USER MOD reduce.3.24.130724 H: found=0, std=0, add=809, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 811 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 89 THR OG1 : rot 115:sc= 0.765 USER MOD Set 1.2: A 91 ASN : amide:sc= 0.673 X(o=1.4,f=1.7) USER MOD Set 2.1: A 11 CYS SG : rot -56:sc= 1.03 USER MOD Set 2.2: A 87 TYR OH : rot 90:sc= 1.48 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 MET CE :methyl -128:sc= -2.55 (180deg=-3.53) USER MOD Single : A 6 ASN : amide:sc= -0.452 K(o=-0.45,f=-6.1!) USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 22 GLN : amide:sc= 0 K(o=0,f=-1.5) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0.0087) USER MOD Single : A 34 ASN : amide:sc= -0.214 X(o=-0.21,f=-0.046) USER MOD Single : A 36 THR OG1 : rot 180:sc= -0.123 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 60 GLN : amide:sc= -0.148 K(o=-0.15,f=-1.9!) USER MOD Single : A 61 SER OG : rot 50:sc= 0 USER MOD Single : A 64 ASN : amide:sc= 0.227 X(o=0.23,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot 17:sc= -0.174 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 THR OG1 : rot 180:sc= 0.106 USER MOD Single : A 90 MET CE :methyl -146:sc= -0.646 (180deg=-1.4) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 ASN : amide:sc= -0.408 K(o=-0.41,f=-1.3) USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 ASN : amide:sc=-0.00235 X(o=-0.0023,f=-0.31) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 29 N SER A 4 7.688 -13.814 -4.229 1.00 24.00 N ATOM 30 CA SER A 4 7.524 -12.744 -3.252 1.00 14.12 C ATOM 31 C SER A 4 6.375 -11.820 -3.646 1.00 1.32 C ATOM 32 O SER A 4 5.780 -11.972 -4.713 1.00 25.23 O ATOM 33 CB SER A 4 8.819 -11.938 -3.123 1.00 22.41 C ATOM 34 OG SER A 4 8.802 -10.805 -3.973 1.00 33.12 O ATOM 0 HA SER A 4 7.289 -13.198 -2.289 1.00 14.12 H new ATOM 0 HB2 SER A 4 8.951 -11.619 -2.089 1.00 22.41 H new ATOM 0 HB3 SER A 4 9.671 -12.571 -3.372 1.00 22.41 H new ATOM 0 HG SER A 4 9.640 -10.307 -3.871 1.00 33.12 H new ATOM 40 N MET A 5 6.070 -10.862 -2.776 1.00 72.14 N ATOM 41 CA MET A 5 4.992 -9.913 -3.034 1.00 4.34 C ATOM 42 C MET A 5 5.483 -8.478 -2.868 1.00 53.44 C ATOM 43 O MET A 5 6.284 -8.184 -1.983 1.00 41.11 O ATOM 44 CB MET A 5 3.817 -10.175 -2.091 1.00 51.12 C ATOM 45 CG MET A 5 2.615 -9.284 -2.356 1.00 52.22 C ATOM 46 SD MET A 5 1.182 -9.734 -1.359 1.00 2.25 S ATOM 47 CE MET A 5 1.781 -9.352 0.286 1.00 61.14 C ATOM 0 H MET A 5 6.553 -10.722 -1.888 1.00 72.14 H new ATOM 0 HA MET A 5 4.659 -10.049 -4.063 1.00 4.34 H new ATOM 0 HB2 MET A 5 3.513 -11.218 -2.183 1.00 51.12 H new ATOM 0 HB3 MET A 5 4.148 -10.029 -1.063 1.00 51.12 H new ATOM 0 HG2 MET A 5 2.884 -8.248 -2.151 1.00 52.22 H new ATOM 0 HG3 MET A 5 2.351 -9.342 -3.412 1.00 52.22 H new ATOM 0 HE1 MET A 5 1.636 -10.215 0.936 1.00 61.14 H new ATOM 0 HE2 MET A 5 2.842 -9.107 0.239 1.00 61.14 H new ATOM 0 HE3 MET A 5 1.230 -8.501 0.685 1.00 61.14 H new ATOM 57 N ASN A 6 4.994 -7.588 -3.727 1.00 2.34 N ATOM 58 CA ASN A 6 5.384 -6.183 -3.675 1.00 20.35 C ATOM 59 C ASN A 6 4.191 -5.301 -3.321 1.00 50.14 C ATOM 60 O ASN A 6 3.093 -5.484 -3.848 1.00 54.44 O ATOM 61 CB ASN A 6 5.975 -5.747 -5.017 1.00 73.11 C ATOM 62 CG ASN A 6 6.783 -6.847 -5.678 1.00 55.02 C ATOM 63 OD1 ASN A 6 7.763 -7.336 -5.116 1.00 53.53 O ATOM 64 ND2 ASN A 6 6.372 -7.242 -6.878 1.00 23.02 N ATOM 0 H ASN A 6 4.328 -7.814 -4.466 1.00 2.34 H new ATOM 0 HA ASN A 6 6.140 -6.069 -2.898 1.00 20.35 H new ATOM 0 HB2 ASN A 6 5.169 -5.442 -5.684 1.00 73.11 H new ATOM 0 HB3 ASN A 6 6.611 -4.875 -4.865 1.00 73.11 H new ATOM 0 HD21 ASN A 6 6.875 -7.979 -7.372 1.00 23.02 H new ATOM 0 HD22 ASN A 6 5.554 -6.808 -7.305 1.00 23.02 H new ATOM 71 N ILE A 7 4.414 -4.344 -2.428 1.00 13.21 N ATOM 72 CA ILE A 7 3.358 -3.432 -2.005 1.00 3.21 C ATOM 73 C ILE A 7 3.594 -2.027 -2.550 1.00 63.11 C ATOM 74 O ILE A 7 4.733 -1.570 -2.647 1.00 41.11 O ATOM 75 CB ILE A 7 3.254 -3.363 -0.470 1.00 71.41 C ATOM 76 CG1 ILE A 7 2.969 -4.752 0.105 1.00 4.32 C ATOM 77 CG2 ILE A 7 2.170 -2.380 -0.056 1.00 74.30 C ATOM 78 CD1 ILE A 7 4.157 -5.369 0.811 1.00 1.12 C ATOM 0 H ILE A 7 5.317 -4.179 -1.983 1.00 13.21 H new ATOM 0 HA ILE A 7 2.424 -3.824 -2.407 1.00 3.21 H new ATOM 0 HB ILE A 7 4.206 -3.012 -0.071 1.00 71.41 H new ATOM 0 HG12 ILE A 7 2.136 -4.683 0.805 1.00 4.32 H new ATOM 0 HG13 ILE A 7 2.653 -5.413 -0.702 1.00 4.32 H new ATOM 0 HG21 ILE A 7 2.109 -2.343 1.032 1.00 74.30 H new ATOM 0 HG22 ILE A 7 2.412 -1.389 -0.440 1.00 74.30 H new ATOM 0 HG23 ILE A 7 1.212 -2.703 -0.462 1.00 74.30 H new ATOM 0 HD11 ILE A 7 3.883 -6.352 1.193 1.00 1.12 H new ATOM 0 HD12 ILE A 7 4.985 -5.470 0.109 1.00 1.12 H new ATOM 0 HD13 ILE A 7 4.460 -4.729 1.640 1.00 1.12 H new ATOM 90 N LEU A 8 2.510 -1.346 -2.905 1.00 13.01 N ATOM 91 CA LEU A 8 2.597 0.008 -3.439 1.00 5.43 C ATOM 92 C LEU A 8 1.938 1.009 -2.496 1.00 53.42 C ATOM 93 O LEU A 8 0.819 0.793 -2.027 1.00 71.13 O ATOM 94 CB LEU A 8 1.938 0.077 -4.817 1.00 53.55 C ATOM 95 CG LEU A 8 2.373 1.239 -5.712 1.00 12.13 C ATOM 96 CD1 LEU A 8 1.883 2.563 -5.143 1.00 65.24 C ATOM 97 CD2 LEU A 8 3.886 1.252 -5.871 1.00 53.54 C ATOM 0 H LEU A 8 1.560 -1.710 -2.832 1.00 13.01 H new ATOM 0 HA LEU A 8 3.651 0.267 -3.534 1.00 5.43 H new ATOM 0 HB2 LEU A 8 2.142 -0.856 -5.342 1.00 53.55 H new ATOM 0 HB3 LEU A 8 0.858 0.136 -4.679 1.00 53.55 H new ATOM 0 HG LEU A 8 1.926 1.102 -6.696 1.00 12.13 H new ATOM 0 HD11 LEU A 8 2.202 3.378 -5.792 1.00 65.24 H new ATOM 0 HD12 LEU A 8 0.795 2.552 -5.081 1.00 65.24 H new ATOM 0 HD13 LEU A 8 2.301 2.708 -4.147 1.00 65.24 H new ATOM 0 HD21 LEU A 8 4.177 2.085 -6.511 1.00 53.54 H new ATOM 0 HD22 LEU A 8 4.354 1.365 -4.893 1.00 53.54 H new ATOM 0 HD23 LEU A 8 4.212 0.316 -6.324 1.00 53.54 H new ATOM 109 N LEU A 9 2.635 2.106 -2.224 1.00 4.15 N ATOM 110 CA LEU A 9 2.117 3.143 -1.337 1.00 74.45 C ATOM 111 C LEU A 9 2.099 4.498 -2.037 1.00 50.44 C ATOM 112 O LEU A 9 3.108 4.936 -2.590 1.00 11.55 O ATOM 113 CB LEU A 9 2.962 3.224 -0.066 1.00 33.12 C ATOM 114 CG LEU A 9 2.268 3.811 1.165 1.00 35.40 C ATOM 115 CD1 LEU A 9 2.343 2.839 2.333 1.00 54.21 C ATOM 116 CD2 LEU A 9 2.887 5.148 1.540 1.00 10.22 C ATOM 0 H LEU A 9 3.561 2.301 -2.605 1.00 4.15 H new ATOM 0 HA LEU A 9 1.094 2.879 -1.069 1.00 74.45 H new ATOM 0 HB2 LEU A 9 3.308 2.220 0.181 1.00 33.12 H new ATOM 0 HB3 LEU A 9 3.847 3.823 -0.280 1.00 33.12 H new ATOM 0 HG LEU A 9 1.218 3.976 0.923 1.00 35.40 H new ATOM 0 HD11 LEU A 9 1.845 3.273 3.200 1.00 54.21 H new ATOM 0 HD12 LEU A 9 1.851 1.905 2.061 1.00 54.21 H new ATOM 0 HD13 LEU A 9 3.387 2.642 2.576 1.00 54.21 H new ATOM 0 HD21 LEU A 9 2.381 5.550 2.417 1.00 10.22 H new ATOM 0 HD22 LEU A 9 3.945 5.009 1.763 1.00 10.22 H new ATOM 0 HD23 LEU A 9 2.780 5.845 0.708 1.00 10.22 H new ATOM 128 N VAL A 10 0.945 5.158 -2.009 1.00 44.43 N ATOM 129 CA VAL A 10 0.797 6.466 -2.638 1.00 24.44 C ATOM 130 C VAL A 10 0.820 7.581 -1.598 1.00 34.32 C ATOM 131 O VAL A 10 -0.094 7.699 -0.780 1.00 51.24 O ATOM 132 CB VAL A 10 -0.512 6.556 -3.443 1.00 74.11 C ATOM 133 CG1 VAL A 10 -0.564 7.853 -4.236 1.00 30.32 C ATOM 134 CG2 VAL A 10 -0.655 5.353 -4.364 1.00 13.21 C ATOM 0 H VAL A 10 0.099 4.809 -1.558 1.00 44.43 H new ATOM 0 HA VAL A 10 1.641 6.589 -3.317 1.00 24.44 H new ATOM 0 HB VAL A 10 -1.348 6.552 -2.744 1.00 74.11 H new ATOM 0 HG11 VAL A 10 -1.497 7.898 -4.799 1.00 30.32 H new ATOM 0 HG12 VAL A 10 -0.511 8.700 -3.552 1.00 30.32 H new ATOM 0 HG13 VAL A 10 0.278 7.891 -4.927 1.00 30.32 H new ATOM 0 HG21 VAL A 10 -1.586 5.433 -4.925 1.00 13.21 H new ATOM 0 HG22 VAL A 10 0.186 5.324 -5.057 1.00 13.21 H new ATOM 0 HG23 VAL A 10 -0.667 4.439 -3.770 1.00 13.21 H new ATOM 144 N CYS A 11 1.867 8.397 -1.637 1.00 32.44 N ATOM 145 CA CYS A 11 2.009 9.504 -0.697 1.00 72.10 C ATOM 146 C CYS A 11 3.186 10.395 -1.081 1.00 15.23 C ATOM 147 O