 1.00 0.00 C ATOM 271 C LYS A 21 11.066 1.794 -0.168 1.00 0.00 C ATOM 272 O LYS A 21 10.911 2.560 -1.118 1.00 0.00 O ATOM 273 CB LYS A 21 12.654 -0.117 -0.455 1.00 0.00 C ATOM 274 CG LYS A 21 12.395 -0.135 -1.952 1.00 0.00 C ATOM 275 CD LYS A 21 13.563 0.453 -2.726 1.00 0.00 C ATOM 276 CE LYS A 21 13.176 0.770 -4.163 1.00 0.00 C ATOM 277 NZ LYS A 21 14.336 0.649 -5.089 1.00 0.00 N ATOM 0 H LYS A 21 13.021 0.292 1.956 1.00 0.00 H new ATOM 0 HA LYS A 21 13.198 1.947 -0.203 1.00 0.00 H new ATOM 0 HB2 LYS A 21 13.676 -0.447 -0.268 1.00 0.00 H new ATOM 0 HB3 LYS A 21 11.993 -0.836 0.028 1.00 0.00 H new ATOM 0 HG2 LYS A 21 12.219 -1.160 -2.280 1.00 0.00 H new ATOM 0 HG3 LYS A 21 11.489 0.430 -2.173 1.00 0.00 H new ATOM 0 HD2 LYS A 21 13.908 1.361 -2.232 1.00 0.00 H new ATOM 0 HD3 LYS A 21 14.396 -0.250 -2.719 1.00 0.00 H new ATOM 0 HE2 LYS A 21 12.383 0.094 -4.483 1.00 0.00 H new ATOM 0 HE3 LYS A 21 12.773 1.781 -4.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 14.561 1.583 -5.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 15.160 0.287 -4.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 14.098 -0.008 -5.859 1.00 0.00 H new ATOM 291 N ALA A 22 10.063 1.387 0.604 1.00 0.00 N ATOM 292 CA ALA A 22 8.694 1.830 0.375 1.00 0.00 C ATOM 293 C ALA A 22 8.538 3.315 0.682 1.00 0.00 C ATOM 294 O ALA A 22 7.824 4.031 -0.018 1.00 0.00 O ATOM 295 CB ALA A 22 7.726 1.011 1.216 1.00 0.00 C ATOM 0 H ALA A 22 10.174 0.751 1.394 1.00 0.00 H new ATOM 0 HA ALA A 22 8.461 1.678 -0.679 1.00 0.00 H new ATOM 0 HB1 ALA A 22 6.707 1.353 1.035 1.00 0.00 H new ATOM 0 HB2 ALA A 22 7.809 -0.041 0.945 1.00 0.00 H new ATOM 0 HB3 ALA A 22 7.967 1.134 2.272 1.00 0.00 H new ATOM 301 N GLU A 23 9.211 3.771 1.735 1.00 0.00 N ATOM 302 CA GLU A 23 9.145 5.171 2.135 1.00 0.00 C ATOM 303 C GLU A 23 10.029 6.035 1.240 1.00 0.00 C ATOM 304 O GLU A 23 9.546 6.941 0.562 1.00 0.00 O ATOM 305 CB GLU A 23 9.571 5.328 3.596 1.00 0.00 C ATOM 306 CG GLU A 23 8.704 4.548 4.570 1.00 0.00 C ATOM 307 CD GLU A 23 9.325 4.442 5.949 1.00 0.00 C ATOM 308 OE1 GLU A 23 10.571 4.406 6.037 1.00 0.00 O ATOM 309 OE2 GLU A 23 8.567 4.396 6.940 1.00 0.00 O ATOM 0 H GLU A 23 9.807 3.191 2.325 1.00 0.00 H new ATOM 0 HA GLU A 23 8.113 5.505 2.027 1.00 0.00 H new ATOM 0 HB2 GLU A 23 10.605 5.001 3.701 1.00 0.00 H new ATOM 0 HB3 GLU A 23 9.542 6.384 3.863 1.00 0.00 H new ATOM 0 HG2 GLU A 23 7.730 5.031 4.651 1.00 0.00 H new ATOM 0 HG3 GLU A 23 8.532 3.547 4.175 1.00 0.00 H new ATOM 316 N GLU A 24 11.327 5.747 1.246 1.00 0.00 N ATOM 317 CA GLU A 24 12.279 6.498 0.436 1.00 0.00 C ATOM 318 C GLU A 24 11.668 6.878 -0.910 1.00 0.00 C ATOM 319 O GLU A 24 11.907 7.971 -1.426 1.00 0.00 O ATOM 320 CB GLU A 24 13.553 5.679 0.216 1.00 0.00 C ATOM 321 CG GLU A 24 13.452 4.693 -0.935 1.00 0.00 C ATOM 322 CD GLU A 24 14.793 4.088 -1.304 1.00 0.00 C ATOM 323 OE1 GLU A 24 15.583 4.769 -1.990 1.00 0.00 O ATOM 324 OE2 GLU A 24 15.051 2.933 -0.906 1.00 0.00 O ATOM 0 H GLU A 24 11.743 5.000 1.802 1.00 0.00 H new ATOM 0 HA GLU A 24 12.531 7.413 0.973 1.00 0.00 H new ATOM 0 HB2 GLU A 24 14.384 6.359 0.029 1.00 0.00 H new ATOM 0 HB3 GLU A 24 13.787 5.134 1.131 1.00 0.00 H new ATOM 0 HG2 GLU A 24 12.760 3.895 -0.666 1.00 0.00 H new ATOM 0 HG3 GLU A 24 13.033 5.198 -1.806 1.00 0.00 H new ATOM 331 N LEU A 25 10.878 5.970 -1.472 1.00 0.00 N ATOM 332 CA LEU A 25 10.232 6.209 -2.758 1.00 0.00 C ATOM 333 C LEU A 25 9.195 7.321 -2.648 1.00 0.00 C ATOM 334 O LEU A 25 9.149 8.227 -3.482 1.00 0.00 O ATOM 335 CB LEU A 25 9.570 4.926 -3.264 1.00 0.00 C ATOM 336 CG LEU A 25 10.517 3.810 -3.704 1.00 0.00 C ATOM 337 CD1 LEU A 25 9.819 2.460 -3.638 1.00 0.00 C ATOM 338 CD2 LEU A 25 11.037 4.075 -5.109 1.00 0.00 C ATOM 0 H LEU A 25 10.669 5.062 -1.058 1.00 0.00 H new ATOM 0 HA LEU A 25 10.997 6.521 -3.469 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.926 4.538 -2.475 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.926 5.181 -4.105 1.00 0.00 H new ATOM 0 HG LEU A 25 11.366 3.790 -3.021 1.00 0.00 H new ATOM 0 HD11 LEU A 25 10.509 1.678 -3.955 1.00 0.00 H new ATOM 0 HD12 LEU A 25 9.497 2.267 -2.615 1.00 0.00 H new ATOM 0 HD13 LEU A 25 8.951 2.467 -4.297 1.00 0.00 H new ATOM 0 HD21 LEU A 25 11.710 3.270 -5.406 1.00 0.00 H new ATOM 0 HD22 LEU A 25 10.199 4.122 -5.804 1.00 0.00 H new ATOM 0 HD23 LEU A 25 11.576 5.023 -5.125 1.00 0.00 H new ATOM 350 N LEU A 26 8.365 7.249 -1.613 1.00 0.00 N ATOM 351 CA LEU A 26 7.328 8.251 -1.392 1.00 0.00 C ATOM 352 C LEU A 26 7.943 9.600 -1.031 1.00 0.00 C ATOM 353 O LEU A 26 7.762 10.587 -1.744 1.00 0.00 O ATOM 354 CB LEU A 26 6.380 7.797 -0.281 1.00 0.00 C ATOM 355 CG LEU A 26 5.473 6.612 -0.615 1.00 0.00 C ATOM 356 CD1 LEU A 26 4.984 5.939 0.657 1.00 0.00 C ATOM 357 CD2 LEU A 26 4.297 7.066 -1.467 1.00 0.00 C ATOM 0 H LEU A 26 8.390 6.507 -0.914 1.00 0.00 H new ATOM 0 HA LEU A 26 6.764 8.365 -2.318 1.00 0.00 H new ATOM 0 HB2 LEU A 26 6.976 7.537 0.594 1.00 0.00 H new ATOM 0 HB3 LEU A 26 5.751 8.642 0.001 1.00 0.00 H new ATOM 0 HG LEU A 26 6.051 5.885 -1.186 1.00 0.00 H new ATOM 0 HD11 LEU A 26 4.340 5.098 0.399 1.00 0.00 H new ATOM 0 HD12 LEU A 26 5.839 5.579 1.230 1.00 0.00 H new ATOM 0 HD13 LEU A 26 4.422 6.656 1.255 1.00 0.00 H new ATOM 0 HD21 LEU A 26 3.662 6.210 -1.696 1.00 0.00 H new ATOM 0 HD22 LEU A 26 3.719 7.812 -0.921 1.00 0.00 H new ATOM 0 HD23 LEU A 26 4.667 7.502 -2.395 1.00 0.00 H new ATOM 369 N SER A 27 8.673 9.633 0.079 1.00 0.00 N ATOM 370 CA SER A 27 9.314 10.861 0.536 1.00 0.00 C ATOM 371 C SER A 27 9.865 11.657 -0.644 1.00 0.00 C ATOM 372 O SER A 27 9.764 12.883 -0.680 1.00 0.00 O ATOM 373 CB SER A 27 10.441 10.538 1.519 1.00 0.00 C ATOM 374 OG SER A 27 11.344 9.595 0.967 1.00 0.00 O ATOM 0 H SER A 27 8.835 8.824 0.679 1.00 0.00 H new ATOM 0 HA SER A 27 8.563 11.467 1.042 1.00 0.00 H new ATOM 0 HB2 SER A 27 10.977 11.452 1.776 1.00 0.00 H new ATOM 0 HB3 SER A 27 10.020 10.144 2.444 1.00 0.00 H new ATOM 0 HG SER A 27 10.881 8.743 0.826 1.00 0.00 H new ATOM 380 N ARG A 28 10.448 10.950 -1.606 1.00 0.00 N ATOM 381 CA ARG A 28 11.017 11.589 -2.786 1.00 0.00 C ATOM 382 C ARG A 28 9.930 12.270 -3.613 1.00 0.00 C ATOM 383 O ARG A 28 10.007 13.466 -3.896 1.00 0.00 O ATOM 384 CB ARG A 28 11.755 10.560 -3.644 1.00 0.00 C ATOM 385 CG ARG A 28 13.135 10.204 -3.115 1.00 0.00 C ATOM 386 CD ARG A 28 13.658 8.921 -3.742 1.00 0.00 C ATOM 387 NE ARG A 28 14.988 8.573 -3.249 1.00 0.00 N ATOM 388 CZ ARG A 28 16.100 9.188 -3.639 1.00 0.00 C ATOM 389 NH1 ARG A 28 16.041 10.175 -4.522 1.00 0.00 N ATOM 390 NH2 ARG A 28 17.273 8.814 -3.145 1.00 0.00 N ATOM 0 H ARG A 28 10.539 9.934 -1.591 1.00 0.00 H new ATOM 0 HA ARG A 28 11.725 12.348 -2.451 1.00 0.00 H new ATOM 0 HB2 ARG A 28 11.154 9.653 -3.706 1.00 0.00 H new ATOM 0 HB3 ARG A 28 11.853 10.948 -4.658 1.00 0.00 H new ATOM 0 HG2 ARG A 28 13.827 11.020 -3.323 1.00 0.00 H new ATOM 0 HG3 ARG A 28 13.092 10.090 -2.032 1.00 0.00 H new ATOM 0 HD2 ARG A 28 12.967 8.105 -3.528 1.00 0.00 H new ATOM 0 HD3 ARG A 28 13.691 9.035 -4.826 1.00 0.00 H new ATOM 0 HE ARG A 28 15.068 7.817 -2.569 1.00 0.00 H new ATOM 0 HH11 ARG A 28 15.141 10.464 -4.904 1.00 0.00 H new ATOM 0 HH12 ARG A 28 16.896 10.645 -4.819 1.00 0.00 H new ATOM 0 HH21 ARG A 28 17.322 8.054 -2.466 1.00 0.00 H new ATOM 0 HH22 ARG A 28 18.126 9.286 -3.444 1.00 0.00 H new ATOM 404 N THR A 29 8.917 11.500 -3.998 1.00 0.00 N ATOM 405 CA THR A 29 7.815 12.027 -4.793 1.00 0.00 C ATOM 406 C THR A 29 7.175 13.233 -4.114 1.00 0.00 C ATOM 407 O THR A 29 7.042 14.298 -4.717 1.00 0.00 O ATOM 408 CB THR A 29 6.734 10.956 -5.035 1.00 0.00 C ATOM 409 OG1 THR A 29 7.303 9.832 -5.717 1.00 0.00 O ATOM 410 CG2 THR A 29 5.584 11.523 -5.854 1.00 0.00 C ATOM 0 H THR A 29 8.837 10.509 -3.772 1.00 0.00 H new ATOM 0 HA THR A 29 8.235 12.333 -5.751 1.00 0.00 H new ATOM 0 HB THR A 29 6.347 10.636 -4.067 1.00 0.00 H new ATOM 0 HG1 THR A 29 7.825 9.295 -5.084 1.00 0.00 H new ATOM 0 HG21 THR A 29 4.833 10.749 -6.012 1.00 0.00 H new ATOM 0 HG22 THR A 29 5.135 12.360 -5.320 1.00 0.00 H new ATOM 0 HG23 THR A 29 5.959 11.867 -6.818 1.00 0.00 H new ATOM 418 N GLY A 30 6.782 13.059 -2.856 1.00 0.00 N ATOM 419 CA GLY A 30 6.162 14.143 -2.117 1.00 0.00 C ATOM 420 C GLY A 30 4.937 14.697 -2.818 1.00 0.00 C ATOM 421 O GLY A 30 4.871 15.888 -3.122 1.00 0.00 O ATOM 0 H GLY A 30 6.882 12.187 -2.336 1.00 0.00 H new ATOM 0 HA2 GLY A 30 5.880 13.788 -1.126 1.00 0.00 H new ATOM 0 HA3 GLY A 30 6.888 14.943 -1.974 1.00 0.00 H new ATOM 425 N LYS A 31 3.963 13.830 -3.077 1.00 0.00 N ATOM 426 CA LYS A 31 2.734 14.238 -3.747 1.00 0.00 C ATOM 427 C LYS A 31 1.509 13.765 -2.970 1.00 0.00 C ATOM 428 O LYS A 31 0.972 12.689 -3.234 1.00 0.00 O ATOM 429 CB LYS A 31 2.695 13.678 -5.170 1.00 0.00 C ATOM 430 CG LYS A 31 3.442 14.533 -6.180 1.00 0.00 C ATOM 431 CD LYS A 31 2.834 14.415 -7.568 1.00 0.00 C ATOM 432 CE LYS A 31 3.827 14.817 -8.647 1.00 0.00 C ATOM 433 NZ LYS A 31 3.150 15.125 -9.937 1.00 0.00 N ATOM 0 H LYS A 31 4.001 12.840 -2.833 1.00 0.00 H new ATOM 0 HA LYS A 31 2.717 15.327 -3.791 1.00 0.00 H new ATOM 0 HB2 LYS A 31 3.122 12.675 -5.169 1.00 0.00 H new ATOM 0 HB3 LYS A 31 1.656 13.582 -5.485 1.00 0.00 H new ATOM 0 HG2 LYS A 31 3.423 15.575 -5.861 1.00 0.00 H new ATOM 0 HG3 LYS A 31 4.488 14.229 -6.213 1.00 0.00 H new ATOM 0 HD2 LYS A 31 2.507 13.389 -7.737 1.00 0.00 H new ATOM 0 HD3 LYS A 31 1.948 15.047 -7.633 1.00 0.00 H new ATOM 0 HE2 LYS A 31 4.390 15.689 -8.315 1.00 0.00 H new ATOM 0 HE3 LYS A 31 4.546 14.011 -8.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 3.861 15.395 -10.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 2.633 14.285 -10.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 2.483 15.911 -9.800 1.00 0.00 H new ATOM 447 N ASP A 32 1.071 14.577 -2.014 1.00 0.00 N ATOM 448 CA ASP A 32 -0.093 14.243 -1.201 1.00 0.00 C ATOM 449 C ASP A 32 -1.129 13.483 -2.023 1.00 0.00 C ATOM 450 O ASP A 32 -1.955 14.083 -2.709 1.00 0.00 O ATOM 451 CB ASP A 32 -0.716 15.513 -0.620 1.00 0.00 C ATOM 452 CG ASP A 32 0.057 16.045 0.571 1.00 0.00 C ATOM 453 OD1 ASP A 32 1.300 16.121 0.484 1.00 0.00 O ATOM 454 OD2 ASP A 32 -0.581 16.384 1.590 1.00 0.00 O ATOM 0 H ASP A 32 1.504 15.471 -1.783 1.00 0.00 H new ATOM 0 HA ASP A 32 0.236 13.602 -0.383 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -0.759 16.280 -1.394 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -1.743 15.306 -0.320 1.00 0.00 H new ATOM 459 N GLY A 33 -1.080 12.156 -1.948 1.00 0.00 N ATOM 460 CA GLY A 33 -2.018 11.335 -2.690 1.00 0.00 C ATOM 461 C GLY A 33 -1.372 10.089 -3.263 1.00 0.00 C ATOM 462 O GLY A 33 -2.063 9.156 -3.673 1.00 0.00 O ATOM 0 H GLY A 33 -0.407 11.635 -1.386 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -2.840 11.046 -2.035 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -2.448 11.923 -3.501 1.00 0.00 H new ATOM 466 N SER A 34 -0.043 10.074 -3.294 1.00 0.00 N ATOM 467 CA SER A 34 0.696 8.936 -3.826 1.00 0.00 C ATOM 468 C SER A 34 0.267 7.642 -3.142 1.00 0.00 C ATOM 469 O SER A 34 -0.339 7.663 -2.071 1.00 0.00 O ATOM 470 CB SER A 34 2.200 9.148 -3.644 1.00 0.00 C ATOM 471 OG SER A 34 2.755 9.840 -4.749 1.00 0.00 O ATOM 0 H SER A 34 0.543 10.837 -2.957 1.00 0.00 H new ATOM 0 HA SER A 34 0.474 8.855 -4.890 1.00 0.00 H new ATOM 0 HB2 SER A 34 2.383 9.711 -2.729 1.00 0.00 H new ATOM 0 HB3 SER A 34 2.695 8.184 -3.529 1.00 0.00 H new ATOM 0 HG SER A 34 3.292 10.594 -4.427 1.00 0.00 H new ATOM 477 N PHE A 35 0.586 6.514 -3.770 1.00 0.00 N ATOM 478 CA PHE A 35 0.233 5.209 -3.224 1.00 0.00 C ATOM 479 C PHE A 35 0.990 4.096 -3.943 1.00 0.00 C ATOM 480 O PHE A 35 1.241 4.178 -5.146 1.00 0.00 O ATOM 481 CB PHE A 35 -1.274 4.974 -3.340 1.00 0.00 C