USER MOD reduce.3.24.130724 H: found=0, std=0, add=901, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 903 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 6 ASN : amide:sc= 1.16 K(o=1.2,f=-0.017) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 CYS SG : rot 14:sc= -0.25 USER MOD Single : A 19 MET CE :methyl -179:sc= -0.318 (180deg=-0.318) USER MOD Single : A 20 LYS NZ :NH3+ 151:sc= 1.07 (180deg=0.789) USER MOD Single : A 21 GLN : amide:sc= -2.09 K(o=-2.1,f=-3.6!) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 80:sc= 1.22 USER MOD Single : A 30 ASN : amide:sc= -0.269 K(o=-0.27,f=-0.88) USER MOD Single : A 34 LYS NZ :NH3+ 170:sc= -0.013 (180deg=-0.137) USER MOD Single : A 35 LYS NZ :NH3+ 169:sc= 0.947 (180deg=0.777!) USER MOD Single : A 39 GLN : amide:sc= -1.46! X(o=-1.5!,f=-1.6) USER MOD Single : A 44 THR OG1 : rot 34:sc= 0.761 USER MOD Single : A 45 HIS : no HD1:sc= -2.93 K(o=-2.9,f=-0.45) USER MOD Single : A 54 ASN : amide:sc= -0.0841 K(o=-0.084,f=-3.9!) USER MOD Single : A 57 GLN : amide:sc= -1.81 K(o=-1.8,f=-0.35) USER MOD Single : B 6 ASN : amide:sc= 1.16 K(o=1.2,f=-0.2) USER MOD Single : B 9 LYS NZ :NH3+ 165:sc= -0.0166 (180deg=-0.222) USER MOD Single : B 15 CYS SG : rot 7:sc= 0.288 USER MOD Single : B 19 MET CE :methyl -154:sc= -2.06 (180deg=-3.02!) USER MOD Single : B 20 LYS NZ :NH3+ -178:sc= 1.34! (180deg=1.27!) USER MOD Single : B 21 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : B 25 TYR OH : rot 180:sc= 0 USER MOD Single : B 29 SER OG : rot 76:sc= 0.776 USER MOD Single : B 30 ASN : amide:sc= -0.0115 K(o=-0.011,f=-2.9) USER MOD Single : B 34 LYS NZ :NH3+ -134:sc= 0.572 (180deg=-0.288) USER MOD Single : B 35 LYS NZ :NH3+ 162:sc= 1.1 (180deg=0.408) USER MOD Single : B 39 GLN : amide:sc= -0.919! X(o=-0.92!,f=-1.2) USER MOD Single : B 44 THR OG1 : rot -26:sc= 0.931 USER MOD Single : B 45 HIS : no HD1:sc= -6.13! C(o=-6.1!,f=-6.9!) USER MOD Single : B 54 ASN : amide:sc= -0.125 X(o=-0.12,f=-0.062) USER MOD Single : B 57 GLN : amide:sc= -1.89 K(o=-1.9,f=-0.35) USER MOD ----------------------------------------------------------------- ATOM 56 N VAL A 5 -6.361 -7.233 8.000 1.00 0.00 N ATOM 57 CA VAL A 5 -7.094 -6.092 7.547 1.00 0.00 C ATOM 58 C VAL A 5 -6.173 -4.919 7.662 1.00 0.00 C ATOM 59 O VAL A 5 -5.846 -4.486 8.767 1.00 0.00 O ATOM 60 CB VAL A 5 -8.376 -5.809 8.372 1.00 0.00 C ATOM 61 CG1 VAL A 5 -9.115 -4.623 7.770 1.00 0.00 C ATOM 62 CG2 VAL A 5 -9.286 -7.032 8.438 1.00 0.00 C ATOM 0 HA VAL A 5 -7.427 -6.278 6.526 1.00 0.00 H new ATOM 0 HB VAL A 5 -8.081 -5.573 9.394 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -10.016 -4.424 8.350 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -8.470 -3.745 7.789 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -9.389 -4.850 6.740 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -10.173 -6.794 9.024 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -9.584 -7.319 7.429 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -8.752 -7.858 8.907 1.00 0.00 H new ATOM 72 N ASN A 6 -5.741 -4.419 6.557 1.00 0.00 N ATOM 73 CA ASN A 6 -4.755 -3.366 6.548 1.00 0.00 C ATOM 74 C ASN A 6 -5.087 -2.374 5.551 1.00 0.00 C ATOM 75 O ASN A 6 -5.115 -2.651 4.342 1.00 0.00 O ATOM 76 CB ASN A 6 -3.315 -3.841 6.311 1.00 0.00 C ATOM 77 CG ASN A 6 -2.785 -4.683 7.424 1.00 0.00 C ATOM 78 OD1 ASN A 6 -2.242 -4.177 8.403 1.00 0.00 O ATOM 79 ND2 ASN A 6 -2.901 -5.958 7.287 1.00 0.00 N ATOM 0 H ASN A 6 -6.052 -4.718 5.633 1.00 0.00 H new ATOM 0 HA ASN A 6 -4.785 -2.943 7.552 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -3.275 -4.410 5.382 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -2.669 -2.973 6.181 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -2.536 -6.583 8.005 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -3.358 -6.343 6.460 1.00 0.00 H new ATOM 86 N VAL A 7 -5.441 -1.264 6.036 1.00 0.00 N ATOM 87 CA VAL A 7 -5.684 -0.139 5.206 1.00 0.00 C ATOM 88 C VAL A 7 -4.674 0.891 5.609 1.00 0.00 C ATOM 89 O VAL A 7 -4.538 1.191 6.804 1.00 0.00 O ATOM 90 CB VAL A 7 -7.126 0.412 5.321 1.00 0.00 C ATOM 91 CG1 VAL A 7 -7.441 1.444 4.257 1.00 0.00 C ATOM 92 CG2 VAL A 7 -8.156 -0.707 5.374 1.00 0.00 C ATOM 0 H VAL A 7 -5.576 -1.093 7.032 1.00 0.00 H new ATOM 0 HA VAL A 7 -5.587 -0.422 4.158 1.00 0.00 H new ATOM 0 HB VAL A 7 -7.186 0.939 6.273 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -8.464 1.797 4.384 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -6.753 2.284 4.350 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -7.332 0.994 3.270 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -9.155 -0.278 5.455 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -8.090 -1.306 4.465 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -7.962 -1.340 6.240 1.00 0.00 H new ATOM 102 N LEU A 8 -3.994 1.429 4.660 1.00 0.00 N ATOM 103 CA LEU A 8 -2.853 2.205 4.951 1.00 0.00 C ATOM 104 C LEU A 8 -2.642 3.267 3.869 1.00 0.00 C ATOM 105 O LEU A 8 -3.145 3.130 2.759 1.00 0.00 O ATOM 106 CB LEU A 8 -1.717 1.202 4.994 1.00 0.00 C ATOM 107 CG LEU A 8 -0.395 1.632 5.533 1.00 0.00 C ATOM 108 CD1 LEU A 8 -0.552 2.165 6.943 1.00 0.00 C ATOM 109 CD2 LEU A 8 0.507 0.438 5.541 1.00 0.00 C ATOM 0 H LEU A 8 -4.215 1.342 3.668 1.00 0.00 H new ATOM 0 HA LEU A 8 -2.936 2.754 5.889 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.052 0.350 5.585 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -1.557 0.842 3.978 1.00 0.00 H new ATOM 0 HG LEU A 8 0.023 2.425 4.913 1.00 0.00 H new ATOM 0 HD11 LEU A 8 0.421 2.476 7.325 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.229 3.019 6.936 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.961 1.384 7.584 1.00 0.00 H new ATOM 0 HD21 LEU A 8 1.484 0.723 5.931 1.00 0.00 H new ATOM 0 HD22 LEU A 8 0.076 -0.339 6.172 1.00 0.00 H new ATOM 0 HD23 LEU A 8 0.619 0.059 4.525 1.00 0.00 H new ATOM 121 N LYS A 9 -1.914 4.312 4.199 1.00 0.00 N ATOM 122 CA LYS A 9 -1.656 5.407 3.279 1.00 0.00 C ATOM 123 C LYS A 9 -0.168 5.501 3.017 1.00 0.00 C ATOM 124 O LYS A 9 0.634 5.365 3.946 1.00 0.00 O ATOM 125 CB LYS A 9 -2.088 6.722 3.898 1.00 0.00 C ATOM 126 CG LYS A 9 -1.923 7.914 2.971 1.00 0.00 C ATOM 127 CD LYS A 9 -1.805 9.191 3.757 1.00 0.00 C ATOM 128 CE LYS A 9 -1.752 10.394 2.840 1.00 0.00 C ATOM 129 NZ LYS A 9 -1.629 11.654 3.591 1.00 0.00 N ATOM 0 H LYS A 9 -1.481 4.430 5.115 1.00 0.00 H new ATOM 0 HA LYS A 9 -2.208 5.220 2.358 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -3.133 6.647 4.197 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -1.509 6.895 4.805 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -1.036 7.779 2.353 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -2.776 7.975 2.295 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -2.654 9.284 4.435 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -0.907 9.160 4.373 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -0.907 10.294 2.159 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -2.653 10.423 2.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -1.596 12.453 2.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -2.448 11.763 4.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -0.756 11.638 4.156 1.00 0.00 H new ATOM 143 N GLY A 10 0.208 5.745 1.781 1.00 0.00 N ATOM 144 CA GLY A 10 1.601 5.885 1.464 1.00 0.00 C ATOM 145 C GLY A 10 1.900 5.512 0.045 1.00 0.00 C ATOM 146 O GLY A 10 1.104 5.800 -0.856 1.00 0.00 O ATOM 0 H GLY A 10 -0.428 5.849 0.990 1.00 0.00 H new ATOM 0 HA2 GLY A 10 1.910 6.916 1.639 1.00 0.00 H new ATOM 0 HA3 GLY A 10 2.189 5.258 2.134 1.00 0.00 H new ATOM 150 N VAL A 11 3.027 4.871 -0.152 1.00 0.00 N ATOM 151 CA VAL A 11 3.499 4.479 -1.450 1.00 0.00 C ATOM 152 C VAL A 11 3.527 2.951 -1.555 1.00 0.00 C ATOM 153 O VAL A 11 4.106 2.250 -0.714 1.00 0.00 O ATOM 154 CB VAL A 11 4.927 5.047 -1.735 1.00 0.00 C ATOM 155 CG1 VAL A 11 5.397 4.679 -3.133 1.00 0.00 C ATOM 156 CG2 VAL A 11 4.964 6.558 -1.555 1.00 0.00 C ATOM 0 H VAL A 11 3.653 4.603 0.607 1.00 0.00 H new ATOM 0 HA VAL A 11 2.814 4.889 -2.192 1.00 0.00 H new ATOM 0 HB VAL A 11 5.605 4.594 -1.011 1.00 0.00 H new ATOM 0 HG11 VAL A 11 6.393 5.088 -3.301 1.00 0.00 H new ATOM 0 HG12 VAL A 11 5.429 3.594 -3.232 1.00 0.00 H new ATOM 0 HG13 VAL A 11 4.706 5.091 -3.869 1.00 0.00 H new ATOM 0 HG21 VAL A 11 5.970 6.924 -1.760 1.00 0.00 H new ATOM 0 HG22 VAL A 11 4.261 7.024 -2.245 1.00 0.00 H new ATOM 0 HG23 VAL A 11 4.688 6.809 -0.531 1.00 0.00 H new ATOM 166 N LEU A 12 2.898 2.472 -2.567 1.00 0.00 N ATOM 167 CA LEU A 12 2.811 1.068 -2.884 1.00 0.00 C ATOM 168 C LEU A 12 3.840 0.744 -3.935 1.00 0.00 C ATOM 169 O LEU A 12 3.968 1.483 -4.903 1.00 0.00 O ATOM 170 CB LEU A 12 1.413 0.775 -3.447 1.00 0.00 C ATOM 171 CG LEU A 12 1.236 -0.545 -4.215 1.00 0.00 C ATOM 172 CD1 LEU A 12 1.445 -1.744 -3.327 1.00 0.00 C ATOM 173 CD2 LEU A 12 -0.121 -0.595 -4.862 1.00 0.00 C ATOM 0 H LEU A 12 2.403 3.064 -3.235 1.00 0.00 H new ATOM 0 HA LEU A 12 2.988 0.468 -1.991 1.00 0.00 H new ATOM 0 HB2 LEU A 12 0.705 0.783 -2.618 1.00 0.00 H new ATOM 0 HB3 LEU A 12 1.136 1.594 -4.111 1.00 0.00 H new ATOM 0 HG LEU A 12 2.000 -0.580 -4.992 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.311 -2.656 -3.909 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.454 -1.721 -2.916 1.00 0.00 H new ATOM 0 HD13 LEU A 12 0.721 -1.724 -2.512 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -0.232 -1.535 -5.402 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -0.892 -0.524 -4.095 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -0.223 0.238 -5.558 1.00 0.00 H new ATOM 185 N ILE A 13 4.585 -0.324 -3.751 1.00 0.00 N ATOM 186 CA ILE A 13 5.526 -0.733 -4.761 1.00 0.00 C ATOM 187 C ILE A 13 5.129 -2.100 -5.272 1.00 0.00 C ATOM 188 O ILE A 13 4.615 -2.963 -4.516 1.00 0.00 O ATOM 189 CB ILE A 13 6.974 -0.943 -4.250 1.00 0.00 C ATOM 190 CG1 ILE A 13 7.399 0.009 -3.158 1.00 0.00 C ATOM 191 CG2 ILE A 13 7.965 -0.837 -5.416 1.00 0.00 C ATOM 192 CD1 ILE A 13 7.514 1.467 -3.537 1.00 0.00 C ATOM 0 H ILE A 13 4.556 -0.916 -2.921 1.00 0.00 H new ATOM 0 HA ILE A 13 5.507 0.070 -5.498 1.00 0.00 H new ATOM 0 HB ILE A 13 6.982 -1.941 -3.812 1.00 0.00 H new ATOM 0 HG12 ILE A 13 6.686 -0.074 -2.337 1.00 0.00 H new ATOM 0 HG13 ILE A 13 8.365 -0.321 -2.776 1.00 0.00 H new ATOM 0 HG21 ILE A 13 8.979 -0.986 -5.046 1.00 0.00 H new ATOM 0 HG22 ILE A 13 7.734 -1.599 -6.160 1.00 0.00 H new ATOM 0 HG23 ILE A 13 7.886 0.150 -5.872 1.00 0.00 H new ATOM 0 HD11 ILE A 13 7.826 2.045 -2.667 1.00 0.00 H new ATOM 0 HD12 ILE A 13 8.252 1.579 -4.331 1.00 0.00 H new ATOM 0 HD13 ILE A 13 6.547 1.830 -3.886 1.00 0.00 H new ATOM 204 N GLU A 14 5.347 -2.294 -6.511 1.00 0.00 N ATOM 205 CA GLU A 14 5.287 -3.561 -7.108 1.00 0.00 C ATOM 206 C GLU A 14 6.516 -3.687 -7.965 1.00 0.00 C ATOM 207 O GLU A 14 6.739 -2.864 -8.840 1.00 0.00 O ATOM 208 CB GLU A 14 4.061 -3.644 -7.993 1.00 0.00 C ATOM 209 CG GLU A 14 4.008 -4.857 -8.901 1.00 0.00 C ATOM 210 CD GLU A 14 2.866 -4.766 -9.857 1.00 0.00 C ATOM 211 OE1 GLU A 14 1.732 -5.091 -9.455 1.00 0.00 O ATOM 212 OE2 GLU A 14 3.082 -4.348 -11.003 1.00 0.00 O ATOM 0 H GLU A 14 5.581 -1.544 -7.161 1.00 0.00 H new ATOM 0 HA GLU A 14 5.235 -4.350 -6.357 1.00 0.00 H new ATOM 0 HB2 GLU A 14 3.174 -3.643 -7.360 1.00 0.00 H new ATOM 0 HB3 GLU A 14 4.014 -2.746 -8.608 1.00 0.00 H new ATOM 0 HG2 GLU A 14 4.943 -4.941 -9.455 1.00 0.00 H new ATOM 0 HG3 GLU A 14 3.911 -5.761 -8.300 1.00 0.00 H new ATOM 219 N CYS A 15 7.315 -4.636 -7.661 1.00 0.00 N ATOM 220 CA CYS A 15 8.424 -5.027 -8.489 1.00 0.00 C ATOM 221 C CYS A 15 8.737 -6.430 -8.088 1.00 0.00 C ATOM 222 O CYS A 15 8.154 -6.913 -7.111 1.00 0.00 O ATOM 223 CB CYS A 15 9.645 -4.152 -8.225 1.00 0.00 C ATOM 224 SG CYS A 15 11.005 -4.352 -9.412 1.00 0.00 S ATOM 0 H CYS A 15 7.226 -5.188 -6.808 1.00 0.00 H new ATOM 0 HA CYS A 15 8.176 -4.929 -9.546 1.00 0.00 H new ATOM 0 HB2 CYS A 15 9.332 -3.108 -8.227 1.00 0.00 H new ATOM 0 HB3 CYS A 15 10.020 -4.371 -7.225 1.00 0.00 H new ATOM 0 HG CYS A 15 10.579 -5.002 -10.454 1.00 0.00 H new ATOM 230 N ASP A 16 9.620 -7.089 -8.806 1.00 0.00 N ATOM 231 CA ASP A 16 10.015 -8.425 -8.445 1.00 0.00 C ATOM 232 C ASP A 16 10.692 -8.397 -7.058 1.00 0.00 C ATOM 233 O ASP A 16 11.361 -7.404 -6.698 1.00 0.00 O ATOM 234 CB ASP A 16 10.926 -9.068 -9.508 1.00 0.00 C ATOM 235 CG ASP A 16 12.282 -8.430 -9.611 1.00 0.00 C ATOM 236 OD1 ASP A 16 12.451 -7.458 -10.378 1.00 0.00 O ATOM 237 OD2 ASP A 16 13.214 -8.908 -8.960 1.00 0.00 O ATOM 0 H ASP A 16 10.075 -6.719 -9.641 1.00 0.00 H new ATOM 0 HA ASP A 16 9.123 -9.050 -8.395 1.00 0.00 H new ATOM 0 HB2 ASP A 16 11.049 -10.126 -9.276 1.00 0.00 H new ATOM 0 HB3 ASP A 16 10.433 -9.010 -10.478 1.00 0.00 H new ATOM 242 N PRO A 17 10.510 -9.468 -6.256 1.00 0.00 N ATOM 243 CA PRO A 17 10.951 -9.562 -4.835 1.00 0.00 C ATOM 244 C PRO A 17 12.444 -9.327 -4.539 1.00 0.00 C ATOM 245 O PRO A 17 12.851 -9.366 -3.375 1.00 0.00 O ATOM 246 