CYS A 11 4.108 10.595 -0.292 1.00 43.22 O ATOM 148 CB CYS A 11 2.197 8.973 0.724 1.00 72.51 C ATOM 149 SG CYS A 11 2.062 10.238 2.009 1.00 31.13 S ATOM 0 H CYS A 11 2.630 8.314 -2.309 1.00 32.44 H new ATOM 0 HA CYS A 11 1.098 10.101 -0.736 1.00 72.10 H new ATOM 0 HB2 CYS A 11 1.454 8.198 0.912 1.00 72.51 H new ATOM 0 HB3 CYS A 11 3.176 8.499 0.797 1.00 72.51 H new ATOM 0 HG CYS A 11 2.910 11.193 1.768 1.00 31.13 H new ATOM 232 N MET A 19 9.690 6.924 6.232 1.00 44.34 N ATOM 233 CA MET A 19 9.301 6.369 7.523 1.00 40.04 C ATOM 234 C MET A 19 8.498 5.084 7.342 1.00 24.21 C ATOM 235 O MET A 19 8.781 4.068 7.979 1.00 43.51 O ATOM 236 CB MET A 19 8.480 7.389 8.313 1.00 30.04 C ATOM 237 CG MET A 19 9.247 8.660 8.644 1.00 35.21 C ATOM 238 SD MET A 19 8.160 10.038 9.058 1.00 21.33 S ATOM 239 CE MET A 19 9.072 10.797 10.401 1.00 65.45 C ATOM 0 HA MET A 19 10.209 6.135 8.079 1.00 40.04 H new ATOM 0 HB2 MET A 19 7.590 7.650 7.740 1.00 30.04 H new ATOM 0 HB3 MET A 19 8.138 6.929 9.240 1.00 30.04 H new ATOM 0 HG2 MET A 19 9.918 8.467 9.481 1.00 35.21 H new ATOM 0 HG3 MET A 19 9.870 8.936 7.793 1.00 35.21 H new ATOM 0 HE1 MET A 19 8.526 11.667 10.766 1.00 65.45 H new ATOM 0 HE2 MET A 19 9.192 10.078 11.211 1.00 65.45 H new ATOM 0 HE3 MET A 19 10.054 11.108 10.044 1.00 65.45 H new ATOM 249 N LEU A 20 7.497 5.135 6.471 1.00 11.15 N ATOM 250 CA LEU A 20 6.653 3.975 6.207 1.00 73.43 C ATOM 251 C LEU A 20 7.499 2.750 5.876 1.00 24.13 C ATOM 252 O LEU A 20 7.555 1.793 6.649 1.00 50.23 O ATOM 253 CB LEU A 20 5.691 4.270 5.055 1.00 14.34 C ATOM 254 CG LEU A 20 4.241 4.552 5.447 1.00 35.11 C ATOM 255 CD1 LEU A 20 3.595 3.306 6.034 1.00 33.32 C ATOM 256 CD2 LEU A 20 4.169 5.708 6.435 1.00 74.51 C ATOM 0 H LEU A 20 7.250 5.967 5.935 1.00 11.15 H new ATOM 0 HA LEU A 20 6.077 3.764 7.108 1.00 73.43 H new ATOM 0 HB2 LEU A 20 6.071 5.129 4.502 1.00 14.34 H new ATOM 0 HB3 LEU A 20 5.703 3.421 4.372 1.00 14.34 H new ATOM 0 HG LEU A 20 3.691 4.834 4.549 1.00 35.11 H new ATOM 0 HD11 LEU A 20 2.563 3.526 6.307 1.00 33.32 H new ATOM 0 HD12 LEU A 20 3.612 2.505 5.295 1.00 33.32 H new ATOM 0 HD13 LEU A 20 4.147 2.994 6.921 1.00 33.32 H new ATOM 0 HD21 LEU A 20 3.129 5.894 6.702 1.00 74.51 H new ATOM 0 HD22 LEU A 20 4.735 5.456 7.332 1.00 74.51 H new ATOM 0 HD23 LEU A 20 4.592 6.603 5.979 1.00 74.51 H new ATOM 268 N VAL A 21 8.158 2.787 4.722 1.00 4.13 N ATOM 269 CA VAL A 21 9.005 1.681 4.290 1.00 25.23 C ATOM 270 C VAL A 21 9.998 1.292 5.378 1.00 24.54 C ATOM 271 O VAL A 21 10.376 0.126 5.499 1.00 1.05 O ATOM 272 CB VAL A 21 9.780 2.036 3.007 1.00 61.41 C ATOM 273 CG1 VAL A 21 10.673 3.245 3.239 1.00 23.24 C ATOM 274 CG2 VAL A 21 10.595 0.843 2.530 1.00 0.12 C ATOM 0 H VAL A 21 8.122 3.570 4.070 1.00 4.13 H new ATOM 0 HA VAL A 21 8.345 0.838 4.086 1.00 25.23 H new ATOM 0 HB VAL A 21 9.061 2.291 2.228 1.00 61.41 H new ATOM 0 HG11 VAL A 21 11.212 3.480 2.321 1.00 23.24 H new ATOM 0 HG12 VAL A 21 10.061 4.099 3.530 1.00 23.24 H new ATOM 0 HG13 VAL A 21 11.387 3.023 4.033 1.00 23.24 H new ATOM 0 HG21 VAL A 21 11.136 1.111 1.623 1.00 0.12 H new ATOM 0 HG22 VAL A 21 11.306 0.555 3.305 1.00 0.12 H new ATOM 0 HG23 VAL A 21 9.928 0.007 2.321 1.00 0.12 H new ATOM 284 N GLN A 22 10.418 2.275 6.169 1.00 72.14 N ATOM 285 CA GLN A 22 11.368 2.034 7.248 1.00 0.21 C ATOM 286 C GLN A 22 10.805 1.041 8.258 1.00 21.53 C ATOM 287 O GLN A 22 11.310 -0.075 8.395 1.00 11.43 O ATOM 288 CB GLN A 22 11.720 3.347 7.949 1.00 45.51 C ATOM 289 CG GLN A 22 13.147 3.807 7.697 1.00 2.44 C ATOM 290 CD GLN A 22 14.150 3.120 8.603 1.00 51.30 C ATOM 291 OE1 GLN A 22 14.016 1.935 8.910 1.00 14.12 O ATOM 292 NE2 GLN A 22 15.163 3.862 9.035 1.00 22.04 N ATOM 0 H GLN A 22 10.115 3.245 6.082 1.00 72.14 H new ATOM 0 HA GLN A 22 12.272 1.608 6.813 1.00 0.21 H new ATOM 0 HB2 GLN A 22 11.032 4.124 7.615 1.00 45.51 H new ATOM 0 HB3 GLN A 22 11.569 3.228 9.022 1.00 45.51 H new ATOM 0 HG2 GLN A 22 13.409 3.612 6.657 1.00 2.44 H new ATOM 0 HG3 GLN A 22 13.209 4.885 7.845 1.00 2.44 H new ATOM 0 HE21 GLN A 22 15.234 4.840 8.755 1.00 22.04 H new ATOM 0 HE22 GLN A 22 15.870 3.454 9.647 1.00 22.04 H new ATOM 301 N ARG A 23 9.755 1.452 8.964 1.00 64.42 N ATOM 302 CA ARG A 23 9.124 0.597 9.963 1.00 41.14 C ATOM 303 C ARG A 23 8.720 -0.743 9.355 1.00 13.40 C ATOM 304 O ARG A 23 9.014 -1.801 9.910 1.00 24.12 O ATOM 305 CB ARG A 23 7.897 1.292 10.555 1.00 10.00 C ATOM 306 CG ARG A 23 8.189 2.676 11.110 1.00 64.11 C ATOM 307 CD ARG A 23 6.974 3.265 11.808 1.00 55.21 C ATOM 308 NE ARG A 23 5.757 3.102 11.017 1.00 54.01 N ATOM 309 CZ ARG A 23 5.514 3.770 9.894 1.00 2.21 C ATOM 310 NH1 ARG A 23 6.401 4.641 9.432 1.00 31.04 N ATOM 311 NH2 ARG A 23 4.384 3.566 9.230 1.00 11.54 N ATOM 0 H ARG A 23 9.324 2.371 8.862 1.00 64.42 H new ATOM 0 HA ARG A 23 9.847 0.412 10.757 1.00 41.14 H new ATOM 0 HB2 ARG A 23 7.129 1.373 9.785 1.00 10.00 H new ATOM 0 HB3 ARG A 23 7.486 0.670 11.350 1.00 10.00 H new ATOM 0 HG2 ARG A 23 9.021 2.619 11.812 1.00 64.11 H new ATOM 0 HG3 ARG A 23 8.500 3.336 10.300 1.00 64.11 H new ATOM 0 HD2 ARG A 23 6.844 2.784 12.777 1.00 55.21 H new ATOM 0 HD3 ARG A 23 7.143 4.325 11.999 1.00 55.21 H new ATOM 0 HE ARG A 23 5.055 2.439 11.345 1.00 54.01 H new ATOM 0 HH11 ARG A 23 7.272 4.799 9.939 1.00 31.04 H new ATOM 0 HH12 ARG A 23 6.212 5.152 8.570 1.00 31.04 H new ATOM 0 HH21 ARG A 23 3.700 2.896 9.581 1.00 11.54 H new ATOM 0 HH22 ARG A 23 4.199 4.079 8.368 1.00 11.54 H new ATOM 325 N ILE A 24 8.044 -0.688 8.213 1.00 72.45 N ATOM 326 CA ILE A 24 7.599 -1.897 7.529 1.00 1.22 C ATOM 327 C ILE A 24 8.770 -2.835 7.253 1.00 2.34 C ATOM 328 O ILE A 24 8.692 -4.034 7.516 1.00 41.30 O ATOM 329 CB ILE A 24 6.896 -1.567 6.200 1.00 40.13 C ATOM 330 CG1 ILE A 24 5.673 -0.681 6.451 1.00 61.42 C ATOM 331 CG2 ILE A 24 6.493 -2.846 5.482 1.00 74.23 C ATOM 332 CD1 ILE A 24 5.410 0.313 5.342 1.00 42.11 C ATOM 0 H ILE A 24 7.792 0.181 7.741 1.00 72.45 H new ATOM 0 HA ILE A 24 6.889 -2.391 8.192 1.00 1.22 H new ATOM 0 HB ILE A 24 7.592 -1.021 5.563 1.00 40.13 H new ATOM 0 HG12 ILE A 24 4.795 -1.315 6.576 1.00 61.42 H new ATOM 0 HG13 ILE A 24 5.812 -0.140 7.387 1.00 61.42 H new ATOM 0 HG21 ILE A 24 5.997 -2.596 4.544 1.00 74.23 H new ATOM 0 HG22 ILE A 24 7.382 -3.442 5.275 1.00 74.23 H new ATOM 0 HG23 ILE A 24 5.811 -3.417 6.112 1.00 74.23 H new ATOM 0 HD11 ILE A 24 4.529 0.907 5.587 1.00 42.11 H new ATOM 0 HD12 ILE A 24 6.272 0.971 5.231 1.00 42.11 H new ATOM 0 HD13 ILE A 24 5.239 -0.221 4.407 1.00 42.11 H new ATOM 344 N GLU A 25 9.855 -2.277 6.723 1.00 31.44 N ATOM 345 CA GLU A 25 11.042 -3.064 6.412 1.00 25.03 C ATOM 346 C GLU A 25 11.596 -3.731 7.668 1.00 21.35 C ATOM 347 O GLU A 25 11.979 -4.902 7.645 1.00 3.44 O ATOM 348 CB GLU A 25 12.116 -2.178 5.777 1.00 60.10 C ATOM 349 CG GLU A 25 11.939 -1.987 4.280 1.00 72.23 C ATOM 350 CD GLU A 25 12.543 -3.120 3.471 1.00 14.43 C ATOM 351 OE1 GLU A 25 13.780 -3.282 3.511 1.00 22.42 O ATOM 352 OE2 GLU A 25 11.778 -3.842 2.799 1.00 21.13 O ATOM 0 H GLU A 25 9.936 -1.285 6.501 1.00 31.44 H new ATOM 0 HA GLU A 25 10.756 -3.841 5.703 1.00 25.03 H new ATOM 0 HB2 GLU A 25 12.105 -1.203 6.263 1.00 60.10 H new ATOM 0 HB3 GLU A 25 13.096 -2.617 5.966 1.00 60.10 H new ATOM 0 HG2 GLU A 25 10.876 -1.908 4.051 1.00 72.23 H new ATOM 0 HG3 GLU A 25 12.400 -1.046 3.981 1.00 72.23 H new ATOM 359 N LYS A 26 11.636 -2.979 8.763 1.00 70.12 N ATOM 360 CA LYS A 26 12.142 -3.496 10.028 1.00 31.14 C ATOM 361 C LYS A 26 11.327 -4.700 10.490 1.00 13.31 C ATOM 362 O LYS A 26 11.862 -5.794 10.668 1.00 44.31 O ATOM 363 CB LYS A 26 12.109 -2.403 11.100 1.00 72.15 C ATOM 364 CG LYS A 26 13.462 -1.763 11.358 1.00 73.41 C ATOM 365 CD LYS A 26 14.387 -2.702 12.113 1.00 32.33 C ATOM 366 CE LYS A 26 15.342 -1.937 13.017 1.00 31.01 C ATOM 367 NZ LYS A 26 16.326 -2.840 13.676 1.00 52.12 N ATOM 0 H LYS A 