ATOM 482 CG PHE A 35 -1.717 4.595 -4.725 1.00 0.00 C ATOM 483 CD1 PHE A 35 -1.886 5.563 -5.702 1.00 0.00 C ATOM 484 CD2 PHE A 35 -1.965 3.271 -5.049 1.00 0.00 C ATOM 485 CE1 PHE A 35 -2.292 5.218 -6.977 1.00 0.00 C ATOM 486 CE2 PHE A 35 -2.371 2.920 -6.322 1.00 0.00 C ATOM 487 CZ PHE A 35 -2.536 3.894 -7.287 1.00 0.00 C ATOM 0 H PHE A 35 1.088 6.478 -4.657 1.00 0.00 H new ATOM 0 HA PHE A 35 0.515 5.195 -2.171 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -1.565 4.186 -2.646 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -1.799 5.879 -3.034 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -1.698 6.600 -5.464 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -1.840 2.505 -4.298 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -2.418 5.982 -7.730 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -2.559 1.884 -6.562 1.00 0.00 H new ATOM 0 HZ PHE A 35 -2.855 3.621 -8.282 1.00 0.00 H new ATOM 497 N LEU A 36 1.350 3.057 -3.198 1.00 0.00 N ATOM 498 CA LEU A 36 2.079 1.927 -3.763 1.00 0.00 C ATOM 499 C LEU A 36 1.725 0.633 -3.037 1.00 0.00 C ATOM 500 O LEU A 36 1.108 0.655 -1.972 1.00 0.00 O ATOM 501 CB LEU A 36 3.586 2.174 -3.683 1.00 0.00 C ATOM 502 CG LEU A 36 4.160 2.373 -2.279 1.00 0.00 C ATOM 503 CD1 LEU A 36 4.552 1.036 -1.669 1.00 0.00 C ATOM 504 CD2 LEU A 36 5.354 3.315 -2.319 1.00 0.00 C ATOM 0 H LEU A 36 1.149 2.974 -2.201 1.00 0.00 H new ATOM 0 HA LEU A 36 1.789 1.827 -4.809 1.00 0.00 H new ATOM 0 HB2 LEU A 36 4.097 1.330 -4.147 1.00 0.00 H new ATOM 0 HB3 LEU A 36 3.822 3.056 -4.279 1.00 0.00 H new ATOM 0 HG LEU A 36 3.390 2.823 -1.652 1.00 0.00 H new ATOM 0 HD11 LEU A 36 4.958 1.197 -0.670 1.00 0.00 H new ATOM 0 HD12 LEU A 36 3.673 0.394 -1.604 1.00 0.00 H new ATOM 0 HD13 LEU A 36 5.306 0.558 -2.295 1.00 0.00 H new ATOM 0 HD21 LEU A 36 5.749 3.445 -1.311 1.00 0.00 H new ATOM 0 HD22 LEU A 36 6.128 2.894 -2.961 1.00 0.00 H new ATOM 0 HD23 LEU A 36 5.042 4.282 -2.713 1.00 0.00 H new ATOM 516 N VAL A 37 2.121 -0.494 -3.620 1.00 0.00 N ATOM 517 CA VAL A 37 1.849 -1.798 -3.027 1.00 0.00 C ATOM 518 C VAL A 37 3.135 -2.595 -2.836 1.00 0.00 C ATOM 519 O VAL A 37 4.091 -2.442 -3.598 1.00 0.00 O ATOM 520 CB VAL A 37 0.875 -2.617 -3.894 1.00 0.00 C ATOM 521 CG1 VAL A 37 0.603 -3.972 -3.258 1.00 0.00 C ATOM 522 CG2 VAL A 37 -0.421 -1.850 -4.108 1.00 0.00 C ATOM 0 H VAL A 37 2.631 -0.530 -4.502 1.00 0.00 H new ATOM 0 HA VAL A 37 1.392 -1.614 -2.055 1.00 0.00 H new ATOM 0 HB VAL A 37 1.336 -2.785 -4.867 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -0.087 -4.536 -3.885 1.00 0.00 H new ATOM 0 HG12 VAL A 37 1.539 -4.523 -3.161 1.00 0.00 H new ATOM 0 HG13 VAL A 37 0.163 -3.829 -2.271 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -1.098 -2.443 -4.723 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -0.888 -1.649 -3.144 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -0.207 -0.907 -4.611 1.00 0.00 H new ATOM 532 N ARG A 38 3.152 -3.445 -1.815 1.00 0.00 N ATOM 533 CA ARG A 38 4.322 -4.266 -1.524 1.00 0.00 C ATOM 534 C ARG A 38 3.910 -5.604 -0.918 1.00 0.00 C ATOM 535 O ARG A 38 2.780 -5.767 -0.458 1.00 0.00 O ATOM 536 CB ARG A 38 5.263 -3.530 -0.569 1.00 0.00 C ATOM 537 CG ARG A 38 4.646 -3.238 0.789 1.00 0.00 C ATOM 538 CD ARG A 38 5.537 -2.331 1.623 1.00 0.00 C ATOM 539 NE ARG A 38 6.492 -3.089 2.427 1.00 0.00 N ATOM 540 CZ ARG A 38 6.186 -3.661 3.586 1.00 0.00 C ATOM 541 NH1 ARG A 38 4.957 -3.562 4.074 1.00 0.00 N ATOM 542 NH2 ARG A 38 7.110 -4.335 4.259 1.00 0.00 N ATOM 0 H ARG A 38 2.370 -3.584 -1.175 1.00 0.00 H new ATOM 0 HA ARG A 38 4.843 -4.457 -2.462 1.00 0.00 H new ATOM 0 HB2 ARG A 38 6.164 -4.127 -0.428 1.00 0.00 H new ATOM 0 HB3 ARG A 38 5.571 -2.591 -1.028 1.00 0.00 H new ATOM 0 HG2 ARG A 38 3.672 -2.768 0.654 1.00 0.00 H new ATOM 0 HG3 ARG A 38 4.477 -4.174 1.322 1.00 0.00 H new ATOM 0 HD2 ARG A 38 6.077 -1.650 0.966 1.00 0.00 H new ATOM 0 HD3 ARG A 38 4.918 -1.718 2.278 1.00 0.00 H new ATOM 0 HE ARG A 38 7.446 -3.184 2.079 1.00 0.00 H new ATOM 0 HH11 ARG A 38 4.244 -3.046 3.559 1.00 0.00 H new ATOM 0 HH12 ARG A 38 4.725 -4.002 4.964 1.00 0.00 H new ATOM 0 HH21 ARG A 38 8.056 -4.414 3.886 1.00 0.00 H new ATOM 0 HH22 ARG A 38 6.874 -4.774 5.149 1.00 0.00 H new ATOM 556 N ALA A 39 4.833 -6.559 -0.923 1.00 0.00 N ATOM 557 CA ALA A 39 4.567 -7.883 -0.373 1.00 0.00 C ATOM 558 C ALA A 39 4.867 -7.927 1.122 1.00 0.00 C ATOM 559 O ALA A 39 6.022 -7.835 1.535 1.00 0.00 O ATOM 560 CB ALA A 39 5.384 -8.935 -1.108 1.00 0.00 C ATOM 0 H ALA A 39 5.773 -6.441 -1.302 1.00 0.00 H new ATOM 0 HA ALA A 39 3.508 -8.100 -0.511 1.00 0.00 H new ATOM 0 HB1 ALA A 39 5.175 -9.918 -0.686 1.00 0.00 H new ATOM 0 HB2 ALA A 39 5.118 -8.929 -2.165 1.00 0.00 H new ATOM 0 HB3 ALA A 39 6.446 -8.712 -1.000 1.00 0.00 H new ATOM 566 N SER A 40 3.819 -8.066 1.927 1.00 0.00 N ATOM 567 CA SER A 40 3.970 -8.118 3.377 1.00 0.00 C ATOM 568 C SER A 40 4.886 -9.267 3.787 1.00 0.00 C ATOM 569 O SER A 40 4.972 -10.282 3.096 1.00 0.00 O ATOM 570 CB SER A 40 2.604 -8.274 4.048 1.00 0.00 C ATOM 571 OG SER A 40 2.026 -7.011 4.329 1.00 0.00 O ATOM 0 H SER A 40 2.856 -8.145 1.600 1.00 0.00 H new ATOM 0 HA SER A 40 4.422 -7.182 3.704 1.00 0.00 H new ATOM 0 HB2 SER A 40 1.940 -8.845 3.399 1.00 0.00 H new ATOM 0 HB3 SER A 40 2.712 -8.842 4.972 1.00 0.00 H new ATOM 0 HG SER A 40 1.153 -7.138 4.756 1.00 0.00 H new ATOM 577 N GLU A 41 5.566 -9.099 4.916 1.00 0.00 N ATOM 578 CA GLU A 41 6.476 -10.122 5.418 1.00 0.00 C ATOM 579 C GLU A 41 5.776 -11.023 6.431 1.00 0.00 C ATOM 580 O GLU A 41 5.706 -12.239 6.253 1.00 0.00 O ATOM 581 CB GLU A 41 7.705 -9.473 6.060 1.00 0.00 C ATOM 582 CG GLU A 41 8.802 -10.463 6.413 1.00 0.00 C ATOM 583 CD GLU A 41 9.662 -9.993 7.569 1.00 0.00 C ATOM 584 OE1 GLU A 41 9.198 -10.076 8.726 1.00 0.00 O ATOM 585 OE2 GLU A 41 10.799 -9.542 7.318 1.00 0.00 O ATOM 0 H GLU A 41 5.504 -8.265 5.500 1.00 0.00 H new ATOM 0 HA GLU A 41 6.796 -10.733 4.574 1.00 0.00 H new ATOM 0 HB2 GLU A 41 8.108 -8.725 5.378 1.00 0.00 H new ATOM 0 HB3 GLU A 41 7.397 -8.947 6.964 1.00 0.00 H new ATOM 0 HG2 GLU A 41 8.352 -11.423 6.667 1.00 0.00 H new ATOM 0 HG3 GLU A 41 9.433 -10.627 5.539 1.00 0.00 H new ATOM 592 N SER A 42 5.259 -10.417 7.496 1.00 0.00 N ATOM 593 CA SER A 42 4.568 -11.165 8.540 1.00 0.00 C ATOM 594 C SER A 42 3.789 -12.334 7.946 1.00 0.00 C ATOM 595 O SER A 42 4.083 -13.496 8.227 1.00 0.00 O ATOM 596 CB SER A 42 3.620 -10.245 9.312 1.00 0.00 C ATOM 597 OG SER A 42 4.327 -9.466 10.262 1.00 0.00 O ATOM 0 H SER A 42 5.306 -9.411 7.658 1.00 0.00 H new ATOM 0 HA SER A 42 5.317 -11.562 9.225 1.00 0.00 H new ATOM 0 HB2 SER A 42 3.097 -9.589 8.616 1.00 0.00 H new ATOM 0 HB3 SER A 42 2.861 -10.842 9.818 1.00 0.00 H new ATOM 0 HG SER A 42 3.699 -8.885 10.741 1.00 0.00 H new ATOM 603 N ILE A 43 2.794 -12.017 7.124 1.00 0.00 N ATOM 604 CA ILE A 43 1.973 -13.040 6.489 1.00 0.00 C ATOM 605 C ILE A 43 2.348 -13.214 5.022 1.00 0.00 C ATOM 606 O ILE A 43 2.692 -12.249 4.340 1.00 0.00 O ATOM 607 CB ILE A 43 0.474 -12.700 6.588 1.00 0.00 C ATOM 608 CG1 ILE A 43 -0.025 -12.904 8.020 1.00 0.00 C ATOM 609 CG2 ILE A 43 -0.328 -13.553 5.616 1.00 0.00 C ATOM 610 CD1 ILE A 43 0.246 -11.725 8.928 1.00 0.00 C ATOM 0 H ILE A 43 2.537 -11.060 6.882 1.00 0.00 H new ATOM 0 HA ILE A 43 2.162 -13.972 7.022 1.00 0.00 H new ATOM 0 HB ILE A 43 0.336 -11.652 6.321 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -1.098 -13.097 7.998 1.00 0.00 H new ATOM 0 HG13 ILE A 43 0.450 -13.791 8.439 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -1.385 -13.301 5.698 1.00 0.00 H new ATOM 0 HG22 ILE A 43 0.013 -13.363 4.598 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -0.187 -14.607 5.855 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -0.135 -11.940 9.927 1.00 0.00 H new ATOM 0 HD12 ILE A 43 1.320 -11.545 8.980 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -0.252 -10.839 8.533 1.00 0.00 H new ATOM 622 N SER A 44 2.276 -14.451 4.541 1.00 0.00 N ATOM 623 CA SER A 44 2.610 -14.753 3.154 1.00 0.00 C ATOM 624 C SER A 44 1.519 -14.252 2.211 1.00 0.00 C ATOM 625 O SER A 44 1.748 -13.354 1.401 1.00 0.00 O ATOM 626 CB SER A 44 2.807 -16.259 2.970 1.00 0.00 C ATOM 627 OG SER A 44 3.740 -16.529 1.938 1.00 0.00 O ATOM 0 H SER A 44 1.989 -15.260 5.091 1.00 0.00 H new ATOM 0 HA SER A 44 3.541 -14.240 2.911 1.00 0.00 H new ATOM 0 HB2 SER A 44 3.155 -16.700 3.904 1.00 0.00 H new ATOM 0 HB3 SER A 44 1.852 -16.728 2.733 1.00 0.00 H new ATOM 0 HG SER A 44 3.850 -17.498 1.841 1.00 0.00 H new ATOM 633 N ARG A 45 0.333 -14.840 2.324 1.00 0.00 N ATOM 634 CA ARG A 45 -0.793 -14.456 1.482 1.00 0.00 C ATOM 635 C ARG A 45 -1.373 -13.116 1.927 1.00 0.00 C ATOM 636 O ARG A 45 -2.481 -13.053 2.457 1.00 0.00 O ATOM 637 CB ARG A 45 -1.880 -15.532 1.524 1.00 0.00 C ATOM 638 CG ARG A 45 -1.544 -16.769 0.706 1.00 0.00 C ATOM 639 CD ARG A 45 -0.802 -17.803 1.539 1.00 0.00 C ATOM 640 NE ARG A 45 -0.458 -18.988 0.759 1.00 0.00 N ATOM 641 CZ ARG A 45 0.633 -19.082 0.006 1.00 0.00 C ATOM 642 NH1 ARG A 45 1.480 -18.065 -0.069 1.00 0.00 N ATOM 643 NH2 ARG A 45 0.877 -20.194 -0.675 1.00 0.00 N ATOM 0 H ARG A 45 0.127 -15.584 2.990 1.00 0.00 H new ATOM 0 HA ARG A 45 -0.430 -14.355 0.459 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -2.048 -15.826 2.560 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -2.814 -15.107 1.158 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -2.462 -17.207 0.313 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -0.934 -16.485 -0.151 1.00 0.00 H new ATOM 0 HD2 ARG A 45 0.107 -17.358 1.943 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -1.419 -18.095 2.389 1.00 0.00 H new ATOM 0 HE ARG A 45 -1.090 -19.788 0.794 1.00 0.00 H new ATOM 0 HH11 ARG A 45 1.295 -17.208 0.452 1.00 0.00 H new ATOM 0 HH12 ARG A 45 2.317 -18.140 -0.648 1.00 0.00 H new ATOM 0 HH21 ARG A 45 0.227 -20.978 -0.621 1.00 0.00 H new ATOM 0 HH22 ARG A 45 1.715 -20.265 -1.253 1.00 0.00 H new ATOM 657 N ALA A 46 -0.614 -12.047 1.708 1.00 0.00 N ATOM 658 CA ALA A 46 -1.052 -10.709 2.085 1.00 0.00 C ATOM 659 C ALA A 46 -0.266 -9.642 1.331 1.00 0.00 C ATOM 660 O ALA A 46 0.619 -9.955 0.534 1.00 0.00 O ATOM 661 CB ALA A 46 -0.909 -10.510 3.587 1.00 0.00 C ATOM 0 H ALA A 46 0.307 -12.082 1.271 1.00 0.00 H new ATOM 0 HA ALA A 46 -2.103 -10.608 1.815 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.240 -9.506 3.854 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.520 -11.245 4.111 1.00 0.00 H new ATOM 0 HB3 ALA A 46 0.135 -10.636 3.873 1.00 0.00 H new ATOM 667 N TYR A 47 -0.595 -8.380 1.587 1.00 0.00 N ATOM 668 CA TYR A 47 0.078 -7.267 0.930 1.00 0.00 C ATOM 669 C TYR A 47 0.011 -6.007 1.788 1.00 0.00 C ATOM 670 O TYR A 47 -0.580 -6.008 2.867 1.00 0.00 O ATOM 671 CB TYR A 47 -0.551 -6.999 -0.439 1.00 0.00 C ATOM 672 CG TYR A 47 -0.068 -7.939 -1.521 1.00 0.00 C ATOM 673 CD1 TYR A 47 -0.669 -9.177 -1.711 1.00 0.00 C ATOM 674 CD2 TYR A 47 0.989 -7.589 -2.351 1.00 0.00 C ATOM 675 CE1 TYR A 47 -0.231 -10.039 -2.698 1.00 0.00 C ATOM 676 CE2 TYR A 47 1.433 -8.444 -3.342 1.00 0.00 C ATOM 677 CZ TYR A 47 0.820 -9.668 -3.511 1.00 0.00 C ATOM 678 OH TYR A 47 1.260 -10.523 -4.495 1.00 0.00 O ATOM 0 H TYR A 47 -1.324 -8.103 2.245 1.00 0.00 H new ATOM 0 HA TYR A 47 1.125 -7.538 0.795 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -1.635 -7.082 -0.354 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -0.332 -5.973 -0.736 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -1.492 -9.471 -1.077 1.00 0.00 H new ATOM 0 HD2 TYR A 47 1.472 -6.632 -2.220 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -0.709 -10.998 -2.832 1.00 0.00 H new ATOM 0 HE2 TYR A 47 2.255 -8.155 -3.980 1.00 0.00 H new ATOM 