CB PRO A 17 10.536 -10.973 -4.445 1.00 0.00 C ATOM 247 CG PRO A 17 9.377 -11.218 -5.314 1.00 0.00 C ATOM 248 CD PRO A 17 9.799 -10.701 -6.635 1.00 0.00 C ATOM 0 HA PRO A 17 10.496 -8.754 -4.262 1.00 0.00 H new ATOM 0 HB2 PRO A 17 11.334 -11.694 -4.621 1.00 0.00 H new ATOM 0 HB3 PRO A 17 10.273 -11.041 -3.389 1.00 0.00 H new ATOM 0 HG2 PRO A 17 9.132 -12.279 -5.361 1.00 0.00 H new ATOM 0 HG3 PRO A 17 8.489 -10.702 -4.949 1.00 0.00 H new ATOM 0 HD2 PRO A 17 10.446 -11.402 -7.162 1.00 0.00 H new ATOM 0 HD3 PRO A 17 8.949 -10.500 -7.287 1.00 0.00 H new ATOM 256 N ALA A 18 13.237 -9.047 -5.552 1.00 0.00 N ATOM 257 CA ALA A 18 14.643 -8.726 -5.368 1.00 0.00 C ATOM 258 C ALA A 18 14.762 -7.465 -4.518 1.00 0.00 C ATOM 259 O ALA A 18 15.604 -7.377 -3.593 1.00 0.00 O ATOM 260 CB ALA A 18 15.275 -8.485 -6.705 1.00 0.00 C ATOM 0 H ALA A 18 12.930 -9.035 -6.524 1.00 0.00 H new ATOM 0 HA ALA A 18 15.147 -9.554 -4.870 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.330 -8.244 -6.571 1.00 0.00 H new ATOM 0 HB2 ALA A 18 15.183 -9.382 -7.318 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.773 -7.654 -7.200 1.00 0.00 H new ATOM 266 N MET A 19 13.871 -6.506 -4.802 1.00 0.00 N ATOM 267 CA MET A 19 13.829 -5.252 -4.068 1.00 0.00 C ATOM 268 C MET A 19 13.442 -5.535 -2.621 1.00 0.00 C ATOM 269 O MET A 19 13.953 -4.921 -1.699 1.00 0.00 O ATOM 270 CB MET A 19 12.793 -4.267 -4.673 1.00 0.00 C ATOM 271 CG MET A 19 11.347 -4.633 -4.352 1.00 0.00 C ATOM 272 SD MET A 19 10.126 -3.525 -5.023 1.00 0.00 S ATOM 273 CE MET A 19 8.640 -4.333 -4.441 1.00 0.00 C ATOM 0 H MET A 19 13.170 -6.583 -5.539 1.00 0.00 H new ATOM 0 HA MET A 19 14.816 -4.794 -4.128 1.00 0.00 H new ATOM 0 HB2 MET A 19 12.997 -3.263 -4.300 1.00 0.00 H new ATOM 0 HB3 MET A 19 12.920 -4.237 -5.755 1.00 0.00 H new ATOM 0 HG2 MET A 19 11.150 -5.637 -4.727 1.00 0.00 H new ATOM 0 HG3 MET A 19 11.228 -4.668 -3.269 1.00 0.00 H new ATOM 0 HE1 MET A 19 7.766 -3.781 -4.787 1.00 0.00 H new ATOM 0 HE2 MET A 19 8.603 -5.351 -4.830 1.00 0.00 H new ATOM 0 HE3 MET A 19 8.644 -4.361 -3.351 1.00 0.00 H new ATOM 283 N LYS A 20 12.555 -6.520 -2.446 1.00 0.00 N ATOM 284 CA LYS A 20 11.991 -6.860 -1.169 1.00 0.00 C ATOM 285 C LYS A 20 13.110 -7.389 -0.311 1.00 0.00 C ATOM 286 O LYS A 20 13.269 -6.979 0.810 1.00 0.00 O ATOM 287 CB LYS A 20 10.854 -7.908 -1.374 1.00 0.00 C ATOM 288 CG LYS A 20 9.628 -7.884 -0.400 1.00 0.00 C ATOM 289 CD LYS A 20 9.833 -8.535 0.984 1.00 0.00 C ATOM 290 CE LYS A 20 10.742 -7.784 1.889 1.00 0.00 C ATOM 291 NZ LYS A 20 10.270 -6.421 2.184 1.00 0.00 N ATOM 0 H LYS A 20 12.214 -7.103 -3.210 1.00 0.00 H new ATOM 0 HA LYS A 20 11.545 -5.997 -0.675 1.00 0.00 H new ATOM 0 HB2 LYS A 20 10.473 -7.789 -2.388 1.00 0.00 H new ATOM 0 HB3 LYS A 20 11.303 -8.899 -1.316 1.00 0.00 H new ATOM 0 HG2 LYS A 20 9.334 -6.846 -0.248 1.00 0.00 H new ATOM 0 HG3 LYS A 20 8.793 -8.383 -0.891 1.00 0.00 H new ATOM 0 HD2 LYS A 20 8.863 -8.640 1.469 1.00 0.00 H new ATOM 0 HD3 LYS A 20 10.230 -9.540 0.844 1.00 0.00 H new ATOM 0 HE2 LYS A 20 10.850 -8.334 2.824 1.00 0.00 H new ATOM 0 HE3 LYS A 20 11.732 -7.729 1.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 10.608 -6.133 3.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 10.638 -5.763 1.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 9.230 -6.403 2.169 1.00 0.00 H new ATOM 305 N GLN A 21 13.920 -8.221 -0.880 1.00 0.00 N ATOM 306 CA GLN A 21 15.002 -8.837 -0.164 1.00 0.00 C ATOM 307 C GLN A 21 16.037 -7.835 0.354 1.00 0.00 C ATOM 308 O GLN A 21 16.445 -7.924 1.517 1.00 0.00 O ATOM 309 CB GLN A 21 15.593 -9.949 -0.986 1.00 0.00 C ATOM 310 CG GLN A 21 14.567 -11.039 -1.236 1.00 0.00 C ATOM 311 CD GLN A 21 14.163 -11.768 0.022 1.00 0.00 C ATOM 312 OE1 GLN A 21 14.961 -11.923 0.940 1.00 0.00 O ATOM 313 NE2 GLN A 21 12.923 -12.181 0.095 1.00 0.00 N ATOM 0 H GLN A 21 13.854 -8.498 -1.860 1.00 0.00 H new ATOM 0 HA GLN A 21 14.596 -9.280 0.745 1.00 0.00 H new ATOM 0 HB2 GLN A 21 15.950 -9.554 -1.937 1.00 0.00 H new ATOM 0 HB3 GLN A 21 16.457 -10.368 -0.471 1.00 0.00 H new ATOM 0 HG2 GLN A 21 13.682 -10.599 -1.694 1.00 0.00 H new ATOM 0 HG3 GLN A 21 14.973 -11.755 -1.950 1.00 0.00 H new ATOM 0 HE21 GLN A 21 12.289 -12.033 -0.690 1.00 0.00 H new ATOM 0 HE22 GLN A 21 12.591 -12.650 0.937 1.00 0.00 H new ATOM 322 N PHE A 22 16.437 -6.845 -0.455 1.00 0.00 N ATOM 323 CA PHE A 22 17.363 -5.853 0.109 1.00 0.00 C ATOM 324 C PHE A 22 16.636 -5.018 1.151 1.00 0.00 C ATOM 325 O PHE A 22 17.195 -4.661 2.171 1.00 0.00 O ATOM 326 CB PHE A 22 18.114 -4.951 -0.932 1.00 0.00 C ATOM 327 CG PHE A 22 17.345 -3.797 -1.561 1.00 0.00 C ATOM 328 CD1 PHE A 22 17.145 -2.592 -0.860 1.00 0.00 C ATOM 329 CD2 PHE A 22 16.868 -3.892 -2.853 1.00 0.00 C ATOM 330 CE1 PHE A 22 16.479 -1.539 -1.448 1.00 0.00 C ATOM 331 CE2 PHE A 22 16.195 -2.832 -3.439 1.00 0.00 C ATOM 332 CZ PHE A 22 16.002 -1.658 -2.737 1.00 0.00 C ATOM 0 H PHE A 22 16.161 -6.711 -1.428 1.00 0.00 H new ATOM 0 HA PHE A 22 18.167 -6.426 0.571 1.00 0.00 H new ATOM 0 HB2 PHE A 22 18.995 -4.538 -0.442 1.00 0.00 H new ATOM 0 HB3 PHE A 22 18.469 -5.594 -1.737 1.00 0.00 H new ATOM 0 HD1 PHE A 22 17.518 -2.492 0.149 1.00 0.00 H new ATOM 0 HD2 PHE A 22 17.021 -4.803 -3.413 1.00 0.00 H new ATOM 0 HE1 PHE A 22 16.330 -0.620 -0.900 1.00 0.00 H new ATOM 0 HE2 PHE A 22 15.820 -2.924 -4.448 1.00 0.00 H new ATOM 0 HZ PHE A 22 15.478 -0.833 -3.197 1.00 0.00 H new ATOM 342 N LEU A 23 15.366 -4.750 0.875 1.00 0.00 N ATOM 343 CA LEU A 23 14.520 -3.950 1.694 1.00 0.00 C ATOM 344 C LEU A 23 14.333 -4.538 3.066 1.00 0.00 C ATOM 345 O LEU A 23 14.356 -3.818 4.035 1.00 0.00 O ATOM 346 CB LEU A 23 13.198 -3.802 1.016 1.00 0.00 C ATOM 347 CG LEU A 23 12.389 -2.635 1.448 1.00 0.00 C ATOM 348 CD1 LEU A 23 13.048 -1.333 0.998 1.00 0.00 C ATOM 349 CD2 LEU A 23 11.047 -2.740 0.875 1.00 0.00 C ATOM 0 H LEU A 23 14.898 -5.105 0.041 1.00 0.00 H new ATOM 0 HA LEU A 23 14.993 -2.977 1.828 1.00 0.00 H new ATOM 0 HB2 LEU A 23 13.366 -3.729 -0.059 1.00 0.00 H new ATOM 0 HB3 LEU A 23 12.617 -4.709 1.187 1.00 0.00 H new ATOM 0 HG LEU A 23 12.323 -2.629 2.536 1.00 0.00 H new ATOM 0 HD11 LEU A 23 12.442 -0.487 1.323 1.00 0.00 H new ATOM 0 HD12 LEU A 23 14.042 -1.257 1.438 1.00 0.00 H new ATOM 0 HD13 LEU A 23 13.131 -1.324 -0.089 1.00 0.00 H new ATOM 0 HD21 LEU A 23 10.449 -1.885 1.190 1.00 0.00 H new ATOM 0 HD22 LEU A 23 11.116 -2.754 -0.213 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.575 -3.660 1.221 1.00 0.00 H new ATOM 361 N LEU A 24 14.144 -5.837 3.144 1.00 0.00 N ATOM 362 CA LEU A 24 13.980 -6.488 4.420 1.00 0.00 C ATOM 363 C LEU A 24 15.260 -6.436 5.216 1.00 0.00 C ATOM 364 O LEU A 24 15.237 -6.203 6.401 1.00 0.00 O ATOM 365 CB LEU A 24 13.430 -7.913 4.276 1.00 0.00 C ATOM 366 CG LEU A 24 14.183 -8.891 3.397 1.00 0.00 C ATOM 367 CD1 LEU A 24 15.342 -9.551 4.106 1.00 0.00 C ATOM 368 CD2 LEU A 24 13.239 -9.888 2.833 1.00 0.00 C ATOM 0 H LEU A 24 14.100 -6.461 2.338 1.00 0.00 H new ATOM 0 HA LEU A 24 13.227 -5.936 4.982 1.00 0.00 H new ATOM 0 HB2 LEU A 24 13.365 -8.346 5.274 1.00 0.00 H new ATOM 0 HB3 LEU A 24 12.412 -7.839 3.894 1.00 0.00 H new ATOM 0 HG LEU A 24 14.630 -8.325 2.579 1.00 0.00 H new ATOM 0 HD11 LEU A 24 15.841 -10.240 3.424 1.00 0.00 H new ATOM 0 HD12 LEU A 24 16.049 -8.789 4.434 1.00 0.00 H new ATOM 0 HD13 LEU A 24 14.973 -10.101 4.972 1.00 0.00 H new ATOM 0 HD21 LEU A 24 13.785 -10.589 2.202 1.00 0.00 H new ATOM 0 HD22 LEU A 24 12.756 -10.431 3.645 1.00 0.00 H new ATOM 0 HD23 LEU A 24 12.483 -9.377 2.238 1.00 0.00 H new ATOM 380 N TYR A 25 16.385 -6.604 4.523 1.00 0.00 N ATOM 381 CA TYR A 25 17.697 -6.540 5.140 1.00 0.00 C ATOM 382 C TYR A 25 17.953 -5.143 5.653 1.00 0.00 C ATOM 383 O TYR A 25 18.527 -4.940 6.719 1.00 0.00 O ATOM 384 CB TYR A 25 18.774 -6.916 4.114 1.00 0.00 C ATOM 385 CG TYR A 25 20.200 -6.720 4.595 1.00 0.00 C ATOM 386 CD1 TYR A 25 20.793 -7.640 5.440 1.00 0.00 C ATOM 387 CD2 TYR A 25 20.960 -5.620 4.184 1.00 0.00 C ATOM 388 CE1 TYR A 25 22.087 -7.484 5.863 1.00 0.00 C ATOM 389 CE2 TYR A 25 22.259 -5.459 4.611 1.00 0.00 C ATOM 390 CZ TYR A 25 22.819 -6.397 5.448 1.00 0.00 C ATOM 391 OH TYR A 25 24.130 -6.250 5.876 1.00 0.00 O ATOM 0 H TYR A 25 16.407 -6.788 3.520 1.00 0.00 H new ATOM 0 HA TYR A 25 17.733 -7.242 5.973 1.00 0.00 H new ATOM 0 HB2 TYR A 25 18.640 -7.960 3.832 1.00 0.00 H new ATOM 0 HB3 TYR A 25 18.623 -6.321 3.213 1.00 0.00 H new ATOM 0 HD1 TYR A 25 20.226 -8.497 5.773 1.00 0.00 H new ATOM 0 HD2 TYR A 25 20.522 -4.887 3.523 1.00 0.00 H new ATOM 0 HE1 TYR A 25 22.532 -8.215 6.522 1.00 0.00 H new ATOM 0 HE2 TYR A 25 22.834 -4.603 4.291 1.00 0.00 H new ATOM 0 HH TYR A 25 24.509 -5.431 5.493 1.00 0.00 H new ATOM 401 N LEU A 26 17.541 -4.199 4.885 1.00 0.00 N ATOM 402 CA LEU A 26 17.723 -2.822 5.192 1.00 0.00 C ATOM 403 C LEU A 26 16.790 -2.404 6.339 1.00 0.00 C ATOM 404 O LEU A 26 17.175 -1.609 7.205 1.00 0.00 O ATOM 405 CB LEU A 26 17.535 -2.002 3.913 1.00 0.00 C ATOM 406 CG LEU A 26 17.902 -0.539 3.954 1.00 0.00 C ATOM 407 CD1 LEU A 26 19.342 -0.380 4.400 1.00 0.00 C ATOM 408 CD2 LEU A 26 17.702 0.078 2.582 1.00 0.00 C ATOM 0 H LEU A 26 17.056 -4.365 4.003 1.00 0.00 H new ATOM 0 HA LEU A 26 18.735 -2.633 5.551 1.00 0.00 H new ATOM 0 HB2 LEU A 26 18.122 -2.472 3.124 1.00 0.00 H new ATOM 0 HB3 LEU A 26 16.488 -2.076 3.618 1.00 0.00 H new ATOM 0 HG LEU A 26 17.258 -0.026 4.668 1.00 0.00 H new ATOM 0 HD11 LEU A 26 19.600 0.679 4.427 1.00 0.00 H new ATOM 0 HD12 LEU A 26 19.464 -0.809 5.395 1.00 0.00 H new ATOM 0 HD13 LEU A 26 19.999 -0.895 3.699 1.00 0.00 H new ATOM 0 HD21 LEU A 26 17.968 1.134 2.616 1.00 0.00 H new ATOM 0 HD22 LEU A 26 18.336 -0.433 1.857 1.00 0.00 H new ATOM 0 HD23 LEU A 26 16.658 -0.024 2.286 1.00 0.00 H new ATOM 420 N ASP A 27 15.587 -2.961 6.340 1.00 0.00 N ATOM 421 CA ASP A 27 14.609 -2.791 7.423 1.00 0.00 C ATOM 422 C ASP A 27 15.192 -3.345 8.699 1.00 0.00 C ATOM 423 O ASP A 27 15.160 -2.708 9.762 1.00 0.00 O ATOM 424 CB ASP A 27 13.330 -3.563 7.086 1.00 0.00 C ATOM 425 CG ASP A 27 12.360 -3.609 8.236 1.00 0.00 C ATOM 426 OD1 ASP A 27 11.834 -2.570 8.618 1.00 0.00 O ATOM 427 OD2 ASP A 27 12.155 -4.696 8.816 1.00 0.00 O ATOM 0 H ASP A 27 15.251 -3.554 5.581 1.00 0.00 H new ATOM 0 HA ASP A 27 14.376 -1.733 7.542 1.00 0.00 H new ATOM 0 HB2 ASP A 27 12.846 -3.099 6.226 1.00 0.00 H new ATOM 0 HB3 ASP A 27 13.591 -4.581 6.795 1.00 0.00 H new ATOM 432 N GLU A 28 15.754 -4.518 8.546 1.00 0.00 N ATOM 433 CA GLU A 28 16.440 -5.270 9.569 1.00 0.00 C ATOM 434 C GLU A 28 17.626 -4.478 10.134 1.00 0.00 C ATOM 435 O GLU A 28 17.853 -4.435 11.348 1.00 0.00 O ATOM 436 CB GLU A 28 16.939 -6.560 8.915 1.00 0.00 C ATOM 437 CG GLU A 28 17.742 -7.437 9.799 1.00 0.00 C ATOM 438 CD GLU A 28 16.952 -7.880 10.988 1.00 0.00 C ATOM 439 OE1 GLU A 28 16.016 -8.681 10.817 1.00 0.00 O ATOM 440 OE2 GLU A 28 17.222 -7.408 12.101 1.00 0.00 O ATOM 0 H GLU A 28 15.744 -5.004 7.649 1.00 0.00 H new ATOM 0 HA GLU A 28 15.766 -5.480 10.399 1.00 0.00 H new ATOM 0 HB2 GLU A 28 16.079 -7.123 8.553 1.00 0.00 H new ATOM 0 HB3 GLU A 28 17.539 -6.300 8.043 1.00 0.00 H new ATOM 0 HG2 GLU A 28 18.081 -8.309 9.239 1.00 0.00 H new ATOM 0 HG3 GLU A 28 18.634 -6.905 10.130 1.00 0.00 H new ATOM 447 N SER A 29 18.370 -3.854 9.254 1.00 0.00 N ATOM 448 CA SER A 29 19.513 -3.073 9.647 1.00 0.00 C ATOM 449 C SER A 29 19.067 -1.761 10.293 1.00 0.00 C ATOM 450 O SER A 29 19.771 -1.203 11.123 1.00 0.00 O ATOM 451 CB SER A 29 20.415 -2.820 8.440 1.00 0.00 C ATOM 452 OG SER A 29 20.814 -4.065 7.844 1.00 0.00 O ATOM 0 H SER A 29 18.200 -3.874 8.249 1.00 0.00 H new ATOM 0 HA SER A 29 20.087 -3.630 10.388 1.00 0.00 H new ATOM 0 HB2 SER A 29 19.888 -2.210 7.706 1.00 0.00 H new ATOM 0 HB3 SER A 29 21.297 -2.258 8.748 1.00 0.00 H new ATOM 0 HG SER A 29 20.087 -4.406 7.282 1.00 0.00 H new ATOM 458 N ASN A 30 17.869 -1.288 9.889 1.00 0.00 N ATOM 459 CA ASN A 30 17.243 -0.062 10.420 1.00 0.00 C ATOM 460 C ASN A 30 18.158 1.138 10.144 1.00 0.00 C ATOM 461 O ASN A 30 18.181 2.128 10.875 1.00 0.00 O ATOM 462 CB ASN A 30 16.970 -0.225 11.927 1.00 0.00 C ATOM 463 CG ASN A 30 16.128 0.884 12.530 1.00 0.00 C ATOM 464 OD1 ASN A 30 15.258 1.451 11.869 1.00 0.00 O ATOM 465 ND2 ASN A 30 16.375 1.201 13.778 1.00 0.00 N ATOM 0 H ASN A 30 17.305 -1.753 9.178 1.00 0.00 H new ATOM 0 HA ASN A 30 16.288 0.113 9.924 1.00 0.00 H new ATOM 0 HB2 ASN A 30 16.468 -1.178 12.093 1.00 0.00 H new ATOM 0 HB3 ASN A 30 17.923 -0.270 12.455 1.00 0.00 H new ATOM 0 HD21 ASN A 30 15.838 1.940 14.232 1.00 0.00 H new ATOM 0 HD22 ASN A 30 17.104 0.709 14.294 1.00 0.00 H new ATOM 472 N ALA A 31 18.850 1.058 9.019 1.00 0.00 N ATOM 473 CA ALA A 31 19.833 2.059 8.602 1.00 0.00 C ATOM 474 C ALA A 31 19.214 3.435 8.414 1.00 0.00 C ATOM 475 O ALA A 31 19.884 4.450 8.520 1.00 0.00 O ATOM 476 CB ALA A 31 20.529 1.608 7.330 1.00 0.00 C ATOM 0 H ALA A 31 18.747 0.288 8.358 1.00 0.00 H new ATOM 0 HA ALA A 31 20.567 2.149 9.403 1.00 0.00 H new ATOM 0 HB1 