26 11.324 -2.009 8.799 1.00 70.12 H new ATOM 0 HA LYS A 26 13.173 -3.815 9.874 1.00 31.14 H new ATOM 0 HB2 LYS A 26 11.403 -1.630 10.797 1.00 72.15 H new ATOM 0 HB3 LYS A 26 11.735 -2.830 12.031 1.00 72.15 H new ATOM 0 HG2 LYS A 26 13.920 -1.484 10.409 1.00 73.41 H new ATOM 0 HG3 LYS A 26 13.328 -0.845 11.930 1.00 73.41 H new ATOM 0 HD2 LYS A 26 13.795 -3.395 12.711 1.00 32.33 H new ATOM 0 HD3 LYS A 26 14.958 -3.301 11.403 1.00 32.33 H new ATOM 0 HE2 LYS A 26 15.873 -1.187 12.432 1.00 31.01 H new ATOM 0 HE3 LYS A 26 14.773 -1.403 13.778 1.00 31.01 H new ATOM 0 HZ1 LYS A 26 16.958 -2.280 14.283 1.00 52.12 H new ATOM 0 HZ2 LYS A 26 15.821 -3.541 14.255 1.00 52.12 H new ATOM 0 HZ3 LYS A 26 16.887 -3.330 12.951 1.00 52.12 H new ATOM 381 N TYR A 27 10.028 -4.490 10.681 1.00 21.11 N ATOM 382 CA TYR A 27 9.139 -5.558 11.123 1.00 45.21 C ATOM 383 C TYR A 27 9.282 -6.788 10.233 1.00 35.24 C ATOM 384 O TYR A 27 9.567 -7.885 10.713 1.00 4.01 O ATOM 385 CB TYR A 27 7.688 -5.075 11.118 1.00 72.32 C ATOM 386 CG TYR A 27 6.682 -6.179 11.361 1.00 45.12 C ATOM 387 CD1 TYR A 27 6.186 -6.937 10.308 1.00 31.52 C ATOM 388 CD2 TYR A 27 6.229 -6.462 12.643 1.00 63.12 C ATOM 389 CE1 TYR A 27 5.267 -7.945 10.525 1.00 10.43 C ATOM 390 CE2 TYR A 27 5.312 -7.470 12.870 1.00 35.34 C ATOM 391 CZ TYR A 27 4.833 -8.208 11.808 1.00 41.11 C ATOM 392 OH TYR A 27 3.919 -9.212 12.028 1.00 31.34 O ATOM 0 H TYR A 27 9.568 -3.591 10.537 1.00 21.11 H new ATOM 0 HA TYR A 27 9.419 -5.834 12.140 1.00 45.21 H new ATOM 0 HB2 TYR A 27 7.566 -4.309 11.884 1.00 72.32 H new ATOM 0 HB3 TYR A 27 7.474 -4.604 10.159 1.00 72.32 H new ATOM 0 HD1 TYR A 27 6.525 -6.735 9.303 1.00 31.52 H new ATOM 0 HD2 TYR A 27 6.600 -5.884 13.477 1.00 63.12 H new ATOM 0 HE1 TYR A 27 4.890 -8.524 9.695 1.00 10.43 H new ATOM 0 HE2 TYR A 27 4.972 -7.679 13.874 1.00 35.34 H new ATOM 0 HH TYR A 27 3.719 -9.268 12.986 1.00 31.34 H new ATOM 402 N ALA A 28 9.080 -6.597 8.933 1.00 12.13 N ATOM 403 CA ALA A 28 9.188 -7.690 7.975 1.00 10.32 C ATOM 404 C ALA A 28 10.541 -8.384 8.084 1.00 61.31 C ATOM 405 O ALA A 28 10.615 -9.603 8.242 1.00 32.04 O ATOM 406 CB ALA A 28 8.971 -7.174 6.560 1.00 14.13 C ATOM 0 H ALA A 28 8.841 -5.696 8.520 1.00 12.13 H new ATOM 0 HA ALA A 28 8.414 -8.421 8.207 1.00 10.32 H new ATOM 0 HB1 ALA A 28 9.054 -8.001 5.854 1.00 14.13 H new ATOM 0 HB2 ALA A 28 7.979 -6.730 6.483 1.00 14.13 H new ATOM 0 HB3 ALA A 28 9.724 -6.421 6.328 1.00 14.13 H new ATOM 412 N LYS A 29 11.612 -7.601 7.999 1.00 55.10 N ATOM 413 CA LYS A 29 12.963 -8.140 8.089 1.00 32.30 C ATOM 414 C LYS A 29 13.122 -9.007 9.334 1.00 10.00 C ATOM 415 O LYS A 29 13.812 -10.026 9.309 1.00 42.34 O ATOM 416 CB LYS A 29 13.987 -7.003 8.113 1.00 43.55 C ATOM 417 CG LYS A 29 15.428 -7.483 8.140 1.00 43.32 C ATOM 418 CD LYS A 29 16.255 -6.703 9.149 1.00 62.02 C ATOM 419 CE LYS A 29 17.622 -6.342 8.588 1.00 0.54 C ATOM 420 NZ LYS A 29 18.656 -6.260 9.657 1.00 61.52 N ATOM 0 H LYS A 29 11.569 -6.590 7.868 1.00 55.10 H new ATOM 0 HA LYS A 29 13.138 -8.761 7.211 1.00 32.30 H new ATOM 0 HB2 LYS A 29 13.839 -6.373 7.236 1.00 43.55 H new ATOM 0 HB3 LYS A 29 13.804 -6.379 8.988 1.00 43.55 H new ATOM 0 HG2 LYS A 29 15.455 -8.544 8.388 1.00 43.32 H new ATOM 0 HG3 LYS A 29 15.867 -7.377 7.148 1.00 43.32 H new ATOM 0 HD2 LYS A 29 15.724 -5.794 9.431 1.00 62.02 H new ATOM 0 HD3 LYS A 29 16.377 -7.295 10.056 1.00 62.02 H new ATOM 0 HE2 LYS A 29 17.920 -7.087 7.851 1.00 0.54 H new ATOM 0 HE3 LYS A 29 17.560 -5.386 8.068 1.00 0.54 H new ATOM 0 HZ1 LYS A 29 19.573 -6.012 9.234 1.00 61.52 H new ATOM 0 HZ2 LYS A 29 18.384 -5.531 10.348 1.00 61.52 H new ATOM 0 HZ3 LYS A 29 18.733 -7.180 10.137 1.00 61.52 H new ATOM 434 N SER A 30 12.476 -8.597 10.421 1.00 44.32 N ATOM 435 CA SER A 30 12.548 -9.335 11.677 1.00 4.22 C ATOM 436 C SER A 30 11.778 -10.648 11.580 1.00 44.05 C ATOM 437 O SER A 30 12.253 -11.694 12.022 1.00 65.33 O ATOM 438 CB SER A 30 11.992 -8.488 12.823 1.00 74.33 C ATOM 439 OG SER A 30 13.032 -7.820 13.515 1.00 4.20 O ATOM 0 H SER A 30 11.897 -7.758 10.457 1.00 44.32 H new ATOM 0 HA SER A 30 13.595 -9.562 11.877 1.00 4.22 H new ATOM 0 HB2 SER A 30 11.285 -7.757 12.430 1.00 74.33 H new ATOM 0 HB3 SER A 30 11.441 -9.124 13.515 1.00 74.33 H new ATOM 0 HG SER A 30 12.650 -7.284 14.241 1.00 4.20 H new ATOM 445 N LYS A 31 10.586 -10.586 10.997 1.00 31.25 N ATOM 446 CA LYS A 31 9.748 -11.769 10.839 1.00 1.52 C ATOM 447 C LYS A 31 10.308 -12.692 9.761 1.00 13.34 C ATOM 448 O LYS A 31 9.919 -13.855 9.663 1.00 0.35 O ATOM 449 CB LYS A 31 8.316 -11.361 10.484 1.00 22.23 C ATOM 450 CG LYS A 31 7.496 -10.917 11.683 1.00 60.53 C ATOM 451 CD LYS A 31 7.110 -12.096 12.561 1.00 11.21 C ATOM 452 CE LYS A 31 5.636 -12.440 12.417 1.00 73.11 C ATOM 453 NZ LYS A 31 5.425 -13.897 12.197 1.00 51.01 N ATOM 0 H LYS A 31 10.178 -9.728 10.626 1.00 31.25 H new ATOM 0 HA LYS A 31 9.741 -12.308 11.786 1.00 1.52 H new ATOM 0 HB2 LYS A 31 8.348 -10.551 9.756 1.00 22.23 H new ATOM 0 HB3 LYS A 31 7.816 -12.202 10.003 1.00 22.23 H new ATOM 0 HG2 LYS A 31 8.067 -10.197 12.269 1.00 60.53 H new ATOM 0 HG3 LYS A 31 6.596 -10.407 11.341 1.00 60.53 H new ATOM 0 HD2 LYS A 31 7.715 -12.963 12.294 1.00 11.21 H new ATOM 0 HD3 LYS A 31 7.330 -11.862 13.603 1.00 11.21 H new ATOM 0 HE2 LYS A 31 5.101 -12.127 13.314 1.00 73.11 H new ATOM 0 HE3 LYS A 31 5.213 -11.882 11.582 1.00 73.11 H new ATOM 0 HZ1 LYS A 31 4.407 -14.090 12.104 1.00 51.01 H new ATOM 0 HZ2 LYS A 31 5.914 -14.191 11.328 1.00 51.01 H new ATOM 0 HZ3 LYS A 31 5.806 -14.429 13.006 1.00 51.01 H new ATOM 467 N ASN A 32 11.223 -12.164 8.955 1.00 61.43 N ATOM 468 CA ASN A 32 11.837 -12.942 7.884 1.00 60.33 C ATOM 469 C ASN A 32 10.799 -13.346 6.841 1.00 34.32 C ATOM 470 O ASN A 32 10.697 -14.518 6.474 1.00 33.03 O ATOM 471 CB ASN A 32 12.516 -14.189 8.455 1.00 52.31 C ATOM 472 CG ASN A 32 13.602 -14.725 7.543 1.00 51.25 C ATOM 473 OD1 ASN A 32 13.368 -15.637 6.750 1.00 63.22 O ATOM 474 ND2 ASN A 32 14.798 -14.157 7.650 1.00 73.43 N ATOM 0 H ASN A 32 11.556 -11.202 9.022 1.00 61.43 H new ATOM 0 HA ASN A 32 12.588 -12.318 7.400 1.00 60.33 H new ATOM 0 HB2 ASN A 32 12.947 -13.952 9.428 1.00 52.31 H new ATOM 0 HB3 ASN A 32 11.767 -14.964 8.619 1.00 52.31 H new ATOM 0 HD21 ASN A 32 15.568 -14.474 7.061 1.00 73.43 H new ATOM 0 HD22 ASN A 32 14.947 -13.404 8.321 1.00 73.43 H new ATOM 481 N ILE A 33 10.031 -12.370 6.369 1.00 33.34 N ATOM 482 CA ILE A 33 9.002 -12.625 5.368 1.00 31.31 C ATOM 483 C ILE A 33 9.458 -12.173 3.985 1.00 72.50 C ATOM 484 O ILE A 33 10.147 -11.164 3.846 1.00 10.44 O ATOM 485 CB ILE A 33 7.684 -11.910 5.722 1.00 65.33 C ATOM 486 CG1 ILE A 33 7.178 -12.375 7.088 1.00 0.44 C ATOM 487 CG2 ILE A 33 6.638 -12.168 4.647 1.00 24.31 C ATOM 488 CD1 ILE A 33 6.194 -11.418 7.725 1.00 73.10 C ATOM 0 H ILE A 33 10.102 -11.396 6.663 1.00 33.34 H new ATOM 0 HA ILE A 33 8.830 -13.701 5.357 1.00 31.31 H new ATOM 0 HB ILE A 33 7.870 -10.837 5.771 1.00 65.33 H new ATOM 0 HG12 ILE A 33 6.705 -13.351 6.978 1.00 0.44 H new ATOM 0 HG13 ILE A 33 8.029 -12.507 7.756 1.00 0.44 H new ATOM 0 HG21 ILE A 33 5.712 -11.657 4.910 1.00 24.31 H new ATOM 0 HG22 ILE A 33 7.000 -11.793 3.690 1.00 24.31 H new ATOM 0 HG23 ILE A 33 6.452 -13.239 4.570 1.00 24.31 H new ATOM 0 HD11 ILE A 33 5.877 -11.811 8.691 1.00 73.10 H new ATOM 0 HD12 ILE A 33 6.670 -10.448 7.867 1.00 73.10 H new ATOM 0 HD13 ILE A 33 5.325 -11.305 7.077 1.00 73.10 H new ATOM 500 N ASN A 34 9.065 -12.927 2.963 1.00 70.12 N ATOM 501 CA ASN A 34 9.431 -12.603 1.589 1.00 24.43 C ATOM 502 C ASN A 34 8.467 -11.580 0.996 1.00 25.11 C ATOM 503 O ASN A 34 7.533 -11.935 0.279 1.00 31.11 O ATOM 504 CB ASN A 34 9.440 -13.869 0.730 1.00 64.41 C ATOM 505 CG ASN A 34 10.843 -14.384 0.473 1.00 62.13 C ATOM 506 OD1 ASN A 34 11.143 -15.552 0.717 1.00 72.00 O ATOM 507 ND2 ASN A 34 