0 HH TYR A 47 2.006 -10.110 -4.978 1.00 0.00 H new ATOM 688 N ALA A 48 0.621 -4.932 1.298 1.00 0.00 N ATOM 689 CA ALA A 48 0.628 -3.664 2.017 1.00 0.00 C ATOM 690 C ALA A 48 0.465 -2.489 1.059 1.00 0.00 C ATOM 691 O ALA A 48 1.349 -2.207 0.249 1.00 0.00 O ATOM 692 CB ALA A 48 1.914 -3.520 2.818 1.00 0.00 C ATOM 0 H ALA A 48 1.116 -4.914 0.407 1.00 0.00 H new ATOM 0 HA ALA A 48 -0.218 -3.659 2.704 1.00 0.00 H new ATOM 0 HB1 ALA A 48 1.907 -2.569 3.350 1.00 0.00 H new ATOM 0 HB2 ALA A 48 1.989 -4.337 3.536 1.00 0.00 H new ATOM 0 HB3 ALA A 48 2.769 -3.551 2.142 1.00 0.00 H new ATOM 698 N LEU A 49 -0.671 -1.807 1.156 1.00 0.00 N ATOM 699 CA LEU A 49 -0.951 -0.662 0.297 1.00 0.00 C ATOM 700 C LEU A 49 -0.623 0.646 1.009 1.00 0.00 C ATOM 701 O LEU A 49 -1.453 1.194 1.736 1.00 0.00 O ATOM 702 CB LEU A 49 -2.420 -0.668 -0.132 1.00 0.00 C ATOM 703 CG LEU A 49 -2.950 0.636 -0.729 1.00 0.00 C ATOM 704 CD1 LEU A 49 -2.339 0.883 -2.099 1.00 0.00 C ATOM 705 CD2 LEU A 49 -4.469 0.603 -0.818 1.00 0.00 C ATOM 0 H LEU A 49 -1.413 -2.027 1.821 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.320 -0.741 -0.588 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -2.561 -1.463 -0.864 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -3.030 -0.922 0.735 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.662 1.457 -0.073 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -2.728 1.815 -2.508 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.255 0.951 -2.007 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -2.595 0.059 -2.766 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -4.829 1.539 -1.245 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -4.778 -0.228 -1.452 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -4.889 0.474 0.179 1.00 0.00 H new ATOM 717 N CYS A 50 0.591 1.142 0.795 1.00 0.00 N ATOM 718 CA CYS A 50 1.029 2.387 1.415 1.00 0.00 C ATOM 719 C CYS A 50 0.405 3.592 0.717 1.00 0.00 C ATOM 720 O CYS A 50 0.182 3.574 -0.494 1.00 0.00 O ATOM 721 CB CYS A 50 2.554 2.493 1.375 1.00 0.00 C ATOM 722 SG CYS A 50 3.407 1.223 2.338 1.00 0.00 S ATOM 0 H CYS A 50 1.289 0.701 0.197 1.00 0.00 H new ATOM 0 HA CYS A 50 0.700 2.381 2.454 1.00 0.00 H new ATOM 0 HB2 CYS A 50 2.885 2.431 0.338 1.00 0.00 H new ATOM 0 HB3 CYS A 50 2.849 3.475 1.746 1.00 0.00 H new ATOM 0 HG CYS A 50 4.692 1.394 2.241 1.00 0.00 H new ATOM 728 N VAL A 51 0.123 4.637 1.489 1.00 0.00 N ATOM 729 CA VAL A 51 -0.476 5.850 0.945 1.00 0.00 C ATOM 730 C VAL A 51 0.106 7.094 1.607 1.00 0.00 C ATOM 731 O VAL A 51 0.012 7.266 2.823 1.00 0.00 O ATOM 732 CB VAL A 51 -2.005 5.851 1.129 1.00 0.00 C ATOM 733 CG1 VAL A 51 -2.608 7.132 0.573 1.00 0.00 C ATOM 734 CG2 VAL A 51 -2.622 4.630 0.465 1.00 0.00 C ATOM 0 H VAL A 51 0.300 4.668 2.493 1.00 0.00 H new ATOM 0 HA VAL A 51 -0.246 5.868 -0.120 1.00 0.00 H new ATOM 0 HB VAL A 51 -2.226 5.806 2.196 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -3.689 7.115 0.712 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -2.188 7.990 1.098 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -2.380 7.210 -0.490 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -3.703 4.647 0.605 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -2.394 4.641 -0.601 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -2.212 3.725 0.914 1.00 0.00 H new ATOM 744 N LEU A 52 0.707 7.960 0.799 1.00 0.00 N ATOM 745 CA LEU A 52 1.305 9.191 1.305 1.00 0.00 C ATOM 746 C LEU A 52 0.239 10.256 1.541 1.00 0.00 C ATOM 747 O LEU A 52 -0.572 10.543 0.661 1.00 0.00 O ATOM 748 CB LEU A 52 2.355 9.712 0.323 1.00 0.00 C ATOM 749 CG LEU A 52 3.363 10.714 0.888 1.00 0.00 C ATOM 750 CD1 LEU A 52 4.270 10.042 1.908 1.00 0.00 C ATOM 751 CD2 LEU A 52 4.185 11.333 -0.233 1.00 0.00 C ATOM 0 H LEU A 52 0.793 7.833 -0.209 1.00 0.00 H new ATOM 0 HA LEU A 52 1.787 8.968 2.257 1.00 0.00 H new ATOM 0 HB2 LEU A 52 2.905 8.860 -0.076 1.00 0.00 H new ATOM 0 HB3 LEU A 52 1.839 10.180 -0.516 1.00 0.00 H new ATOM 0 HG LEU A 52 2.813 11.510 1.390 1.00 0.00 H new ATOM 0 HD11 LEU A 52 4.980 10.770 2.299 1.00 0.00 H new ATOM 0 HD12 LEU A 52 3.668 9.647 2.726 1.00 0.00 H new ATOM 0 HD13 LEU A 52 4.813 9.226 1.431 1.00 0.00 H new ATOM 0 HD21 LEU A 52 4.897 12.043 0.187 1.00 0.00 H new ATOM 0 HD22 LEU A 52 4.725 10.549 -0.764 1.00 0.00 H new ATOM 0 HD23 LEU A 52 3.523 11.851 -0.927 1.00 0.00 H new ATOM 763 N TYR A 53 0.249 10.841 2.734 1.00 0.00 N ATOM 764 CA TYR A 53 -0.717 11.875 3.086 1.00 0.00 C ATOM 765 C TYR A 53 -0.183 12.759 4.209 1.00 0.00 C ATOM 766 O TYR A 53 0.139 12.276 5.295 1.00 0.00 O ATOM 767 CB TYR A 53 -2.043 11.241 3.508 1.00 0.00 C ATOM 768 CG TYR A 53 -3.110 12.251 3.867 1.00 0.00 C ATOM 769 CD1 TYR A 53 -3.861 12.878 2.880 1.00 0.00 C ATOM 770 CD2 TYR A 53 -3.366 12.580 5.192 1.00 0.00 C ATOM 771 CE1 TYR A 53 -4.836 13.802 3.203 1.00 0.00 C ATOM 772 CE2 TYR A 53 -4.340 13.501 5.524 1.00 0.00 C ATOM 773 CZ TYR A 53 -5.072 14.109 4.526 1.00 0.00 C ATOM 774 OH TYR A 53 -6.042 15.029 4.853 1.00 0.00 O ATOM 0 H TYR A 53 0.915 10.617 3.473 1.00 0.00 H new ATOM 0 HA TYR A 53 -0.883 12.497 2.206 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -2.409 10.611 2.697 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -1.868 10.590 4.364 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -3.679 12.639 1.843 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -2.793 12.107 5.976 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -5.410 14.281 2.424 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -4.527 13.744 6.560 1.00 0.00 H new ATOM 0 HH TYR A 53 -6.082 15.130 5.827 1.00 0.00 H new ATOM 784 N ARG A 54 -0.092 14.057 3.939 1.00 0.00 N ATOM 785 CA ARG A 54 0.402 15.010 4.925 1.00 0.00 C ATOM 786 C ARG A 54 1.733 14.546 5.510 1.00 0.00 C ATOM 787 O ARG A 54 1.932 14.574 6.724 1.00 0.00 O ATOM 788 CB ARG A 54 -0.623 15.196 6.046 1.00 0.00 C ATOM 789 CG ARG A 54 -1.894 15.899 5.598 1.00 0.00 C ATOM 790 CD ARG A 54 -2.523 16.689 6.734 1.00 0.00 C ATOM 791 NE ARG A 54 -3.753 17.358 6.320 1.00 0.00 N ATOM 792 CZ ARG A 54 -4.256 18.422 6.938 1.00 0.00 C ATOM 793 NH1 ARG A 54 -3.636 18.934 7.993 1.00 0.00 N ATOM 794 NH2 ARG A 54 -5.380 18.975 6.502 1.00 0.00 N ATOM 0 H ARG A 54 -0.354 14.473 3.045 1.00 0.00 H new ATOM 0 HA ARG A 54 0.558 15.965 4.423 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -0.883 14.220 6.455 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -0.166 15.769 6.853 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -1.667 16.569 4.769 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -2.607 15.163 5.227 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -2.737 16.019 7.566 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -1.812 17.431 7.097 1.00 0.00 H new ATOM 0 HE ARG A 54 -4.254 16.989 5.512 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -2.772 18.511 8.331 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -4.024 19.750 8.466 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -5.860 18.584 5.691 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -5.765 19.791 6.977 1.00 0.00 H new ATOM 808 N ASN A 55 2.640 14.117 4.638 1.00 0.00 N ATOM 809 CA ASN A 55 3.951 13.645 5.069 1.00 0.00 C ATOM 810 C ASN A 55 3.819 12.424 5.974 1.00 0.00 C ATOM 811 O ASN A 55 4.559 12.278 6.948 1.00 0.00 O ATOM 812 CB ASN A 55 4.702 14.759 5.801 1.00 0.00 C ATOM 813 CG ASN A 55 6.185 14.471 5.925 1.00 0.00 C ATOM 814 OD1 ASN A 55 6.603 13.314 5.975 1.00 0.00 O ATOM 815 ND2 ASN A 55 6.990 15.526 5.975 1.00 0.00 N ATOM 0 H ASN A 55 2.491 14.087 3.629 1.00 0.00 H new ATOM 0 HA ASN A 55 4.516 13.358 4.182 1.00 0.00 H new ATOM 0 HB2 ASN A 55 4.561 15.700 5.269 1.00 0.00 H new ATOM 0 HB3 ASN A 55 4.275 14.888 6.796 1.00 0.00 H new ATOM 0 HD21 ASN A 55 7.998 15.395 6.058 1.00 0.00 H new ATOM 0 HD22 ASN A 55 6.600 16.468 5.930 1.00 0.00 H new ATOM 822 N CYS A 56 2.873 11.551 5.647 1.00 0.00 N ATOM 823 CA CYS A 56 2.644 10.342 6.430 1.00 0.00 C ATOM 824 C CYS A 56 2.378 9.147 5.521 1.00 0.00 C ATOM 825 O CYS A 56 1.740 9.277 4.477 1.00 0.00 O ATOM 826 CB CYS A 56 1.466 10.544 7.385 1.00 0.00 C ATOM 827 SG CYS A 56 1.383 9.330 8.722 1.00 0.00 S ATOM 0 H CYS A 56 2.252 11.658 4.845 1.00 0.00 H new ATOM 0 HA CYS A 56 3.544 10.139 7.011 1.00 0.00 H new ATOM 0 HB2 CYS A 56 1.531 11.542 7.818 1.00 0.00 H new ATOM 0 HB3 CYS A 56 0.538 10.504 6.814 1.00 0.00 H new ATOM 0 HG CYS A 56 0.356 9.585 9.477 1.00 0.00 H new ATOM 833 N VAL A 57 2.874 7.981 5.925 1.00 0.00 N ATOM 834 CA VAL A 57 2.691 6.762 5.146 1.00 0.00 C ATOM 835 C VAL A 57 1.687 5.829 5.814 1.00 0.00 C ATOM 836 O VAL A 57 2.025 5.100 6.746 1.00 0.00 O ATOM 837 CB VAL A 57 4.023 6.013 4.956 1.00 0.00 C ATOM 838 CG1 VAL A 57 3.779 4.631 4.369 1.00 0.00 C ATOM 839 CG2 VAL A 57 4.965 6.817 4.073 1.00 0.00 C ATOM 0 H VAL A 57 3.405 7.855 6.787 1.00 0.00 H new ATOM 0 HA VAL A 57 2.310 7.063 4.170 1.00 0.00 H new ATOM 0 HB VAL A 57 4.493 5.890 5.932 1.00 0.00 H new ATOM 0 HG11 VAL A 57 4.731 4.116 4.242 1.00 0.00 H new ATOM 0 HG12 VAL A 57 3.143 4.057 5.043 1.00 0.00 H new ATOM 0 HG13 VAL A 57 3.287 4.728 3.401 1.00 0.00 H new ATOM 0 HG21 VAL A 57 5.901 6.273 3.949 1.00 0.00 H new ATOM 0 HG22 VAL A 57 4.505 6.973 3.097 1.00 0.00 H new ATOM 0 HG23 VAL A 57 5.165 7.782 4.538 1.00 0.00 H new ATOM 849 N TYR A 58 0.450 5.858 5.330 1.00 0.00 N ATOM 850 CA TYR A 58 -0.605 5.016 5.881 1.00 0.00 C ATOM 851 C TYR A 58 -0.509 3.594 5.336 1.00 0.00 C ATOM 852 O TYR A 58 -1.086 3.274 4.296 1.00 0.00 O ATOM 853 CB TYR A 58 -1.979 5.606 5.557 1.00 0.00 C ATOM 854 CG TYR A 58 -2.294 6.866 6.331 1.00 0.00 C ATOM 855 CD1 TYR A 58 -1.638 8.058 6.052 1.00 0.00 C ATOM 856 CD2 TYR A 58 -3.248 6.864 7.341 1.00 0.00 C ATOM 857 CE1 TYR A 58 -1.922 9.212 6.757 1.00 0.00 C ATOM 858 CE2 TYR A 58 -3.540 8.013 8.050 1.00 0.00 C ATOM 859 CZ TYR A 58 -2.874 9.184 7.755 1.00 0.00 C ATOM 860 OH TYR A 58 -3.161 10.331 8.460 1.00 0.00 O ATOM 0 H TYR A 58 0.154 6.455 4.558 1.00 0.00 H new ATOM 0 HA TYR A 58 -0.478 4.980 6.963 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -2.030 5.823 4.490 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -2.745 4.859 5.767 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -0.893 8.083 5.270 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -3.770 5.948 7.576 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -1.402 10.130 6.528 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -4.286 7.994 8.831 1.00 0.00 H new ATOM 0 HH TYR A 58 -3.854 10.141 9.126 1.00 0.00 H new ATOM 870 N THR A 59 0.225 2.743 6.046 1.00 0.00 N ATOM 871 CA THR A 59 0.399 1.356 5.635 1.00 0.00 C ATOM 872 C THR A 59 -0.878 0.553 5.855 1.00 0.00 C ATOM 873 O THR A 59 -1.332 0.388 6.988 1.00 0.00 O ATOM 874 CB THR A 59 1.553 0.683 6.402 1.00 0.00 C ATOM 875 OG1 THR A 59 2.737 1.484 6.308 1.00 0.00 O ATOM 876 CG2 THR A 59 1.831 -0.707 5.851 1.00 0.00 C ATOM 0 H THR A 59 0.709 2.991 6.909 1.00 0.00 H new ATOM 0 HA THR A 59 0.638 1.369 4.572 1.00 0.00 H new ATOM 0 HB THR A 59 1.259 0.590 7.448 1.00 0.00 H new ATOM 0 HG1 THR A 59 3.465 1.050 6.800 1.00 0.00 H new ATOM 0 HG21 THR A 59 2.650 -1.162 6.408 1.00 0.00 H new ATOM 0 HG22 THR A 59 0.937 -1.323 5.950 1.00 0.00 H new ATOM 0 HG23 THR A 59 2.105 -0.633 4.799 1.00 0.00 H new ATOM 884 N TYR A 60 -1.453 0.055 4.766 1.00 0.00 N ATOM 885 CA TYR A 60 -2.679 -0.729 4.840 1.00 0.00 C ATOM 886 C TYR A 60 -2.405 -2.199 4.538 1.00 0.00 C ATOM 887 O TYR A 60 -1.937 -2.544 3.453 1.00 0.00 O ATOM 888 CB TYR A 60 -3.720 -0.182 3.862 1.00 0.00 C ATOM 889 CG TYR A 60 -4.417 1.066 4.356 1.00 0.00 C ATOM 890 CD1 TYR A 60 -5.322 1.010 5.408 1.00 0.00 C ATOM 891 CD2 TYR A 60 -4.169 2.302 3.770 