ALA A 31 21.258 2.360 7.028 1.00 0.00 H new ATOM 0 HB2 ALA A 31 21.037 0.661 7.510 1.00 0.00 H new ATOM 0 HB3 ALA A 31 19.792 1.479 6.538 1.00 0.00 H new ATOM 482 N LEU A 32 17.941 3.455 8.160 1.00 0.00 N ATOM 483 CA LEU A 32 17.247 4.683 7.900 1.00 0.00 C ATOM 484 C LEU A 32 16.480 5.181 9.125 1.00 0.00 C ATOM 485 O LEU A 32 15.721 6.128 9.037 1.00 0.00 O ATOM 486 CB LEU A 32 16.357 4.494 6.683 1.00 0.00 C ATOM 487 CG LEU A 32 17.123 4.173 5.388 1.00 0.00 C ATOM 488 CD1 LEU A 32 16.174 3.835 4.267 1.00 0.00 C ATOM 489 CD2 LEU A 32 18.031 5.336 4.992 1.00 0.00 C ATOM 0 H LEU A 32 17.353 2.622 8.127 1.00 0.00 H new ATOM 0 HA LEU A 32 17.971 5.468 7.682 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.651 3.688 6.884 1.00 0.00 H new ATOM 0 HB3 LEU A 32 15.771 5.400 6.531 1.00 0.00 H new ATOM 0 HG LEU A 32 17.747 3.300 5.577 1.00 0.00 H new ATOM 0 HD11 LEU A 32 16.742 3.612 3.364 1.00 0.00 H new ATOM 0 HD12 LEU A 32 15.578 2.965 4.544 1.00 0.00 H new ATOM 0 HD13 LEU A 32 15.514 4.682 4.081 1.00 0.00 H new ATOM 0 HD21 LEU A 32 18.562 5.086 4.074 1.00 0.00 H new ATOM 0 HD22 LEU A 32 17.428 6.230 4.831 1.00 0.00 H new ATOM 0 HD23 LEU A 32 18.751 5.523 5.789 1.00 0.00 H new ATOM 501 N GLY A 33 16.684 4.509 10.264 1.00 0.00 N ATOM 502 CA GLY A 33 16.122 4.924 11.566 1.00 0.00 C ATOM 503 C GLY A 33 14.600 4.888 11.673 1.00 0.00 C ATOM 504 O GLY A 33 14.034 5.251 12.710 1.00 0.00 O ATOM 0 H GLY A 33 17.245 3.658 10.315 1.00 0.00 H new ATOM 0 HA2 GLY A 33 16.537 4.281 12.342 1.00 0.00 H new ATOM 0 HA3 GLY A 33 16.459 5.939 11.779 1.00 0.00 H new ATOM 508 N LYS A 34 13.946 4.460 10.633 1.00 0.00 N ATOM 509 CA LYS A 34 12.508 4.379 10.591 1.00 0.00 C ATOM 510 C LYS A 34 12.108 3.085 9.937 1.00 0.00 C ATOM 511 O LYS A 34 12.911 2.464 9.225 1.00 0.00 O ATOM 512 CB LYS A 34 11.865 5.518 9.758 1.00 0.00 C ATOM 513 CG LYS A 34 11.832 6.948 10.327 1.00 0.00 C ATOM 514 CD LYS A 34 13.178 7.650 10.346 1.00 0.00 C ATOM 515 CE LYS A 34 13.023 9.118 10.731 1.00 0.00 C ATOM 516 NZ LYS A 34 12.371 9.289 12.047 1.00 0.00 N ATOM 0 H LYS A 34 14.401 4.151 9.774 1.00 0.00 H new ATOM 0 HA LYS A 34 12.161 4.455 11.622 1.00 0.00 H new ATOM 0 HB2 LYS A 34 12.388 5.559 8.802 1.00 0.00 H new ATOM 0 HB3 LYS A 34 10.836 5.227 9.546 1.00 0.00 H new ATOM 0 HG2 LYS A 34 11.134 7.544 9.738 1.00 0.00 H new ATOM 0 HG3 LYS A 34 11.441 6.912 11.344 1.00 0.00 H new ATOM 0 HD2 LYS A 34 13.842 7.153 11.053 1.00 0.00 H new ATOM 0 HD3 LYS A 34 13.645 7.575 9.364 1.00 0.00 H new ATOM 0 HE2 LYS A 34 14.005 9.591 10.751 1.00 0.00 H new ATOM 0 HE3 LYS A 34 12.437 9.631 9.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 12.439 10.284 12.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 11.370 9.017 11.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 12.845 8.686 12.750 1.00 0.00 H new ATOM 530 N LYS A 35 10.890 2.677 10.165 1.00 0.00 N ATOM 531 CA LYS A 35 10.334 1.544 9.472 1.00 0.00 C ATOM 532 C LYS A 35 9.741 2.045 8.190 1.00 0.00 C ATOM 533 O LYS A 35 8.636 2.584 8.164 1.00 0.00 O ATOM 534 CB LYS A 35 9.270 0.811 10.308 1.00 0.00 C ATOM 535 CG LYS A 35 9.720 0.218 11.664 1.00 0.00 C ATOM 536 CD LYS A 35 10.584 -1.049 11.548 1.00 0.00 C ATOM 537 CE LYS A 35 12.040 -0.782 11.176 1.00 0.00 C ATOM 538 NZ LYS A 35 12.779 -2.048 11.021 1.00 0.00 N ATOM 0 H LYS A 35 10.256 3.117 10.833 1.00 0.00 H new ATOM 0 HA LYS A 35 11.124 0.817 9.281 1.00 0.00 H new ATOM 0 HB2 LYS A 35 8.452 1.506 10.498 1.00 0.00 H new ATOM 0 HB3 LYS A 35 8.865 0.000 9.703 1.00 0.00 H new ATOM 0 HG2 LYS A 35 10.281 0.977 12.210 1.00 0.00 H new ATOM 0 HG3 LYS A 35 8.835 -0.013 12.257 1.00 0.00 H new ATOM 0 HD2 LYS A 35 10.556 -1.583 12.498 1.00 0.00 H new ATOM 0 HD3 LYS A 35 10.144 -1.708 10.799 1.00 0.00 H new ATOM 0 HE2 LYS A 35 12.085 -0.213 10.247 1.00 0.00 H new ATOM 0 HE3 LYS A 35 12.511 -0.172 11.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 13.707 -1.858 10.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 12.914 -2.488 11.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 12.239 -2.693 10.409 1.00 0.00 H new ATOM 552 N PHE A 36 10.510 1.933 7.150 1.00 0.00 N ATOM 553 CA PHE A 36 10.080 2.362 5.853 1.00 0.00 C ATOM 554 C PHE A 36 9.102 1.371 5.276 1.00 0.00 C ATOM 555 O PHE A 36 7.978 1.730 4.932 1.00 0.00 O ATOM 556 CB PHE A 36 11.286 2.647 4.916 1.00 0.00 C ATOM 557 CG PHE A 36 12.384 1.616 4.951 1.00 0.00 C ATOM 558 CD1 PHE A 36 12.374 0.517 4.111 1.00 0.00 C ATOM 559 CD2 PHE A 36 13.433 1.760 5.840 1.00 0.00 C ATOM 560 CE1 PHE A 36 13.386 -0.411 4.167 1.00 0.00 C ATOM 561 CE2 PHE A 36 14.444 0.833 5.893 1.00 0.00 C ATOM 562 CZ PHE A 36 14.417 -0.251 5.054 1.00 0.00 C ATOM 0 H PHE A 36 11.452 1.542 7.176 1.00 0.00 H new ATOM 0 HA PHE A 36 9.555 3.312 5.952 1.00 0.00 H new ATOM 0 HB2 PHE A 36 10.919 2.729 3.893 1.00 0.00 H new ATOM 0 HB3 PHE A 36 11.710 3.615 5.181 1.00 0.00 H new ATOM 0 HD1 PHE A 36 11.566 0.387 3.407 1.00 0.00 H new ATOM 0 HD2 PHE A 36 13.457 2.613 6.502 1.00 0.00 H new ATOM 0 HE1 PHE A 36 13.368 -1.268 3.510 1.00 0.00 H new ATOM 0 HE2 PHE A 36 15.257 0.957 6.593 1.00 0.00 H new ATOM 0 HZ PHE A 36 15.212 -0.981 5.093 1.00 0.00 H new ATOM 572 N ILE A 37 9.498 0.131 5.225 1.00 0.00 N ATOM 573 CA ILE A 37 8.632 -0.897 4.774 1.00 0.00 C ATOM 574 C ILE A 37 7.705 -1.238 5.940 1.00 0.00 C ATOM 575 O ILE A 37 8.129 -1.746 6.985 1.00 0.00 O ATOM 576 CB ILE A 37 9.445 -2.125 4.145 1.00 0.00 C ATOM 577 CG1 ILE A 37 8.597 -3.312 3.652 1.00 0.00 C ATOM 578 CG2 ILE A 37 10.553 -2.626 5.013 1.00 0.00 C ATOM 579 CD1 ILE A 37 7.918 -4.126 4.741 1.00 0.00 C ATOM 0 H ILE A 37 10.429 -0.185 5.496 1.00 0.00 H new ATOM 0 HA ILE A 37 8.011 -0.575 3.938 1.00 0.00 H new ATOM 0 HB ILE A 37 9.876 -1.664 3.256 1.00 0.00 H new ATOM 0 HG12 ILE A 37 7.832 -2.933 2.975 1.00 0.00 H new ATOM 0 HG13 ILE A 37 9.236 -3.976 3.071 1.00 0.00 H new ATOM 0 HG21 ILE A 37 11.055 -3.457 4.518 1.00 0.00 H new ATOM 0 HG22 ILE A 37 11.268 -1.823 5.190 1.00 0.00 H new ATOM 0 HG23 ILE A 37 10.145 -2.964 5.965 1.00 0.00 H new ATOM 0 HD11 ILE A 37 7.347 -4.936 4.287 1.00 0.00 H new ATOM 0 HD12 ILE A 37 8.673 -4.543 5.408 1.00 0.00 H new ATOM 0 HD13 ILE A 37 7.246 -3.483 5.310 1.00 0.00 H new ATOM 591 N ILE A 38 6.469 -0.854 5.781 1.00 0.00 N ATOM 592 CA ILE A 38 5.468 -1.017 6.803 1.00 0.00 C ATOM 593 C ILE A 38 4.864 -2.401 6.750 1.00 0.00 C ATOM 594 O ILE A 38 4.776 -3.102 7.773 1.00 0.00 O ATOM 595 CB ILE A 38 4.362 0.058 6.668 1.00 0.00 C ATOM 596 CG1 ILE A 38 4.928 1.458 6.948 1.00 0.00 C ATOM 597 CG2 ILE A 38 3.184 -0.257 7.574 1.00 0.00 C ATOM 598 CD1 ILE A 38 3.915 2.573 6.793 1.00 0.00 C ATOM 0 H ILE A 38 6.122 -0.414 4.929 1.00 0.00 H new ATOM 0 HA ILE A 38 5.955 -0.891 7.770 1.00 0.00 H new ATOM 0 HB ILE A 38 3.997 0.046 5.641 1.00 0.00 H new ATOM 0 HG12 ILE A 38 5.327 1.482 7.962 1.00 0.00 H new ATOM 0 HG13 ILE A 38 5.763 1.643 6.273 1.00 0.00 H new ATOM 0 HG21 ILE A 38 2.421 0.513 7.460 1.00 0.00 H new ATOM 0 HG22 ILE A 38 2.765 -1.226 7.302 1.00 0.00 H new ATOM 0 HG23 ILE A 38 3.520 -0.285 8.611 1.00 0.00 H new ATOM 0 HD11 ILE A 38 4.391 3.530 7.007 1.00 0.00 H new ATOM 0 HD12 ILE A 38 3.533 2.578 5.772 1.00 0.00 H new ATOM 0 HD13 ILE A 38 3.090 2.414 7.488 1.00 0.00 H new ATOM 610 N GLN A 39 4.432 -2.790 5.591 1.00 0.00 N ATOM 611 CA GLN A 39 3.875 -4.084 5.423 1.00 0.00 C ATOM 612 C GLN A 39 4.291 -4.681 4.144 1.00 0.00 C ATOM 613 O GLN A 39 4.372 -3.992 3.112 1.00 0.00 O ATOM 614 CB GLN A 39 2.344 -4.137 5.581 1.00 0.00 C ATOM 615 CG GLN A 39 1.564 -3.184 4.695 1.00 0.00 C ATOM 616 CD GLN A 39 0.068 -3.506 4.634 1.00 0.00 C ATOM 617 OE1 GLN A 39 -0.749 -2.624 4.490 1.00 0.00 O ATOM 618 NE2 GLN A 39 -0.292 -4.772 4.709 1.00 0.00 N ATOM 0 H GLN A 39 4.457 -2.221 4.745 1.00 0.00 H new ATOM 0 HA GLN A 39 4.278 -4.680 6.242 1.00 0.00 H new ATOM 0 HB2 GLN A 39 2.010 -5.154 5.375 1.00 0.00 H new ATOM 0 HB3 GLN A 39 2.096 -3.925 6.621 1.00 0.00 H new ATOM 0 HG2 GLN A 39 1.695 -2.166 5.063 1.00 0.00 H new ATOM 0 HG3 GLN A 39 1.977 -3.215 3.687 1.00 0.00 H new ATOM 0 HE21 GLN A 39 0.415 -5.497 4.830 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -1.278 -5.027 4.646 1.00 0.00 H new ATOM 627 N ASP A 40 4.620 -5.932 4.207 1.00 0.00 N ATOM 628 CA ASP A 40 4.887 -6.673 3.034 1.00 0.00 C ATOM 629 C ASP A 40 3.596 -7.153 2.547 1.00 0.00 C ATOM 630 O ASP A 40 2.931 -7.971 3.196 1.00 0.00 O ATOM 631 CB ASP A 40 5.804 -7.871 3.248 1.00 0.00 C ATOM 632 CG ASP A 40 7.200 -7.497 3.580 1.00 0.00 C ATOM 633 OD1 ASP A 40 7.811 -6.750 2.820 1.00 0.00 O ATOM 634 OD2 ASP A 40 7.715 -7.944 4.632 1.00 0.00 O ATOM 0 H ASP A 40 4.709 -6.460 5.075 1.00 0.00 H new ATOM 0 HA ASP A 40 5.406 -6.022 2.331 1.00 0.00 H new ATOM 0 HB2 ASP A 40 5.401 -8.488 4.051 1.00 0.00 H new ATOM 0 HB3 ASP A 40 5.805 -8.483 2.346 1.00 0.00 H new ATOM 639 N ILE A 41 3.197 -6.648 1.460 1.00 0.00 N ATOM 640 CA ILE A 41 1.974 -7.020 0.877 1.00 0.00 C ATOM 641 C ILE A 41 2.182 -8.205 -0.074 1.00 0.00 C ATOM 642 O ILE A 41 2.228 -8.115 -1.305 1.00 0.00 O ATOM 643 CB ILE A 41 1.210 -5.837 0.288 1.00 0.00 C ATOM 644 CG1 ILE A 41 2.151 -4.684 -0.034 1.00 0.00 C ATOM 645 CG2 ILE A 41 0.079 -5.362 1.214 1.00 0.00 C ATOM 646 CD1 ILE A 41 1.467 -3.416 -0.402 1.00 0.00 C ATOM 0 H ILE A 41 3.719 -5.948 0.933 1.00 0.00 H new ATOM 0 HA ILE A 41 1.304 -7.374 1.660 1.00 0.00 H new ATOM 0 HB ILE A 41 0.754 -6.184 -0.639 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.790 -4.500 0.830 1.00 0.00 H new ATOM 0 HG13 ILE A 41 2.803 -4.982 -0.855 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -0.437 -4.519 0.755 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -0.627 -6.177 1.373 1.00 0.00 H new ATOM 0 HG23 ILE A 41 0.498 -5.053 2.171 1.00 0.00 H new ATOM 0 HD11 ILE A 41 2.212 -2.649 -0.615 1.00 0.00 H new ATOM 0 HD12 ILE A 41 0.850 -3.579 -1.286 1.00 0.00 H new ATOM 0 HD13 ILE A 41 0.837 -3.089 0.425 1.00 0.00 H new ATOM 658 N ASP A 42 2.477 -9.227 0.629 1.00 0.00 N ATOM 659 CA ASP A 42 2.781 -10.612 0.286 1.00 0.00 C ATOM 660 C ASP A 42 3.731 -10.862 -0.842 1.00 0.00 C ATOM 661 O ASP A 42 3.397 -10.735 -2.022 1.00 0.00 O ATOM 662 CB ASP A 42 1.591 -11.518 0.227 1.00 0.00 C ATOM 663 CG ASP A 42 2.010 -12.977 0.357 1.00 0.00 C ATOM 664 OD1 ASP A 42 2.429 -13.386 1.471 1.00 0.00 O ATOM 665 OD2 ASP A 42 1.928 -13.746 -0.609 1.00 0.00 O ATOM 0 H ASP A 42 2.526 -9.116 1.642 1.00 0.00 H new ATOM 0 HA ASP A 42 3.361 -10.891 1.166 1.00 0.00 H new ATOM 0 HB2 ASP A 42 0.895 -11.263 1.026 1.00 0.00 H new ATOM 0 HB3 ASP A 42 1.063 -11.370 -0.715 1.00 0.00 H new ATOM 670 N ASP A 43 4.942 -11.148 -0.421 1.00 0.00 N ATOM 671 CA ASP A 43 6.093 -11.659 -1.213 1.00 0.00 C ATOM 672 C ASP A 43 6.664 -10.666 -2.197 1.00 0.00 C ATOM 673 O ASP A 43 7.877 -10.442 -2.257 1.00 0.00 O ATOM 674 CB ASP A 43 5.715 -12.968 -1.925 1.00 0.00 C ATOM 675 CG ASP A 43 6.787 -13.503 -2.862 1.00 0.00 C ATOM 676 OD1 ASP A 43 7.672 -14.267 -2.409 1.00 0.00 O ATOM 677 OD2 ASP A 43 6.714 -13.216 -4.078 1.00 0.00 O ATOM 0 H ASP A 43 5.192 -11.028 0.561 1.00 0.00 H new ATOM 0 HA ASP A 43 6.888 -11.844 -0.491 1.00 0.00 H new ATOM 0 HB2 ASP A 43 5.495 -13.726 -1.173 1.00 0.00 H new ATOM 0 HB3 ASP A 43 4.799 -12.807 -2.494 1.00 0.00 H new ATOM 682 N THR A 44 5.804 -10.055 -2.896 1.00 0.00 N ATOM 683 CA THR A 44 6.171 -9.214 -4.000 1.00 0.00 C ATOM 684 C THR A 44 5.852 -7.740 -3.754 1.00 0.00 C ATOM 685 O THR A 44 6.608 -6.858 -4.170 1.00 0.00 O ATOM 686 CB THR A 44 5.509 -9.726 -5.321 1.00 0.00 C ATOM 687 OG1 THR A 44 6.006 -11.040 -5.658 1.00 0.00 O ATOM 688 CG2 THR A 44 5.748 -8.780 -6.499 1.00 0.00 C ATOM 0 H THR A 44 4.799 -10.112 -2.732 1.00 0.00 H new ATOM 0 HA THR A 44 7.254 -9.277 -4.104 1.00 0.00 H new ATOM 0 HB THR A 44 4.436 -9.768 -5.137 1.00 0.00 H new ATOM 0 HG1 THR A 44 6.182 -11.544 -4.836 1.00 0.00 H new ATOM 0 HG21 THR A 44 5.268 -9.182 -7.391 1.00 0.00 H new ATOM 0 HG22 THR A 44 5.328 -7.801 -6.270 1.00 0.00 H new ATOM 0 HG23 THR A 44 6.819 -8.683 -6.676 1.00 0.00 H new ATOM 696 N HIS A 45 4.775 -7.440 -3.055 1.00 0.00 N ATOM 697 CA HIS A 45 4.440 -6.052 -2.912 1.00 0.00 C ATOM 698 C HIS A 45 4.991 -5.505 -1.635 1.00 0.00 C ATOM 699 O HIS A 45 5.033 -6.189 -0.620 1.00 0.00 O ATOM 700 CB HIS A 45 2.938 -5.804 -3.034 1.00 0.00 C ATOM 701 CG HIS A 45 2.403 -6.125 -4.380 1.00 0.00 C ATOM 702 ND1 HIS A 45 2.356 -5.209 -5.384 1.00 0.00 N ATOM 703 CD2 HIS A 45 1.925 -7.284 -4.902 1.00 0.00 C ATOM 704 CE1 HIS A 45 1.885 -5.776 -6.477 1.00 0.00 C ATOM 705 NE2 HIS A 45 1.612 -7.029 -6.208 1.00 0.00 N ATOM 0 H HIS A 45 4.150 -8.106 -2.601 1.00 0.00 H new ATOM 0 HA HIS A 45 4.907 -5.515 -3.738 1.00 0.00 H new ATOM 0 HB2 HIS A 45 2.415 -6.404 -2.289 1.00 0.00 H new ATOM 0 HB3 HIS A 45 2.729 -4.759 -2.806 1.00 0.00 H new ATOM 0 HD2 HIS A 45 1.814 -8.226 -4.385 1.00 0.00 H new ATOM 0 HE1 HIS A 45 1.748 -5.290 -7.432 1.00 0.00 H new ATOM 0 HE2 HIS A 45 1.228 -7.706 -6.867 1.00 0.00 H new ATOM 714 N VAL A 46 5.412 -4.296 -1.691 1.00 0.00 