11.712 -13.510 -0.023 1.00 53.44 N ATOM 0 H ASN A 34 8.493 -13.766 3.061 1.00 70.12 H new ATOM 0 HA ASN A 34 10.431 -12.171 1.598 1.00 24.43 H new ATOM 0 HB2 ASN A 34 8.856 -14.645 1.225 1.00 64.41 H new ATOM 0 HB3 ASN A 34 8.952 -13.662 -0.222 1.00 64.41 H new ATOM 0 HD21 ASN A 34 12.671 -13.798 -0.217 1.00 53.44 H new ATOM 0 HD22 ASN A 34 11.420 -12.551 -0.210 1.00 53.44 H new ATOM 514 N ALA A 35 8.704 -10.308 1.299 1.00 2.45 N ATOM 515 CA ALA A 35 7.860 -9.232 0.795 1.00 32.31 C ATOM 516 C ALA A 35 8.644 -7.931 0.670 1.00 4.01 C ATOM 517 O ALA A 35 9.743 -7.802 1.209 1.00 64.54 O ATOM 518 CB ALA A 35 6.653 -9.039 1.701 1.00 71.22 C ATOM 0 H ALA A 35 9.474 -9.997 1.891 1.00 2.45 H new ATOM 0 HA ALA A 35 7.513 -9.512 -0.199 1.00 32.31 H new ATOM 0 HB1 ALA A 35 6.032 -8.232 1.312 1.00 71.22 H new ATOM 0 HB2 ALA A 35 6.072 -9.961 1.734 1.00 71.22 H new ATOM 0 HB3 ALA A 35 6.989 -8.786 2.706 1.00 71.22 H new ATOM 524 N THR A 36 8.072 -6.967 -0.045 1.00 22.13 N ATOM 525 CA THR A 36 8.719 -5.676 -0.242 1.00 11.34 C ATOM 526 C THR A 36 7.689 -4.561 -0.386 1.00 63.00 C ATOM 527 O THR A 36 6.538 -4.810 -0.746 1.00 15.21 O ATOM 528 CB THR A 36 9.625 -5.686 -1.487 1.00 45.40 C ATOM 529 OG1 THR A 36 10.189 -4.385 -1.694 1.00 33.30 O ATOM 530 CG2 THR A 36 8.844 -6.107 -2.722 1.00 61.11 C ATOM 0 H THR A 36 7.162 -7.056 -0.497 1.00 22.13 H new ATOM 0 HA THR A 36 9.330 -5.491 0.641 1.00 11.34 H new ATOM 0 HB THR A 36 10.426 -6.406 -1.320 1.00 45.40 H new ATOM 0 HG1 THR A 36 10.765 -4.401 -2.487 1.00 33.30 H new ATOM 0 HG21 THR A 36 9.505 -6.106 -3.588 1.00 61.11 H new ATOM 0 HG22 THR A 36 8.441 -7.109 -2.574 1.00 61.11 H new ATOM 0 HG23 THR A 36 8.025 -5.408 -2.890 1.00 61.11 H new ATOM 538 N ILE A 37 8.110 -3.333 -0.105 1.00 40.32 N ATOM 539 CA ILE A 37 7.223 -2.180 -0.205 1.00 65.21 C ATOM 540 C ILE A 37 7.928 -1.001 -0.866 1.00 41.20 C ATOM 541 O ILE A 37 9.146 -0.856 -0.763 1.00 61.23 O ATOM 542 CB ILE A 37 6.706 -1.745 1.178 1.00 22.14 C ATOM 543 CG1 ILE A 37 5.604 -0.695 1.029 1.00 42.21 C ATOM 544 CG2 ILE A 37 7.849 -1.205 2.025 1.00 0.22 C ATOM 545 CD1 ILE A 37 4.544 -0.772 2.104 1.00 30.04 C ATOM 0 H ILE A 37 9.060 -3.110 0.194 1.00 40.32 H new ATOM 0 HA ILE A 37 6.376 -2.486 -0.820 1.00 65.21 H new ATOM 0 HB ILE A 37 6.286 -2.615 1.682 1.00 22.14 H new ATOM 0 HG12 ILE A 37 6.055 0.297 1.046 1.00 42.21 H new ATOM 0 HG13 ILE A 37 5.130 -0.814 0.054 1.00 42.21 H new ATOM 0 HG21 ILE A 37 7.468 -0.902 3.000 1.00 0.22 H new ATOM 0 HG22 ILE A 37 8.603 -1.981 2.156 1.00 0.22 H new ATOM 0 HG23 ILE A 37 8.296 -0.345 1.527 1.00 0.22 H new ATOM 0 HD11 ILE A 37 3.796 0.002 1.934 1.00 30.04 H new ATOM 0 HD12 ILE A 37 4.066 -1.751 2.074 1.00 30.04 H new ATOM 0 HD13 ILE A 37 5.005 -0.623 3.081 1.00 30.04 H new ATOM 557 N GLU A 38 7.154 -0.159 -1.543 1.00 72.04 N ATOM 558 CA GLU A 38 7.704 1.010 -2.220 1.00 23.12 C ATOM 559 C GLU A 38 6.684 2.144 -2.265 1.00 65.31 C ATOM 560 O GLU A 38 5.483 1.907 -2.389 1.00 12.23 O ATOM 561 CB GLU A 38 8.142 0.645 -3.640 1.00 53.13 C ATOM 562 CG GLU A 38 9.330 1.451 -4.137 1.00 2.12 C ATOM 563 CD GLU A 38 10.272 0.632 -4.996 1.00 64.04 C ATOM 564 OE1 GLU A 38 9.797 -0.310 -5.665 1.00 64.52 O ATOM 565 OE2 GLU A 38 11.485 0.932 -5.001 1.00 12.02 O ATOM 0 H GLU A 38 6.144 -0.264 -1.637 1.00 72.04 H new ATOM 0 HA GLU A 38 8.573 1.350 -1.656 1.00 23.12 H new ATOM 0 HB2 GLU A 38 8.394 -0.415 -3.672 1.00 53.13 H new ATOM 0 HB3 GLU A 38 7.303 0.794 -4.320 1.00 53.13 H new ATOM 0 HG2 GLU A 38 8.970 2.305 -4.711 1.00 2.12 H new ATOM 0 HG3 GLU A 38 9.877 1.849 -3.282 1.00 2.12 H new ATOM 572 N ALA A 39 7.172 3.375 -2.164 1.00 43.42 N ATOM 573 CA ALA A 39 6.305 4.546 -2.195 1.00 34.01 C ATOM 574 C ALA A 39 6.656 5.459 -3.365 1.00 41.30 C ATOM 575 O ALA A 39 7.831 5.684 -3.658 1.00 12.13 O ATOM 576 CB ALA A 39 6.399 5.308 -0.881 1.00 70.04 C ATOM 0 H ALA A 39 8.164 3.588 -2.060 1.00 43.42 H new ATOM 0 HA ALA A 39 5.279 4.204 -2.331 1.00 34.01 H new ATOM 0 HB1 ALA A 39 5.746 6.180 -0.919 1.00 70.04 H new ATOM 0 HB2 ALA A 39 6.091 4.659 -0.061 1.00 70.04 H new ATOM 0 HB3 ALA A 39 7.428 5.631 -0.721 1.00 70.04 H new ATOM 582 N ILE A 40 5.632 5.982 -4.030 1.00 62.24 N ATOM 583 CA ILE A 40 5.833 6.871 -5.167 1.00 64.15 C ATOM 584 C ILE A 40 4.670 7.845 -5.317 1.00 42.13 C ATOM 585 O ILE A 40 3.735 7.838 -4.518 1.00 12.33 O ATOM 586 CB ILE A 40 5.998 6.079 -6.478 1.00 74.54 C ATOM 587 CG1 ILE A 40 4.846 5.086 -6.648 1.00 22.41 C ATOM 588 CG2 ILE A 40 7.335 5.355 -6.496 1.00 44.21 C ATOM 589 CD1 ILE A 40 4.066 5.278 -7.929 1.00 33.14 C ATOM 0 H ILE A 40 4.654 5.805 -3.801 1.00 62.24 H new ATOM 0 HA ILE A 40 6.748 7.430 -4.972 1.00 64.15 H new ATOM 0 HB ILE A 40 5.976 6.779 -7.313 1.00 74.54 H new ATOM 0 HG12 ILE A 40 5.245 4.072 -6.624 1.00 22.41 H new ATOM 0 HG13 ILE A 40 4.167 5.182 -5.801 1.00 22.41 H new ATOM 0 HG21 ILE A 40 7.436 4.800 -7.429 1.00 44.21 H new ATOM 0 HG22 ILE A 40 8.143 6.082 -6.417 1.00 44.21 H new ATOM 0 HG23 ILE A 40 7.385 4.663 -5.655 1.00 44.21 H new ATOM 0 HD11 ILE A 40 3.266 4.540 -7.982 1.00 33.14 H new ATOM 0 HD12 ILE A 40 3.637 6.280 -7.947 1.00 33.14 H new ATOM 0 HD13 ILE A 40 4.732 5.153 -8.783 1.00 33.14 H new ATOM 601 N ALA A 41 4.734 8.680 -6.349 1.00 71.11 N ATOM 602 CA ALA A 41 3.684 9.658 -6.606 1.00 72.11 C ATOM 603 C ALA A 41 2.521 9.027 -7.367 1.00 2.41 C ATOM 604 O ALA A 41 2.524 7.827 -7.637 1.00 40.13 O ATOM 605 CB ALA A 41 4.244 10.842 -7.381 1.00 33.45 C ATOM 0 H ALA A 41 5.502 8.699 -7.020 1.00 71.11 H new ATOM 0 HA ALA A 41 3.307 10.012 -5.646 1.00 72.11 H new ATOM 0 HB1 ALA A 41 3.449 11.565 -7.566 1.00 33.45 H new ATOM 0 HB2 ALA A 41 5.036 11.315 -6.801 1.00 33.45 H new ATOM 0 HB3 ALA A 41 4.648 10.496 -8.332 1.00 33.45 H new ATOM 611 N GLU A 42 1.531 9.846 -7.708 1.00 31.24 N ATOM 612 CA GLU A 42 0.362 9.367 -8.435 1.00 74.41 C ATOM 613 C GLU A 42 0.572 9.487 -9.942 1.00 34.21 C ATOM 614 O GLU A 42 -0.317 9.165 -10.732 1.00 1.10 O ATOM 615 CB GLU A 42 -0.884 10.151 -8.018 1.00 42.51 C ATOM 616 CG GLU A 42 -0.817 11.629 -8.369 1.00 13.31 C ATOM 617 CD GLU A 42 -1.969 12.071 -9.250 1.00 53.44 C ATOM 618 OE1 GLU A 42 -1.838 11.977 -10.489 1.00 70.10 O ATOM 619 OE2 GLU A 42 -3.000 12.513 -8.702 1.00 73.12 O ATOM 0 H GLU A 42 1.515 10.843 -7.493 1.00 31.24 H new ATOM 0 HA GLU A 42 0.219 8.315 -8.188 1.00 74.41 H new ATOM 0 HB2 GLU A 42 -1.758 9.711 -8.498 1.00 42.51 H new ATOM 0 HB3 GLU A 42 -1.026 10.047 -6.942 1.00 42.51 H new ATOM 0 HG2 GLU A 42 -0.820 12.217 -7.451 1.00 13.31 H new ATOM 0 HG3 GLU A 42 0.125 11.836 -8.877 1.00 13.31 H new ATOM 626 N THR A 43 1.753 9.953 -10.333 1.00 61.02 N ATOM 627 CA THR A 43 2.080 10.117 -11.744 1.00 40.33 C ATOM 628 C THR A 43 2.636 8.827 -12.334 1.00 23.04 C ATOM 629 O THR A 43 2.452 8.545 -13.518 1.00 21.04 O ATOM 630 CB THR A 43 3.105 11.249 -11.954 1.00 62.25 C ATOM 631 OG1 THR A 43 3.449 11.346 -13.341 1.00 52.22 O ATOM 632 CG2 THR A 43 4.360 11.000 -11.132 1.00 44.52 C ATOM 0 H THR A 43 2.499 10.224 -9.693 1.00 61.02 H new ATOM 0 HA THR A 43 1.153 10.376 -12.256 1.00 40.33 H new ATOM 0 HB THR A 43 2.654 12.185 -11.625 1.00 62.25 H new ATOM 0 HG1 THR A 43 4.099 12.068 -13.467 1.00 52.22 H new ATOM 0 HG21 THR A 43 5.069 11.811 -11.296 1.00 44.52 H new ATOM 0 HG22 THR A 43 4.099 10.954 -10.075 1.00 44.52 H new ATOM 0 HG23 THR A 43 4.812 10.056 -11.436 1.00 44.52 H new ATOM 640 N ARG A 44 3.317 8.046 -11.501 1.00 51.50 N ATOM 641 CA ARG A 44 3.901 6.785 -11.941 1.00 74.00 C ATOM 642 C ARG A 44 3.227 5.604 -11.250 1.00 23.33 C ATOM 643 O ARG A 44 3.763 4.494 -11.230 1.00 34.54 O ATOM 644 CB ARG A 44 5.404 6.767 -11.657 1.00 54.02 C ATOM 645 CG ARG A 44 6.208 7.677 -12.570 1.00 50.23 C ATOM 646 CD ARG A 44 7.579 7.983 -11.988 1.00 73.10 C ATOM 647 NE ARG A 44 8.210 9.124 -12.643 1.00 44.25 N ATOM 648 CZ ARG A 44 9.468 