1.00 0.00 C ATOM 892 CE1 TYR A 60 -5.962 2.148 5.861 1.00 0.00 C ATOM 893 CE2 TYR A 60 -4.803 3.445 4.218 1.00 0.00 C ATOM 894 CZ TYR A 60 -5.698 3.363 5.263 1.00 0.00 C ATOM 895 OH TYR A 60 -6.332 4.498 5.713 1.00 0.00 O ATOM 0 H TYR A 60 -1.089 0.181 3.821 1.00 0.00 H new ATOM 0 HA TYR A 60 -3.068 -0.651 5.855 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -3.234 0.036 2.911 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -4.466 -0.953 3.670 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -5.529 0.061 5.880 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -3.469 2.370 2.951 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -6.665 2.087 6.679 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -4.598 4.398 3.752 1.00 0.00 H new ATOM 0 HH TYR A 60 -5.872 5.290 5.364 1.00 0.00 H new ATOM 905 N ARG A 61 -2.701 -3.061 5.506 1.00 0.00 N ATOM 906 CA ARG A 61 -2.486 -4.494 5.344 1.00 0.00 C ATOM 907 C ARG A 61 -3.681 -5.149 4.659 1.00 0.00 C ATOM 908 O ARG A 61 -4.802 -5.106 5.168 1.00 0.00 O ATOM 909 CB ARG A 61 -2.241 -5.151 6.704 1.00 0.00 C ATOM 910 CG ARG A 61 -3.365 -4.922 7.702 1.00 0.00 C ATOM 911 CD ARG A 61 -3.077 -5.602 9.031 1.00 0.00 C ATOM 912 NE ARG A 61 -4.097 -5.303 10.032 1.00 0.00 N ATOM 913 CZ ARG A 61 -4.001 -5.658 11.308 1.00 0.00 C ATOM 914 NH1 ARG A 61 -2.936 -6.322 11.737 1.00 0.00 N ATOM 915 NH2 ARG A 61 -4.971 -5.349 12.159 1.00 0.00 N ATOM 0 H ARG A 61 -3.090 -2.792 6.410 1.00 0.00 H new ATOM 0 HA ARG A 61 -1.607 -4.635 4.716 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -2.106 -6.223 6.561 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -1.311 -4.766 7.122 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -3.499 -3.852 7.861 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -4.300 -5.303 7.292 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -3.021 -6.680 8.882 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -2.103 -5.280 9.399 1.00 0.00 H new ATOM 0 HE ARG A 61 -4.929 -4.793 9.735 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -2.188 -6.561 11.086 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -2.865 -6.593 12.718 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -5.792 -4.838 11.833 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -4.896 -5.622 13.139 1.00 0.00 H new ATOM 929 N ILE A 62 -3.435 -5.755 3.502 1.00 0.00 N ATOM 930 CA ILE A 62 -4.490 -6.419 2.748 1.00 0.00 C ATOM 931 C ILE A 62 -4.536 -7.910 3.063 1.00 0.00 C ATOM 932 O ILE A 62 -3.691 -8.679 2.604 1.00 0.00 O ATOM 933 CB ILE A 62 -4.301 -6.232 1.231 1.00 0.00 C ATOM 934 CG1 ILE A 62 -4.407 -4.751 0.860 1.00 0.00 C ATOM 935 CG2 ILE A 62 -5.330 -7.051 0.464 1.00 0.00 C ATOM 936 CD1 ILE A 62 -3.089 -4.014 0.936 1.00 0.00 C ATOM 0 H ILE A 62 -2.514 -5.799 3.067 1.00 0.00 H new ATOM 0 HA ILE A 62 -5.431 -5.957 3.048 1.00 0.00 H new ATOM 0 HB ILE A 62 -3.307 -6.585 0.957 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -4.804 -4.666 -0.152 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -5.123 -4.268 1.525 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -5.184 -6.908 -0.607 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -5.211 -8.106 0.709 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -6.333 -6.725 0.740 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -3.239 -2.970 0.660 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.700 -4.068 1.953 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -2.376 -4.472 0.250 1.00 0.00 H new ATOM 948 N LEU A 63 -5.530 -8.313 3.848 1.00 0.00 N ATOM 949 CA LEU A 63 -5.689 -9.714 4.224 1.00 0.00 C ATOM 950 C LEU A 63 -6.722 -10.401 3.338 1.00 0.00 C ATOM 951 O LEU A 63 -7.807 -9.876 3.084 1.00 0.00 O ATOM 952 CB LEU A 63 -6.104 -9.824 5.692 1.00 0.00 C ATOM 953 CG LEU A 63 -5.038 -9.447 6.721 1.00 0.00 C ATOM 954 CD1 LEU A 63 -3.876 -10.428 6.671 1.00 0.00 C ATOM 955 CD2 LEU A 63 -4.548 -8.025 6.485 1.00 0.00 C ATOM 0 H LEU A 63 -6.238 -7.689 4.236 1.00 0.00 H new ATOM 0 HA LEU A 63 -4.730 -10.213 4.086 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -6.975 -9.188 5.851 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -6.419 -10.850 5.884 1.00 0.00 H new ATOM 0 HG LEU A 63 -5.486 -9.496 7.714 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -3.127 -10.143 7.410 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.238 -11.433 6.890 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -3.429 -10.412 5.677 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -3.790 -7.774 7.227 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -4.118 -7.949 5.486 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -5.385 -7.332 6.573 1.00 0.00 H new ATOM 967 N PRO A 64 -6.382 -11.606 2.856 1.00 0.00 N ATOM 968 CA PRO A 64 -7.268 -12.393 1.994 1.00 0.00 C ATOM 969 C PRO A 64 -8.482 -12.928 2.745 1.00 0.00 C ATOM 970 O PRO A 64 -8.410 -13.212 3.939 1.00 0.00 O ATOM 971 CB PRO A 64 -6.376 -13.547 1.528 1.00 0.00 C ATOM 972 CG PRO A 64 -5.344 -13.682 2.593 1.00 0.00 C ATOM 973 CD PRO A 64 -5.105 -12.293 3.117 1.00 0.00 C ATOM 0 HA PRO A 64 -7.678 -11.797 1.179 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -6.948 -14.468 1.412 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -5.921 -13.330 0.561 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -5.687 -14.345 3.387 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -4.425 -14.112 2.194 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -4.862 -12.300 4.180 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -4.275 -11.807 2.604 1.00 0.00 H new ATOM 981 N ASN A 65 -9.598 -13.063 2.035 1.00 0.00 N ATOM 982 CA ASN A 65 -10.829 -13.565 2.636 1.00 0.00 C ATOM 983 C ASN A 65 -10.984 -15.062 2.391 1.00 0.00 C ATOM 984 O ASN A 65 -10.092 -15.705 1.838 1.00 0.00 O ATOM 985 CB ASN A 65 -12.039 -12.817 2.070 1.00 0.00 C ATOM 986 CG ASN A 65 -12.428 -13.308 0.689 1.00 0.00 C ATOM 987 OD1 ASN A 65 -11.649 -13.984 0.016 1.00 0.00 O ATOM 988 ND2 ASN A 65 -13.637 -12.969 0.259 1.00 0.00 N ATOM 0 H ASN A 65 -9.675 -12.832 1.044 1.00 0.00 H new ATOM 0 HA ASN A 65 -10.774 -13.395 3.711 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -12.885 -12.936 2.747 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -11.815 -11.751 2.024 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -13.953 -13.270 -0.663 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -14.250 -12.407 0.850 1.00 0.00 H new ATOM 995 N GLU A 66 -12.121 -15.611 2.807 1.00 0.00 N ATOM 996 CA GLU A 66 -12.391 -17.033 2.632 1.00 0.00 C ATOM 997 C GLU A 66 -12.254 -17.437 1.167 1.00 0.00 C ATOM 998 O GLU A 66 -12.036 -18.608 0.853 1.00 0.00 O ATOM 999 CB GLU A 66 -13.795 -17.374 3.138 1.00 0.00 C ATOM 1000 CG GLU A 66 -14.898 -16.598 2.438 1.00 0.00 C ATOM 1001 CD GLU A 66 -16.250 -17.276 2.552 1.00 0.00 C ATOM 1002 OE1 GLU A 66 -16.902 -17.124 3.607 1.00 0.00 O ATOM 1003 OE2 GLU A 66 -16.656 -17.957 1.588 1.00 0.00 O ATOM 0 H GLU A 66 -12.869 -15.093 3.267 1.00 0.00 H new ATOM 0 HA GLU A 66 -11.657 -17.590 3.214 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -13.971 -18.441 3.004 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -13.845 -17.175 4.208 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -14.960 -15.597 2.865 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -14.642 -16.480 1.385 1.00 0.00 H new ATOM 1010 N ASP A 67 -12.384 -16.461 0.276 1.00 0.00 N ATOM 1011 CA ASP A 67 -12.274 -16.714 -1.156 1.00 0.00 C ATOM 1012 C ASP A 67 -10.909 -16.279 -1.682 1.00 0.00 C ATOM 1013 O ASP A 67 -10.757 -15.975 -2.865 1.00 0.00 O ATOM 1014 CB ASP A 67 -13.383 -15.980 -1.912 1.00 0.00 C ATOM 1015 CG ASP A 67 -14.760 -16.277 -1.351 1.00 0.00 C ATOM 1016 OD1 ASP A 67 -15.102 -17.471 -1.220 1.00 0.00 O ATOM 1017 OD2 ASP A 67 -15.496 -15.315 -1.044 1.00 0.00 O ATOM 0 H ASP A 67 -12.566 -15.487 0.520 1.00 0.00 H new ATOM 0 HA ASP A 67 -12.381 -17.786 -1.320 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -13.200 -14.906 -1.868 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -13.353 -16.266 -2.963 1.00 0.00 H new ATOM 1022 N ASP A 68 -9.921 -16.250 -0.794 1.00 0.00 N ATOM 1023 CA ASP A 68 -8.569 -15.852 -1.169 1.00 0.00 C ATOM 1024 C ASP A 68 -8.590 -14.578 -2.007 1.00 0.00 C ATOM 1025 O ASP A 68 -7.777 -14.406 -2.916 1.00 0.00 O ATOM 1026 CB ASP A 68 -7.880 -16.976 -1.943 1.00 0.00 C ATOM 1027 CG ASP A 68 -7.988 -18.315 -1.240 1.00 0.00 C ATOM 1028 OD1 ASP A 68 -9.005 -19.011 -1.444 1.00 0.00 O ATOM 1029 OD2 ASP A 68 -7.058 -18.666 -0.485 1.00 0.00 O ATOM 0 H ASP A 68 -10.031 -16.497 0.190 1.00 0.00 H new ATOM 0 HA ASP A 68 -8.008 -15.654 -0.255 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -8.323 -17.054 -2.936 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -6.828 -16.726 -2.082 1.00 0.00 H new ATOM 1034 N LYS A 69 -9.526 -13.688 -1.698 1.00 0.00 N ATOM 1035 CA LYS A 69 -9.655 -12.429 -2.423 1.00 0.00 C ATOM 1036 C LYS A 69 -8.659 -11.397 -1.902 1.00 0.00 C ATOM 1037 O LYS A 69 -7.822 -11.702 -1.051 1.00 0.00 O ATOM 1038 CB LYS A 69 -11.080 -11.886 -2.296 1.00 0.00 C ATOM 1039 CG LYS A 69 -12.141 -12.832 -2.831 1.00 0.00 C ATOM 1040 CD LYS A 69 -12.459 -12.545 -4.289 1.00 0.00 C ATOM 1041 CE LYS A 69 -11.615 -13.399 -5.223 1.00 0.00 C ATOM 1042 NZ LYS A 69 -11.994 -14.837 -5.154 1.00 0.00 N ATOM 0 H LYS A 69 -10.207 -13.815 -0.950 1.00 0.00 H new ATOM 0 HA LYS A 69 -9.438 -12.621 -3.474 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -11.288 -11.676 -1.247 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -11.148 -10.938 -2.830 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -11.797 -13.861 -2.728 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -13.048 -12.738 -2.234 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -13.516 -12.735 -4.476 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -12.283 -11.490 -4.500 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -11.731 -13.042 -6.246 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -10.562 -13.288 -4.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -11.691 -15.318 -6.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -11.530 -15.279 -4.