N ATOM 715 CA VAL A 46 5.977 -3.614 -0.566 1.00 0.00 C ATOM 716 C VAL A 46 5.240 -2.328 -0.362 1.00 0.00 C ATOM 717 O VAL A 46 4.804 -1.703 -1.334 1.00 0.00 O ATOM 718 CB VAL A 46 7.505 -3.344 -0.782 1.00 0.00 C ATOM 719 CG1 VAL A 46 7.985 -2.135 0.017 1.00 0.00 C ATOM 720 CG2 VAL A 46 8.313 -4.573 -0.366 1.00 0.00 C ATOM 0 H VAL A 46 5.376 -3.730 -2.539 1.00 0.00 H new ATOM 0 HA VAL A 46 5.878 -4.240 0.321 1.00 0.00 H new ATOM 0 HB VAL A 46 7.655 -3.135 -1.841 1.00 0.00 H new ATOM 0 HG11 VAL A 46 9.049 -1.981 -0.160 1.00 0.00 H new ATOM 0 HG12 VAL A 46 7.433 -1.249 -0.297 1.00 0.00 H new ATOM 0 HG13 VAL A 46 7.815 -2.310 1.079 1.00 0.00 H new ATOM 0 HG21 VAL A 46 9.375 -4.379 -0.519 1.00 0.00 H new ATOM 0 HG22 VAL A 46 8.131 -4.789 0.687 1.00 0.00 H new ATOM 0 HG23 VAL A 46 8.010 -5.429 -0.969 1.00 0.00 H new ATOM 730 N PHE A 47 5.044 -1.965 0.868 1.00 0.00 N ATOM 731 CA PHE A 47 4.449 -0.729 1.156 1.00 0.00 C ATOM 732 C PHE A 47 5.384 0.095 2.018 1.00 0.00 C ATOM 733 O PHE A 47 5.869 -0.380 3.060 1.00 0.00 O ATOM 734 CB PHE A 47 3.139 -0.922 1.865 1.00 0.00 C ATOM 735 CG PHE A 47 2.349 0.317 1.899 1.00 0.00 C ATOM 736 CD1 PHE A 47 1.518 0.639 0.848 1.00 0.00 C ATOM 737 CD2 PHE A 47 2.445 1.166 2.962 1.00 0.00 C ATOM 738 CE1 PHE A 47 0.790 1.792 0.869 1.00 0.00 C ATOM 739 CE2 PHE A 47 1.726 2.317 2.995 1.00 0.00 C ATOM 740 CZ PHE A 47 0.893 2.629 1.943 1.00 0.00 C ATOM 0 H PHE A 47 5.295 -2.523 1.684 1.00 0.00 H new ATOM 0 HA PHE A 47 4.259 -0.206 0.219 1.00 0.00 H new ATOM 0 HB2 PHE A 47 2.567 -1.704 1.366 1.00 0.00 H new ATOM 0 HB3 PHE A 47 3.324 -1.263 2.884 1.00 0.00 H new ATOM 0 HD1 PHE A 47 1.443 -0.027 0.001 1.00 0.00 H new ATOM 0 HD2 PHE A 47 3.099 0.920 3.785 1.00 0.00 H new ATOM 0 HE1 PHE A 47 0.138 2.041 0.044 1.00 0.00 H new ATOM 0 HE2 PHE A 47 1.807 2.984 3.841 1.00 0.00 H new ATOM 0 HZ PHE A 47 0.317 3.542 1.968 1.00 0.00 H new ATOM 750 N VAL A 48 5.625 1.297 1.594 1.00 0.00 N ATOM 751 CA VAL A 48 6.445 2.233 2.308 1.00 0.00 C ATOM 752 C VAL A 48 5.724 3.574 2.354 1.00 0.00 C ATOM 753 O VAL A 48 5.143 3.993 1.375 1.00 0.00 O ATOM 754 CB VAL A 48 7.889 2.335 1.698 1.00 0.00 C ATOM 755 CG1 VAL A 48 7.874 2.516 0.193 1.00 0.00 C ATOM 756 CG2 VAL A 48 8.686 3.447 2.343 1.00 0.00 C ATOM 0 H VAL A 48 5.249 1.666 0.721 1.00 0.00 H new ATOM 0 HA VAL A 48 6.595 1.883 3.329 1.00 0.00 H new ATOM 0 HB VAL A 48 8.374 1.383 1.913 1.00 0.00 H new ATOM 0 HG11 VAL A 48 8.898 2.581 -0.176 1.00 0.00 H new ATOM 0 HG12 VAL A 48 7.374 1.666 -0.271 1.00 0.00 H new ATOM 0 HG13 VAL A 48 7.339 3.432 -0.058 1.00 0.00 H new ATOM 0 HG21 VAL A 48 9.680 3.489 1.897 1.00 0.00 H new ATOM 0 HG22 VAL A 48 8.177 4.398 2.185 1.00 0.00 H new ATOM 0 HG23 VAL A 48 8.776 3.257 3.412 1.00 0.00 H new ATOM 766 N ILE A 49 5.723 4.225 3.484 1.00 0.00 N ATOM 767 CA ILE A 49 4.926 5.456 3.609 1.00 0.00 C ATOM 768 C ILE A 49 5.658 6.665 3.037 1.00 0.00 C ATOM 769 O ILE A 49 6.880 6.789 3.143 1.00 0.00 O ATOM 770 CB ILE A 49 4.421 5.713 5.055 1.00 0.00 C ATOM 771 CG1 ILE A 49 3.408 6.875 5.090 1.00 0.00 C ATOM 772 CG2 ILE A 49 5.571 5.945 6.028 1.00 0.00 C ATOM 773 CD1 ILE A 49 2.813 7.140 6.454 1.00 0.00 C ATOM 0 H ILE A 49 6.241 3.951 4.319 1.00 0.00 H new ATOM 0 HA ILE A 49 4.032 5.299 3.005 1.00 0.00 H new ATOM 0 HB ILE A 49 3.906 4.811 5.384 1.00 0.00 H new ATOM 0 HG12 ILE A 49 3.901 7.782 4.739 1.00 0.00 H new ATOM 0 HG13 ILE A 49 2.601 6.659 4.390 1.00 0.00 H new ATOM 0 HG21 ILE A 49 5.172 6.121 7.027 1.00 0.00 H new ATOM 0 HG22 ILE A 49 6.217 5.067 6.044 1.00 0.00 H new ATOM 0 HG23 ILE A 49 6.147 6.814 5.710 1.00 0.00 H new ATOM 0 HD11 ILE A 49 2.112 7.972 6.390 1.00 0.00 H new ATOM 0 HD12 ILE A 49 2.289 6.250 6.802 1.00 0.00 H new ATOM 0 HD13 ILE A 49 3.609 7.390 7.156 1.00 0.00 H new ATOM 785 N ALA A 50 4.894 7.560 2.439 1.00 0.00 N ATOM 786 CA ALA A 50 5.427 8.708 1.736 1.00 0.00 C ATOM 787 C ALA A 50 6.188 9.679 2.637 1.00 0.00 C ATOM 788 O ALA A 50 7.038 10.418 2.159 1.00 0.00 O ATOM 789 CB ALA A 50 4.339 9.423 0.967 1.00 0.00 C ATOM 0 H ALA A 50 3.875 7.508 2.429 1.00 0.00 H new ATOM 0 HA ALA A 50 6.160 8.316 1.031 1.00 0.00 H new ATOM 0 HB1 ALA A 50 4.765 10.282 0.448 1.00 0.00 H new ATOM 0 HB2 ALA A 50 3.899 8.741 0.240 1.00 0.00 H new ATOM 0 HB3 ALA A 50 3.568 9.763 1.658 1.00 0.00 H new ATOM 795 N GLU A 51 5.911 9.646 3.931 1.00 0.00 N ATOM 796 CA GLU A 51 6.561 10.549 4.879 1.00 0.00 C ATOM 797 C GLU A 51 8.069 10.324 4.875 1.00 0.00 C ATOM 798 O GLU A 51 8.861 11.263 4.975 1.00 0.00 O ATOM 799 CB GLU A 51 6.030 10.336 6.297 1.00 0.00 C ATOM 800 CG GLU A 51 4.515 10.365 6.422 1.00 0.00 C ATOM 801 CD GLU A 51 3.889 11.559 5.758 1.00 0.00 C ATOM 802 OE1 GLU A 51 4.052 12.695 6.252 1.00 0.00 O ATOM 803 OE2 GLU A 51 3.226 11.381 4.712 1.00 0.00 O ATOM 0 H GLU A 51 5.240 9.004 4.353 1.00 0.00 H new ATOM 0 HA GLU A 51 6.339 11.570 4.567 1.00 0.00 H new ATOM 0 HB2 GLU A 51 6.392 9.376 6.665 1.00 0.00 H new ATOM 0 HB3 GLU A 51 6.449 11.105 6.946 1.00 0.00 H new ATOM 0 HG2 GLU A 51 4.103 9.456 5.983 1.00 0.00 H new ATOM 0 HG3 GLU A 51 4.244 10.361 7.478 1.00 0.00 H new ATOM 810 N LEU A 52 8.455 9.085 4.708 1.00 0.00 N ATOM 811 CA LEU A 52 9.842 8.718 4.728 1.00 0.00 C ATOM 812 C LEU A 52 10.306 8.156 3.391 1.00 0.00 C ATOM 813 O LEU A 52 11.401 7.615 3.286 1.00 0.00 O ATOM 814 CB LEU A 52 10.144 7.779 5.921 1.00 0.00 C ATOM 815 CG LEU A 52 9.157 6.630 6.158 1.00 0.00 C ATOM 816 CD1 LEU A 52 9.180 5.612 5.050 1.00 0.00 C ATOM 817 CD2 LEU A 52 9.384 5.970 7.492 1.00 0.00 C ATOM 0 H LEU A 52 7.815 8.305 4.555 1.00 0.00 H new ATOM 0 HA LEU A 52 10.429 9.624 4.881 1.00 0.00 H new ATOM 0 HB2 LEU A 52 11.136 7.351 5.775 1.00 0.00 H new ATOM 0 HB3 LEU A 52 10.187 8.383 6.827 1.00 0.00 H new ATOM 0 HG LEU A 52 8.163 7.078 6.164 1.00 0.00 H new ATOM 0 HD11 LEU A 52 8.463 4.821 5.268 1.00 0.00 H new ATOM 0 HD12 LEU A 52 8.915 6.093 4.109 1.00 0.00 H new ATOM 0 HD13 LEU A 52 10.179 5.184 4.970 1.00 0.00 H new ATOM 0 HD21 LEU A 52 8.666 5.161 7.624 1.00 0.00 H new ATOM 0 HD22 LEU A 52 10.396 5.567 7.531 1.00 0.00 H new ATOM 0 HD23 LEU A 52 9.255 6.704 8.288 1.00 0.00 H new ATOM 829 N VAL A 53 9.493 8.325 2.343 1.00 0.00 N ATOM 830 CA VAL A 53 9.913 7.887 1.012 1.00 0.00 C ATOM 831 C VAL A 53 11.073 8.756 0.582 1.00 0.00 C ATOM 832 O VAL A 53 11.938 8.326 -0.127 1.00 0.00 O ATOM 833 CB VAL A 53 8.779 7.861 -0.076 1.00 0.00 C ATOM 834 CG1 VAL A 53 8.297 9.250 -0.462 1.00 0.00 C ATOM 835 CG2 VAL A 53 9.223 7.080 -1.311 1.00 0.00 C ATOM 0 H VAL A 53 8.567 8.750 2.388 1.00 0.00 H new ATOM 0 HA VAL A 53 10.207 6.841 1.093 1.00 0.00 H new ATOM 0 HB VAL A 53 7.930 7.349 0.377 1.00 0.00 H new ATOM 0 HG11 VAL A 53 7.515 9.167 -1.216 1.00 0.00 H new ATOM 0 HG12 VAL A 53 7.900 9.755 0.419 1.00 0.00 H new ATOM 0 HG13 VAL A 53 9.130 9.825 -0.865 1.00 0.00 H new ATOM 0 HG21 VAL A 53 8.420 7.077 -2.048 1.00 0.00 H new ATOM 0 HG22 VAL A 53 10.108 7.550 -1.740 1.00 0.00 H new ATOM 0 HG23 VAL A 53 9.459 6.054 -1.028 1.00 0.00 H new ATOM 845 N ASN A 54 11.070 9.991 1.071 1.00 0.00 N ATOM 846 CA ASN A 54 12.154 10.966 0.883 1.00 0.00 C ATOM 847 C ASN A 54 13.479 10.356 1.352 1.00 0.00 C ATOM 848 O ASN A 54 14.522 10.543 0.737 1.00 0.00 O ATOM 849 CB ASN A 54 11.895 12.223 1.739 1.00 0.00 C ATOM 850 CG ASN A 54 10.577 12.937 1.479 1.00 0.00 C ATOM 851 OD1 ASN A 54 9.581 12.334 1.076 1.00 0.00 O ATOM 852 ND2 ASN A 54 10.550 14.210 1.746 1.00 0.00 N ATOM 0 H ASN A 54 10.296 10.358 1.625 1.00 0.00 H new ATOM 0 HA ASN A 54 12.197 11.229 -0.174 1.00 0.00 H new ATOM 0 HB2 ASN A 54 11.932 11.938 2.790 1.00 0.00 H new ATOM 0 HB3 ASN A 54 12.709 12.929 1.571 1.00 0.00 H new ATOM 0 HD21 ASN A 54 9.686 14.739 1.623 1.00 0.00 H new ATOM 0 HD22 ASN A 54 11.392 14.679 2.078 1.00 0.00 H new ATOM 859 N VAL A 55 13.393 9.537 2.394 1.00 0.00 N ATOM 860 CA VAL A 55 14.551 8.931 3.023 1.00 0.00 C ATOM 861 C VAL A 55 15.054 7.837 2.115 1.00 0.00 C ATOM 862 O VAL A 55 16.248 7.620 1.939 1.00 0.00 O ATOM 863 CB VAL A 55 14.152 8.357 4.415 1.00 0.00 C ATOM 864 CG1 VAL A 55 15.265 7.595 5.061 1.00 0.00 C ATOM 865 CG2 VAL A 55 13.715 9.462 5.334 1.00 0.00 C ATOM 0 H VAL A 55 12.507 9.275 2.827 1.00 0.00 H new ATOM 0 HA VAL A 55 15.338 9.669 3.178 1.00 0.00 H new ATOM 0 HB VAL A 55 13.327 7.666 4.241 1.00 0.00 H new ATOM 0 HG11 VAL A 55 14.934 7.217 6.028 1.00 0.00 H new ATOM 0 HG12 VAL A 55 15.552 6.759 4.423 1.00 0.00 H new ATOM 0 HG13 VAL A 55 16.122 8.253 5.203 1.00 0.00 H new ATOM 0 HG21 VAL A 55 13.440 9.043 6.302 1.00 0.00 H new ATOM 0 HG22 VAL A 55 14.532 10.171 5.465 1.00 0.00 H new ATOM 0 HG23 VAL A 55 12.855 9.975 4.903 1.00 0.00 H new ATOM 875 N LEU A 56 14.115 7.188 1.518 1.00 0.00 N ATOM 876 CA LEU A 56 14.352 6.158 0.562 1.00 0.00 C ATOM 877 C LEU A 56 14.955 6.773 -0.718 1.00 0.00 C ATOM 878 O LEU A 56 15.814 6.182 -1.344 1.00 0.00 O ATOM 879 CB LEU A 56 13.027 5.458 0.280 1.00 0.00 C ATOM 880 CG LEU A 56 13.014 3.939 0.285 1.00 0.00 C ATOM 881 CD1 LEU A 56 13.819 3.368 -0.866 1.00 0.00 C ATOM 882 CD2 LEU A 56 13.528 3.390 1.608 1.00 0.00 C ATOM 0 H LEU A 56 13.125 7.365 1.687 1.00 0.00 H new ATOM 0 HA LEU A 56 15.064 5.426 0.942 1.00 0.00 H new ATOM 0 HB2 LEU A 56 12.303 5.802 1.018 1.00 0.00 H new ATOM 0 HB3 LEU A 56 12.672 5.793 -0.695 1.00 0.00 H new ATOM 0 HG LEU A 56 11.977 3.629 0.159 1.00 0.00 H new ATOM 0 HD11 LEU A 56 13.786 2.279 -0.828 1.00 0.00 H new ATOM 0 HD12 LEU A 56 13.397 3.711 -1.811 1.00 0.00 H new ATOM 0 HD13 LEU A 56 14.853 3.702 -0.788 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.507 2.300 1.582 1.00 0.00 H new ATOM 0 HD22 LEU A 56 14.551 3.730 1.770 1.00 0.00 H new ATOM 0 HD23 LEU A 56 12.894 3.746 2.420 1.00 0.00 H new ATOM 894 N GLN A 57 14.506 7.986 -1.073 1.00 0.00 N ATOM 895 CA GLN A 57 14.994 8.695 -2.269 1.00 0.00 C ATOM 896 C GLN A 57 16.427 9.007 -2.113 1.00 0.00 C ATOM 897 O GLN A 57 17.228 8.797 -3.038 1.00 0.00 O ATOM 898 CB GLN A 57 14.218 9.993 -2.537 1.00 0.00 C ATOM 899 CG GLN A 57 12.733 9.785 -2.604 1.00 0.00 C ATOM 900 CD GLN A 57 12.303 8.799 -3.659 1.00 0.00 C ATOM 901 OE1 GLN A 57 11.944 9.169 -4.771 1.00 0.00 O ATOM 902 NE2 GLN A 57 12.483 7.551 -3.360 1.00 0.00 N ATOM 0 H GLN A 57 13.801 8.501 -0.546 1.00 0.00 H new ATOM 0 HA GLN A 57 14.839 8.034 -3.122 1.00 0.00 H new ATOM 0 HB2 GLN A 57 14.443 10.714 -1.751 1.00 0.00 H new ATOM 0 HB3 GLN A 57 14.561 10.428 -3.476 1.00 0.00 H new ATOM 0 HG2 GLN A 57 12.380 9.440 -1.632 1.00 0.00 H new ATOM 0 HG3 GLN A 57 12.250 10.743 -2.797 1.00 0.00 H new ATOM 0 HE21 GLN A 57 12.783 7.290 -2.421 1.00 0.00 H new ATOM 0 HE22 GLN A 57 12.325 6.830 -4.064 1.00 0.00 H new ATOM 1237 N VAL B 5 6.003 -3.445 -12.796 1.00 0.00 N ATOM 1238 CA VAL B 5 6.455 -2.488 -11.823 1.00 0.00 C ATOM 1239 C VAL B 5 5.392 -1.430 -11.657 1.00 0.00 C ATOM 1240 O VAL B 5 5.210 -0.570 -12.525 1.00 0.00 O ATOM 1241 CB VAL B 5 7.803 -1.795 -12.188 1.00 0.00 C ATOM 1242 CG1 VAL B 5 8.215 -0.829 -11.080 1.00 0.00 C ATOM 1243 CG2 VAL B 5 8.906 -2.809 -12.421 1.00 0.00 C ATOM 0 HA VAL B 5 6.633 -3.041 -10.901 1.00 0.00 H new ATOM 0 HB VAL B 5 7.650 -1.242 -13.115 1.00 0.00 H new ATOM 0 HG11 VAL B 5 9.158 -0.351 -11.346 1.00 0.00 H new ATOM 0 HG12 VAL B 5 7.445 -0.068 -10.956 1.00 0.00 H new ATOM 0 HG13 VAL B 5 8.337 -1.377 -10.146 1.00 0.00 H new ATOM 0 HG21 VAL B 5 9.830 -2.290 -12.673 1.00 0.00 H new ATOM 0 HG22 VAL B 5 9.056 -3.398 -11.516 1.00 0.00 H new ATOM 0 HG23 VAL B 5 8.626 -3.470 -13.241 1.00 0.00 H new ATOM 1253 N ASN B 6 4.665 -1.520 -10.601 1.00 0.00 N ATOM 1254 CA ASN B 6 3.647 -0.544 -10.300 1.00 0.00 C ATOM 1255 C ASN B 6 3.858 0.041 -8.954 1.00 0.00 C ATOM 1256 O ASN B 6 3.588 -0.565 -7.936 1.00 0.00 O ATOM 1257 CB ASN B 6 2.230 -1.100 -10.436 1.00 0.00 C ATOM 1258 CG ASN B 6 1.797 -1.247 -11.866 1.00 0.00 C ATOM 1259 OD1 ASN B 6 1.225 -0.326 -12.451 1.00 0.00 O ATOM 1260 ND2 ASN B 6 2.028 -2.377 -12.441 1.00 0.00 N ATOM 0 H ASN B 6 4.749 -2.268 -9.913 1.00 0.00 H new ATOM 0 HA ASN B 6 3.743 0.245 -11.045 1.00 0.00 H new ATOM 0 HB2 ASN B 6 2.177 -2.071 -9.944 1.00 0.00 H new ATOM 0 HB3 ASN B 6 1.535 -0.441 -9.917 1.00 0.00 H new ATOM 0 HD21 ASN B 6 1.735 -2.527 -13.406 1.00 0.00 H new ATOM 0 HD22 ASN B 6 2.504 -3.121 -11.931 1.00 0.00 H new ATOM 1267 N VAL B 7 4.416 1.181 -8.958 1.00 0.00 N ATOM 1268 CA VAL B 7 4.639 1.928 -7.757 1.00 0.00 C ATOM 1269 C VAL B 7 3.856 3.242 -7.831 1.00 0.00 C ATOM 1270 O VAL B 7 3.931 3.948 -8.844 1.00 0.00 O ATOM 1271 CB VAL B 7 6.169 2.156 -7.477 1.00 0.00 C ATOM 1272 CG1 VAL B 7 6.903 2.620 -8.718 1.00 0.00 C ATOM 1273 CG2 VAL B 7 6.385 3.162 -6.364 1.00 0.00 C ATOM 0 H VAL B 7 4.744 1.646 -9.805 1.00 0.00 H new ATOM 0 HA VAL B 7 4.272 1.351 -6.908 1.00 0.00 H new ATOM 0 HB VAL B 7 6.574 1.192 -7.169 1.00 0.00 H new ATOM 0 HG11 VAL B 7 7.957 2.766 -8.484 1.00 0.00 H new ATOM 0 HG12 VAL B 7 6.806 1.867 -9.501 1.00 0.00 H new ATOM 0 HG13 VAL B 7 6.474 3.560 -9.064 1.00 0.00 H new ATOM 0 HG21 VAL B 7 7.454 3.296 -6.197 1.00 0.00 H new ATOM 