9.494 -12.426 1.00 33.24 C ATOM 649 NH1 ARG A 44 10.224 8.814 -11.574 1.00 51.14 N ATOM 650 NH2 ARG A 44 9.971 10.544 -13.061 1.00 40.12 N ATOM 0 H ARG A 44 3.478 8.265 -10.518 1.00 51.50 H new ATOM 0 HA ARG A 44 3.741 6.695 -13.015 1.00 74.00 H new ATOM 0 HB2 ARG A 44 5.573 7.064 -10.622 1.00 54.02 H new ATOM 0 HB3 ARG A 44 5.772 5.746 -11.760 1.00 54.02 H new ATOM 0 HG2 ARG A 44 6.323 7.205 -13.546 1.00 50.23 H new ATOM 0 HG3 ARG A 44 5.663 8.608 -12.729 1.00 50.23 H new ATOM 0 HD2 ARG A 44 7.483 8.185 -10.921 1.00 73.10 H new ATOM 0 HD3 ARG A 44 8.220 7.107 -12.090 1.00 73.10 H new ATOM 0 HE ARG A 44 7.655 9.668 -13.304 1.00 44.25 H new ATOM 0 HH11 ARG A 44 9.840 8.006 -11.084 1.00 51.14 H new ATOM 0 HH12 ARG A 44 11.189 9.099 -11.409 1.00 51.14 H new ATOM 0 HH21 ARG A 44 9.392 11.069 -13.717 1.00 40.12 H new ATOM 0 HH22 ARG A 44 10.937 10.827 -12.894 1.00 40.12 H new ATOM 664 N LEU A 45 2.052 5.848 -10.682 1.00 12.23 N ATOM 665 CA LEU A 45 1.305 4.806 -9.988 1.00 32.15 C ATOM 666 C LEU A 45 0.767 3.773 -10.973 1.00 53.11 C ATOM 667 O LEU A 45 0.835 2.569 -10.726 1.00 41.21 O ATOM 668 CB LEU A 45 0.150 5.420 -9.194 1.00 54.10 C ATOM 669 CG LEU A 45 -0.944 4.451 -8.742 1.00 53.43 C ATOM 670 CD1 LEU A 45 -1.525 4.888 -7.406 1.00 22.01 C ATOM 671 CD2 LEU A 45 -2.038 4.354 -9.795 1.00 50.43 C ATOM 0 H LEU A 45 1.595 6.760 -10.688 1.00 12.23 H new ATOM 0 HA LEU A 45 1.985 4.305 -9.299 1.00 32.15 H new ATOM 0 HB2 LEU A 45 0.562 5.909 -8.311 1.00 54.10 H new ATOM 0 HB3 LEU A 45 -0.310 6.198 -9.803 1.00 54.10 H new ATOM 0 HG LEU A 45 -0.500 3.464 -8.616 1.00 53.43 H new ATOM 0 HD11 LEU A 45 -2.302 4.187 -7.100 1.00 22.01 H new ATOM 0 HD12 LEU A 45 -0.736 4.906 -6.654 1.00 22.01 H new ATOM 0 HD13 LEU A 45 -1.955 5.885 -7.505 1.00 22.01 H new ATOM 0 HD21 LEU A 45 -2.808 3.660 -9.457 1.00 50.43 H new ATOM 0 HD22 LEU A 45 -2.480 5.338 -9.952 1.00 50.43 H new ATOM 0 HD23 LEU A 45 -1.611 3.994 -10.731 1.00 50.43 H new ATOM 683 N SER A 46 0.235 4.253 -12.093 1.00 74.33 N ATOM 684 CA SER A 46 -0.317 3.373 -13.116 1.00 72.42 C ATOM 685 C SER A 46 0.798 2.667 -13.883 1.00 13.11 C ATOM 686 O SER A 46 0.571 1.643 -14.526 1.00 20.15 O ATOM 687 CB SER A 46 -1.195 4.167 -14.085 1.00 31.13 C ATOM 688 OG SER A 46 -1.488 3.410 -15.246 1.00 64.01 O ATOM 0 H SER A 46 0.175 5.247 -12.315 1.00 74.33 H new ATOM 0 HA SER A 46 -0.928 2.619 -12.620 1.00 72.42 H new ATOM 0 HB2 SER A 46 -2.123 4.452 -13.589 1.00 31.13 H new ATOM 0 HB3 SER A 46 -0.688 5.090 -14.367 1.00 31.13 H new ATOM 0 HG SER A 46 -2.052 3.939 -15.848 1.00 64.01 H new ATOM 694 N GLU A 47 2.002 3.225 -13.811 1.00 31.21 N ATOM 695 CA GLU A 47 3.152 2.650 -14.499 1.00 52.42 C ATOM 696 C GLU A 47 3.834 1.597 -13.632 1.00 23.52 C ATOM 697 O GLU A 47 4.506 0.698 -14.140 1.00 54.55 O ATOM 698 CB GLU A 47 4.153 3.747 -14.871 1.00 13.23 C ATOM 699 CG GLU A 47 3.815 4.466 -16.166 1.00 73.51 C ATOM 700 CD GLU A 47 4.240 5.921 -16.154 1.00 42.14 C ATOM 701 OE1 GLU A 47 5.314 6.220 -15.591 1.00 31.41 O ATOM 702 OE2 GLU A 47 3.500 6.761 -16.708 1.00 62.40 O ATOM 0 H GLU A 47 2.207 4.074 -13.284 1.00 31.21 H new ATOM 0 HA GLU A 47 2.795 2.170 -15.410 1.00 52.42 H new ATOM 0 HB2 GLU A 47 4.198 4.476 -14.062 1.00 13.23 H new ATOM 0 HB3 GLU A 47 5.146 3.306 -14.958 1.00 13.23 H new ATOM 0 HG2 GLU A 47 4.301 3.956 -16.998 1.00 73.51 H new ATOM 0 HG3 GLU A 47 2.741 4.407 -16.340 1.00 73.51 H new ATOM 709 N VAL A 48 3.658 1.714 -12.320 1.00 2.20 N ATOM 710 CA VAL A 48 4.256 0.773 -11.381 1.00 21.44 C ATOM 711 C VAL A 48 3.253 -0.297 -10.962 1.00 3.32 C ATOM 712 O VAL A 48 3.625 -1.438 -10.687 1.00 21.10 O ATOM 713 CB VAL A 48 4.781 1.490 -10.123 1.00 32.10 C ATOM 714 CG1 VAL A 48 5.794 2.559 -10.502 1.00 63.32 C ATOM 715 CG2 VAL A 48 3.628 2.092 -9.334 1.00 21.13 C ATOM 0 H VAL A 48 3.106 2.452 -11.883 1.00 2.20 H new ATOM 0 HA VAL A 48 5.093 0.301 -11.896 1.00 21.44 H new ATOM 0 HB VAL A 48 5.282 0.757 -9.490 1.00 32.10 H new ATOM 0 HG11 VAL A 48 6.154 3.055 -9.601 1.00 63.32 H new ATOM 0 HG12 VAL A 48 6.633 2.097 -11.022 1.00 63.32 H new ATOM 0 HG13 VAL A 48 5.322 3.292 -11.156 1.00 63.32 H new ATOM 0 HG21 VAL A 48 4.017 2.595 -8.448 1.00 21.13 H new ATOM 0 HG22 VAL A 48 3.098 2.812 -9.957 1.00 21.13 H new ATOM 0 HG23 VAL A 48 2.942 1.301 -9.031 1.00 21.13 H new ATOM 725 N VAL A 49 1.980 0.080 -10.914 1.00 51.11 N ATOM 726 CA VAL A 49 0.922 -0.846 -10.530 1.00 62.43 C ATOM 727 C VAL A 49 0.945 -2.099 -11.400 1.00 13.32 C ATOM 728 O VAL A 49 0.505 -3.167 -10.978 1.00 74.52 O ATOM 729 CB VAL A 49 -0.467 -0.188 -10.634 1.00 41.24 C ATOM 730 CG1 VAL A 49 -0.819 0.087 -12.088 1.00 50.21 C ATOM 731 CG2 VAL A 49 -1.523 -1.065 -9.978 1.00 5.22 C ATOM 0 H VAL A 49 1.656 1.021 -11.136 1.00 51.11 H new ATOM 0 HA VAL A 49 1.107 -1.124 -9.492 1.00 62.43 H new ATOM 0 HB VAL A 49 -0.439 0.764 -10.105 1.00 41.24 H new ATOM 0 HG11 VAL A 49 -1.803 0.552 -12.142 1.00 50.21 H new ATOM 0 HG12 VAL A 49 -0.077 0.757 -12.522 1.00 50.21 H new ATOM 0 HG13 VAL A 49 -0.829 -0.851 -12.643 1.00 50.21 H new ATOM 0 HG21 VAL A 49 -2.498 -0.584 -10.061 1.00 5.22 H new ATOM 0 HG22 VAL A 49 -1.552 -2.034 -10.477 1.00 5.22 H new ATOM 0 HG23 VAL A 49 -1.276 -1.206 -8.926 1.00 5.22 H new ATOM 741 N ASP A 50 1.462 -1.958 -12.615 1.00 64.02 N ATOM 742 CA ASP A 50 1.546 -3.078 -13.545 1.00 75.32 C ATOM 743 C ASP A 50 2.498 -4.149 -13.023 1.00 45.21 C ATOM 744 O ASP A 50 2.380 -5.323 -13.373 1.00 71.10 O ATOM 745 CB ASP A 50 2.007 -2.594 -14.921 1.00 14.02 C ATOM 746 CG ASP A 50 1.451 -3.440 -16.049 1.00 30.24 C ATOM 747 OD1 ASP A 50 1.772 -4.646 -16.101 1.00 0.32 O ATOM 748 OD2 ASP A 50 0.693 -2.896 -16.880 1.00 24.23 O ATOM 0 H ASP A 50 1.829 -1.079 -12.979 1.00 64.02 H new ATOM 0 HA ASP A 50 0.552 -3.516 -13.637 1.00 75.32 H new ATOM 0 HB2 ASP A 50 1.697 -1.558 -15.061 1.00 14.02 H new ATOM 0 HB3 ASP A 50 3.096 -2.609 -14.962 1.00 14.02 H new ATOM 753 N ARG A 51 3.444 -3.735 -12.185 1.00 55.10 N ATOM 754 CA ARG A 51 4.418 -4.658 -11.617 1.00 23.45 C ATOM 755 C ARG A 51 4.010 -5.080 -10.208 1.00 3.23 C ATOM 756 O ARG A 51 4.070 -6.259 -9.860 1.00 4.03 O ATOM 757 CB ARG A 51 5.805 -4.013 -11.586 1.00 40.12 C ATOM 758 CG ARG A 51 6.351 -3.677 -12.964 1.00 70.12 C ATOM 759 CD ARG A 51 7.729 -4.282 -13.181 1.00 70.43 C ATOM 760 NE ARG A 51 8.603 -3.395 -13.944 1.00 33.33 N ATOM 761 CZ ARG A 51 8.502 -3.215 -15.256 1.00 33.03 C ATOM 762 NH1 ARG A 51 7.570 -3.857 -15.947 1.00 53.43 N ATOM 763 NH2 ARG A 51 9.335 -2.391 -15.879 1.00 71.24 N ATOM 0 H ARG A 51 3.556 -2.767 -11.885 1.00 55.10 H new ATOM 0 HA ARG A 51 4.451 -5.546 -12.248 1.00 23.45 H new ATOM 0 HB2 ARG A 51 5.759 -3.101 -10.990 1.00 40.12 H new ATOM 0 HB3 ARG A 51 6.499 -4.687 -11.084 1.00 40.12 H new ATOM 0 HG2 ARG A 51 5.666 -4.046 -13.728 1.00 70.12 H new ATOM 0 HG3 ARG A 51 6.405 -2.595 -13.081 1.00 70.12 H new ATOM 0 HD2 ARG A 51 8.186 -4.498 -12.215 1.00 70.43 H new ATOM 0 HD3 ARG A 51 7.629 -5.232 -13.706 1.00 70.43 H new ATOM 0 HE ARG A 51 9.331 -2.886 -13.442 1.00 33.33 H new ATOM 0 HH11 ARG A 51 6.928 -4.491 -15.471 1.00 53.43 H new ATOM 0 HH12 ARG A 51 7.495 -3.717 -16.955 1.00 53.43 H new ATOM 0 HH21 ARG A 51 10.053 -1.896 -15.350 1.00 71.24 H new ATOM 0 HH22 ARG A 51 9.257 -2.253 -16.887 1.00 71.24 H new ATOM 777 N PHE A 52 3.595 -4.108 -9.402 1.00 64.41 N ATOM 778 CA PHE A 52 3.179 -4.379 -8.031 1.00 3.53 C ATOM 779 C PHE A 52 1.900 -5.210 -8.004 1.00 21.21 C ATOM 780 O PHE A 52 1.314 -5.501 -9.048 1.00 4.53 O ATOM 781 CB PHE A 52 2.964 -3.066 -7.272 1.00 75.45 C ATOM 782 CG PHE A 52 4.242 -2.393 -6.864 1.00 62.33 C ATOM 783 CD1 PHE A 52 4.917 -2.793 -5.723 1.00 24.45 C ATOM 784 CD2 PHE A 52 4.769 -1.360 -7.622 1.00 0.22 C ATOM 785 CE1 PHE A 52 6.095 -2.177 -5.344 1.00 4.34 C ATOM 786 CE2 PHE A 52 5.947 -0.739 -7.248 1.00 51.12 C ATOM 787 CZ PHE A 52 6.610 -1.147 -6.107 1.00 73.41 C ATOM 0 H PHE A 52 3.538 -3.127 -9.674 1.00 64.41 H new ATOM 0 HA PHE A 52 3.971 -4.948 -7.543 1.00 3.53 H new ATOM 0 HB2 PHE A 52 2.388 -2.384 -7.898 1.00 75.45 H new ATOM 0 HB3 PHE A 52 2.367 -3.264 -6.382 1.00 75.45 H new ATOM 0 HD1 PHE A 52 4.518 -3.596 -5.122 1.00 24.45 H new ATOM 0 HD2 PHE A 52 4.254 -1.036 -8.515 1.00 0.22 H new ATOM 0 HE1 PHE A 52 6.612 -2.501 -4.453 1.00 4.34 H new ATOM 0 HE2 PHE A 52 6.348 0.065 -7.848 1.00 51.12 H new ATOM 0 HZ PHE A 52 7.529 -0.662 -5.812 1.00 73.41 H new ATOM 797 N ASP A 53 1.473 -5.590 -6.805 1.00 41.24 N ATOM 798 CA ASP A 53 0.263 -6.388 -6.641 1.00 65.55 C ATOM 799 C ASP A 53 -0.745 -5.669 -5.751 1.00 13.41 C ATOM 800 O ASP A 53 -1.940 -5.643 -6.045 1.00 73.22 O ATOM 801 CB ASP A 53 0.605 -7.755 -6.046 1.00 3.15 C ATOM 802 CG ASP A 53 1.083 -8.741 -7.093 1.00 43.43 C ATOM 803 OD1 ASP A 53 0.720 -8.572 -8.276 1.00 43.34 O ATOM 804 OD2 ASP A 53 1.822 -9.680 -6.730 1.00 53.33 O ATOM 0 H ASP A 53 1.947 -5.358 -5.932 1.00 41.24 H new ATOM 0 HA ASP A 53 -0.185 -6.531 -7.624 1.00 65.55 H new ATOM 0 HB2 ASP A 53 1.377 -7.634 -5.286 1.00 3.15 H new ATOM 0 HB3 ASP A 53 -0.274 -8.160 -5.545 1.00 3.15 H new ATOM 809 N VAL A 54 -0.256 -5.087 -4.661 1.00 40.31 N ATOM 810 CA VAL A 54 -1.114 -4.368 -3.728 1.00 15.14 C ATOM 811 C VAL A 54 -0.875 -2.864 -3.809 1.00 13.15 C ATOM 812 O VAL A 54 0.246 -2.415 -4.042 1.00 5.42 O ATOM 813 CB VAL A 54 -0.885 -4.835 -2.278 1.00 60.41 C ATOM 814 CG1 VAL A 54 -1.918 -4.220 -1.348 1.00 0.30 C ATOM 815 CG2 VAL A 54 -0.920 -6.354 -2.198 1.00 24.01 C ATOM 0 H VAL A 54 0.731 -5.100 -4.402 1.00 40.31 H new ATOM 0 HA VAL A 54 -2.143 -4.586 -4.013 1.00 15.14 H new ATOM 0 HB VAL A 54 0.101 -4.498 -1.957 1.00 60.41 H new ATOM 0 HG11 VAL A 54 -1.739 -4.562 -0.329 1.00 0.30 H new ATOM 0 HG12 VAL A 54 -1.840 -3.133 -1.385 1.00 0.30 H new ATOM 0 HG13 VAL A 54 -2.917 -4.523 -1.662 1.00 0.30 H new ATOM 0 HG21 VAL A 54 -0.757 -6.668 -1.167 1.00 24.01 H new ATOM 0 HG22 VAL A 54 -1.891 -6.714 -2.537 1.00 24.01 H new ATOM 0 HG23 VAL A 54 -0.137 -6.770 -2.832 1.00 24.01 H new ATOM 825 N VAL A 55 -1.939 -2.090 -3.615 1.00 71.11 N ATOM 826 CA VAL A 55 -1.845 -0.636 -3.664 1.00 53.31 C ATOM 827 C VAL A 55 -2.467 -0.003 -2.424 1.00 61.31 C ATOM 828 O VAL A 55 -3.433 -0.523 -1.866 1.00 31.30 O ATOM 829 CB VAL A 55 -2.539 -0.071 -4.918 1.00 71.13 C ATOM 830 CG1 VAL A 55 -2.266 1.419 -5.053 1.00 74.13 C ATOM 831 CG2 VAL A 55 -2.084 -0.820 -6.161 1.00 42.42 C ATOM 0 H VAL A 55 -2.875 -2.446 -3.423 1.00 71.11 H new ATOM 0 HA VAL A 55 -0.784 -0.388 -3.702 1.00 53.31 H new ATOM 0 HB VAL A 55 -3.615 -0.211 -4.811 1.00 71.13 H new ATOM 0 HG11 VAL A 55 -2.764 1.801 -5.944 1.00 74.13 H new ATOM 0 HG12 VAL A 55 -2.646 1.940 -4.174 1.00 74.13 H new ATOM 0 HG13 VAL A 55 -1.192 1.586 -5.138 1.00 74.13 H new ATOM 0 HG21 VAL A 55 -2.584 -0.408 -7.038 1.00 42.42 H new ATOM 0 HG22 VAL A 55 -1.005 -0.714 -6.275 1.00 42.42 H new ATOM 0 HG23 VAL A 55 -2.336 -1.876 -6.062 1.00 42.42 H new ATOM 841 N LEU A 56 -1.907 1.124 -1.998 1.00 24.01 N ATOM 842 CA LEU A 56 -2.405 1.829 -0.823 1.00 12.42 C ATOM 843 C LEU A 56 -2.426 3.336 -1.061 1.00 74.25 C ATOM 844 O LEU A 56 -1.602 3.870 -1.804 1.00 5.32 O ATOM 845 CB LEU A 56 -1.540 1.507 0.396 1.00 53.52 C ATOM 846 CG LEU A 56 -1.701 0.104 0.981 1.00 12.13 C ATOM 847 CD1 LEU A 56 -0.445 -0.720 0.747 1.00 13.12 C ATOM 848 CD2 LEU A 56 -2.023 0.179 2.468 1.00 43.44 C ATOM 0 H LEU A 56 -1.108 1.569 -2.449 1.00 24.01 H new ATOM 0 HA LEU A 56 -3.425 1.494 -0.635 1.00 12.42 H new ATOM 0 HB2 LEU A 56 -0.494 1.647 0.122 1.00 53.52 H new ATOM 0 HB3 LEU A 56 -1.764 2.233 1.178 1.00 53.52 H new ATOM 0 HG LEU A 56 -2.532 -0.386 0.474 1.00 12.13 H new ATOM 0 HD11 LEU A 56 -0.579 -1.715 1.170 1.00 13.12 H new ATOM 0 HD12 LEU A 56 -0.259 -0.803 -0.324 1.00 13.12 H new ATOM 0 HD13 LEU A 56 0.404 -0.233 1.226 1.00 13.12 H new ATOM 0 HD21 LEU A 56 -2.134 -0.829 2.867 1.00 43.44 H new ATOM 0 HD22 LEU A 56 -1.214 0.689 2.990 1.00 43.44 H new ATOM 0 HD23 LEU A 56 -2.952 0.731 2.612 1.00 43.44 H new ATOM 860 N LEU A 57 -3.374 4.017 -0.426 1.00 21.01 N ATOM 861 CA LEU A 57 -3.501 5.464 -0.566 1.00 73.31 C ATOM 862 C LEU A 57 -3.456 6.150 0.796 1.00 71.52 C ATOM 863 O LEU A 57 -4.111 5.716 1.742 1.00 75.32 O ATOM 864 CB LEU A 57 -4.808 5.813 -1.282 1.00 32.10 C ATOM 865 CG LEU A 57 -5.215 7.286 -1.255 1.00 11.31 C ATOM 866 CD1 LEU A 57 -4.188 8.138 -1.985 1.00 14.11 C ATOM 867 CD2 LEU A 57 -6.596 7.469 -1.868 1.00 5.45 C ATOM 0 H LEU A 57 -4.066 3.591 0.191 1.00 21.01 H new ATOM 0 HA LEU A 57 -2.660 5.822 -1.160 1.00 73.31 H new ATOM 0 HB2 LEU A 57 -4.724 5.499 -2.322 1.00 32.10 H new ATOM 0 HB3 LEU A 57 -5.611 5.227 -0.836 1.00 32.10 H new ATOM 0 HG LEU A 57 -5.254 7.613 -0.216 1.00 11.31 H new ATOM 0 HD11 LEU A 57 -4.495 9.183 -1.955 1.00 14.11 H new ATOM 0 HD12 LEU A 57 -3.217 8.031 -1.502 1.00 14.11 H new ATOM 0 HD13 LEU A 57 -4.115 7.811 -3.022 1.00 14.11 H new ATOM 0 HD21 LEU A 57 -6.870 8.524 -1.840 1.00 5.45 H new ATOM 0 HD22 LEU A 57 -6.584 7.124 -2.902 1.00 5.45 H new ATOM 0 HD23 LEU A 57 -7.325 6.890 -1.301 1.00 5.45 H new ATOM 879 N ALA A 58 -2.678 7.223 0.886 1.00 74.21 N ATOM 880 CA ALA A 58 -2.550 7.971 2.130 1.00 53.05 C ATOM 881 C ALA A 58 -3.794 8.812 2.395 1.00 2.11 C ATOM 882 O ALA A 58 -4.581 9.102 1.493 1.00 33.42 O ATOM 883 CB ALA A 58 -1.312 8.855 2.089 1.00 12.51 C ATOM 0 H ALA A 58 -2.127 7.594 0.112 1.00 74.21 H new ATOM 0 HA ALA A 58 -2.446 7.256 2.946 1.00 53.05 H new ATOM 0 HB1 ALA A 58 -1.229 9.408 3.025 1.00 12.51 H new ATOM 0 HB2 ALA A 58 -0.426 8.234 1.954 1.00 12.51 H new ATOM 0 HB3 ALA A 58 -1.393 9.557 1.259 1.00 12.51 H new ATOM 889 N PRO A 59 -3.979 9.214 3.661 1.00 0.32 N ATOM 890 CA PRO A 59 -5.126 10.028 4.075 1.00 71.34 C ATOM 891 C PRO A 59 -5.055 11.450 3.530 1.00 3.12 C ATOM 892 O PRO A 59 -4.090 11.820 2.862 1.00 52.11 O ATOM 893 CB PRO A 59 -5.025 10.033 5.602 1.00 54.30 C ATOM 894 CG PRO A 59 -3.581 9.801 5.887 1.00 14.34 C ATOM 895 CD PRO A 59 -3.081 8.906 4.787 1.00 12.23 C ATOM 0 HA PRO A 59 -6.067 9.627 3.699 1.00 71.34 H new ATOM 0 HB2 PRO A 59 -5.363 10.982 6.018 1.00 54.30 H new ATOM 0 HB3 PRO A 59 -5.646 9.253 6.042 1.00 54.30 H new ATOM 0 HG2 PRO A 59 -3.031 10.742 5.905 1.00 14.34 H new ATOM 0 HG3 PRO A 59 -3.446 9.334 6.862 1.00 14.34 H new ATOM 0 HD2 PRO A 59 -2.040 9.116 4.540 1.00 12.23 H new ATOM 0 HD3 PRO A 59 -3.136 7.854 5.069 1.00 12.23 H new ATOM 903 N GLN A 60 -6.081 12.243 3.822 1.00 64.33 N ATOM 904 CA GLN A 60 -6.133 13.625 3.361 1.00 52.24 C ATOM 905 C GLN A 60 -6.158 13.690 1.837 1.00 63.00 C ATOM 906 O GLN A 60 -5.286 14.300 1.218 1.00 53.21 O ATOM 907 CB GLN A 60 -4.934 14.409 3.897 1.00 21.30 C ATOM 908 CG GLN A 60 -4.711 14.232 5.391 1.00 42.55 C ATOM 909 CD GLN A 60 -4.045 15.436 6.027 1.00 30.12 C ATOM 910 OE1 GLN A 60 -4.145 16.555 5.523 1.00 1.30 O ATOM 911 NE2 GLN A 60 -3.359 15.213 7.142 1.00 50.05 N ATOM 0 H GLN A 60 -6.887 11.952 4.375 1.00 64.33 H new ATOM 0 HA GLN A 60 -7.051 14.074 3.741 1.00 52.24 H new ATOM 0 HB2 GLN A 60 -4.037 14.094 3.364 1.00 21.30 H new ATOM 0 HB3 GLN A 60 -5.077 15.468 3.682 1.00 21.30 H new ATOM 0 HG2 GLN A 60 -5.669 14.051 5.879 1.00 42.55 H new ATOM 0 HG3 GLN A 60 -4.095 13.349 5.561 1.00 42.55 H new ATOM 0 HE21 GLN A 60 -3.302 14.270 7.526 1.00 50.05 H new ATOM 0 HE22 GLN A 60 -2.889 15.985 7.615 1.00 50.05 H new ATOM 920 N SER A 61 -7.162 13.057 1.239 1.00 64.13 N ATOM 921 CA SER A 61 -7.297 13.039 -0.213 1.00 74.11 C ATOM 922 C SER A 61 -8.694 13.484 -0.634 1.00 61.10 C ATOM 923 O SER A 61 -9.689 12.842 -0.297 1.00 54.03 O ATOM 924 CB SER A 61 -7.011 11.637 -0.757 1.00 4.04 C ATOM 925 OG SER A 61 -7.309 10.645 0.210 1.00 2.13 O ATOM 0 H SER A 61 -7.894 12.550 1.737 1.00 64.13 H new ATOM 0 HA SER A 61 -6.571 13.737 -0.629 1.00 74.11 H new ATOM 0 HB2 SER A 61 -7.604 11.464 -1.655 1.00 4.04 H new ATOM 0 HB3 SER A 61 -5.963 11.563 -1.048 1.00 4.04 H new ATOM 0 HG SER A 61 -8.207 10.799 0.570 1.00 2.13 H new ATOM 931 N ARG A 62 -8.760 14.587 -1.371 1.00 51.32 N ATOM 932 CA ARG A 62 -10.035 15.120 -1.838 1.00 4.31 C ATOM 933 C ARG A 62 -10.393 14.551 -3.208 1.00 3.12 C ATOM 934 O ARG A 62 -11.368 13.813 -3.349 1.00 31.50 O ATOM 935 CB ARG A 62 -9.979 16.647 -1.906 1.00 10.21 C ATOM 936 CG ARG A 62 -10.042 17.320 -0.545 1.00 12.22 C ATOM 937 CD ARG A 62 -9.271 18.632 -0.536 1.00 63.32 C ATOM 938 NE ARG A 62 -9.633 19.471 0.602 1.00 14.33 N ATOM 939 CZ ARG A 62 -9.213 20.722 0.756 1.00 1.11 C ATOM 940 NH1 ARG A 62 -8.420 21.275 -0.151 1.00 62.34 N ATOM 941 NH2 ARG A 62 -9.586 21.422 1.819 1.00 11.23 N ATOM 0 H ARG A 62 -7.946 15.130 -1.658 1.00 51.32 H new ATOM 0 HA ARG A 62 -10.807 14.823 -1.128 1.00 4.31 H new ATOM 0 HB2 ARG A 62 -9.059 16.946 -2.408 1.00 10.21 H new ATOM 0 HB3 ARG A 62 -10.807 17.006 -2.518 1.00 10.21 H new ATOM 0 HG2 ARG A 62 -11.082 17.506 -0.278 1.00 12.22 H new ATOM 0 HG3 ARG A 62 -9.633 16.651 0.212 1.00 12.22 H new ATOM 0 HD2 ARG A 62 -8.201 18.424 -0.507 1.00 63.32 H new ATOM 0 HD3 ARG A 62 -9.466 19.173 -1.462 1.00 63.32 H new ATOM 0 HE ARG A 62 -10.242 19.075 1.318 1.00 14.33 H new ATOM 0 HH11 ARG A 62 -8.131 20.740 -0.970 1.00 62.34 H new ATOM 0 HH12 ARG A 62 -8.099 22.236 -0.030 1.00 62.34 H new ATOM 0 HH21 ARG A 62 -10.196 21.000 2.519 1.00 11.23 H new ATOM 0 HH22 ARG A 62 -9.263 22.382 1.936 1.00 11.23 H new ATOM 955 N PHE A 63 -9.599 14.901 -4.214 1.00 64.12 N ATOM 956 CA PHE A 63 -9.833 14.427 -5.573 1.00 34.25 C ATOM 957 C PHE A 63 -9.155 13.080 -5.804 1.00 24.20 C ATOM 958 O PHE A 63 -9.700 12.205 -6.475 1.00 73.11 O ATOM 959 CB PHE A 63 -9.320 15.450 -6.589 1.00 30.33 C ATOM 960 CG PHE A 63 -10.410 16.088 -7.400 1.00 42.33 C ATOM 961 CD1 PHE A 63 -11.077 17.208 -6.930 1.00 64.11 C ATOM 962 CD2 PHE A 63 -10.769 15.568 -8.633 1.00 43.24 C ATOM 963 CE1 PHE A 63 -12.081 17.798 -7.675 1.00 60.22 C ATOM 964 CE2 PHE A 63 -11.772 16.154 -9.382 1.00 60.10 C ATOM 965 CZ PHE A 63 -12.429 17.269 -8.902 1.00 43.34 C ATOM 0 H PHE A 63 -8.788 15.511 -4.114 1.00 64.12 H new ATOM 0 HA PHE A 63 -10.907 14.301 -5.706 1.00 34.25 H new ATOM 0 HB2 PHE A 63 -8.768 16.228 -6.062 1.00 30.33 H new ATOM 0 HB3 PHE A 63 -8.617 14.960 -7.262 1.00 30.33 H new ATOM 0 HD1 PHE A 63 -10.809 17.625 -5.970 1.00 64.11 H new ATOM 0 HD2 PHE A 63 -10.259 14.695 -9.013 1.00 43.24 H new ATOM 0 HE1 PHE A 63 -12.592 18.671 -7.298 1.00 60.22 H new ATOM 0 HE2 PHE A 63 -12.042 15.740 -10.342 1.00 60.10 H new ATOM 0 HZ PHE A 63 -13.214 17.727 -9.485 1.00 43.34 H new ATOM 975 N ASN A 64 -7.961 12.922 -5.242 1.00 24.03 N ATOM 976 CA ASN A 64 -7.206 11.682 -5.387 1.00 63.52 C ATOM 977 C ASN A 64 -8.030 10.486 -4.922 1.00 54.02 C ATOM 978 O ASN A 64 -8.060 9.445 -5.579 1.00 21.10 O ATOM 979 CB ASN A 64 -5.902 11.758 -4.589 1.00 52.14 C ATOM 980 CG ASN A 64 -4.688 11.936 -5.482 1.00 30.32 C ATOM 981 OD1 ASN A 64 -3.773 11.112 -5.474 1.00 2.22 O ATOM 982 ND2 ASN A 64 -4.676 13.014 -6.256 1.00 62.30 N ATOM 0 H ASN A 64 -7.495 13.636 -4.682 1.00 24.03 H new ATOM 0 HA ASN A 64 -6.971 11.550 -6.443 1.00 63.52 H new ATOM 0 HB2 ASN A 64 -5.957 12.589 -3.886 1.00 52.14 H new ATOM 0 HB3 ASN A 64 -5.786 10.848 -4.000 1.00 52.14 H new ATOM 0 HD21 ASN A 64 -3.886 13.187 -6.878 1.00 62.30 H new ATOM 0 HD22 ASN A 64 -5.457 13.670 -6.229 1.00 62.30 H new ATOM 989 N LYS A 65 -8.700 10.642 -3.785 1.00 33.42 N ATOM 990 CA LYS A 65 -9.527 9.576 -3.232 1.00 33.02 C ATOM 991 C LYS A 65 -10.594 9.140 -4.231 1.00 5.23 C ATOM 992 O LYS A 65 -10.673 7.968 -4.599 1.00 30.54 O ATOM 993 CB LYS A 65 -10.190 10.040 -1.933 1.00 14.34 C ATOM 994 CG LYS A 65 -11.235 9.073 -1.404 1.00 0.22 C ATOM 995 CD LYS A 65 -11.422 9.220 0.097 1.00 72.22 C ATOM 996 CE LYS A 65 -12.711 8.561 0.565 1.00 52.43 C ATOM 997 NZ LYS A 65 -12.492 7.701 1.761 1.00 55.14 N ATOM 0 H LYS A 65 -8.686 11.497 -3.228 1.00 33.42 H new ATOM 0 HA LYS A 65 -8.882 8.723 -3.021 1.00 33.02 H new ATOM 0 HB2 LYS A 65 -9.421 10.182 -1.173 1.00 14.34 H new ATOM 0 HB3 LYS A 65 -10.657 11.011 -2.100 1.00 14.34 H new ATOM 0 HG2 LYS A 65 -12.185 9.250 -1.909 1.00 0.22 H new ATOM 0 HG3 LYS A 65 -10.937 8.051 -1.636 1.00 0.22 H new ATOM 0 HD2 LYS A 65 -10.574 8.773 0.616 1.00 72.22 H new ATOM 0 HD3 LYS A 65 -11.436 10.277 0.361 1.00 72.22 H new ATOM 0 HE2 LYS A 65 -13.447 9.330 0.800 1.00 52.43 H new ATOM 0 HE3 LYS A 65 -13.126 7.959 -0.244 1.00 52.43 H new ATOM 0 HZ1 LYS A 65 -13.394 7.270 2.049 1.00 55.14 H new ATOM 0 HZ2 LYS A 65 -11.809 6.952 1.530 1.00 55.14 H new ATOM 0 HZ3 LYS A 65 -12.120 8.280 2.541 1.00 55.14 H new ATOM 1011 N LYS A 66 -11.411 10.091 -4.670 1.00 73.10 N ATOM 1012 CA LYS A 66 -12.471 9.806 -5.629 1.00 13.41 C ATOM 1013 C LYS A 66 -11.902 9.184 -6.900 1.00 54.55 C ATOM 1014 O LYS A 66 -12.445 8.210 -7.422 1.00 64.13 O ATOM 1015 CB LYS A 66 -13.234 11.088 -5.973 1.00 44.41 C ATOM 1016 CG LYS A 66 -14.304 10.894 -7.032 1.00 34.41 C ATOM 1017 CD LYS A 66 -15.557 11.693 -6.712 1.00 63.15 C ATOM 1018 CE LYS A 66 -16.512 10.905 -5.829 1.00 65.42 C ATOM 1019 NZ LYS A 66 -17.608 10.278 -6.619 1.00 64.01 N ATOM 0 H LYS A 66 -11.359 11.067 -4.377 1.00 73.10 H new ATOM 0 HA LYS A 66 -13.158 9.093 -5.173 1.00 13.41 H new ATOM 0 HB2 LYS A 66 -13.698 11.479 -5.067 1.00 44.41 H new ATOM 0 HB3 LYS A 66 -12.525 11.841 -6.318 1.00 44.41 H new ATOM 0 HG2 LYS A 66 -13.915 11.199 -8.004 1.00 34.41 H new ATOM 0 HG3 LYS A 66 -14.555 9.836 -7.107 1.00 34.41 H new ATOM 0 HD2 LYS A 66 -15.280 12.621 -6.212 1.00 63.15 H new ATOM 0 HD3 LYS A 66 -16.060 11.968 -7.639 1.00 63.15 H new ATOM 0 HE2 LYS A 66 -15.959 10.131 -5.297 1.00 65.42 H new ATOM 0 HE3 LYS A 66 -16.940 11.567 -5.076 1.00 65.42 H new ATOM 0 HZ1 LYS A 66 -18.237 9.750 -5.981 1.00 64.01 H new ATOM 0 HZ2 LYS A 66 -18.151 11.018 -7.107 1.00 64.01 H new ATOM 0 HZ3 LYS A 66 -17.201 9.627 -7.321 1.00 64.01 H new ATOM 1033 N ARG A 67 -10.806 9.753 -7.393 1.00 30.45 N ATOM 1034 CA ARG A 67 -10.164 9.253 -8.602 1.00 25.22 C ATOM 1035 C ARG A 67 -9.716 7.806 -8.422 1.00 31.54 C ATOM 1036 O ARG A 67 -10.219 6.901 -9.090 1.00 15.24 O ATOM 1037 CB ARG A 67 -8.963 10.127 -8.965 1.00 43.40 C ATOM 1038 CG ARG A 67 -9.263 11.161 -10.040 1.00 34.43 C ATOM 1039 CD ARG A 67 -8.162 11.211 -11.087 1.00 53.53 C ATOM 1040 NE ARG A 67 -8.481 12.139 -12.169 1.00 44.04 N ATOM 1041 CZ ARG A 67 -7.889 12.111 -13.359 1.00 75.42 C ATOM 1042 NH1 ARG A 67 -6.956 11.206 -13.617 1.00 41.12 N ATOM 1043 NH2 ARG A 67 -8.232 12.989 -14.293 1.00 73.32 N ATOM 0 H ARG A 67 -10.345 10.560 -6.973 1.00 30.45 H new ATOM 0 HA ARG A 67 -10.892 9.292 -9.412 1.00 25.22 H new ATOM 0 HB2 ARG A 67 -8.613 10.639 -8.069 1.00 43.40 H new ATOM 0 HB3 ARG A 67 -8.149 9.487 -9.305 1.00 43.40 H new ATOM 0 HG2 ARG A 67 -10.212 10.924 -10.520 1.00 34.43 H new ATOM 0 HG3 ARG A 67 -9.375 12.143 -9.581 1.00 34.43 H new ATOM 0 HD2 ARG A 67 -7.226 11.511 -10.616 1.00 53.53 H new ATOM 0 HD3 ARG A 67 -8.006 10.214 -11.498 1.00 53.53 H new ATOM 0 HE ARG A 67 -9.197 12.847 -12.003 1.00 44.04 H new ATOM 0 HH11 ARG A 67 -6.691 10.529 -12.902 1.00 41.12 H new ATOM 0 HH12 ARG A 67 -6.503 11.187 -14.531 1.00 41.12 H new ATOM 0 HH21 ARG A 67 -8.951 13.686 -14.098 1.00 73.32 H new ATOM 0 HH22 ARG A 67 -7.777 12.967 -15.206 1.00 73.32 H new ATOM 1057 N LEU A 68 -8.769 7.593 -7.516 1.00 64.34 N ATOM 1058 CA LEU A 68 -8.252 6.256 -7.248 1.00 73.50 C ATOM 1059 C LEU A 68 -9.391 5.273 -6.995 1.00 62.52 C ATOM 1060 O LEU A 68 -9.295 4.095 -7.338 1.00 43.32 O ATOM 1061 CB LEU A 68 -7.310 6.282 -6.043 1.00 53.53 C ATOM 1062 CG LEU A 68 -5.816 6.347 -6.361 1.00 5.33 C ATOM 1063 CD1 LEU A 68 -5.435 7.734 -6.855 1.00 0.34 C ATOM 1064 CD2 LEU