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -13.026 -14.920 -5.054 1.00 0.00 H new ATOM 1056 N PHE A 70 -8.755 -10.176 -2.416 1.00 0.00 N ATOM 1057 CA PHE A 70 -7.863 -9.099 -2.002 1.00 0.00 C ATOM 1058 C PHE A 70 -8.655 -7.917 -1.453 1.00 0.00 C ATOM 1059 O PHE A 70 -9.246 -7.145 -2.209 1.00 0.00 O ATOM 1060 CB PHE A 70 -6.997 -8.645 -3.179 1.00 0.00 C ATOM 1061 CG PHE A 70 -5.849 -9.568 -3.471 1.00 0.00 C ATOM 1062 CD1 PHE A 70 -4.728 -9.580 -2.657 1.00 0.00 C ATOM 1063 CD2 PHE A 70 -5.892 -10.426 -4.559 1.00 0.00 C ATOM 1064 CE1 PHE A 70 -3.670 -10.428 -2.924 1.00 0.00 C ATOM 1065 CE2 PHE A 70 -4.837 -11.277 -4.831 1.00 0.00 C ATOM 1066 CZ PHE A 70 -3.725 -11.278 -4.011 1.00 0.00 C ATOM 0 H PHE A 70 -9.442 -9.907 -3.120 1.00 0.00 H new ATOM 0 HA PHE A 70 -7.218 -9.480 -1.210 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -7.622 -8.563 -4.068 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -6.607 -7.649 -2.970 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -4.680 -8.919 -1.804 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -6.760 -10.430 -5.202 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -2.801 -10.426 -2.283 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -4.882 -11.940 -5.683 1.00 0.00 H new ATOM 0 HZ PHE A 70 -2.900 -11.943 -4.220 1.00 0.00 H new ATOM 1076 N THR A 71 -8.664 -7.782 -0.130 1.00 0.00 N ATOM 1077 CA THR A 71 -9.385 -6.696 0.522 1.00 0.00 C ATOM 1078 C THR A 71 -8.542 -6.059 1.621 1.00 0.00 C ATOM 1079 O THR A 71 -7.783 -6.741 2.310 1.00 0.00 O ATOM 1080 CB THR A 71 -10.713 -7.187 1.129 1.00 0.00 C ATOM 1081 OG1 THR A 71 -11.363 -6.114 1.819 1.00 0.00 O ATOM 1082 CG2 THR A 71 -10.474 -8.344 2.088 1.00 0.00 C ATOM 0 H THR A 71 -8.180 -8.411 0.510 1.00 0.00 H new ATOM 0 HA THR A 71 -9.599 -5.953 -0.246 1.00 0.00 H new ATOM 0 HB THR A 71 -11.352 -7.535 0.317 1.00 0.00 H new ATOM 0 HG1 THR A 71 -12.240 -5.949 1.415 1.00 0.00 H new ATOM 0 HG21 THR A 71 -11.426 -8.674 2.504 1.00 0.00 H new ATOM 0 HG22 THR A 71 -10.006 -9.170 1.552 1.00 0.00 H new ATOM 0 HG23 THR A 71 -9.818 -8.018 2.895 1.00 0.00 H new ATOM 1090 N VAL A 72 -8.681 -4.747 1.781 1.00 0.00 N ATOM 1091 CA VAL A 72 -7.933 -4.017 2.799 1.00 0.00 C ATOM 1092 C VAL A 72 -8.489 -4.292 4.192 1.00 0.00 C ATOM 1093 O VAL A 72 -7.810 -4.075 5.195 1.00 0.00 O ATOM 1094 CB VAL A 72 -7.962 -2.500 2.537 1.00 0.00 C ATOM 1095 CG1 VAL A 72 -7.140 -1.762 3.582 1.00 0.00 C ATOM 1096 CG2 VAL A 72 -7.457 -2.192 1.135 1.00 0.00 C ATOM 0 H VAL A 72 -9.304 -4.167 1.219 1.00 0.00 H new ATOM 0 HA VAL A 72 -6.902 -4.367 2.747 1.00 0.00 H new ATOM 0 HB VAL A 72 -8.994 -2.156 2.611 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -7.172 -0.691 3.381 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -7.551 -1.957 4.573 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -6.107 -2.108 3.543 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -7.484 -1.115 0.967 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -6.433 -2.550 1.030 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -8.092 -2.690 0.402 1.00 0.00 H new ATOM 1106 N GLN A 73 -9.728 -4.771 4.245 1.00 0.00 N ATOM 1107 CA GLN A 73 -10.375 -5.075 5.515 1.00 0.00 C ATOM 1108 C GLN A 73 -10.409 -3.845 6.417 1.00 0.00 C ATOM 1109 O GLN A 73 -10.450 -3.962 7.641 1.00 0.00 O ATOM 1110 CB GLN A 73 -9.647 -6.220 6.222 1.00 0.00 C ATOM 1111 CG GLN A 73 -9.618 -7.510 5.418 1.00 0.00 C ATOM 1112 CD GLN A 73 -10.807 -8.404 5.707 1.00 0.00 C ATOM 1113 OE1 GLN A 73 -11.916 -7.924 5.945 1.00 0.00 O ATOM 1114 NE2 GLN A 73 -10.583 -9.713 5.688 1.00 0.00 N ATOM 0 H GLN A 73 -10.303 -4.957 3.423 1.00 0.00 H new ATOM 0 HA GLN A 73 -11.401 -5.380 5.307 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -8.624 -5.912 6.436 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -10.130 -6.410 7.181 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -9.598 -7.271 4.355 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -8.698 -8.052 5.640 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -9.648 -10.068 5.486 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -11.346 -10.364 5.875 1.00 0.00 H new ATOM 1123 N ALA A 74 -10.392 -2.667 5.803 1.00 0.00 N ATOM 1124 CA ALA A 74 -10.423 -1.415 6.550 1.00 0.00 C ATOM 1125 C ALA A 74 -11.564 -1.408 7.562 1.00 0.00 C ATOM 1126 O ALA A 74 -12.455 -2.256 7.514 1.00 0.00 O ATOM 1127 CB ALA A 74 -10.552 -0.235 5.599 1.00 0.00 C ATOM 0 H ALA A 74 -10.357 -2.553 4.790 1.00 0.00 H new ATOM 0 HA ALA A 74 -9.485 -1.325 7.098 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -10.574 0.693 6.171 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.701 -0.222 4.918 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -11.474 -0.329 5.025 1.00 0.00 H new ATOM 1133 N SER A 75 -11.529 -0.446 8.479 1.00 0.00 N ATOM 1134 CA SER A 75 -12.558 -0.332 9.506 1.00 0.00 C ATOM 1135 C SER A 75 -13.735 0.500 9.005 1.00 0.00 C ATOM 1136 O SER A 75 -14.880 0.049 9.026 1.00 0.00 O ATOM 1137 CB SER A 75 -11.977 0.298 10.773 1.00 0.00 C ATOM 1138 OG SER A 75 -11.356 -0.679 11.589 1.00 0.00 O ATOM 0 H SER A 75 -10.800 0.265 8.532 1.00 0.00 H new ATOM 0 HA SER A 75 -12.916 -1.335 9.739 1.00 0.00 H new ATOM 0 HB2 SER A 75 -11.251 1.065 10.502 1.00 0.00 H new ATOM 0 HB3 SER A 75 -12.770 0.794 11.333 1.00 0.00 H new ATOM 0 HG SER A 75 -10.991 -0.251 12.392 1.00 0.00 H new ATOM 1144 N GLU A 76 -13.444 1.716 8.555 1.00 0.00 N ATOM 1145 CA GLU A 76 -14.478 2.611 8.050 1.00 0.00 C ATOM 1146 C GLU A 76 -15.438 1.867 7.127 1.00 0.00 C ATOM 1147 O GLU A 76 -15.023 1.032 6.324 1.00 0.00 O ATOM 1148 CB GLU A 76 -13.845 3.788 7.304 1.00 0.00 C ATOM 1149 CG GLU A 76 -13.105 3.381 6.040 1.00 0.00 C ATOM 1150 CD GLU A 76 -14.037 3.161 4.864 1.00 0.00 C ATOM 1151 OE1 GLU A 76 -14.914 4.020 4.632 1.00 0.00 O ATOM 1152 OE2 GLU A 76 -13.889 2.130 4.175 1.00 0.00 O ATOM 0 H GLU A 76 -12.501 2.104 8.530 1.00 0.00 H new ATOM 0 HA GLU A 76 -15.042 2.991 8.902 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -14.625 4.504 7.044 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -13.152 4.300 7.972 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -12.379 4.153 5.784 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -12.544 2.466 6.230 1.00 0.00 H new ATOM 1159 N GLY A 77 -16.726 2.177 7.247 1.00 0.00 N ATOM 1160 CA GLY A 77 -17.725 1.528 6.419 1.00 0.00 C ATOM 1161 C GLY A 77 -17.924 0.070 6.784 1.00 0.00 C ATOM 1162 O GLY A 77 -16.959 -0.686 6.892 1.00 0.00 O ATOM 0 H GLY A 77 -17.095 2.866 7.903 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -18.673 2.057 6.518 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -17.428 1.600 5.373 1.00 0.00 H new ATOM 1166 N VAL A 78 -19.178 -0.325 6.975 1.00 0.00 N ATOM 1167 CA VAL A 78 -19.500 -1.702 7.330 1.00 0.00 C ATOM 1168 C VAL A 78 -19.480 -2.605 6.102 1.00 0.00 C ATOM 1169 O VAL A 78 -18.968 -3.724 6.149 1.00 0.00 O ATOM 1170 CB VAL A 78 -20.882 -1.800 8.003 1.00 0.00 C ATOM 1171 CG1 VAL A 78 -21.973 -1.328 7.054 1.00 0.00 C ATOM 1172 CG2 VAL A 78 -21.147 -3.223 8.469 1.00 0.00 C ATOM 0 H VAL A 78 -19.988 0.289 6.890 1.00 0.00 H new ATOM 0 HA VAL A 78 -18.737 -2.034 8.034 1.00 0.00 H new ATOM 0 HB VAL A 78 -20.889 -1.149 8.877 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -22.942 -1.405 7.547 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -21.789 -0.291 6.775 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -21.971 -1.950 6.159 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -22.128 -3.274 8.942 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -21.122 -3.897 7.613 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -20.382 -3.519 9.187 1.00 0.00 H new ATOM 1182 N SER A 79 -20.041 -2.112 5.002 1.00 0.00 N ATOM 1183 CA SER A 79 -20.091 -2.876 3.761 1.00 0.00 C ATOM 1184 C SER A 79 -18.765 -3.587 3.507 1.00 0.00 C ATOM 1185 O SER A 79 -17.695 -2.995 3.644 1.00 0.00 O ATOM 1186 CB SER A 79 -20.423 -1.957 2.584 1.00 0.00 C ATOM 1187 OG SER A 79 -19.543 -0.847 2.540 1.00 0.00 O ATOM 0 H SER A 79 -20.467 -1.187 4.945 1.00 0.00 H new ATOM 0 HA SER A 79 -20.874 -3.628 3.858 1.00 0.00 H new ATOM 0 HB2 SER A 79 -20.355 -2.517 1.651 1.00 0.00 H new ATOM 0 HB3 SER A 79 -21.451 -1.607 2.671 1.00 0.00 H new ATOM 0 HG SER A 79 -19.775 -0.276 1.778 1.00 0.00 H new ATOM 1193 N MET A 80 -18.846 -4.861 3.136 1.00 0.00 N ATOM 1194 CA MET A 80 -17.653 -5.653 2.862 1.00 0.00 C ATOM 1195 C MET A 80 -17.611 -6.085 1.399 1.00 0.00 C ATOM 1196 O MET A 80 -18.615 -6.538 0.848 1.00 0.00 O ATOM 1197 CB MET A 80 -17.611 -6.883 3.770 1.00 0.00 C ATOM 1198 CG MET A 80 -16.208 -7.422 4.000 1.00 0.00 C ATOM 1199 SD MET A 80 -15.181 -6.295 4.963 1.00 0.00 S ATOM 1200 CE MET A 80 -14.200 -5.541 3.667 1.00 0.00 C ATOM 0 H MET A 80 -19.724 -5.366 3.018 1.00 0.00 H new ATOM 0 HA MET A 80 -16.781 -5.031 3.064 1.00 0.00 H new ATOM 0 HB2 MET A 80 -18.056 -6.629 4.732 1.00 0.00 H new ATOM 0 HB3 MET A 80 -18.226 -7.669 3.332 1.00 0.00 H new ATOM 0 HG2 MET A 80 -16.271 -8.380 4.515 1.00 0.00 H new ATOM 0 HG3 MET A 80 -15.732 -7.608 3.037 1.00 0.00 H new ATOM 0 HE1 MET A 80 -13.168 -5.441 4.003 1.00 0.00 H new ATOM 0 HE2 MET A 80 -14.232 -6.167 2.776 1.00 0.00 H new ATOM 0 HE3 MET A 80 -14.603 -4.556 3.432 1.00 0.00 H new ATOM 1210 N ARG A 81 -16.446 -5.942 0.777 1.00 0.00 N ATOM 1211 CA ARG A 81 -16.275 -6.317 -0.622 1.00 0.00 C ATOM 1212 C ARG A 81 -15.016 -7.157 -0.810 1.00 0.00 C ATOM 1213 O ARG A 81 -14.139 -7.183 0.054 1.00 0.00 O ATOM 1214 CB ARG A 81 -16.203 -5.067 -1.501 1.00 0.00 C ATOM 1215 CG ARG A 81 -17.562 -4.456 -1.804 1.00 0.00 C ATOM 1216 CD ARG A 81 -17.566 -3.747 -3.149 1.00 0.00 C ATOM 1217 NE ARG A 81 -18.882 -3.205 -3.478 1.00 0.00 N ATOM 1218 CZ ARG A 81 -19.907 -3.953 -3.871 1.00 0.00 C ATOM 1219 NH1 ARG A 81 -19.769 -5.267 -3.982 1.00 0.00 N ATOM 1220 NH2 ARG A 81 -21.074 -3.387 -4.152 1.00 0.00 N ATOM 0 H ARG A 81 -15.606 -5.569 1.219 1.00 0.00 H new ATOM 0 HA ARG A 81 -17.137 -6.914 -0.920 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -15.581 -4.321 -1.007 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -15.711 -5.321 -2.440 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -18.322 -5.237 -1.801 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -17.828 -3.749 -1.018 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -16.834 -2.939 -3.135 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -17.256 -4.444 -3.927 1.00 0.00 H new ATOM 0 HE ARG A 81 -19.021 -2.197 -3.402 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -18.874 -5.706 -3.765 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -20.558 -5.839 -4.284 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -21.185 -2.377 -4.066 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -21.860 -3.962 -4.454 1.00 0.00 H new ATOM 1234 N PHE A 82 -14.934 -7.845 -1.945 1.00 0.00 N ATOM 1235 CA PHE A 82 -13.783 -8.688 -2.246 1.00 0.00 C ATOM 1236 C PHE A 82 -13.500 -8.707 -3.745 1.00 0.00 C ATOM 1237 O PHE A 82 -14.406 -8.898 -4.557 1.00 0.00 O ATOM 1238 CB PHE A 82 -14.023 -10.113 -1.743 1.00 0.00 C ATOM 1239 CG PHE A 82 -14.500 -10.174 -0.320 1.00 0.00 C ATOM 1240 CD1 PHE A 82 -13.599 -10.120 0.730 1.00 0.00 C ATOM 1241 CD2 PHE A 82 -15.851 -10.286 -0.033 1.00 0.00 C ATOM 1242 CE1 PHE A 82 -14.035 -10.176 2.041 1.00 0.00 C ATOM 1243 CE2 PHE A 82 -16.294 -10.341 1.275 1.00 0.00 C ATOM 1244 CZ PHE A 82 -15.384 -10.288 2.313 1.00 0.00 C ATOM 0 H PHE A 82 -15.651 -7.835 -2.671 1.00 0.00 H new ATOM 0 HA PHE A 82 -12.915 -8.271 -1.736 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -14.758 -10.597 -2.385 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -13.098 -10.682 -1.832 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -12.543 -10.033 0.522 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -16.566 -10.331 -0.841 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -13.322 -10.132 2.851 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -17.350 -10.425 1.485 1.00 0.00 H new ATOM 0 HZ PHE A 82 -15.727 -10.334 3.336 1.00 0.00 H new ATOM 1254 N PHE A 83 -12.237 -8.506 -4.105 1.00 0.00 N ATOM 1255 CA PHE A 83 -11.834 -8.498 -5.507 1.00 0.00 C ATOM 1256 C PHE A 83 -10.896 -9.663 -5.809 1.00 0.00 C ATOM 1257 O PHE A 83 -10.262 -10.216 -4.909 1.00 0.00 O ATOM 1258 CB PHE A 83 -11.150 -7.174 -5.855 1.00 0.00 C ATOM 1259 CG PHE A 83 -11.956 -5.965 -5.474 1.00 0.00 C ATOM 1260 CD1 PHE A 83 -11.957 -5.500 -4.169 1.00 0.00 C ATOM 1261 CD2 PHE A 83 -12.712 -5.294 -6.421 1.00 0.00 C ATOM 1262 CE1 PHE A 83 -12.697 -4.387 -3.815 1.00 0.00 C ATOM 1263 CE2 PHE A 83 -13.454 -4.180 -6.074 1.00 0.00 C ATOM 1264 CZ PHE A 83 -13.447 -3.727 -4.769 1.00 0.00 C ATOM 0 H PHE A 83 -11.475 -8.347 -3.446 1.00 0.00 H new ATOM 0 HA PHE A 83 -12.730 -8.608 -6.118 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -10.184 -7.130 -5.352 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -10.953 -7.147 -6.927 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -11.373 -6.013 -3.419 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -12.722 -5.645 -7.442 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -12.689 -4.034 -2.794 