0 HG22 VAL B 7 5.940 4.116 -6.645 1.00 0.00 H new ATOM 0 HG23 VAL B 7 5.917 2.798 -5.449 1.00 0.00 H new ATOM 1283 N LEU B 8 3.095 3.552 -6.805 1.00 0.00 N ATOM 1284 CA LEU B 8 2.257 4.743 -6.807 1.00 0.00 C ATOM 1285 C LEU B 8 1.845 5.130 -5.390 1.00 0.00 C ATOM 1286 O LEU B 8 2.129 4.401 -4.437 1.00 0.00 O ATOM 1287 CB LEU B 8 1.021 4.600 -7.750 1.00 0.00 C ATOM 1288 CG LEU B 8 -0.017 3.524 -7.466 1.00 0.00 C ATOM 1289 CD1 LEU B 8 -1.151 3.676 -8.445 1.00 0.00 C ATOM 1290 CD2 LEU B 8 0.541 2.114 -7.563 1.00 0.00 C ATOM 0 H LEU B 8 3.035 2.996 -5.952 1.00 0.00 H new ATOM 0 HA LEU B 8 2.860 5.556 -7.211 1.00 0.00 H new ATOM 0 HB2 LEU B 8 0.503 5.559 -7.758 1.00 0.00 H new ATOM 0 HB3 LEU B 8 1.398 4.433 -8.759 1.00 0.00 H new ATOM 0 HG LEU B 8 -0.355 3.661 -6.439 1.00 0.00 H new ATOM 0 HD11 LEU B 8 -1.903 2.910 -8.253 1.00 0.00 H new ATOM 0 HD12 LEU B 8 -1.600 4.663 -8.331 1.00 0.00 H new ATOM 0 HD13 LEU B 8 -0.772 3.565 -9.461 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -0.249 1.394 -7.350 1.00 0.00 H new ATOM 0 HD22 LEU B 8 0.925 1.943 -8.569 1.00 0.00 H new ATOM 0 HD23 LEU B 8 1.348 1.992 -6.841 1.00 0.00 H new ATOM 1302 N LYS B 9 1.175 6.253 -5.263 1.00 0.00 N ATOM 1303 CA LYS B 9 0.835 6.818 -3.974 1.00 0.00 C ATOM 1304 C LYS B 9 -0.697 6.877 -3.838 1.00 0.00 C ATOM 1305 O LYS B 9 -1.404 7.176 -4.807 1.00 0.00 O ATOM 1306 CB LYS B 9 1.450 8.230 -3.931 1.00 0.00 C ATOM 1307 CG LYS B 9 1.729 8.860 -2.543 1.00 0.00 C ATOM 1308 CD LYS B 9 0.487 9.040 -1.682 1.00 0.00 C ATOM 1309 CE LYS B 9 0.795 9.786 -0.393 1.00 0.00 C ATOM 1310 NZ LYS B 9 1.215 11.185 -0.642 1.00 0.00 N ATOM 0 H LYS B 9 0.848 6.805 -6.056 1.00 0.00 H new ATOM 0 HA LYS B 9 1.220 6.217 -3.150 1.00 0.00 H new ATOM 0 HB2 LYS B 9 2.391 8.201 -4.480 1.00 0.00 H new ATOM 0 HB3 LYS B 9 0.785 8.901 -4.474 1.00 0.00 H new ATOM 0 HG2 LYS B 9 2.441 8.232 -2.008 1.00 0.00 H new ATOM 0 HG3 LYS B 9 2.203 9.831 -2.685 1.00 0.00 H new ATOM 0 HD2 LYS B 9 -0.270 9.586 -2.246 1.00 0.00 H new ATOM 0 HD3 LYS B 9 0.065 8.063 -1.445 1.00 0.00 H new ATOM 0 HE2 LYS B 9 -0.087 9.782 0.247 1.00 0.00 H new ATOM 0 HE3 LYS B 9 1.583 9.263 0.148 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 1.169 11.725 0.246 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 2.190 11.196 -1.003 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 0.581 11.618 -1.343 1.00 0.00 H new ATOM 1324 N GLY B 10 -1.197 6.565 -2.657 1.00 0.00 N ATOM 1325 CA GLY B 10 -2.612 6.597 -2.405 1.00 0.00 C ATOM 1326 C GLY B 10 -2.968 5.817 -1.160 1.00 0.00 C ATOM 1327 O GLY B 10 -2.239 5.884 -0.153 1.00 0.00 O ATOM 0 H GLY B 10 -0.632 6.285 -1.855 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -2.940 7.631 -2.295 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -3.145 6.183 -3.261 1.00 0.00 H new ATOM 1331 N VAL B 11 -4.055 5.071 -1.236 1.00 0.00 N ATOM 1332 CA VAL B 11 -4.565 4.283 -0.135 1.00 0.00 C ATOM 1333 C VAL B 11 -4.575 2.800 -0.503 1.00 0.00 C ATOM 1334 O VAL B 11 -5.064 2.393 -1.566 1.00 0.00 O ATOM 1335 CB VAL B 11 -6.008 4.727 0.288 1.00 0.00 C ATOM 1336 CG1 VAL B 11 -6.571 3.836 1.394 1.00 0.00 C ATOM 1337 CG2 VAL B 11 -6.008 6.167 0.755 1.00 0.00 C ATOM 0 H VAL B 11 -4.618 4.996 -2.083 1.00 0.00 H new ATOM 0 HA VAL B 11 -3.900 4.448 0.713 1.00 0.00 H new ATOM 0 HB VAL B 11 -6.644 4.629 -0.592 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -7.572 4.175 1.660 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -6.618 2.805 1.042 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -5.925 3.891 2.270 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -7.019 6.456 1.044 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -5.342 6.272 1.611 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -5.664 6.812 -0.054 1.00 0.00 H new ATOM 1347 N LEU B 12 -4.026 2.038 0.368 1.00 0.00 N ATOM 1348 CA LEU B 12 -3.939 0.616 0.276 1.00 0.00 C ATOM 1349 C LEU B 12 -5.005 0.022 1.173 1.00 0.00 C ATOM 1350 O LEU B 12 -5.074 0.375 2.328 1.00 0.00 O ATOM 1351 CB LEU B 12 -2.563 0.192 0.785 1.00 0.00 C ATOM 1352 CG LEU B 12 -2.340 -1.298 0.995 1.00 0.00 C ATOM 1353 CD1 LEU B 12 -2.468 -2.062 -0.301 1.00 0.00 C ATOM 1354 CD2 LEU B 12 -0.997 -1.533 1.619 1.00 0.00 C ATOM 0 H LEU B 12 -3.598 2.405 1.218 1.00 0.00 H new ATOM 0 HA LEU B 12 -4.080 0.278 -0.751 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -1.814 0.552 0.080 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -2.379 0.700 1.732 1.00 0.00 H new ATOM 0 HG LEU B 12 -3.113 -1.666 1.670 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -2.303 -3.123 -0.116 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -3.467 -1.917 -0.712 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -1.727 -1.698 -1.012 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -0.846 -2.602 1.766 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -0.218 -1.143 0.964 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -0.949 -1.024 2.582 1.00 0.00 H new ATOM 1366 N ILE B 13 -5.833 -0.847 0.659 1.00 0.00 N ATOM 1367 CA ILE B 13 -6.865 -1.445 1.485 1.00 0.00 C ATOM 1368 C ILE B 13 -6.998 -2.957 1.277 1.00 0.00 C ATOM 1369 O ILE B 13 -6.888 -3.452 0.149 1.00 0.00 O ATOM 1370 CB ILE B 13 -8.243 -0.690 1.330 1.00 0.00 C ATOM 1371 CG1 ILE B 13 -9.376 -1.363 2.133 1.00 0.00 C ATOM 1372 CG2 ILE B 13 -8.627 -0.523 -0.122 1.00 0.00 C ATOM 1373 CD1 ILE B 13 -10.663 -0.569 2.179 1.00 0.00 C ATOM 0 H ILE B 13 -5.821 -1.158 -0.312 1.00 0.00 H new ATOM 0 HA ILE B 13 -6.545 -1.321 2.520 1.00 0.00 H new ATOM 0 HB ILE B 13 -8.100 0.304 1.753 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -9.582 -2.341 1.699 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -9.031 -1.533 3.153 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -9.581 0.001 -0.188 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -7.859 0.054 -0.637 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -8.718 -1.504 -0.589 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -11.406 -1.113 2.763 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -10.476 0.400 2.642 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -11.036 -0.421 1.165 1.00 0.00 H new ATOM 1385 N GLU B 14 -7.102 -3.686 2.386 1.00 0.00 N ATOM 1386 CA GLU B 14 -7.436 -5.099 2.382 1.00 0.00 C ATOM 1387 C GLU B 14 -8.339 -5.341 3.565 1.00 0.00 C ATOM 1388 O GLU B 14 -8.269 -4.588 4.572 1.00 0.00 O ATOM 1389 CB GLU B 14 -6.225 -6.038 2.550 1.00 0.00 C ATOM 1390 CG GLU B 14 -5.720 -6.158 3.986 1.00 0.00 C ATOM 1391 CD GLU B 14 -4.655 -7.192 4.192 1.00 0.00 C ATOM 1392 OE1 GLU B 14 -4.808 -8.328 3.721 1.00 0.00 O ATOM 1393 OE2 GLU B 14 -3.616 -6.855 4.775 1.00 0.00 O ATOM 0 H GLU B 14 -6.954 -3.303 3.320 1.00 0.00 H new ATOM 0 HA GLU B 14 -7.886 -5.319 1.414 1.00 0.00 H new ATOM 0 HB2 GLU B 14 -6.496 -7.030 2.188 1.00 0.00 H new ATOM 0 HB3 GLU B 14 -5.411 -5.680 1.919 1.00 0.00 H new ATOM 0 HG2 GLU B 14 -5.333 -5.189 4.302 1.00 0.00 H new ATOM 0 HG3 GLU B 14 -6.564 -6.391 4.635 1.00 0.00 H new ATOM 1400 N CYS B 15 -9.141 -6.342 3.462 1.00 0.00 N ATOM 1401 CA CYS B 15 -10.003 -6.786 4.536 1.00 0.00 C ATOM 1402 C CYS B 15 -10.208 -8.257 4.397 1.00 0.00 C ATOM 1403 O CYS B 15 -9.784 -9.063 5.228 1.00 0.00 O ATOM 1404 CB CYS B 15 -11.372 -6.123 4.457 1.00 0.00 C ATOM 1405 SG CYS B 15 -11.360 -4.332 4.663 1.00 0.00 S ATOM 0 H CYS B 15 -9.229 -6.899 2.612 1.00 0.00 H new ATOM 0 HA CYS B 15 -9.532 -6.525 5.484 1.00 0.00 H new ATOM 0 HB2 CYS B 15 -11.819 -6.360 3.492 1.00 0.00 H new ATOM 0 HB3 CYS B 15 -12.015 -6.558 5.222 1.00 0.00 H new ATOM 0 HG CYS B 15 -10.132 -3.909 4.711 1.00 0.00 H new ATOM 1411 N ASP B 16 -10.831 -8.587 3.319 1.00 0.00 N ATOM 1412 CA ASP B 16 -11.205 -9.908 2.990 1.00 0.00 C ATOM 1413 C ASP B 16 -11.247 -9.989 1.478 1.00 0.00 C ATOM 1414 O ASP B 16 -11.322 -8.963 0.811 1.00 0.00 O ATOM 1415 CB ASP B 16 -12.569 -10.273 3.629 1.00 0.00 C ATOM 1416 CG ASP B 16 -13.703 -9.352 3.233 1.00 0.00 C ATOM 1417 OD1 ASP B 16 -14.380 -9.622 2.220 1.00 0.00 O ATOM 1418 OD2 ASP B 16 -13.963 -8.371 3.958 1.00 0.00 O ATOM 0 H ASP B 16 -11.104 -7.905 2.612 1.00 0.00 H new ATOM 0 HA ASP B 16 -10.488 -10.629 3.383 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -12.829 -11.293 3.347 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -12.465 -10.258 4.714 1.00 0.00 H new ATOM 1423 N PRO B 17 -11.142 -11.168 0.907 1.00 0.00 N ATOM 1424 CA PRO B 17 -11.072 -11.357 -0.549 1.00 0.00 C ATOM 1425 C PRO B 17 -12.423 -11.165 -1.237 1.00 0.00 C ATOM 1426 O PRO B 17 -12.487 -10.906 -2.441 1.00 0.00 O ATOM 1427 CB PRO B 17 -10.559 -12.801 -0.655 1.00 0.00 C ATOM 1428 CG PRO B 17 -10.004 -13.048 0.707 1.00 0.00 C ATOM 1429 CD PRO B 17 -11.001 -12.445 1.585 1.00 0.00 C ATOM 0 HA PRO B 17 -10.436 -10.627 -1.050 1.00 0.00 H new ATOM 0 HB2 PRO B 17 -11.360 -13.499 -0.899 1.00 0.00 H new ATOM 0 HB3 PRO B 17 -9.798 -12.905 -1.428 1.00 0.00 H new ATOM 0 HG2 PRO B 17 -9.883 -14.113 0.906 1.00 0.00 H new ATOM 0 HG3 PRO B 17 -9.024 -12.587 0.833 1.00 0.00 H new ATOM 0 HD2 PRO B 17 -11.932 -13.011 1.619 1.00 0.00 H new ATOM 0 HD3 PRO B 17 -10.653 -12.342 2.613 1.00 0.00 H new ATOM 1437 N ALA B 18 -13.487 -11.235 -0.455 1.00 0.00 N ATOM 1438 CA ALA B 18 -14.844 -11.013 -0.945 1.00 0.00 C ATOM 1439 C ALA B 18 -15.002 -9.555 -1.291 1.00 0.00 C ATOM 1440 O ALA B 18 -15.724 -9.179 -2.234 1.00 0.00 O ATOM 1441 CB ALA B 18 -15.812 -11.356 0.127 1.00 0.00 C ATOM 0 H ALA B 18 -13.438 -11.448 0.541 1.00 0.00 H new ATOM 0 HA ALA B 18 -15.027 -11.633 -1.823 1.00 0.00 H new ATOM 0 HB1 ALA B 18 -16.827 -11.192 -0.234 1.00 0.00 H new ATOM 0 HB2 ALA B 18 -15.691 -12.403 0.406 1.00 0.00 H new ATOM 0 HB3 ALA B 18 -15.630 -10.725 0.997 1.00 0.00 H new ATOM 1447 N MET B 19 -14.284 -8.751 -0.540 1.00 0.00 N ATOM 1448 CA MET B 19 -14.219 -7.325 -0.714 1.00 0.00 C ATOM 1449 C MET B 19 -13.689 -7.008 -2.091 1.00 0.00 C ATOM 1450 O MET B 19 -14.244 -6.175 -2.803 1.00 0.00 O ATOM 1451 CB MET B 19 -13.273 -6.756 0.353 1.00 0.00 C ATOM 1452 CG MET B 19 -12.411 -5.624 -0.145 1.00 0.00 C ATOM 1453 SD MET B 19 -11.100 -5.156 0.973 1.00 0.00 S ATOM 1454 CE MET B 19 -10.215 -4.037 -0.098 1.00 0.00 C ATOM 0 H MET B 19 -13.711 -9.087 0.234 1.00 0.00 H new ATOM 0 HA MET B 19 -15.210 -6.883 -0.610 1.00 0.00 H new ATOM 0 HB2 MET B 19 -13.863 -6.406 1.200 1.00 0.00 H new ATOM 0 HB3 MET B 19 -12.630 -7.556 0.721 1.00 0.00 H new ATOM 0 HG2 MET B 19 -11.973 -5.909 -1.102 1.00 0.00 H new ATOM 0 HG3 MET B 19 -13.043 -4.755 -0.330 1.00 0.00 H new ATOM 0 HE1 MET B 19 -9.168 -3.996 0.204 1.00 0.00 H new ATOM 0 HE2 MET B 19 -10.282 -4.389 -1.127 1.00 0.00 H new ATOM 0 HE3 MET B 19 -10.653 -3.041 -0.026 1.00 0.00 H new ATOM 1464 N LYS B 20 -12.672 -7.744 -2.483 1.00 0.00 N ATOM 1465 CA LYS B 20 -12.036 -7.577 -3.762 1.00 0.00 C ATOM 1466 C LYS B 20 -13.038 -7.720 -4.865 1.00 0.00 C ATOM 1467 O LYS B 20 -13.100 -6.896 -5.781 1.00 0.00 O ATOM 1468 CB LYS B 20 -10.898 -8.617 -3.893 1.00 0.00 C ATOM 1469 CG LYS B 20 -10.471 -9.043 -5.324 1.00 0.00 C ATOM 1470 CD LYS B 20 -10.189 -7.873 -6.268 1.00 0.00 C ATOM 1471 CE LYS B 20 -9.265 -6.890 -5.664 1.00 0.00 C ATOM 1472 NZ LYS B 20 -7.950 -7.437 -5.389 1.00 0.00 N ATOM 0 H LYS B 20 -12.262 -8.483 -1.912 1.00 0.00 H new ATOM 0 HA LYS B 20 -11.610 -6.577 -3.839 1.00 0.00 H new ATOM 0 HB2 LYS B 20 -10.019 -8.219 -3.385 1.00 0.00 H new ATOM 0 HB3 LYS B 20 -11.199 -9.514 -3.352 1.00 0.00 H new ATOM 0 HG2 LYS B 20 -9.577 -9.663 -5.255 1.00 0.00 H new ATOM 0 HG3 LYS B 20 -11.257 -9.663 -5.756 1.00 0.00 H new ATOM 0 HD2 LYS B 20 -9.761 -8.250 -7.197 1.00 0.00 H new ATOM 0 HD3 LYS B 20 -11.126 -7.380 -6.526 1.00 0.00 H new ATOM 0 HE2 LYS B 20 -9.164 -6.037 -6.334 1.00 0.00 H new ATOM 0 HE3 LYS B 20 -9.698 -6.517 -4.736 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 -7.360 -6.711 -4.936 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 -8.040 -8.255 -4.754 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 -7.506 -7.738 -6.280 1.00 0.00 H new ATOM 1486 N GLN B 21 -13.851 -8.691 -4.721 1.00 0.00 N ATOM 1487 CA GLN B 21 -14.763 -9.042 -5.722 1.00 0.00 C ATOM 1488 C GLN B 21 -15.859 -7.996 -5.881 1.00 0.00 C ATOM 1489 O GLN B 21 -16.302 -7.729 -7.005 1.00 0.00 O ATOM 1490 CB GLN B 21 -15.231 -10.460 -5.475 1.00 0.00 C ATOM 1491 CG GLN B 21 -14.008 -11.380 -5.348 1.00 0.00 C ATOM 1492 CD GLN B 21 -14.325 -12.831 -5.110 1.00 0.00 C ATOM 1493 OE1 GLN B 21 -15.327 -13.170 -4.490 1.00 0.00 O ATOM 1494 NE2 GLN B 21 -13.472 -13.699 -5.585 1.00 0.00 N ATOM 0 H GLN B 21 -13.899 -9.274 -3.885 1.00 0.00 H new ATOM 0 HA GLN B 21 -14.286 -9.043 -6.702 1.00 0.00 H new ATOM 0 HB2 GLN B 21 -15.831 -10.505 -4.566 1.00 0.00 H new ATOM 0 HB3 GLN B 21 -15.868 -10.793 -6.294 1.00 0.00 H new ATOM 0 HG2 GLN B 21 -13.415 -11.298 -6.259 1.00 0.00 H new ATOM 0 HG3 GLN B 21 -13.386 -11.021 -4.529 1.00 0.00 H new ATOM 0 HE21 GLN B 21 -12.649 -13.379 -6.096 1.00 0.00 H new ATOM 0 HE22 GLN B 21 -13.629 -14.697 -5.445 1.00 0.00 