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -14.038 -3.665 -6.822 1.00 0.00 H new ATOM 0 HZ PHE A 83 -14.027 -2.858 -4.495 1.00 0.00 H new ATOM 1274 N THR A 84 -10.812 -10.031 -7.084 1.00 0.00 N ATOM 1275 CA THR A 84 -9.954 -11.131 -7.507 1.00 0.00 C ATOM 1276 C THR A 84 -8.549 -10.637 -7.835 1.00 0.00 C ATOM 1277 O THR A 84 -7.562 -11.137 -7.294 1.00 0.00 O ATOM 1278 CB THR A 84 -10.532 -11.854 -8.738 1.00 0.00 C ATOM 1279 OG1 THR A 84 -11.832 -12.373 -8.435 1.00 0.00 O ATOM 1280 CG2 THR A 84 -9.618 -12.987 -9.179 1.00 0.00 C ATOM 0 H THR A 84 -11.328 -9.583 -7.841 1.00 0.00 H new ATOM 0 HA THR A 84 -9.905 -11.832 -6.674 1.00 0.00 H new ATOM 0 HB THR A 84 -10.609 -11.134 -9.552 1.00 0.00 H new ATOM 0 HG1 THR A 84 -12.194 -12.830 -9.223 1.00 0.00 H new ATOM 0 HG21 THR A 84 -10.047 -13.483 -10.050 1.00 0.00 H new ATOM 0 HG22 THR A 84 -8.638 -12.585 -9.437 1.00 0.00 H new ATOM 0 HG23 THR A 84 -9.513 -13.707 -8.367 1.00 0.00 H new ATOM 1288 N LYS A 85 -8.466 -9.653 -8.723 1.00 0.00 N ATOM 1289 CA LYS A 85 -7.182 -9.089 -9.123 1.00 0.00 C ATOM 1290 C LYS A 85 -6.836 -7.869 -8.276 1.00 0.00 C ATOM 1291 O LYS A 85 -7.681 -7.005 -8.040 1.00 0.00 O ATOM 1292 CB LYS A 85 -7.209 -8.704 -10.604 1.00 0.00 C ATOM 1293 CG LYS A 85 -7.890 -9.735 -11.488 1.00 0.00 C ATOM 1294 CD LYS A 85 -7.354 -9.692 -12.909 1.00 0.00 C ATOM 1295 CE LYS A 85 -8.211 -10.522 -13.853 1.00 0.00 C ATOM 1296 NZ LYS A 85 -7.738 -11.932 -13.935 1.00 0.00 N ATOM 0 H LYS A 85 -9.273 -9.229 -9.180 1.00 0.00 H new ATOM 0 HA LYS A 85 -6.416 -9.848 -8.965 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -7.722 -7.748 -10.713 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -6.186 -8.558 -10.952 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -7.738 -10.730 -11.071 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -8.965 -9.554 -11.498 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -7.324 -8.659 -13.256 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -6.329 -10.064 -12.924 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -9.247 -10.505 -13.513 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -8.194 -10.075 -14.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -8.347 -12.465 -14.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -6.758 -11.950 -14.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -7.778 -12.367 -12.991 1.00 0.00 H new ATOM 1310 N LEU A 86 -5.589 -7.803 -7.822 1.00 0.00 N ATOM 1311 CA LEU A 86 -5.131 -6.687 -7.002 1.00 0.00 C ATOM 1312 C LEU A 86 -5.465 -5.353 -7.662 1.00 0.00 C ATOM 1313 O LEU A 86 -6.010 -4.453 -7.024 1.00 0.00 O ATOM 1314 CB LEU A 86 -3.623 -6.788 -6.765 1.00 0.00 C ATOM 1315 CG LEU A 86 -3.114 -6.230 -5.435 1.00 0.00 C ATOM 1316 CD1 LEU A 86 -3.580 -4.795 -5.246 1.00 0.00 C ATOM 1317 CD2 LEU A 86 -3.580 -7.101 -4.278 1.00 0.00 C ATOM 0 H LEU A 86 -4.877 -8.509 -8.008 1.00 0.00 H new ATOM 0 HA LEU A 86 -5.648 -6.737 -6.044 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -3.335 -7.837 -6.830 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -3.112 -6.266 -7.574 1.00 0.00 H new ATOM 0 HG LEU A 86 -2.024 -6.237 -5.453 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.209 -4.414 -4.295 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -3.196 -4.178 -6.058 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -4.670 -4.763 -5.249 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -3.209 -6.689 -3.340 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -4.670 -7.126 -4.257 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.196 -8.113 -4.407 1.00 0.00 H new ATOM 1329 N ASP A 87 -5.137 -5.235 -8.944 1.00 0.00 N ATOM 1330 CA ASP A 87 -5.405 -4.012 -9.692 1.00 0.00 C ATOM 1331 C ASP A 87 -6.878 -3.628 -9.595 1.00 0.00 C ATOM 1332 O ASP A 87 -7.213 -2.516 -9.188 1.00 0.00 O ATOM 1333 CB ASP A 87 -5.007 -4.188 -11.158 1.00 0.00 C ATOM 1334 CG ASP A 87 -5.425 -3.012 -12.017 1.00 0.00 C ATOM 1335 OD1 ASP A 87 -5.507 -1.886 -11.482 1.00 0.00 O ATOM 1336 OD2 ASP A 87 -5.672 -3.216 -13.224 1.00 0.00 O ATOM 0 H ASP A 87 -4.685 -5.971 -9.487 1.00 0.00 H new ATOM 0 HA ASP A 87 -4.809 -3.210 -9.256 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -3.927 -4.317 -11.225 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -5.462 -5.099 -11.548 1.00 0.00 H new ATOM 1341 N GLN A 88 -7.753 -4.555 -9.972 1.00 0.00 N ATOM 1342 CA GLN A 88 -9.190 -4.312 -9.929 1.00 0.00 C ATOM 1343 C GLN A 88 -9.576 -3.556 -8.662 1.00 0.00 C ATOM 1344 O GLN A 88 -10.461 -2.700 -8.682 1.00 0.00 O ATOM 1345 CB GLN A 88 -9.954 -5.635 -10.002 1.00 0.00 C ATOM 1346 CG GLN A 88 -10.209 -6.113 -11.422 1.00 0.00 C ATOM 1347 CD GLN A 88 -11.172 -7.282 -11.480 1.00 0.00 C ATOM 1348 OE1 GLN A 88 -11.793 -7.640 -10.479 1.00 0.00 O ATOM 1349 NE2 GLN A 88 -11.301 -7.885 -12.656 1.00 0.00 N ATOM 0 H GLN A 88 -7.492 -5.481 -10.311 1.00 0.00 H new ATOM 0 HA GLN A 88 -9.456 -3.699 -10.790 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -9.392 -6.400 -9.466 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -10.909 -5.522 -9.489 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -10.608 -5.289 -12.013 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -9.263 -6.403 -11.879 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -10.767 -7.555 -13.460 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -11.934 -8.678 -12.756 1.00 0.00 H new ATOM 1358 N LEU A 89 -8.907 -3.878 -7.560 1.00 0.00 N ATOM 1359 CA LEU A 89 -9.181 -3.230 -6.282 1.00 0.00 C ATOM 1360 C LEU A 89 -8.686 -1.787 -6.287 1.00 0.00 C ATOM 1361 O LEU A 89 -9.389 -0.879 -5.843 1.00 0.00 O ATOM 1362 CB LEU A 89 -8.517 -4.005 -5.142 1.00 0.00 C ATOM 1363 CG LEU A 89 -8.615 -3.372 -3.754 1.00 0.00 C ATOM 1364 CD1 LEU A 89 -8.578 -4.443 -2.675 1.00 0.00 C ATOM 1365 CD2 LEU A 89 -7.494 -2.364 -3.547 1.00 0.00 C ATOM 0 H LEU A 89 -8.171 -4.584 -7.526 1.00 0.00 H new ATOM 0 HA LEU A 89 -10.260 -3.225 -6.129 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -8.962 -4.999 -5.098 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -7.463 -4.138 -5.385 1.00 0.00 H new ATOM 0 HG LEU A 89 -9.567 -2.846 -3.682 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -8.649 -3.974 -1.694 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -9.416 -5.126 -2.812 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -7.642 -4.998 -2.745 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -7.580 -1.923 -2.554 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -6.531 -2.867 -3.639 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -7.567 -1.579 -4.300 1.00 0.00 H new ATOM 1377 N ILE A 90 -7.475 -1.584 -6.793 1.00 0.00 N ATOM 1378 CA ILE A 90 -6.888 -0.251 -6.858 1.00 0.00 C ATOM 1379 C ILE A 90 -7.849 0.741 -7.504 1.00 0.00 C ATOM 1380 O ILE A 90 -7.950 1.890 -7.076 1.00 0.00 O ATOM 1381 CB ILE A 90 -5.566 -0.256 -7.648 1.00 0.00 C ATOM 1382 CG1 ILE A 90 -4.596 -1.280 -7.054 1.00 0.00 C ATOM 1383 CG2 ILE A 90 -4.944 1.133 -7.649 1.00 0.00 C ATOM 1384 CD1 ILE A 90 -4.163 -0.954 -5.642 1.00 0.00 C ATOM 0 H ILE A 90 -6.881 -2.325 -7.164 1.00 0.00 H new ATOM 0 HA ILE A 90 -6.687 0.056 -5.832 1.00 0.00 H new ATOM 0 HB ILE A 90 -5.777 -0.539 -8.679 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -5.067 -2.263 -7.063 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -3.713 -1.344 -7.690 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -4.010 1.113 -8.211 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -5.632 1.839 -8.113 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -4.743 1.443 -6.623 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -3.477 -1.722 -5.285 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -3.662 0.014 -5.629 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -5.037 -0.919 -4.992 1.00 0.00 H new ATOM 1396 N GLU A 91 -8.555 0.288 -8.536 1.00 0.00 N ATOM 1397 CA GLU A 91 -9.509 1.137 -9.239 1.00 0.00 C ATOM 1398 C GLU A 91 -10.700 1.474 -8.346 1.00 0.00 C ATOM 1399 O GLU A 91 -11.207 2.595 -8.366 1.00 0.00 O ATOM 1400 CB GLU A 91 -9.995 0.447 -10.516 1.00 0.00 C ATOM 1401 CG GLU A 91 -8.910 0.276 -11.566 1.00 0.00 C ATOM 1402 CD GLU A 91 -9.430 -0.349 -12.846 1.00 0.00 C ATOM 1403 OE1 GLU A 91 -10.061 -1.423 -12.767 1.00 0.00 O ATOM 1404 OE2 GLU A 91 -9.205 0.236 -13.926 1.00 0.00 O ATOM 0 H GLU A 91 -8.484 -0.661 -8.903 1.00 0.00 H new ATOM 0 HA GLU A 91 -9.003 2.065 -9.505 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -10.398 -0.533 -10.259 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -10.814 1.026 -10.943 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -8.472 1.248 -11.793 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -8.112 -0.346 -11.160 1.00 0.00 H new ATOM 1411 N PHE A 92 -11.141 0.494 -7.564 1.00 0.00 N ATOM 1412 CA PHE A 92 -12.273 0.685 -6.664 1.00 0.00 C ATOM 1413 C PHE A 92 -11.940 1.709 -5.582 1.00 0.00 C ATOM 1414 O PHE A 92 -12.795 2.495 -5.172 1.00 0.00 O ATOM 1415 CB PHE A 92 -12.669 -0.645 -6.020 1.00 0.00 C ATOM 1416 CG PHE A 92 -13.925 -0.562 -5.200 1.00 0.00 C ATOM 1417 CD1 PHE A 92 -13.907 0.003 -3.935 1.00 0.00 C ATOM 1418 CD2 PHE A 92 -15.124 -1.050 -5.695 1.00 0.00 C ATOM 1419 CE1 PHE A 92 -15.062 0.079 -3.179 1.00 0.00 C ATOM 1420 CE2 PHE A 92 -16.282 -0.976 -4.944 1.00 0.00 C ATOM 1421 CZ PHE A 92 -16.250 -0.410 -3.684 1.00 0.00 C ATOM 0 H PHE A 92 -10.732 -0.440 -7.535 1.00 0.00 H new ATOM 0 HA PHE A 92 -13.112 1.061 -7.249 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -12.803 -1.393 -6.802 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -11.852 -0.990 -5.386 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -12.981 0.388 -3.535 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -15.154 -1.493 -6.679 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -15.035 0.521 -2.194 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -17.210 -1.360 -5.341 1.00 0.00 H new ATOM 0 HZ PHE A 92 -17.153 -0.350 -3.095 1.00 0.00 H new ATOM 1431 N TYR A 93 -10.694 1.692 -5.123 1.00 0.00 N ATOM 1432 CA TYR A 93 -10.248 2.615 -4.087 1.00 0.00 C ATOM 1433 C TYR A 93 -9.721 3.909 -4.700 1.00 0.00 C ATOM 1434 O TYR A 93 -8.765 4.503 -4.201 1.00 0.00 O ATOM 1435 CB TYR A 93 -9.162 1.966 -3.228 1.00 0.00 C ATOM 1436 CG TYR A 93 -9.685 0.890 -2.302 1.00 0.00 C ATOM 1437 CD1 TYR A 93 -10.266 -0.266 -2.806 1.00 0.00 C ATOM 1438 CD2 TYR A 93 -9.598 1.032 -0.922 1.00 0.00 C ATOM 1439 CE1 TYR A 93 -10.746 -1.251 -1.964 1.00 0.00 C ATOM 1440 CE2 TYR A 93 -10.074 0.052 -0.073 1.00 0.00 C ATOM 1441 CZ TYR A 93 -10.647 -1.087 -0.598 1.00 0.00 C ATOM 1442 OH TYR A 93 -11.122 -2.066 0.244 1.00 0.00 O ATOM 0 H TYR A 93 -9.974 1.049 -5.452 1.00 0.00 H new ATOM 0 HA TYR A 93 -11.105 2.855 -3.457 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -8.403 1.534 -3.881 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -8.671 2.737 -2.635 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -10.344 -0.398 -3.875 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -9.151 1.923 -0.507 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -11.196 -2.144 -2.373 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -9.998 0.177 0.997 1.00 0.00 H new ATOM 0 HH TYR A 93 -10.975 -1.797 1.175 1.00 0.00 H new ATOM 1452 N LYS A 94 -10.353 4.342 -5.786 1.00 0.00 N ATOM 1453 CA LYS A 94 -9.951 5.566 -6.468 1.00 0.00 C ATOM 1454 C LYS A 94 -10.760 6.758 -5.968 1.00 0.00 C ATOM 1455 O LYS A 94 -10.257 7.880 -5.904 1.00 0.00 O ATOM 1456 CB LYS A 94 -10.129 5.413 -7.981 1.00 0.00 C ATOM 1457 CG LYS A 94 -9.074 4.536 -8.632 1.00 0.00 C ATOM 1458 CD LYS A 94 -7.677 5.097 -8.425 1.00 0.00 C ATOM 1459 CE LYS A 94 -6.677 4.469 -9.383 1.00 0.00 C ATOM 1460 NZ LYS A 94 -6.907 3.007 -9.545 1.00 0.00 N ATOM 0 H LYS A 94 -11.146 3.863 -6.213 1.00 0.00 H new ATOM 0 HA LYS A 94 -8.899 5.746 -6.248 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -11.114 4.992 -8.182 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -10.104 6.400 -8.443 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -9.128 3.530 -8.216 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -9.278 4.451 -9.699 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -7.692 6.177 -8.570 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -7.360 4.918 -7.398 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -6.749 4.958 -10.355 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -5.665 4.639 -9.