H new ATOM 1503 N PHE B 22 -16.279 -7.364 -4.783 1.00 0.00 N ATOM 1504 CA PHE B 22 -17.223 -6.271 -4.925 1.00 0.00 C ATOM 1505 C PHE B 22 -16.597 -5.013 -5.561 1.00 0.00 C ATOM 1506 O PHE B 22 -17.266 -4.312 -6.303 1.00 0.00 O ATOM 1507 CB PHE B 22 -18.136 -5.970 -3.701 1.00 0.00 C ATOM 1508 CG PHE B 22 -17.512 -5.337 -2.474 1.00 0.00 C ATOM 1509 CD1 PHE B 22 -17.126 -4.000 -2.480 1.00 0.00 C ATOM 1510 CD2 PHE B 22 -17.371 -6.055 -1.303 1.00 0.00 C ATOM 1511 CE1 PHE B 22 -16.609 -3.405 -1.348 1.00 0.00 C ATOM 1512 CE2 PHE B 22 -16.848 -5.463 -0.167 1.00 0.00 C ATOM 1513 CZ PHE B 22 -16.466 -4.137 -0.190 1.00 0.00 C ATOM 0 H PHE B 22 -15.992 -7.582 -3.829 1.00 0.00 H new ATOM 0 HA PHE B 22 -17.941 -6.662 -5.646 1.00 0.00 H new ATOM 0 HB2 PHE B 22 -18.940 -5.316 -4.039 1.00 0.00 H new ATOM 0 HB3 PHE B 22 -18.597 -6.908 -3.392 1.00 0.00 H new ATOM 0 HD1 PHE B 22 -17.233 -3.420 -3.384 1.00 0.00 H new ATOM 0 HD2 PHE B 22 -17.673 -7.092 -1.273 1.00 0.00 H new ATOM 0 HE1 PHE B 22 -16.316 -2.366 -1.370 1.00 0.00 H new ATOM 0 HE2 PHE B 22 -16.738 -6.040 0.740 1.00 0.00 H new ATOM 0 HZ PHE B 22 -16.057 -3.675 0.696 1.00 0.00 H new ATOM 1523 N LEU B 23 -15.311 -4.720 -5.258 1.00 0.00 N ATOM 1524 CA LEU B 23 -14.640 -3.569 -5.907 1.00 0.00 C ATOM 1525 C LEU B 23 -14.588 -3.749 -7.402 1.00 0.00 C ATOM 1526 O LEU B 23 -14.735 -2.792 -8.145 1.00 0.00 O ATOM 1527 CB LEU B 23 -13.218 -3.280 -5.393 1.00 0.00 C ATOM 1528 CG LEU B 23 -13.053 -2.507 -4.066 1.00 0.00 C ATOM 1529 CD1 LEU B 23 -14.010 -1.325 -3.940 1.00 0.00 C ATOM 1530 CD2 LEU B 23 -13.106 -3.390 -2.855 1.00 0.00 C ATOM 0 H LEU B 23 -14.736 -5.241 -4.596 1.00 0.00 H new ATOM 0 HA LEU B 23 -15.254 -2.709 -5.639 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -12.705 -4.236 -5.285 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -12.693 -2.722 -6.168 1.00 0.00 H new ATOM 0 HG LEU B 23 -12.045 -2.095 -4.107 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -13.845 -0.823 -2.987 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -13.831 -0.624 -4.755 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -15.038 -1.683 -3.988 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -12.984 -2.784 -1.957 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -14.068 -3.901 -2.819 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -12.305 -4.127 -2.907 1.00 0.00 H new ATOM 1542 N LEU B 24 -14.412 -4.973 -7.836 1.00 0.00 N ATOM 1543 CA LEU B 24 -14.406 -5.274 -9.256 1.00 0.00 C ATOM 1544 C LEU B 24 -15.778 -5.010 -9.823 1.00 0.00 C ATOM 1545 O LEU B 24 -15.914 -4.323 -10.812 1.00 0.00 O ATOM 1546 CB LEU B 24 -14.083 -6.725 -9.467 1.00 0.00 C ATOM 1547 CG LEU B 24 -12.778 -7.207 -8.900 1.00 0.00 C ATOM 1548 CD1 LEU B 24 -12.778 -8.699 -8.925 1.00 0.00 C ATOM 1549 CD2 LEU B 24 -11.602 -6.658 -9.700 1.00 0.00 C ATOM 0 H LEU B 24 -14.270 -5.781 -7.230 1.00 0.00 H new ATOM 0 HA LEU B 24 -13.660 -4.651 -9.749 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -14.886 -7.321 -9.032 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -14.084 -6.923 -10.539 1.00 0.00 H new ATOM 0 HG LEU B 24 -12.669 -6.851 -7.875 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -11.838 -9.070 -8.517 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -13.607 -9.073 -8.324 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -12.889 -9.046 -9.952 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -10.668 -7.021 -9.270 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -11.679 -6.991 -10.735 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -11.617 -5.569 -9.668 1.00 0.00 H new ATOM 1561 N TYR B 25 -16.794 -5.514 -9.120 1.00 0.00 N ATOM 1562 CA TYR B 25 -18.195 -5.382 -9.518 1.00 0.00 C ATOM 1563 C TYR B 25 -18.556 -3.905 -9.635 1.00 0.00 C ATOM 1564 O TYR B 25 -19.260 -3.471 -10.575 1.00 0.00 O ATOM 1565 CB TYR B 25 -19.091 -6.053 -8.453 1.00 0.00 C ATOM 1566 CG TYR B 25 -20.565 -6.184 -8.813 1.00 0.00 C ATOM 1567 CD1 TYR B 25 -21.417 -5.083 -8.832 1.00 0.00 C ATOM 1568 CD2 TYR B 25 -21.098 -7.420 -9.119 1.00 0.00 C ATOM 1569 CE1 TYR B 25 -22.749 -5.216 -9.147 1.00 0.00 C ATOM 1570 CE2 TYR B 25 -22.430 -7.563 -9.435 1.00 0.00 C ATOM 1571 CZ TYR B 25 -23.252 -6.459 -9.450 1.00 0.00 C ATOM 1572 OH TYR B 25 -24.585 -6.605 -9.771 1.00 0.00 O ATOM 0 H TYR B 25 -16.665 -6.030 -8.250 1.00 0.00 H new ATOM 0 HA TYR B 25 -18.349 -5.866 -10.482 1.00 0.00 H new ATOM 0 HB2 TYR B 25 -18.697 -7.048 -8.249 1.00 0.00 H new ATOM 0 HB3 TYR B 25 -19.012 -5.483 -7.527 1.00 0.00 H new ATOM 0 HD1 TYR B 25 -21.024 -4.105 -8.595 1.00 0.00 H new ATOM 0 HD2 TYR B 25 -20.459 -8.290 -9.110 1.00 0.00 H new ATOM 0 HE1 TYR B 25 -23.395 -4.351 -9.156 1.00 0.00 H new ATOM 0 HE2 TYR B 25 -22.829 -8.539 -9.670 1.00 0.00 H new ATOM 0 HH TYR B 25 -24.775 -7.548 -9.959 1.00 0.00 H new ATOM 1582 N LEU B 26 -18.080 -3.135 -8.694 1.00 0.00 N ATOM 1583 CA LEU B 26 -18.365 -1.744 -8.680 1.00 0.00 C ATOM 1584 C LEU B 26 -17.590 -1.052 -9.796 1.00 0.00 C ATOM 1585 O LEU B 26 -18.119 -0.163 -10.413 1.00 0.00 O ATOM 1586 CB LEU B 26 -18.121 -1.117 -7.279 1.00 0.00 C ATOM 1587 CG LEU B 26 -18.844 0.228 -6.921 1.00 0.00 C ATOM 1588 CD1 LEU B 26 -18.412 1.406 -7.774 1.00 0.00 C ATOM 1589 CD2 LEU B 26 -20.356 0.068 -6.958 1.00 0.00 C ATOM 0 H LEU B 26 -17.491 -3.459 -7.927 1.00 0.00 H new ATOM 0 HA LEU B 26 -19.427 -1.594 -8.876 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -18.408 -1.856 -6.531 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -17.049 -0.955 -7.171 1.00 0.00 H new ATOM 0 HG LEU B 26 -18.533 0.461 -5.902 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -18.957 2.298 -7.465 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -17.342 1.573 -7.649 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -18.626 1.195 -8.822 1.00 0.00 H new ATOM 0 HD21 LEU B 26 -20.829 1.017 -6.705 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -20.665 -0.237 -7.958 1.00 0.00 H new ATOM 0 HD23 LEU B 26 -20.659 -0.691 -6.237 1.00 0.00 H new ATOM 1601 N ASP B 27 -16.366 -1.488 -10.078 1.00 0.00 N ATOM 1602 CA ASP B 27 -15.581 -0.907 -11.192 1.00 0.00 C ATOM 1603 C ASP B 27 -16.278 -1.187 -12.531 1.00 0.00 C ATOM 1604 O ASP B 27 -16.295 -0.343 -13.433 1.00 0.00 O ATOM 1605 CB ASP B 27 -14.135 -1.435 -11.230 1.00 0.00 C ATOM 1606 CG ASP B 27 -13.320 -0.791 -12.352 1.00 0.00 C ATOM 1607 OD1 ASP B 27 -13.314 -1.313 -13.484 1.00 0.00 O ATOM 1608 OD2 ASP B 27 -12.672 0.265 -12.118 1.00 0.00 O ATOM 0 H ASP B 27 -15.891 -2.231 -9.566 1.00 0.00 H new ATOM 0 HA ASP B 27 -15.528 0.168 -11.022 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -13.652 -1.239 -10.273 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -14.147 -2.516 -11.365 1.00 0.00 H new ATOM 1613 N GLU B 28 -16.873 -2.379 -12.627 1.00 0.00 N ATOM 1614 CA GLU B 28 -17.663 -2.810 -13.795 1.00 0.00 C ATOM 1615 C GLU B 28 -18.827 -1.862 -14.024 1.00 0.00 C ATOM 1616 O GLU B 28 -19.147 -1.501 -15.158 1.00 0.00 O ATOM 1617 CB GLU B 28 -18.265 -4.186 -13.533 1.00 0.00 C ATOM 1618 CG GLU B 28 -17.273 -5.277 -13.255 1.00 0.00 C ATOM 1619 CD GLU B 28 -16.470 -5.673 -14.457 1.00 0.00 C ATOM 1620 OE1 GLU B 28 -16.926 -6.545 -15.225 1.00 0.00 O ATOM 1621 OE2 GLU B 28 -15.371 -5.136 -14.662 1.00 0.00 O ATOM 0 H GLU B 28 -16.822 -3.083 -11.891 1.00 0.00 H new ATOM 0 HA GLU B 28 -16.998 -2.825 -14.659 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -18.945 -4.111 -12.685 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -18.864 -4.473 -14.397 1.00 0.00 H new ATOM 0 HG2 GLU B 28 -16.595 -4.949 -12.467 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -17.803 -6.152 -12.877 1.00 0.00 H new ATOM 1628 N SER B 29 -19.468 -1.498 -12.939 1.00 0.00 N ATOM 1629 CA SER B 29 -20.618 -0.630 -12.968 1.00 0.00 C ATOM 1630 C SER B 29 -20.174 0.832 -13.115 1.00 0.00 C ATOM 1631 O SER B 29 -20.802 1.630 -13.817 1.00 0.00 O ATOM 1632 CB SER B 29 -21.396 -0.818 -11.664 1.00 0.00 C ATOM 1633 OG SER B 29 -21.709 -2.200 -11.449 1.00 0.00 O ATOM 0 H SER B 29 -19.202 -1.800 -12.002 1.00 0.00 H new ATOM 0 HA SER B 29 -21.252 -0.879 -13.819 1.00 0.00 H new ATOM 0 HB2 SER B 29 -20.808 -0.440 -10.828 1.00 0.00 H new ATOM 0 HB3 SER B 29 -22.316 -0.234 -11.697 1.00 0.00 H new ATOM 0 HG SER B 29 -20.905 -2.675 -11.152 1.00 0.00 H new ATOM 1639 N ASN B 30 -19.076 1.146 -12.429 1.00 0.00 N ATOM 1640 CA ASN B 30 -18.459 2.473 -12.360 1.00 0.00 C ATOM 1641 C ASN B 30 -19.524 3.485 -11.922 1.00 0.00 C ATOM 1642 O ASN B 30 -19.655 4.578 -12.456 1.00 0.00 O ATOM 1643 CB ASN B 30 -17.793 2.842 -13.708 1.00 0.00 C ATOM 1644 CG ASN B 30 -16.785 3.987 -13.600 1.00 0.00 C ATOM 1645 OD1 ASN B 30 -16.902 4.862 -12.761 1.00 0.00 O ATOM 1646 ND2 ASN B 30 -15.771 3.963 -14.434 1.00 0.00 N ATOM 0 H ASN B 30 -18.568 0.452 -11.881 1.00 0.00 H new ATOM 0 HA ASN B 30 -17.658 2.482 -11.621 1.00 0.00 H new ATOM 0 HB2 ASN B 30 -17.289 1.962 -14.108 1.00 0.00 H new ATOM 0 HB3 ASN B 30 -18.568 3.118 -14.423 1.00 0.00 H new ATOM 0 HD21 ASN B 30 -15.056 4.689 -14.389 1.00 0.00 H new ATOM 0 HD22 ASN B 30 -15.698 3.218 -15.127 1.00 0.00 H new ATOM 1653 N ALA B 31 -20.258 3.093 -10.890 1.00 0.00 N ATOM 1654 CA ALA B 31 -21.393 3.860 -10.364 1.00 0.00 C ATOM 1655 C ALA B 31 -20.977 5.216 -9.813 1.00 0.00 C ATOM 1656 O ALA B 31 -21.769 6.144 -9.771 1.00 0.00 O ATOM 1657 CB ALA B 31 -22.121 3.054 -9.300 1.00 0.00 C ATOM 0 H ALA B 31 -20.085 2.224 -10.384 1.00 0.00 H new ATOM 0 HA ALA B 31 -22.067 4.052 -11.199 1.00 0.00 H new ATOM 0 HB1 ALA B 31 -22.961 3.633 -8.917 1.00 0.00 H new ATOM 0 HB2 ALA B 31 -22.489 2.125 -9.736 1.00 0.00 H new ATOM 0 HB3 ALA B 31 -21.435 2.826 -8.484 1.00 0.00 H new ATOM 1663 N LEU B 32 -19.730 5.320 -9.427 1.00 0.00 N ATOM 1664 CA LEU B 32 -19.215 6.520 -8.797 1.00 0.00 C ATOM 1665 C LEU B 32 -18.563 7.454 -9.816 1.00 0.00 C ATOM 1666 O LEU B 32 -18.110 8.549 -9.470 1.00 0.00 O ATOM 1667 CB LEU B 32 -18.224 6.102 -7.727 1.00 0.00 C ATOM 1668 CG LEU B 32 -18.800 5.163 -6.662 1.00 0.00 C ATOM 1669 CD1 LEU B 32 -17.702 4.585 -5.812 1.00 0.00 C ATOM 1670 CD2 LEU B 32 -19.812 5.897 -5.789 1.00 0.00 C ATOM 0 H LEU B 32 -19.039 4.578 -9.539 1.00 0.00 H new ATOM 0 HA LEU B 32 -20.037 7.078 -8.348 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -17.376 5.612 -8.206 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -17.840 6.996 -7.236 1.00 0.00 H new ATOM 0 HG LEU B 32 -19.309 4.345 -7.172 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -18.133 3.921 -5.062 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -17.013 4.022 -6.441 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -17.163 5.392 -5.315 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -20.209 5.213 -5.039 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -19.324 6.736 -5.293 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -20.627 6.268 -6.410 1.00 0.00 H new ATOM 1682 N GLY B 33 -18.507 7.005 -11.073 1.00 0.00 N ATOM 1683 CA GLY B 33 -17.935 7.807 -12.153 1.00 0.00 C ATOM 1684 C GLY B 33 -16.434 7.991 -12.018 1.00 0.00 C ATOM 1685 O GLY B 33 -15.855 8.917 -12.593 1.00 0.00 O ATOM 0 H GLY B 33 -18.851 6.091 -11.366 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -18.153 7.330 -13.108 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -18.416 8.785 -12.167 1.00 0.00 H new ATOM 1689 N LYS B 34 -15.813 7.127 -11.250 1.00 0.00 N ATOM 1690 CA LYS B 34 -14.396 7.181 -10.984 1.00 0.00 C ATOM 1691 C LYS B 34 -13.838 5.785 -10.979 1.00 0.00 C ATOM 1692 O LYS B 34 -14.496 4.850 -10.509 1.00 0.00 O ATOM 1693 CB LYS B 34 -14.115 7.835 -9.621 1.00 0.00 C ATOM 1694 CG LYS B 34 -14.570 9.283 -9.500 1.00 0.00 C ATOM 1695 CD LYS B 34 -13.761 10.213 -10.396 1.00 0.00 C ATOM 1696 CE LYS B 34 -14.389 11.598 -10.471 1.00 0.00 C ATOM 1697 NZ LYS B 34 -15.698 11.569 -11.187 1.00 0.00 N ATOM 0 H LYS B 34 -16.287 6.353 -10.785 1.00 0.00 H new ATOM 0 HA LYS B 34 -13.923 7.778 -11.763 1.00 0.00 H new ATOM 0 HB2 LYS B 34 -14.606 7.249 -8.845 1.00 0.00 H new ATOM 0 HB3 LYS B 34 -13.044 7.788 -9.426 1.00 0.00 H new ATOM 0 HG2 LYS B 34 -15.625 9.354 -9.763 1.00 0.00 H new ATOM 0 HG3 LYS B 34 -14.477 9.607 -8.463 1.00 0.00 H new ATOM 0 HD2 LYS B 34 -12.743 10.294 -10.014 1.00 0.00 H new ATOM 0 HD3 LYS B 34 -13.693 9.788 -11.397 1.00 0.00 H new ATOM 0 HE2 LYS B 34 -14.533 11.988 -9.463 1.00 0.00 H new ATOM 0 HE3 LYS B 34 -13.709 12.279 -10.982 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 -15.737 12.351 -11.872 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 -15.799 10.664 -11.689 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 -16.472 11.672 -10.500 1.00 0.00 H new ATOM 1711 N LYS B 35 -12.650 5.633 -11.488 1.00 0.00 N ATOM 1712 CA LYS B 35 -11.986 4.357 -11.454 1.00 0.00 C ATOM 1713 C LYS B 35 -11.054 4.332 -10.288 1.00 0.00 C ATOM 1714 O LYS B 35 -9.930 4.824 -10.334 1.00 0.00 O ATOM 1715 CB LYS B 35 -11.298 4.006 -12.769 1.00 0.00 C ATOM 1716 CG LYS B 35 -12.274 3.846 -13.928 1.00 0.00 C ATOM 1717 CD LYS B 35 -11.590 3.375 -15.203 1.00 0.00 C ATOM 1718 CE LYS B 35 -10.969 1.989 -15.043 1.00 0.00 C ATOM 1719 NZ LYS B 35 -11.965 0.957 -14.647 1.00 0.00 N ATOM 0 H LYS B 35 -12.117 6.379 -11.934 1.00 0.00 H new ATOM 0 HA LYS B 35 -12.735 3.576 -11.326 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -10.576 4.785 -13.014 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -10.737 3.080 -12.643 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -13.049 3.132 -13.650 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -12.770 4.798 -14.116 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -12.315 3.355 -16.017 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -10.815 4.089 -15.483 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -10.500 1.695 -15.982 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -10.180 2.033 -14.293 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -11.582 0.011 -14.844 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -12.169 1.043 -13.631 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -12.842 1.095 -15.189 1.00 0.00 H new ATOM 1733 N PHE B 36 -11.589 3.834 -9.235 1.00 0.00 N ATOM 1734 CA PHE B 36 -10.959 3.782 -7.953 1.00 0.00 C ATOM 1735 C PHE B 36 -9.901 2.686 -7.851 1.00 0.00 C ATOM 1736 O PHE B 36 -8.815 2.927 -7.339 1.00 0.00 O ATOM 1737 CB PHE B 36 -12.046 3.606 -6.879 1.00 0.00 C ATOM 1738 CG PHE B 36 -12.963 2.443 -7.163 1.00 0.00 C ATOM 1739 CD1 PHE B 36 -12.666 1.184 -6.686 1.00 0.00 C ATOM 1740 CD2 PHE B 36 -14.091 2.608 -7.947 1.00 0.00 C ATOM 1741 CE1 PHE B 36 -13.470 0.112 -6.988 1.00 0.00 C ATOM 1742 CE2 PHE B 36 -14.900 1.543 -8.243 1.00 0.00 C ATOM 1743 CZ PHE B 36 -14.588 0.294 -7.765 1.00 0.00 C ATOM 0 H PHE B 36 -12.525 3.429 -9.236 1.00 0.00 H new ATOM 0 HA PHE B 36 -10.424 4.719 -7.798 1.00 0.00 H new ATOM 0 HB2 PHE B 36 -11.572 3.461 -5.908 1.00 0.00 H new ATOM 0 HB3 PHE B 36 -12.636 4.520 -6.812 1.00 0.00 H new ATOM 0 HD1 PHE B 36 -11.792 1.039 -6.068 1.00 0.00 H new ATOM 0 HD2 PHE B 36 -14.336 3.588 -8.330 1.00 0.00 H new ATOM 0 HE1 PHE B 36 -13.224 -0.871 -6.616 1.00 0.00 H new ATOM 0 HE2 PHE B 36 -15.781 1.685 -8.851 1.00 0.00 H new ATOM 0 HZ PHE B 36 -15.223 -0.547 -8.001 1.00 0.00 H new ATOM 1753 N ILE B 37 -10.207 1.497 -8.348 1.00 0.00 N ATOM 1754 CA ILE B 37 -9.309 0.393 -8.182 1.00 0.00 C ATOM 1755 C ILE B 37 -8.286 0.499 -9.335 1.00 0.00 C ATOM 1756 O ILE B 37 -8.585 0.244 -10.499 1.00 0.00 O ATOM 1757 CB ILE B 37 -10.149 -1.002 -8.105 1.00 0.00 C ATOM 1758 CG1 ILE B 37 -9.433 -2.173 -7.410 1.00 0.00 C ATOM 1759 CG2 ILE B 37 -10.734 -1.478 -9.389 1.00 0.00 C ATOM 1760 CD1 ILE B 37 -10.134 -3.520 -7.571 1.00 0.00 C ATOM 0 H ILE B 37 -11.062 1.285 -8.862 1.00 0.00 H new ATOM 0 HA ILE B 37 -8.756 0.412 -7.243 1.00 0.00 H new ATOM 0 HB ILE B 37 -10.972 -0.687 -7.464 1.00 0.00 H new ATOM 0 HG12 ILE B 37 -8.421 -2.253 -7.808 1.00 0.00 H new ATOM 0 HG13 ILE B 37 -9.341 -1.949 -6.347 1.00 0.00 H new ATOM 0 HG21 ILE B 37 -11.270 -2.412 -9.221 1.00 0.00 H new ATOM 0 HG22 ILE B 37 -11.425 -0.728 -9.774 1.00 0.00 H new ATOM 0 HG23 ILE B 37 -9.936 -1.643 -10.113 1.00 0.00 H new ATOM 0 HD11 ILE B 37 -9.565 -4.291 -7.052 1.00 0.00 H new ATOM 0 HD12 ILE B 37 -11.136 -3.462 -7.147 1.00 0.00 H new ATOM 0 HD13 ILE B 37 -10.202 -3.770 -8.630 1.00 0.00 H new ATOM 1772 N ILE B 38 -7.104 0.976 -8.992 1.00 0.00 N ATOM 1773 CA ILE B 38 -6.056 1.242 -9.974 1.00 0.00 C ATOM 1774 C ILE B 38 -5.354 -0.031 -10.306 1.00 0.00 C ATOM 1775 O ILE B 38 -5.227 -0.432 -11.471 1.00 0.00 O ATOM 1776 CB ILE B 38 -5.043 2.275 -9.415 1.00 0.00 C ATOM 1777 CG1 ILE B 38 -5.704 3.664 -9.296 1.00 0.00 C ATOM 1778 CG2 ILE B 38 -3.760 2.306 -10.244 1.00 0.00 C ATOM 1779 CD1 ILE B 38 -4.823 4.726 -8.666 1.00 0.00 C ATOM 0 H ILE B 38 -6.839 1.191 -8.031 1.00 0.00 H new ATOM 0 HA ILE B 38 -6.509 1.654 -10.876 1.00 0.00 H new ATOM 0 HB ILE B 38 -4.749 1.966 -8.412 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -6.000 3.998 -10.290 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -6.616 3.569 -8.707 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -3.073 3.041 -9.824 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -3.293 1.321 -10.228 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -3.998 2.578 -11.272 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -5.366 5.670 -8.622 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -4.547 4.418 -7.657 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -3.922 4.854 -9.266 1.00 0.00 H new ATOM 1791 N GLN B 39 -4.901 -0.657 -9.296 1.00 0.00 N ATOM 1792 CA GLN B 39 -4.376 -1.934 -9.408 1.00 0.00 C ATOM 1793 C GLN B 39 -4.784 -2.633 -8.191 1.00 0.00 C ATOM 1794 O GLN B 39 -4.867 -2.025 -7.102 1.00 0.00 O ATOM 1795 CB GLN B 39 -2.846 -2.008 -9.600 1.00 0.00 C ATOM 1796 CG GLN B 39 -2.013 -1.506 -8.431 1.00 0.00 C ATOM 1797 CD GLN B 39 -0.580 -2.067 -8.426 1.00 0.00 C ATOM 1798 OE1 GLN B 39 0.332 -1.420 -7.953 1.00 0.00 O ATOM 1799 NE2 GLN B 39 -0.390 -3.284 -8.934 1.00 0.00 N ATOM 0 H GLN B 39 -4.889 -0.278 -8.349 1.00 0.00 H new ATOM 0 HA GLN B 39 -4.761 -2.391 -10.320 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -2.572 -3.044 -9.800 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -2.581 -1.432 -10.486 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -1.970 -0.417 -8.464 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -2.506 -1.778 -7.498 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -1.177 -3.802 -9.324 1.00 0.00 H new ATOM 0 HE22 GLN B 39 0.542 -3.697 -8.933 1.00 0.00 H new ATOM 1808 N ASP B 40 -5.124 -3.824 -8.328 1.00 0.00 N ATOM 1809 CA ASP B 40 -5.468 -4.562 -7.209 1.00 0.00 C ATOM 1810 C ASP B 40 -4.283 -5.357 -6.807 1.00 0.00 C ATOM 1811 O ASP B 40 -3.613 -5.974 -7.637 1.00 0.00 O ATOM 1812 CB ASP B 40 -6.687 -5.428 -7.432 1.00 0.00 C ATOM 1813 CG ASP B 40 -6.456 -6.679 -8.238 1.00 0.00 C ATOM 1814 OD1 ASP B 40 -6.241 -6.603 -9.451 1.00 0.00 O ATOM 1815 OD2 ASP B 40 -6.529 -7.768 -7.647 1.00 0.00 O ATOM 0 H ASP B 40 -5.174 -4.323 -9.216 1.00 0.00 H new ATOM 0 HA ASP B 40 -5.752 -3.885 -6.403 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -7.092 -5.712 -6.461 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -7.449 -4.830 -7.932 1.00 0.00 H new ATOM 1820 N ILE B 41 -3.967 -5.293 -5.573 1.00 0.00 N ATOM 1821 CA ILE B 41 -2.849 -5.993 -5.104 1.00 0.00 C ATOM 1822 C ILE B 41 -3.218 -7.311 -4.442 1.00 0.00 C ATOM 1823 O ILE B 41 -4.380 -7.510 -4.099 1.00 0.00 O ATOM 1824 CB ILE B 41 -1.687 -5.141 -4.424 1.00 0.00 C ATOM 1825 CG1 ILE B 41 -2.072 -4.187 -3.289 1.00 0.00 C ATOM 1826 CG2 ILE B 41 -0.959 -4.327 -5.453 1.00 0.00 C ATOM 1827 CD1 ILE B 41 -3.103 -3.147 -3.635 1.00 0.00 C ATOM 0 H ILE B 41 -4.473 -4.758 -4.868 1.00 0.00 H new ATOM 0 HA ILE B 41 -2.314 -6.281 -6.009 1.00 0.00 H new ATOM 0 HB ILE B 41 -1.076 -5.919 -3.966 1.00 0.00 H new ATOM 0 HG12 ILE B 41 -2.445 -4.778 -2.452 1.00 0.00 H new ATOM 0 HG13 ILE B 41 -1.171 -3.679 -2.944 1.00 0.00 H new ATOM 0 HG21 ILE B 41 -0.169 -3.752 -4.970 1.00 0.00 H new ATOM 0 HG22 ILE B 41 -0.521 -4.991 -6.198 1.00 0.00 H new ATOM 0 HG23 ILE B 41 -1.658 -3.646 -5.939 1.00 0.00 H new ATOM 0 HD11 ILE B 41 -3.301 -2.526 -2.761 1.00 0.00 H new ATOM 0 HD12 ILE B 41 -2.731 -2.522 -4.447 1.00 0.00 H new ATOM 0 HD13 ILE B 41 -4.024 -3.638 -3.948 1.00 0.00 H new ATOM 1839 N ASP B 42 -2.211 -8.132 -4.212 1.00 0.00 N ATOM 1840 CA ASP B 42 -2.284 -9.590 -3.952 1.00 0.00 C ATOM 1841 C ASP B 42 -3.546 -10.077 -3.323 1.00 0.00 C ATOM 1842 O ASP B 42 -3.708 -10.069 -2.102 1.00 0.00 O ATOM 1843 CB ASP B 42 -1.098 -10.081 -3.198 1.00 0.00 C ATOM 1844 CG ASP B 42 -0.816 -11.532 -3.508 1.00 0.00 C ATOM 1845 OD1 ASP B 42 -0.127 -11.803 -4.532 1.00 0.00 O ATOM 1846 OD2 ASP B 42 -1.280 -12.418 -2.782 1.00 0.00 O ATOM 0 H ASP B 42 -1.249 -7.793 -4.197 1.00 0.00 H new ATOM 0 HA ASP B 42 -2.284 -10.024 -4.952 1.00 0.00 H new ATOM 0 HB2 ASP B 42 -0.227 -9.476 -3.451 1.00 0.00 H new ATOM 0 HB3 ASP B 42 -1.269 -9.962 -2.128 1.00 0.00 H new ATOM 1851 N ASP B 43 -4.458 -10.337 -4.223 1.00 0.00 N ATOM 1852 CA ASP B 43 -5.809 -10.912 -4.084 1.00 0.00 C ATOM 1853 C ASP B 43 -6.736 -10.080 -3.255 1.00 0.00 C ATOM 1854 O ASP B 43 -7.774 -9.605 -3.705 1.00 0.00 O ATOM 1855 CB ASP B 43 -5.783 -12.352 -3.554 1.00 0.00 C ATOM 1856 CG ASP B 43 -7.184 -12.871 -3.261 1.00 0.00 C ATOM 1857 OD1 ASP B 43 -7.863 -13.375 -4.192 1.00 0.00 O ATOM 1858 OD2 ASP B 43 -7.626 -12.772 -2.092 1.00 0.00 O ATOM 0 H ASP B 43 -4.264 -10.131 -5.203 1.00 0.00 H new ATOM 0 HA ASP B 43 -6.204 -10.922 -5.100 1.00 0.00 H new ATOM 0 HB2 ASP B 43 -5.301 -13.000 -4.286 1.00 0.00 H new ATOM 0 HB3 ASP B 43 -5.182 -12.394 -2.646 1.00 0.00 H new ATOM 1863 N THR B 44 -6.297 -9.810 -2.129 1.00 0.00 N ATOM 1864 CA THR B 44 -7.118 -9.275 -1.083 1.00 0.00 C ATOM 1865 C THR B 44 -6.966 -7.761 -1.009 1.00 0.00 C ATOM 1866 O THR B 44 -7.682 -7.075 -0.288 1.00 0.00 O ATOM 1867 CB THR B 44 -6.690 -9.934 0.245 1.00 0.00 C ATOM 1868 OG1 THR B 44 -6.532 -11.354 0.018 1.00 0.00 O ATOM 1869 CG2 THR B 44 -7.737 -9.730 1.336 1.00 0.00 C ATOM 0 H THR B 44 -5.323 -9.946 -1.860 1.00 0.00 H new ATOM 0 HA THR B 44 -8.168 -9.489 -1.281 1.00 0.00 H new ATOM 0 HB THR B 44 -5.758 -9.475 0.575 1.00 0.00 H new ATOM 0 HG1 THR B 44 -7.093 -11.629 -0.737 1.00 0.00 H new ATOM 0 HG21 THR B 44 -7.401 -10.208 2.256 1.00 0.00 H new ATOM 0 HG22 THR B 44 -7.877 -8.663 1.511 1.00 0.00 H new ATOM 0 HG23 THR B 44 -8.682 -10.173 1.021 1.00 0.00 H new ATOM 1877 N HIS B 45 -6.064 -7.228 -1.790 1.00 0.00 N ATOM 1878 CA HIS B 45 -5.789 -5.839 -1.710 1.00 0.00 C ATOM 1879 C HIS B 45 -6.324 -5.052 -2.873 1.00 0.00 C ATOM 1880 O HIS B 45 -6.466 -5.557 -3.989 1.00 0.00 O ATOM 1881 CB HIS B 45 -4.327 -5.603 -1.561 1.00 0.00 C ATOM 1882 CG HIS B 45 -3.730 -6.086 -0.280 1.00 0.00 C ATOM 1883 ND1 HIS B 45 -3.603 -5.288 0.821 1.00 0.00 N ATOM 1884 CD2 HIS B 45 -3.221 -7.293 0.069 1.00 0.00 C ATOM 1885 CE1 HIS B 45 -3.049 -5.972 1.794 1.00 0.00 C ATOM 1886 NE2 HIS B 45 -2.805 -7.192 1.361 1.00 0.00 N ATOM 0 H HIS B 45 -5.516 -7.740 -2.481 1.00 0.00 H new ATOM 0 HA HIS B 45 -6.313 -5.479 -0.825 1.00 0.00 H new ATOM 0 HB2 HIS B 45 -3.811 -6.089 -2.389 1.00 0.00 H new ATOM 0 HB3 HIS B 45 -4.137 -4.533 -1.651 1.00 0.00 H new ATOM 0 HD2 HIS B 45 -3.158 -8.169 -0.559 1.00 0.00 H new ATOM 0 HE1 HIS B 45 -2.830 -5.598 2.783 1.00 0.00 H new ATOM 0 HE2 HIS B 45 -2.374 -7.939 1.905 1.00 0.00 H new ATOM 1895 N VAL B 46 -6.653 -3.838 -2.598 1.00 0.00 N ATOM 1896 CA VAL B 46 -7.068 -2.877 -3.576 1.00 0.00 C ATOM 1897 C VAL B 46 -6.267 -1.626 -3.365 1.00 0.00 C ATOM 1898 O VAL B 46 -6.045 -1.223 -2.217 1.00 0.00 O ATOM 1899 CB VAL B 46 -8.596 -2.555 -3.452 1.00 0.00 C ATOM 1900 CG1 VAL B 46 -8.976 -1.259 -4.164 1.00 0.00 C ATOM 1901 CG2 VAL B 46 -9.430 -3.710 -3.972 1.00 0.00 C ATOM 0 H VAL B 46 -6.642 -3.466 -1.648 1.00 0.00 H new ATOM 0 HA VAL B 46 -6.900 -3.284 -4.573 1.00 0.00 H new ATOM 0 HB VAL B 46 -8.807 -2.414 -2.392 1.00 0.00 H new ATOM 0 HG11 VAL B 46 -10.045 -1.080 -4.049 1.00 0.00 H new ATOM 0 HG12 VAL B 46 -8.420 -0.428 -3.729 1.00 0.00 H new ATOM 0 HG13 VAL B 46 -8.734 -1.342 -5.224 1.00 0.00 H new ATOM 0 HG21 VAL B 46 -10.488 -3.466 -3.877 1.00 0.00 H new ATOM 0 HG22 VAL B 46 -9.191 -3.888 -5.021 1.00 0.00 H new ATOM 0 HG23 VAL B 46 -9.211 -4.607 -3.393 1.00 0.00 H new ATOM 1911 N PHE B 47 -5.744 -1.078 -4.427 1.00 0.00 N ATOM 1912 CA PHE B 47 -5.126 0.192 -4.342 1.00 0.00 C ATOM 1913 C PHE B 47 -6.024 1.206 -4.991 1.00 0.00 C ATOM 1914 O PHE B 47 -6.406 1.064 -6.171 1.00 0.00 O ATOM 1915 CB PHE B 47 -3.761 0.221 -5.007 1.00 0.00 C ATOM 1916 CG PHE B 47 -3.014 1.447 -4.661 1.00 0.00 C ATOM 1917 CD1 PHE B 47 -2.434 1.555 -3.412 1.00 0.00 C ATOM 1918 CD2 PHE B 47 -2.917 2.503 -5.540 1.00 0.00 C ATOM 1919 CE1 PHE B 47 -1.761 2.684 -3.049 1.00 0.00 C ATOM 1920 CE2 PHE B 47 -2.252 3.640 -5.168 1.00 0.00 C ATOM 1921 CZ PHE B 47 -1.671 3.723 -3.928 1.00 0.00 C ATOM 0 H PHE B 47 -5.739 -1.500 -5.356 1.00 0.00 H new ATOM 0 HA PHE B 47 -4.972 0.422 -3.288 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -3.188 -0.654 -4.701 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -3.881 0.160 -6.089 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -2.515 0.735 -2.714 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -3.365 2.434 -6.520 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -1.303 2.755 -2.073 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -2.185 4.473 -5.852 1.00 0.00 H new ATOM 0 HZ PHE B 47 -1.138 4.619 -3.645 1.00 0.00 H new ATOM 1931 N VAL B 48 -6.365 2.188 -4.239 1.00 0.00 N ATOM 1932 CA VAL B 48 -7.184 3.261 -4.682 1.00 0.00 C ATOM 1933 C VAL B 48 -6.469 4.543 -4.340 1.00 0.00 C ATOM 1934 O VAL B 48 -5.746 4.598 -3.360 1.00 0.00 O ATOM 1935 CB VAL B 48 -8.612 3.195 -4.037 1.00 0.00 C ATOM 1936 CG1 VAL B 48 -8.544 3.057 -2.522 1.00 0.00 C ATOM 1937 CG2 VAL B 48 -9.448 4.408 -4.413 