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -5.997 2.527 -9.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -7.359 2.630 -8.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -7.526 2.842 -10.364 1.00 0.00 H new ATOM 1474 N LYS A 95 -12.016 6.509 -5.614 1.00 0.00 N ATOM 1475 CA LYS A 95 -12.895 7.560 -5.117 1.00 0.00 C ATOM 1476 C LYS A 95 -12.273 8.267 -3.917 1.00 0.00 C ATOM 1477 O LYS A 95 -11.229 7.853 -3.414 1.00 0.00 O ATOM 1478 CB LYS A 95 -14.255 6.976 -4.729 1.00 0.00 C ATOM 1479 CG LYS A 95 -15.237 6.900 -5.886 1.00 0.00 C ATOM 1480 CD LYS A 95 -15.689 8.283 -6.324 1.00 0.00 C ATOM 1481 CE LYS A 95 -16.677 8.207 -7.478 1.00 0.00 C ATOM 1482 NZ LYS A 95 -18.039 7.819 -7.018 1.00 0.00 N ATOM 0 H LYS A 95 -12.449 5.587 -5.662 1.00 0.00 H new ATOM 0 HA LYS A 95 -13.034 8.289 -5.915 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -14.109 5.976 -4.321 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -14.689 7.584 -3.935 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -14.772 6.385 -6.726 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -16.104 6.309 -5.591 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -16.150 8.800 -5.482 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -14.822 8.872 -6.624 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -16.725 9.174 -7.979 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -16.322 7.484 -8.213 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -18.683 7.778 -7.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -17.999 6.885 -6.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -18.389 8.522 -6.336 1.00 0.00 H new ATOM 1496 N GLU A 96 -12.922 9.335 -3.463 1.00 0.00 N ATOM 1497 CA GLU A 96 -12.432 10.097 -2.321 1.00 0.00 C ATOM 1498 C GLU A 96 -13.454 10.100 -1.188 1.00 0.00 C ATOM 1499 O GLU A 96 -13.094 10.084 -0.012 1.00 0.00 O ATOM 1500 CB GLU A 96 -12.113 11.535 -2.739 1.00 0.00 C ATOM 1501 CG GLU A 96 -13.326 12.312 -3.221 1.00 0.00 C ATOM 1502 CD GLU A 96 -13.003 13.758 -3.542 1.00 0.00 C ATOM 1503 OE1 GLU A 96 -11.804 14.094 -3.624 1.00 0.00 O ATOM 1504 OE2 GLU A 96 -13.951 14.553 -3.711 1.00 0.00 O ATOM 0 H GLU A 96 -13.787 9.691 -3.868 1.00 0.00 H new ATOM 0 HA GLU A 96 -11.521 9.619 -1.962 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -11.668 12.060 -1.894 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -11.365 11.517 -3.532 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -13.733 11.829 -4.109 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -14.102 12.278 -2.456 1.00 0.00 H new ATOM 1511 N ASN A 97 -14.732 10.121 -1.553 1.00 0.00 N ATOM 1512 CA ASN A 97 -15.808 10.128 -0.568 1.00 0.00 C ATOM 1513 C ASN A 97 -15.829 8.823 0.222 1.00 0.00 C ATOM 1514 O ASN A 97 -15.984 8.828 1.443 1.00 0.00 O ATOM 1515 CB ASN A 97 -17.157 10.342 -1.257 1.00 0.00 C ATOM 1516 CG ASN A 97 -17.379 11.787 -1.658 1.00 0.00 C ATOM 1517 OD1 ASN A 97 -16.451 12.596 -1.644 1.00 0.00 O ATOM 1518 ND2 ASN A 97 -18.613 12.119 -2.019 1.00 0.00 N ATOM 0 H ASN A 97 -15.048 10.133 -2.523 1.00 0.00 H new ATOM 0 HA ASN A 97 -15.628 10.950 0.125 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -17.214 9.709 -2.143 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -17.958 10.026 -0.588 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -18.822 13.077 -2.300 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -19.352 11.416 -2.016 1.00 0.00 H new ATOM 1525 N MET A 98 -15.672 7.707 -0.483 1.00 0.00 N ATOM 1526 CA MET A 98 -15.672 6.395 0.153 1.00 0.00 C ATOM 1527 C MET A 98 -14.406 5.620 -0.200 1.00 0.00 C ATOM 1528 O MET A 98 -14.371 4.887 -1.187 1.00 0.00 O ATOM 1529 CB MET A 98 -16.907 5.598 -0.272 1.00 0.00 C ATOM 1530 CG MET A 98 -17.162 4.370 0.587 1.00 0.00 C ATOM 1531 SD MET A 98 -17.298 4.765 2.341 1.00 0.00 S ATOM 1532 CE MET A 98 -18.978 5.381 2.421 1.00 0.00 C ATOM 0 H MET A 98 -15.543 7.685 -1.495 1.00 0.00 H new ATOM 0 HA MET A 98 -15.698 6.542 1.233 1.00 0.00 H new ATOM 0 HB2 MET A 98 -17.781 6.248 -0.231 1.00 0.00 H new ATOM 0 HB3 MET A 98 -16.789 5.287 -1.310 1.00 0.00 H new ATOM 0 HG2 MET A 98 -18.080 3.884 0.256 1.00 0.00 H new ATOM 0 HG3 MET A 98 -16.352 3.655 0.441 1.00 0.00 H new ATOM 0 HE1 MET A 98 -19.212 5.667 3.446 1.00 0.00 H new ATOM 0 HE2 MET A 98 -19.079 6.249 1.770 1.00 0.00 H new ATOM 0 HE3 MET A 98 -19.667 4.602 2.095 1.00 0.00 H new ATOM 1542 N GLY A 99 -13.368 5.789 0.613 1.00 0.00 N ATOM 1543 CA GLY A 99 -12.114 5.099 0.369 1.00 0.00 C ATOM 1544 C GLY A 99 -11.185 5.144 1.566 1.00 0.00 C ATOM 1545 O GLY A 99 -11.611 4.920 2.700 1.00 0.00 O ATOM 0 H GLY A 99 -13.373 6.391 1.436 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -12.319 4.060 0.111 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -11.617 5.549 -0.490 1.00 0.00 H new ATOM 1549 N LEU A 100 -9.913 5.431 1.315 1.00 0.00 N ATOM 1550 CA LEU A 100 -8.920 5.502 2.381 1.00 0.00 C ATOM 1551 C LEU A 100 -8.641 6.951 2.769 1.00 0.00 C ATOM 1552 O LEU A 100 -9.250 7.876 2.233 1.00 0.00 O ATOM 1553 CB LEU A 100 -7.623 4.820 1.943 1.00 0.00 C ATOM 1554 CG LEU A 100 -7.775 3.450 1.281 1.00 0.00 C ATOM 1555 CD1 LEU A 100 -6.656 3.214 0.279 1.00 0.00 C ATOM 1556 CD2 LEU A 100 -7.793 2.350 2.332 1.00 0.00 C ATOM 0 H LEU A 100 -9.545 5.618 0.383 1.00 0.00 H new ATOM 0 HA LEU A 100 -9.320 4.982 3.252 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -7.105 5.481 1.248 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -6.981 4.710 2.817 1.00 0.00 H new ATOM 0 HG LEU A 100 -8.724 3.430 0.745 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -6.781 2.234 -0.182 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.689 3.984 -0.491 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.695 3.254 0.791 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -7.902 1.382 1.843 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -6.860 2.370 2.895 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -8.630 2.510 3.011 1.00 0.00 H new ATOM 1568 N VAL A 101 -7.713 7.140 3.703 1.00 0.00 N ATOM 1569 CA VAL A 101 -7.350 8.476 4.160 1.00 0.00 C ATOM 1570 C VAL A 101 -7.425 9.486 3.021 1.00 0.00 C ATOM 1571 O VAL A 101 -7.996 10.567 3.170 1.00 0.00 O ATOM 1572 CB VAL A 101 -5.931 8.497 4.759 1.00 0.00 C ATOM 1573 CG1 VAL A 101 -4.939 7.853 3.804 1.00 0.00 C ATOM 1574 CG2 VAL A 101 -5.516 9.922 5.092 1.00 0.00 C ATOM 0 H VAL A 101 -7.200 6.385 4.157 1.00 0.00 H new ATOM 0 HA VAL A 101 -8.067 8.752 4.933 1.00 0.00 H new ATOM 0 HB VAL A 101 -5.936 7.919 5.683 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -3.942 7.877 4.244 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -5.230 6.819 3.620 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -4.933 8.401 2.862 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -4.511 9.919 5.514 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -5.526 10.526 4.184 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -6.213 10.344 5.816 1.00 0.00 H new ATOM 1584 N THR A 102 -6.844 9.127 1.880 1.00 0.00 N ATOM 1585 CA THR A 102 -6.844 10.002 0.714 1.00 0.00 C ATOM 1586 C THR A 102 -7.043 9.206 -0.570 1.00 0.00 C ATOM 1587 O THR A 102 -6.619 8.054 -0.671 1.00 0.00 O ATOM 1588 CB THR A 102 -5.531 10.800 0.612 1.00 0.00 C ATOM 1589 OG1 THR A 102 -5.626 11.768 -0.440 1.00 0.00 O ATOM 1590 CG2 THR A 102 -4.353 9.874 0.349 1.00 0.00 C ATOM 0 H THR A 102 -6.367 8.236 1.739 1.00 0.00 H new ATOM 0 HA THR A 102 -7.674 10.697 0.839 1.00 0.00 H new ATOM 0 HB THR A 102 -5.368 11.310 1.562 1.00 0.00 H new ATOM 0 HG1 THR A 102 -4.788 12.272 -0.497 1.00 0.00 H new ATOM 0 HG21 THR A 102 -3.437 10.461 0.281 1.00 0.00 H new ATOM 0 HG22 THR A 102 -4.265 9.157 1.165 1.00 0.00 H new ATOM 0 HG23 THR A 102 -4.512 9.340 -0.588 1.00 0.00 H new ATOM 1598 N HIS A 103 -7.690 9.827 -1.551 1.00 0.00 N ATOM 1599 CA HIS A 103 -7.945 9.176 -2.832 1.00 0.00 C ATOM 1600 C HIS A 103 -6.655 9.034 -3.635 1.00 0.00 C ATOM 1601 O HIS A 103 -5.787 9.907 -3.595 1.00 0.00 O ATOM 1602 CB HIS A 103 -8.975 9.969 -3.636 1.00 0.00 C ATOM 1603 CG HIS A 103 -8.463 11.287 -4.130 1.00 0.00 C ATOM 1604 ND1 HIS A 103 -8.561 12.454 -3.401 1.00 0.00 N ATOM 1605 CD2 HIS A 103 -7.843 11.619 -5.287 1.00 0.00 C ATOM 1606 CE1 HIS A 103 -8.026 13.447 -4.090 1.00 0.00 C ATOM 1607 NE2 HIS A 103 -7.582 12.966 -5.237 1.00 0.00 N ATOM 0 H HIS A 103 -8.047 10.780 -1.484 1.00 0.00 H new ATOM 0 HA HIS A 103 -8.340 8.180 -2.633 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -9.297 9.371 -4.488 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -9.855 10.140 -3.016 1.00 0.00 H new ATOM 0 HD1 HIS A 103 -8.981 12.538 -2.475 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -7.599 10.949 -6.098 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -7.963 14.476 -3.770 1.00 0.00 H new ATOM 1616 N LEU A 104 -6.536 7.928 -4.362 1.00 0.00 N ATOM 1617 CA LEU A 104 -5.351 7.671 -5.174 1.00 0.00 C ATOM 1618 C LEU A 104 -5.215 8.710 -6.283 1.00 0.00 C ATOM 1619 O LEU A 104 -6.007 8.732 -7.225 1.00 0.00 O ATOM 1620 CB LEU A 104 -5.418 6.268 -5.779 1.00 0.00 C ATOM 1621 CG LEU A 104 -5.682 5.126 -4.797 1.00 0.00 C ATOM 1622 CD1 LEU A 104 -5.555 3.781 -5.496 1.00 0.00 C ATOM 1623 CD2 LEU A 104 -4.728 5.207 -3.615 1.00 0.00 C ATOM 0 H LEU A 104 -7.245 7.196 -4.406 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.476 7.740 -4.528 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -6.202 6.258 -6.537 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -4.477 6.070 -6.291 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.701 5.223 -4.422 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.746 2.980 -4.782 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.280 3.723 -6.308 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.548 3.674 -5.900 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.931 4.386 -2.927 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -3.700 5.136 -3.971 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.868 6.157 -3.099 1.00 0.00 H new ATOM 1635 N GLN A 105 -4.206 9.566 -6.164 1.00 0.00 N ATOM 1636 CA GLN A 105 -3.966 10.606 -7.158 1.00 0.00 C ATOM 1637 C GLN A 105 -3.102 10.080 -8.299 1.00 0.00 C ATOM 1638 O GLN A 105 -3.568 9.941 -9.430 1.00 0.00 O ATOM 1639 CB GLN A 105 -3.292 11.816 -6.508 1.00 0.00 C ATOM 1640 CG GLN A 105 -4.174 12.535 -5.500 1.00 0.00 C ATOM 1641 CD GLN A 105 -3.498 13.750 -4.895 1.00 0.00 C ATOM 1642 OE1 GLN A 105 -2.442 14.181 -5.357 1.00 0.00 O ATOM 1643 NE2 GLN A 105 -4.106 14.309 -3.855 1.00 0.00 N ATOM 0 H GLN A 105 -3.542 9.560 -5.390 1.00 0.00 H new ATOM 0 HA GLN A 105 -4.929 10.911 -7.567 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -2.379 11.489 -6.011 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -2.997 12.519 -7.287 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -5.099 12.844 -5.987 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -4.448 11.843 -4.704 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -4.981 