1.00 0.00 C ATOM 0 H VAL B 48 -6.073 2.272 -3.265 1.00 0.00 H new ATOM 0 HA VAL B 48 -7.343 3.201 -5.759 1.00 0.00 H new ATOM 0 HB VAL B 48 -9.094 2.303 -4.437 1.00 0.00 H new ATOM 0 HG11 VAL B 48 -9.554 3.015 -2.115 1.00 0.00 H new ATOM 0 HG12 VAL B 48 -8.010 2.143 -2.264 1.00 0.00 H new ATOM 0 HG13 VAL B 48 -8.019 3.915 -2.102 1.00 0.00 H new ATOM 0 HG21 VAL B 48 -10.431 4.330 -3.949 1.00 0.00 H new ATOM 0 HG22 VAL B 48 -8.953 5.314 -4.063 1.00 0.00 H new ATOM 0 HG23 VAL B 48 -9.560 4.451 -5.496 1.00 0.00 H new ATOM 1947 N ILE B 49 -6.611 5.549 -5.139 1.00 0.00 N ATOM 1948 CA ILE B 49 -5.903 6.774 -4.843 1.00 0.00 C ATOM 1949 C ILE B 49 -6.652 7.548 -3.767 1.00 0.00 C ATOM 1950 O ILE B 49 -7.896 7.573 -3.750 1.00 0.00 O ATOM 1951 CB ILE B 49 -5.632 7.650 -6.090 1.00 0.00 C ATOM 1952 CG1 ILE B 49 -4.631 8.776 -5.756 1.00 0.00 C ATOM 1953 CG2 ILE B 49 -6.918 8.200 -6.691 1.00 0.00 C ATOM 1954 CD1 ILE B 49 -4.387 9.750 -6.891 1.00 0.00 C ATOM 0 H ILE B 49 -7.189 5.561 -5.979 1.00 0.00 H new ATOM 0 HA ILE B 49 -4.916 6.497 -4.472 1.00 0.00 H new ATOM 0 HB ILE B 49 -5.182 7.013 -6.851 1.00 0.00 H new ATOM 0 HG12 ILE B 49 -4.999 9.328 -4.891 1.00 0.00 H new ATOM 0 HG13 ILE B 49 -3.681 8.327 -5.467 1.00 0.00 H new ATOM 0 HG21 ILE B 49 -6.681 8.809 -7.564 1.00 0.00 H new ATOM 0 HG22 ILE B 49 -7.563 7.373 -6.990 1.00 0.00 H new ATOM 0 HG23 ILE B 49 -7.433 8.812 -5.951 1.00 0.00 H new ATOM 0 HD11 ILE B 49 -3.672 10.508 -6.572 1.00 0.00 H new ATOM 0 HD12 ILE B 49 -3.987 9.213 -7.751 1.00 0.00 H new ATOM 0 HD13 ILE B 49 -5.326 10.230 -7.167 1.00 0.00 H new ATOM 1966 N ALA B 50 -5.904 8.177 -2.885 1.00 0.00 N ATOM 1967 CA ALA B 50 -6.464 8.844 -1.725 1.00 0.00 C ATOM 1968 C ALA B 50 -7.409 9.972 -2.106 1.00 0.00 C ATOM 1969 O ALA B 50 -8.411 10.203 -1.445 1.00 0.00 O ATOM 1970 CB ALA B 50 -5.361 9.350 -0.813 1.00 0.00 C ATOM 0 H ALA B 50 -4.888 8.241 -2.951 1.00 0.00 H new ATOM 0 HA ALA B 50 -7.054 8.104 -1.185 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -5.802 9.847 0.051 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -4.753 8.510 -0.477 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -4.734 10.057 -1.357 1.00 0.00 H new ATOM 1976 N GLU B 51 -7.105 10.615 -3.204 1.00 0.00 N ATOM 1977 CA GLU B 51 -7.860 11.751 -3.686 1.00 0.00 C ATOM 1978 C GLU B 51 -9.334 11.427 -3.969 1.00 0.00 C ATOM 1979 O GLU B 51 -10.203 12.265 -3.746 1.00 0.00 O ATOM 1980 CB GLU B 51 -7.181 12.330 -4.918 1.00 0.00 C ATOM 1981 CG GLU B 51 -5.772 12.837 -4.643 1.00 0.00 C ATOM 1982 CD GLU B 51 -5.757 13.971 -3.646 1.00 0.00 C ATOM 1983 OE1 GLU B 51 -5.882 15.133 -4.061 1.00 0.00 O ATOM 1984 OE2 GLU B 51 -5.634 13.716 -2.430 1.00 0.00 O ATOM 0 H GLU B 51 -6.316 10.363 -3.799 1.00 0.00 H new ATOM 0 HA GLU B 51 -7.870 12.494 -2.888 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -7.140 11.567 -5.695 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -7.786 13.149 -5.307 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -5.160 12.017 -4.267 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -5.319 13.171 -5.577 1.00 0.00 H new ATOM 1991 N LEU B 52 -9.627 10.219 -4.427 1.00 0.00 N ATOM 1992 CA LEU B 52 -11.006 9.890 -4.741 1.00 0.00 C ATOM 1993 C LEU B 52 -11.598 8.754 -3.896 1.00 0.00 C ATOM 1994 O LEU B 52 -12.739 8.392 -4.082 1.00 0.00 O ATOM 1995 CB LEU B 52 -11.242 9.725 -6.271 1.00 0.00 C ATOM 1996 CG LEU B 52 -10.336 8.751 -7.046 1.00 0.00 C ATOM 1997 CD1 LEU B 52 -10.610 7.298 -6.700 1.00 0.00 C ATOM 1998 CD2 LEU B 52 -10.455 8.984 -8.544 1.00 0.00 C ATOM 0 H LEU B 52 -8.951 9.472 -4.585 1.00 0.00 H new ATOM 0 HA LEU B 52 -11.586 10.762 -4.437 1.00 0.00 H new ATOM 0 HB2 LEU B 52 -12.274 9.407 -6.416 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -11.144 10.708 -6.731 1.00 0.00 H new ATOM 0 HG LEU B 52 -9.311 8.958 -6.739 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -9.943 6.655 -7.275 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -10.439 7.139 -5.635 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -11.645 7.056 -6.941 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -9.807 8.286 -9.073 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -11.488 8.828 -8.856 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -10.156 10.006 -8.778 1.00 0.00 H new ATOM 2010 N VAL B 53 -10.840 8.242 -2.923 1.00 0.00 N ATOM 2011 CA VAL B 53 -11.320 7.150 -2.020 1.00 0.00 C ATOM 2012 C VAL B 53 -12.628 7.535 -1.315 1.00 0.00 C ATOM 2013 O VAL B 53 -13.426 6.676 -0.956 1.00 0.00 O ATOM 2014 CB VAL B 53 -10.245 6.645 -1.001 1.00 0.00 C ATOM 2015 CG1 VAL B 53 -9.851 7.722 -0.019 1.00 0.00 C ATOM 2016 CG2 VAL B 53 -10.709 5.391 -0.261 1.00 0.00 C ATOM 0 H VAL B 53 -9.889 8.555 -2.727 1.00 0.00 H new ATOM 0 HA VAL B 53 -11.521 6.301 -2.674 1.00 0.00 H new ATOM 0 HB VAL B 53 -9.363 6.384 -1.586 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -9.103 7.330 0.670 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -9.436 8.573 -0.559 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -10.729 8.042 0.542 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -9.934 5.073 0.437 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -11.624 5.611 0.289 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -10.900 4.594 -0.980 1.00 0.00 H new ATOM 2026 N ASN B 54 -12.822 8.830 -1.113 1.00 0.00 N ATOM 2027 CA ASN B 54 -14.027 9.369 -0.477 1.00 0.00 C ATOM 2028 C ASN B 54 -15.305 8.845 -1.167 1.00 0.00 C ATOM 2029 O ASN B 54 -16.325 8.628 -0.503 1.00 0.00 O ATOM 2030 CB ASN B 54 -14.024 10.911 -0.480 1.00 0.00 C ATOM 2031 CG ASN B 54 -12.757 11.511 0.111 1.00 0.00 C ATOM 2032 OD1 ASN B 54 -12.644 11.683 1.328 1.00 0.00 O ATOM 2033 ND2 ASN B 54 -11.823 11.896 -0.743 1.00 0.00 N ATOM 0 H ASN B 54 -12.147 9.545 -1.385 1.00 0.00 H new ATOM 0 HA ASN B 54 -14.023 9.026 0.558 1.00 0.00 H new ATOM 0 HB2 ASN B 54 -14.142 11.266 -1.504 1.00 0.00 H new ATOM 0 HB3 ASN B 54 -14.885 11.270 0.084 1.00 0.00 H new ATOM 0 HD21 ASN B 54 -10.976 12.351 -0.402 1.00 0.00 H new ATOM 0 HD22 ASN B 54 -11.950 11.738 -1.743 1.00 0.00 H new ATOM 2040 N VAL B 55 -15.232 8.577 -2.489 1.00 0.00 N ATOM 2041 CA VAL B 55 -16.389 8.028 -3.209 1.00 0.00 C ATOM 2042 C VAL B 55 -16.666 6.594 -2.753 1.00 0.00 C ATOM 2043 O VAL B 55 -17.802 6.156 -2.660 1.00 0.00 O ATOM 2044 CB VAL B 55 -16.262 8.089 -4.770 1.00 0.00 C ATOM 2045 CG1 VAL B 55 -16.050 9.508 -5.240 1.00 0.00 C ATOM 2046 CG2 VAL B 55 -15.166 7.176 -5.324 1.00 0.00 C ATOM 0 H VAL B 55 -14.403 8.729 -3.063 1.00 0.00 H new ATOM 0 HA VAL B 55 -17.232 8.671 -2.954 1.00 0.00 H new ATOM 0 HB VAL B 55 -17.208 7.718 -5.164 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -15.965 9.523 -6.327 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -16.896 10.123 -4.934 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -15.135 9.904 -4.799 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -15.132 7.266 -6.410 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -14.203 7.468 -4.905 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -15.382 6.143 -5.053 1.00 0.00 H new ATOM 2056 N LEU B 56 -15.610 5.886 -2.460 1.00 0.00 N ATOM 2057 CA LEU B 56 -15.698 4.539 -1.950 1.00 0.00 C ATOM 2058 C LEU B 56 -16.256 4.525 -0.569 1.00 0.00 C ATOM 2059 O LEU B 56 -16.970 3.626 -0.211 1.00 0.00 O ATOM 2060 CB LEU B 56 -14.357 3.847 -1.948 1.00 0.00 C ATOM 2061 CG LEU B 56 -13.727 3.618 -3.291 1.00 0.00 C ATOM 2062 CD1 LEU B 56 -12.479 2.818 -3.117 1.00 0.00 C ATOM 2063 CD2 LEU B 56 -14.686 2.911 -4.209 1.00 0.00 C ATOM 0 H LEU B 56 -14.655 6.227 -2.568 1.00 0.00 H new ATOM 0 HA LEU B 56 -16.367 3.998 -2.619 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -13.668 4.436 -1.343 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -14.470 2.882 -1.454 1.00 0.00 H new ATOM 0 HG LEU B 56 -13.478 4.578 -3.742 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -12.017 2.648 -4.090 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -11.785 3.361 -2.475 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -12.722 1.859 -2.659 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -14.213 2.753 -5.178 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -14.960 1.948 -3.778 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -15.582 3.519 -4.337 1.00 0.00 H new ATOM 2075 N GLN B 57 -15.908 5.528 0.207 1.00 0.00 N ATOM 2076 CA GLN B 57 -16.347 5.620 1.597 1.00 0.00 C ATOM 2077 C GLN B 57 -17.825 5.734 1.638 1.00 0.00 C ATOM 2078 O GLN B 57 -18.499 5.045 2.420 1.00 0.00 O ATOM 2079 CB GLN B 57 -15.683 6.803 2.288 1.00 0.00 C ATOM 2080 CG GLN B 57 -14.191 6.791 2.109 1.00 0.00 C ATOM 2081 CD GLN B 57 -13.528 5.570 2.681 1.00 0.00 C ATOM 2082 OE1 GLN B 57 -13.040 5.579 3.802 1.00 0.00 O ATOM 2083 NE2 GLN B 57 -13.649 4.482 1.984 1.00 0.00 N ATOM 0 H GLN B 57 -15.317 6.302 -0.097 1.00 0.00 H new ATOM 0 HA GLN B 57 -16.051 4.718 2.133 1.00 0.00 H new ATOM 0 HB2 GLN B 57 -16.089 7.732 1.888 1.00 0.00 H new ATOM 0 HB3 GLN B 57 -15.921 6.783 3.351 1.00 0.00 H new ATOM 0 HG2 GLN B 57 -13.960 6.855 1.046 1.00 0.00 H new ATOM 0 HG3 GLN B 57 -13.769 7.678 2.581 1.00 0.00 H new ATOM 0 HE21 GLN B 57 -14.062 4.517 1.052 1.00 0.00 H new ATOM 0 HE22 GLN B 57 -13.331 3.592 2.368 1.00 0.00 H new ATOM 2092 N GLU B 58 -18.345 6.553 0.754 1.00 0.00 N ATOM 2093 CA GLU B 58 -19.750 6.685 0.663 1.00 0.00 C ATOM 2094 C GLU B 58 -20.401 5.478 0.034 1.00 0.00 C ATOM 2095 O GLU B 58 -21.510 5.141 0.371 1.00 0.00 O ATOM 2096 CB GLU B 58 -20.220 7.970 0.033 1.00 0.00 C ATOM 2097 CG GLU B 58 -19.583 8.298 -1.292 1.00 0.00 C ATOM 2098 CD GLU B 58 -20.085 9.584 -1.847 1.00 0.00 C ATOM 2099 OE1 GLU B 58 -19.524 10.646 -1.519 1.00 0.00 O ATOM 2100 OE2 GLU B 58 -21.078 9.574 -2.589 1.00 0.00 O ATOM 0 H GLU B 58 -17.809 7.125 0.101 1.00 0.00 H new ATOM 0 HA GLU B 58 -20.086 6.739 1.699 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -21.300 7.917 -0.103 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -20.026 8.789 0.725 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -18.501 8.353 -1.171 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -19.784 7.494 -2.000 1.00 0.00 H new ATOM 2107 N ARG B 59 -19.721 4.842 -0.890 1.00 0.00 N ATOM 2108 CA ARG B 59 -20.256 3.643 -1.493 1.00 0.00 C ATOM 2109 C ARG B 59 -20.371 2.536 -0.436 1.00 0.00 C ATOM 2110 O ARG B 59 -21.375 1.857 -0.346 1.00 0.00 O ATOM 2111 CB ARG B 59 -19.390 3.208 -2.723 1.00 0.00 C ATOM 2112 CG ARG B 59 -19.798 1.896 -3.452 1.00 0.00 C ATOM 2113 CD ARG B 59 -19.367 0.638 -2.683 1.00 0.00 C ATOM 2114 NE ARG B 59 -19.845 -0.625 -3.278 1.00 0.00 N ATOM 2115 CZ ARG B 59 -20.216 -1.710 -2.555 1.00 0.00 C ATOM 2116 NH1 ARG B 59 -20.294 -1.627 -1.226 1.00 0.00 N ATOM 2117 NH2 ARG B 59 -20.534 -2.847 -3.166 1.00 0.00 N ATOM 0 H ARG B 59 -18.806 5.130 -1.238 1.00 0.00 H new ATOM 0 HA ARG B 59 -21.258 3.843 -1.872 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -19.407 4.019 -3.452 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -18.358 3.102 -2.389 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -20.879 1.881 -3.589 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -19.350 1.882 -4.446 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -18.279 0.613 -2.630 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -19.735 0.707 -1.659 1.00 0.00 H new ATOM 0 HE ARG B 59 -19.900 -0.685 -4.295 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -20.075 -0.749 -0.756 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -20.573 -2.442 -0.680 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -20.499 -2.906 -4.184 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -20.812 -3.660 -2.617 1.00 0.00 H new ATOM 2131 N VAL B 60 -19.357 2.389 0.374 1.00 0.00 N ATOM 2132 CA VAL B 60 -19.347 1.359 1.386 1.00 0.00 C ATOM 2133 C VAL B 60 -20.422 1.631 2.444 1.00 0.00 C ATOM 2134 O VAL B 60 -21.107 0.710 2.887 1.00 0.00 O ATOM 2135 CB VAL B 60 -17.929 1.176 2.025 1.00 0.00 C ATOM 2136 CG1 VAL B 60 -17.955 0.131 3.133 1.00 0.00 C ATOM 2137 CG2 VAL B 60 -16.929 0.738 0.960 1.00 0.00 C ATOM 0 H VAL B 60 -18.520 2.972 0.355 1.00 0.00 H new ATOM 0 HA VAL B 60 -19.588 0.413 0.900 1.00 0.00 H new ATOM 0 HB VAL B 60 -17.630 2.135 2.449 1.00 0.00 H new ATOM 0 HG11 VAL B 60 -16.957 0.026 3.558 1.00 0.00 H new ATOM 0 HG12 VAL B 60 -18.650 0.444 3.912 1.00 0.00 H new ATOM 0 HG13 VAL B 60 -18.277 -0.826 2.723 1.00 0.00 H new ATOM 0 HG21 VAL B 60 -15.946 0.613 1.414 1.00 0.00 H new ATOM 0 HG22 VAL B 60 -17.251 -0.208 0.526 1.00 0.00 H new ATOM 0 HG23 VAL B 60 -16.875 1.496 0.178 1.00 0.00 H new ATOM 2147 N GLY B 61 -20.603 2.885 2.802 1.00 0.00 N ATOM 2148 CA GLY B 61 -21.601 3.206 3.799 1.00 0.00 C ATOM 2149 C GLY B 61 -23.035 3.344 3.258 1.00 0.00 C ATOM 2150 O GLY B 61 -23.954 2.658 3.724 1.00 0.00 O ATOM 0 H GLY B 61 -20.086 3.681 2.428 1.00 0.00 H new ATOM 0 HA2 GLY B 61 -21.590 2.431 4.566 1.00 0.00 H new ATOM 0 HA3 GLY B 61 -21.320 4.140 4.286 1.00 0.00 H new