13.918 -3.505 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -3.698 15.129 -3.406 1.00 0.00 H new ATOM 1652 N TYR A 106 -1.842 9.789 -7.994 1.00 0.00 N ATOM 1653 CA TYR A 106 -0.912 9.280 -8.995 1.00 0.00 C ATOM 1654 C TYR A 106 -0.250 7.991 -8.518 1.00 0.00 C ATOM 1655 O TYR A 106 0.397 7.945 -7.471 1.00 0.00 O ATOM 1656 CB TYR A 106 0.156 10.329 -9.309 1.00 0.00 C ATOM 1657 CG TYR A 106 -0.329 11.753 -9.150 1.00 0.00 C ATOM 1658 CD1 TYR A 106 -1.184 12.325 -10.083 1.00 0.00 C ATOM 1659 CD2 TYR A 106 0.068 12.525 -8.065 1.00 0.00 C ATOM 1660 CE1 TYR A 106 -1.628 13.626 -9.941 1.00 0.00 C ATOM 1661 CE2 TYR A 106 -0.372 13.825 -7.914 1.00 0.00 C ATOM 1662 CZ TYR A 106 -1.220 14.371 -8.855 1.00 0.00 C ATOM 1663 OH TYR A 106 -1.661 15.667 -8.709 1.00 0.00 O ATOM 0 H TYR A 106 -1.442 9.897 -7.062 1.00 0.00 H new ATOM 0 HA TYR A 106 -1.477 9.063 -9.902 1.00 0.00 H new ATOM 0 HB2 TYR A 106 1.013 10.171 -8.654 1.00 0.00 H new ATOM 0 HB3 TYR A 106 0.505 10.185 -10.331 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -1.507 11.743 -10.934 1.00 0.00 H new ATOM 0 HD2 TYR A 106 0.732 12.101 -7.327 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -2.291 14.057 -10.677 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -0.054 14.411 -7.064 1.00 0.00 H new ATOM 0 HH TYR A 106 -1.282 16.051 -7.891 1.00 0.00 H new ATOM 1673 N PRO A 107 -0.412 6.917 -9.305 1.00 0.00 N ATOM 1674 CA PRO A 107 0.162 5.607 -8.985 1.00 0.00 C ATOM 1675 C PRO A 107 1.682 5.594 -9.115 1.00 0.00 C ATOM 1676 O PRO A 107 2.224 5.169 -10.136 1.00 0.00 O ATOM 1677 CB PRO A 107 -0.471 4.679 -10.024 1.00 0.00 C ATOM 1678 CG PRO A 107 -0.813 5.568 -11.169 1.00 0.00 C ATOM 1679 CD PRO A 107 -1.170 6.899 -10.568 1.00 0.00 C ATOM 0 HA PRO A 107 -0.038 5.314 -7.954 1.00 0.00 H new ATOM 0 HB2 PRO A 107 0.221 3.893 -10.326 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -1.359 4.187 -9.626 1.00 0.00 H new ATOM 0 HG2 PRO A 107 0.029 5.663 -11.855 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -1.647 5.163 -11.742 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -0.884 7.724 -11.220 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -2.242 6.987 -10.394 1.00 0.00 H new ATOM 1687 N VAL A 108 2.364 6.061 -8.075 1.00 0.00 N ATOM 1688 CA VAL A 108 3.822 6.101 -8.072 1.00 0.00 C ATOM 1689 C VAL A 108 4.406 4.888 -8.786 1.00 0.00 C ATOM 1690 O VAL A 108 4.139 3.739 -8.432 1.00 0.00 O ATOM 1691 CB VAL A 108 4.379 6.156 -6.637 1.00 0.00 C ATOM 1692 CG1 VAL A 108 3.731 7.289 -5.856 1.00 0.00 C ATOM 1693 CG2 VAL A 108 4.170 4.824 -5.934 1.00 0.00 C ATOM 0 H VAL A 108 1.931 6.417 -7.223 1.00 0.00 H new ATOM 0 HA VAL A 108 4.115 7.007 -8.602 1.00 0.00 H new ATOM 0 HB VAL A 108 5.451 6.349 -6.688 1.00 0.00 H new ATOM 0 HG11 VAL A 108 4.137 7.312 -4.845 1.00 0.00 H new ATOM 0 HG12 VAL A 108 3.938 8.237 -6.352 1.00 0.00 H new ATOM 0 HG13 VAL A 108 2.654 7.130 -5.811 1.00 0.00 H new ATOM 0 HG21 VAL A 108 4.569 4.880 -4.921 1.00 0.00 H new ATOM 0 HG22 VAL A 108 3.105 4.598 -5.892 1.00 0.00 H new ATOM 0 HG23 VAL A 108 4.686 4.037 -6.484 1.00 0.00 H new ATOM 1703 N PRO A 109 5.225 5.146 -9.817 1.00 0.00 N ATOM 1704 CA PRO A 109 5.866 4.087 -10.603 1.00 0.00 C ATOM 1705 C PRO A 109 6.937 3.345 -9.811 1.00 0.00 C ATOM 1706 O PRO A 109 7.133 3.600 -8.622 1.00 0.00 O ATOM 1707 CB PRO A 109 6.496 4.846 -11.773 1.00 0.00 C ATOM 1708 CG PRO A 109 6.714 6.226 -11.256 1.00 0.00 C ATOM 1709 CD PRO A 109 5.588 6.490 -10.295 1.00 0.00 C ATOM 0 HA PRO A 109 5.155 3.319 -10.908 1.00 0.00 H new ATOM 0 HB2 PRO A 109 7.435 4.387 -12.083 1.00 0.00 H new ATOM 0 HB3 PRO A 109 5.839 4.848 -12.643 1.00 0.00 H new ATOM 0 HG2 PRO A 109 7.680 6.308 -10.758 1.00 0.00 H new ATOM 0 HG3 PRO A 109 6.712 6.952 -12.069 1.00 0.00 H new ATOM 0 HD2 PRO A 109 5.902 7.137 -9.476 1.00 0.00 H new ATOM 0 HD3 PRO A 109 4.748 6.982 -10.785 1.00 0.00 H new ATOM 1717 N LEU A 110 7.627 2.425 -10.476 1.00 0.00 N ATOM 1718 CA LEU A 110 8.680 1.646 -9.834 1.00 0.00 C ATOM 1719 C LEU A 110 10.014 2.383 -9.889 1.00 0.00 C ATOM 1720 O LEU A 110 10.115 3.460 -10.475 1.00 0.00 O ATOM 1721 CB LEU A 110 8.811 0.278 -10.507 1.00 0.00 C ATOM 1722 CG LEU A 110 7.547 -0.581 -10.533 1.00 0.00 C ATOM 1723 CD1 LEU A 110 7.695 -1.718 -11.532 1.00 0.00 C ATOM 1724 CD2 LEU A 110 7.243 -1.126 -9.144 1.00 0.00 C ATOM 0 H LEU A 110 7.476 2.200 -11.459 1.00 0.00 H new ATOM 0 HA LEU A 110 8.408 1.505 -8.788 1.00 0.00 H new ATOM 0 HB2 LEU A 110 9.143 0.431 -11.534 1.00 0.00 H new ATOM 0 HB3 LEU A 110 9.596 -0.281 -9.998 1.00 0.00 H new ATOM 0 HG LEU A 110 6.712 0.045 -10.847 1.00 0.00 H new ATOM 0 HD11 LEU A 110 6.786 -2.319 -11.537 1.00 0.00 H new ATOM 0 HD12 LEU A 110 7.864 -1.308 -12.528 1.00 0.00 H new ATOM 0 HD13 LEU A 110 8.542 -2.343 -11.249 1.00 0.00 H new ATOM 0 HD21 LEU A 110 6.340 -1.735 -9.182 1.00 0.00 H new ATOM 0 HD22 LEU A 110 8.079 -1.737 -8.802 1.00 0.00 H new ATOM 0 HD23 LEU A 110 7.093 -0.297 -8.453 1.00 0.00 H new ATOM 1736 N GLU A 111 11.036 1.793 -9.277 1.00 0.00 N ATOM 1737 CA GLU A 111 12.365 2.394 -9.258 1.00 0.00 C ATOM 1738 C GLU A 111 13.353 1.554 -10.062 1.00 0.00 C ATOM 1739 O GLU A 111 14.462 1.278 -9.607 1.00 0.00 O ATOM 1740 CB GLU A 111 12.860 2.545 -7.819 1.00 0.00 C ATOM 1741 CG GLU A 111 13.991 3.548 -7.666 1.00 0.00 C ATOM 1742 CD GLU A 111 14.309 3.853 -6.216 1.00 0.00 C ATOM 1743 OE1 GLU A 111 15.032 3.055 -5.585 1.00 0.00 O ATOM 1744 OE2 GLU A 111 13.834 4.893 -5.711 1.00 0.00 O ATOM 0 H GLU A 111 10.969 0.900 -8.788 1.00 0.00 H new ATOM 0 HA GLU A 111 12.296 3.381 -9.716 1.00 0.00 H new ATOM 0 HB2 GLU A 111 12.026 2.851 -7.187 1.00 0.00 H new ATOM 0 HB3 GLU A 111 13.195 1.574 -7.455 1.00 0.00 H new ATOM 0 HG2 GLU A 111 14.884 3.160 -8.156 1.00 0.00 H new ATOM 0 HG3 GLU A 111 13.723 4.473 -8.177 1.00 0.00 H new ATOM 1751 N GLU A 112 12.941 1.150 -11.260 1.00 0.00 N ATOM 1752 CA GLU A 112 13.789 0.341 -12.127 1.00 0.00 C ATOM 1753 C GLU A 112 14.169 1.110 -13.389 1.00 0.00 C ATOM 1754 O GLU A 112 13.397 1.931 -13.882 1.00 0.00 O ATOM 1755 CB GLU A 112 13.078 -0.961 -12.503 1.00 0.00 C ATOM 1756 CG GLU A 112 13.230 -2.060 -11.465 1.00 0.00 C ATOM 1757 CD GLU A 112 12.181 -3.146 -11.608 1.00 0.00 C ATOM 1758 OE1 GLU A 112 11.033 -2.819 -11.972 1.00 0.00 O ATOM 1759 OE2 GLU A 112 12.511 -4.324 -11.356 1.00 0.00 O ATOM 0 H GLU A 112 12.025 1.370 -11.652 1.00 0.00 H new ATOM 0 HA GLU A 112 14.701 0.103 -11.580 1.00 0.00 H new ATOM 0 HB2 GLU A 112 12.018 -0.756 -12.650 1.00 0.00 H new ATOM 0 HB3 GLU A 112 13.469 -1.317 -13.456 1.00 0.00 H new ATOM 0 HG2 GLU A 112 14.222 -2.504 -11.554 1.00 0.00 H new ATOM 0 HG3 GLU A 112 13.164 -1.625 -10.468 1.00 0.00 H new ATOM 1766 N GLU A 113 15.363 0.836 -13.905 1.00 0.00 N ATOM 1767 CA GLU A 113 15.845 1.503 -15.108 1.00 0.00 C ATOM 1768 C GLU A 113 15.988 0.512 -16.260 1.00 0.00 C ATOM 1769 O GLU A 113 16.148 -0.689 -16.043 1.00 0.00 O ATOM 1770 CB GLU A 113 17.189 2.184 -14.837 1.00 0.00 C ATOM 1771 CG GLU A 113 17.057 3.594 -14.287 1.00 0.00 C ATOM 1772 CD GLU A 113 18.359 4.369 -14.351 1.00 0.00 C ATOM 1773 OE1 GLU A 113 19.292 4.023 -13.597 1.00 0.00 O ATOM 1774 OE2 GLU A 113 18.444 5.321 -15.155 1.00 0.00 O ATOM 0 H GLU A 113 16.013 0.157 -13.509 1.00 0.00 H new ATOM 0 HA GLU A 113 15.113 2.259 -15.391 1.00 0.00 H new ATOM 0 HB2 GLU A 113 17.757 1.579 -14.130 1.00 0.00 H new ATOM 0 HB3 GLU A 113 17.763 2.216 -15.763 1.00 0.00 H new ATOM 0 HG2 GLU A 113 16.292 4.129 -14.849 1.00 0.00 H new ATOM 0 HG3 GLU A 113 16.717 3.546 -13.252 1.00 0.00 H new ATOM 1781 N ASP A 114 15.928 1.024 -17.484 1.00 0.00 N ATOM 1782 CA ASP A 114 16.051 0.185 -18.670 1.00 0.00 C ATOM 1783 C ASP A 114 17.498 0.129 -19.149 1.00 0.00 C ATOM 1784 O ASP A 114 18.085 1.150 -19.508 1.00 0.00 O ATOM 1785 CB ASP A 114 15.151 0.712 -19.789 1.00 0.00 C ATOM 1786 CG ASP A 114 15.290 -0.088 -21.069 1.00 0.00 C ATOM 1787 OD1 ASP A 114 16.438 -0.367 -21.472 1.00 0.00 O ATOM 1788 OD2 ASP A 114 14.250 -0.433 -21.669 1.00 0.00 O ATOM 0 H ASP A 114 15.795 2.016 -17.681 1.00 0.00 H new ATOM 0 HA ASP A 114 15.736 -0.824 -18.405 1.00 0.00 H new ATOM 0 HB2 ASP A 114 14.113 0.686 -19.459 1.00 0.00 H new ATOM 0 HB3 ASP A 114 15.396 1.755 -19.988 1.00 0.00 H new ATOM 1793 N THR A 115 18.070 -1.071 -19.151 1.00 0.00 N ATOM 1794 CA THR A 115 19.449 -1.261 -19.582 1.00 0.00 C ATOM 1795 C THR A 115 19.579 -1.100 -21.093 1.00 0.00 C ATOM 1796 O THR A 115 20.475 -0.412 -21.579 1.00 0.00 O ATOM 1797 CB THR A 115 19.978 -2.649 -19.177 1.00 0.00 C ATOM 1798 OG1 THR A 115 19.190 -3.673 -19.794 1.00 0.00 O ATOM 1799 CG2 THR A 115 19.949 -2.820 -17.666 1.00 0.00 C ATOM 0 H THR A 115 17.598 -1.927 -18.858 1.00 0.00 H new ATOM 0 HA THR A 115 20.044 -0.495 -19.085 1.00 0.00 H new ATOM 0 HB THR A 115 21.011 -2.733 -19.516 1.00 0.00 H new ATOM 0 HG1 THR A 115 19.534 -4.553 -19.533 1.00 0.00 H new ATOM 0 HG21 THR A 115 20.327 -3.808 -17.404 1.00 0.00 H new ATOM 0 HG22 THR A 115 20.574 -2.057 -17.201 1.00 0.00 H new ATOM 0 HG23 THR A 115 18.925 -2.717 -17.308 1.00 0.00 H new ATOM 1807 N GLY A 116 18.678 -1.741 -21.831 1.00 0.00 N ATOM 1808 CA GLY A 116 18.709 -1.656 -23.280 1.00 0.00 C ATOM 1809 C GLY A 116 17.536 -2.364 -23.928 1.00 0.00 C ATOM 1810 O GLY A 116 16.398 -2.232 -23.479 1.00 0.00 O ATOM 0 H GLY A 116 17.927 -2.318 -21.452 1.00 0.00 H new ATOM 0 HA2 GLY A 116 18.707 -0.608 -23.579 1.00 0.00 H new ATOM 0 HA3 GLY A 116 19.639 -2.091 -23.646 1.00 0.00 H new ATOM 1814 N ASP A 117 17.813 -3.116 -24.988 1.00 0.00 N ATOM 1815 CA ASP A 117 16.772 -3.847 -25.700 1.00 0.00 C ATOM 1816 C ASP A 117 17.080 -5.341 -25.730 1.00 0.00 C ATOM 1817 O ASP A 117 17.891 -5.801 -26.535 1.00 0.00 O ATOM 1818 CB ASP A 117 16.629 -3.314 -27.126 1.00 0.00 C ATOM 1819 CG ASP A 117 15.924 -4.294 -28.043 1.00 0.00 C ATOM 1820 OD1 ASP A 117 14.859 -4.813 -27.649 1.00 0.00 O ATOM 1821 OD2 ASP A 117 16.438 -4.543 -29.154 1.00 0.00 O ATOM 0 H ASP A 117 18.750 -3.235 -25.373 1.00 0.00 H new ATOM 0 HA ASP A 117 15.831 -3.699 -25.170 1.00 0.00 H new ATOM 0 HB2 ASP A 117 16.074 -2.376 -27.106 1.00 0.00 H new ATOM 0 HB3 ASP A 117 17.617 -3.091 -27.528 1.00 0.00 H new ATOM 1826 N ASP A 118 16.430 -6.092 -24.849 1.00 0.00 N ATOM 1827 CA ASP A 118 16.635 -7.534 -24.775 1.00 0.00 C ATOM 1828 C ASP A 118 16.543 -8.168 -26.159 1.00 0.00 C ATOM 1829 O ASP A 118 15.747 -7.759 -27.004 1.00 0.00 O ATOM 1830 CB ASP A 118 15.605 -8.169 -23.840 1.00 0.00 C ATOM 1831 CG ASP A 118 15.623 -9.684 -23.902 1.00 0.00 C ATOM 1832 OD1 ASP A 118 15.413 -10.235 -25.003 1.00 0.00 O ATOM 1833 OD2 ASP A 118 15.846 -10.319 -22.849 1.00 0.00 O ATOM 0 H ASP A 118 15.756 -5.727 -24.176 1.00 0.00 H new ATOM 0 HA ASP A 118 17.634 -7.714 -24.379 1.00 0.00 H new ATOM 0 HB2 ASP A 118 15.801 -7.848 -22.817 1.00 0.00 H new ATOM 0 HB3 ASP A 118 14.610 -7.809 -24.102 1.00 0.00 H new ATOM 1838 N PRO A 119 17.378 -9.190 -26.399 1.00 0.00 N ATOM 1839 CA PRO A 119 17.411 -9.902 -27.680 1.00 0.00 C ATOM 1840 C PRO A 119 16.159 -10.742 -27.908 1.00 0.00 C ATOM 1841 O PRO A 119 15.486 -10.606 -28.929 1.00 0.00 O ATOM 1842 CB PRO A 119 18.644 -10.800 -27.555 1.00 0.00 C ATOM 1843 CG PRO A 119 18.818 -11.003 -26.089 1.00 0.00 C ATOM 1844 CD PRO A 119 18.354 -9.730 -25.437 1.00 0.00 C ATOM 0 HA PRO A 119 17.451 -9.217 -28.527 1.00 0.00 H new ATOM 0 HB2 PRO A 119 18.497 -11.749 -28.071 1.00 0.00 H new ATOM 0 HB3 PRO A 119 19.523 -10.330 -27.997 1.00 0.00 H new ATOM 0 HG2 PRO A 119 18.234 -11.855 -25.741 1.00 0.00 H new ATOM 0 HG3 PRO A 119 19.860 -11.209 -25.845 1.00 0.00 H new ATOM 0 HD2 PRO A 119 17.898 -9.919 -24.465 1.00 0.00 H new ATOM 0 HD3 PRO A 119 19.180 -9.039 -25.272 1.00 0.00 H new TER 1852 PRO A 119