A 68 -4.994 5.970 -5.137 1.00 13.44 C ATOM 0 H LEU A 68 -8.343 8.330 -6.954 1.00 64.34 H new ATOM 0 HA LEU A 68 -7.698 5.926 -8.127 1.00 73.50 H new ATOM 0 HB2 LEU A 68 -7.567 7.142 -5.424 1.00 53.53 H new ATOM 0 HB3 LEU A 68 -7.495 5.391 -5.443 1.00 53.53 H new ATOM 0 HG LEU A 68 -5.601 5.630 -7.154 1.00 5.33 H new ATOM 0 HD11 LEU A 68 -4.368 7.761 -7.076 1.00 0.34 H new ATOM 0 HD12 LEU A 68 -5.999 7.966 -7.758 1.00 0.34 H new ATOM 0 HD13 LEU A 68 -5.665 8.470 -6.085 1.00 0.34 H new ATOM 0 HD21 LEU A 68 -3.933 6.022 -5.381 1.00 13.44 H new ATOM 0 HD22 LEU A 68 -5.213 6.662 -4.324 1.00 13.44 H new ATOM 0 HD23 LEU A 68 -5.246 4.956 -4.828 1.00 13.44 H new ATOM 1076 N GLU A 69 -10.470 5.767 -6.395 1.00 62.22 N ATOM 1077 CA GLU A 69 -11.628 4.931 -6.098 1.00 51.54 C ATOM 1078 C GLU A 69 -12.363 4.546 -7.379 1.00 72.34 C ATOM 1079 O GLU A 69 -12.549 3.365 -7.668 1.00 73.12 O ATOM 1080 CB GLU A 69 -12.581 5.661 -5.150 1.00 72.11 C ATOM 1081 CG GLU A 69 -12.253 5.456 -3.680 1.00 73.14 C ATOM 1082 CD GLU A 69 -13.374 4.771 -2.923 1.00 53.45 C ATOM 1083 OE1 GLU A 69 -13.770 3.658 -3.328 1.00 42.43 O ATOM 1084 OE2 GLU A 69 -13.855 5.347 -1.926 1.00 52.52 O ATOM 0 H GLU A 69 -10.566 6.740 -6.105 1.00 62.22 H new ATOM 0 HA GLU A 69 -11.273 4.020 -5.615 1.00 51.54 H new ATOM 0 HB2 GLU A 69 -12.556 6.727 -5.374 1.00 72.11 H new ATOM 0 HB3 GLU A 69 -13.599 5.319 -5.338 1.00 72.11 H new ATOM 0 HG2 GLU A 69 -11.344 4.860 -3.594 1.00 73.14 H new ATOM 0 HG3 GLU A 69 -12.046 6.422 -3.220 1.00 73.14 H new ATOM 1091 N GLU A 70 -12.778 5.552 -8.142 1.00 51.50 N ATOM 1092 CA GLU A 70 -13.495 5.320 -9.390 1.00 63.50 C ATOM 1093 C GLU A 70 -12.626 4.548 -10.380 1.00 5.30 C ATOM 1094 O GLU A 70 -13.126 3.989 -11.356 1.00 24.21 O ATOM 1095 CB GLU A 70 -13.935 6.648 -10.008 1.00 43.04 C ATOM 1096 CG GLU A 70 -12.780 7.491 -10.523 1.00 50.31 C ATOM 1097 CD GLU A 70 -13.246 8.678 -11.345 1.00 60.14 C ATOM 1098 OE1 GLU A 70 -14.211 8.520 -12.121 1.00 43.03 O ATOM 1099 OE2 GLU A 70 -12.645 9.764 -11.211 1.00 3.43 O ATOM 0 H GLU A 70 -12.630 6.536 -7.918 1.00 51.50 H new ATOM 0 HA GLU A 70 -14.379 4.723 -9.165 1.00 63.50 H new ATOM 0 HB2 GLU A 70 -14.622 6.447 -10.830 1.00 43.04 H new ATOM 0 HB3 GLU A 70 -14.488 7.220 -9.263 1.00 43.04 H new ATOM 0 HG2 GLU A 70 -12.190 7.848 -9.678 1.00 50.31 H new ATOM 0 HG3 GLU A 70 -12.123 6.868 -11.130 1.00 50.31 H new ATOM 1106 N ILE A 71 -11.322 4.526 -10.121 1.00 55.03 N ATOM 1107 CA ILE A 71 -10.384 3.824 -10.988 1.00 21.34 C ATOM 1108 C ILE A 71 -10.124 2.408 -10.485 1.00 1.13 C ATOM 1109 O ILE A 71 -9.910 1.486 -11.273 1.00 33.22 O ATOM 1110 CB ILE A 71 -9.044 4.575 -11.091 1.00 64.12 C ATOM 1111 CG1 ILE A 71 -9.262 5.978 -11.661 1.00 71.52 C ATOM 1112 CG2 ILE A 71 -8.064 3.794 -11.953 1.00 44.14 C ATOM 1113 CD1 ILE A 71 -8.202 6.972 -11.243 1.00 44.53 C ATOM 0 H ILE A 71 -10.892 4.986 -9.318 1.00 55.03 H new ATOM 0 HA ILE A 71 -10.842 3.777 -11.976 1.00 21.34 H new ATOM 0 HB ILE A 71 -8.621 4.672 -10.091 1.00 64.12 H new ATOM 0 HG12 ILE A 71 -9.285 5.920 -12.749 1.00 71.52 H new ATOM 0 HG13 ILE A 71 -10.238 6.344 -11.341 1.00 71.52 H new ATOM 0 HG21 ILE A 71 -7.121 4.338 -12.016 1.00 44.14 H new ATOM 0 HG22 ILE A 71 -7.889 2.814 -11.508 1.00 44.14 H new ATOM 0 HG23 ILE A 71 -8.479 3.669 -12.953 1.00 44.14 H new ATOM 0 HD11 ILE A 71 -8.421 7.944 -11.684 1.00 44.53 H new ATOM 0 HD12 ILE A 71 -8.194 7.060 -10.157 1.00 44.53 H new ATOM 0 HD13 ILE A 71 -7.226 6.629 -11.587 1.00 44.53 H new ATOM 1125 N THR A 72 -10.144 2.242 -9.166 1.00 22.41 N ATOM 1126 CA THR A 72 -9.911 0.938 -8.556 1.00 51.32 C ATOM 1127 C THR A 72 -11.088 0.000 -8.797 1.00 55.40 C ATOM 1128 O THR A 72 -10.905 -1.192 -9.043 1.00 64.43 O ATOM 1129 CB THR A 72 -9.670 1.063 -7.040 1.00 32.55 C ATOM 1130 OG1 THR A 72 -10.572 2.022 -6.478 1.00 32.22 O ATOM 1131 CG2 THR A 72 -8.236 1.478 -6.752 1.00 41.22 C ATOM 0 H THR A 72 -10.319 2.994 -8.500 1.00 22.41 H new ATOM 0 HA THR A 72 -9.019 0.524 -9.025 1.00 51.32 H new ATOM 0 HB THR A 72 -9.847 0.088 -6.585 1.00 32.55 H new ATOM 0 HG1 THR A 72 -11.309 2.184 -7.104 1.00 32.22 H new ATOM 0 HG21 THR A 72 -8.090 1.560 -5.675 1.00 41.22 H new ATOM 0 HG22 THR A 72 -7.553 0.730 -7.155 1.00 41.22 H new ATOM 0 HG23 THR A 72 -8.035 2.442 -7.219 1.00 41.22 H new ATOM 1139 N LYS A 73 -12.298 0.545 -8.726 1.00 40.53 N ATOM 1140 CA LYS A 73 -13.506 -0.241 -8.939 1.00 23.44 C ATOM 1141 C LYS A 73 -13.413 -1.043 -10.234 1.00 23.24 C ATOM 1142 O LYS A 73 -13.506 -2.270 -10.240 1.00 61.41 O ATOM 1143 CB LYS A 73 -14.734 0.671 -8.978 1.00 41.14 C ATOM 1144 CG LYS A 73 -15.872 0.124 -9.822 1.00 43.12 C ATOM 1145 CD LYS A 73 -16.324 -1.242 -9.331 1.00 41.44 C ATOM 1146 CE LYS A 73 -17.828 -1.417 -9.479 1.00 5.43 C ATOM 1147 NZ LYS A 73 -18.553 -1.046 -8.232 1.00 53.12 N ATOM 0 H LYS A 73 -12.467 1.530 -8.522 1.00 40.53 H new ATOM 0 HA LYS A 73 -13.606 -0.938 -8.107 1.00 23.44 H new ATOM 0 HB2 LYS A 73 -15.091 0.829 -7.960 1.00 41.14 H new ATOM 0 HB3 LYS A 73 -14.440 1.646 -9.368 1.00 41.14 H new ATOM 0 HG2 LYS A 73 -16.712 0.818 -9.795 1.00 43.12 H new ATOM 0 HG3 LYS A 73 -15.553 0.051 -10.862 1.00 43.12 H new ATOM 0 HD2 LYS A 73 -15.809 -2.021 -9.893 1.00 41.44 H new ATOM 0 HD3 LYS A 73 -16.043 -1.365 -8.285 1.00 41.44 H new ATOM 0 HE2 LYS A 73 -18.186 -0.802 -10.304 1.00 5.43 H new ATOM 0 HE3 LYS A 73 -18.050 -2.453 -9.734 1.00 5.43 H new ATOM 0 HZ1 LYS A 73 -19.575 -1.179 -8.372 1.00 53.12 H new ATOM 0 HZ2 LYS A 73 -18.230 -1.650 -7.450 1.00 53.12 H new ATOM 0 HZ3 LYS A 73 -18.361 -0.050 -8.002 1.00 53.12 H new ATOM 1161 N PRO A 74 -13.224 -0.334 -11.356 1.00 4.34 N ATOM 1162 CA PRO A 74 -13.112 -0.960 -12.677 1.00 43.24 C ATOM 1163 C PRO A 74 -11.815 -1.746 -12.838 1.00 54.14 C ATOM 1164 O PRO A 74 -11.800 -2.822 -13.436 1.00 73.13 O ATOM 1165 CB PRO A 74 -13.136 0.233 -13.637 1.00 41.01 C ATOM 1166 CG PRO A 74 -12.634 1.380 -12.829 1.00 75.33 C ATOM 1167 CD PRO A 74 -13.103 1.132 -11.423 1.00 22.22 C ATOM 0 HA PRO A 74 -13.907 -1.684 -12.854 1.00 43.24 H new ATOM 0 HB2 PRO A 74 -12.503 0.054 -14.506 1.00 41.01 H new ATOM 0 HB3 PRO A 74 -14.143 0.422 -14.009 1.00 41.01 H new ATOM 0 HG2 PRO A 74 -11.547 1.442 -12.873 1.00 75.33 H new ATOM 0 HG3 PRO A 74 -13.022 2.325 -13.209 1.00 75.33 H new ATOM 0 HD2 PRO A 74 -12.391 1.510 -10.690 1.00 22.22 H new ATOM 0 HD3 PRO A 74 -14.056 1.623 -11.225 1.00 22.22 H new ATOM 1175 N LYS A 75 -10.728 -1.203 -12.301 1.00 11.12 N ATOM 1176 CA LYS A 75 -9.427 -1.854 -12.382 1.00 65.35 C ATOM 1177 C LYS A 75 -9.432 -3.179 -11.627 1.00 22.01 C ATOM 1178 O LYS A 75 -8.621 -4.063 -11.897 1.00 61.01 O ATOM 1179 CB LYS A 75 -8.338 -0.938 -11.819 1.00 42.30 C ATOM 1180 CG LYS A 75 -7.868 0.122 -12.799 1.00 63.25 C ATOM 1181 CD LYS A 75 -6.990 -0.475 -13.887 1.00 0.33 C ATOM 1182 CE LYS A 75 -6.958 0.409 -15.124 1.00 43.24 C ATOM 1183 NZ LYS A 75 -5.889 1.442 -15.040 1.00 3.45 N ATOM 0 H LYS A 75 -10.723 -0.312 -11.804 1.00 11.12 H new ATOM 0 HA LYS A 75 -9.216 -2.056 -13.432 1.00 65.35 H new ATOM 0 HB2 LYS A 75 -8.715 -0.449 -10.921 1.00 42.30 H new ATOM 0 HB3 LYS A 75 -7.485 -1.545 -11.517 1.00 42.30 H new ATOM 0 HG2 LYS A 75 -8.732 0.608 -13.253 1.00 63.25 H new ATOM 0 HG3 LYS A 75 -7.313 0.893 -12.264 1.00 63.25 H new ATOM 0 HD2 LYS A 75 -5.977 -0.608 -13.507 1.00 0.33 H new ATOM 0 HD3 LYS A 75 -7.362 -1.464 -14.155 1.00 0.33 H new ATOM 0 HE2 LYS A 75 -6.797 -0.209 -16.008 1.00 43.24 H new ATOM 0 HE3 LYS A 75 -7.925 0.896 -15.247 1.00 43.24 H new ATOM 0 HZ1 LYS A 75 -5.900 2.024 -15.902 1.00 3.45 H new ATOM 0 HZ2 LYS A 75 -6.056 2.048 -14.211 1.00 3.45 H new ATOM 0 HZ3 LYS A 75 -4.963 0.977 -14.948 1.00 3.45 H new ATOM 1197 N GLY A 76 -10.355 -3.310 -10.678 1.00 24.23 N ATOM 1198 CA GLY A 76 -10.448 -4.530 -9.897 1.00 75.45 C ATOM 1199 C GLY A 76 -9.122 -4.930 -9.284 1.00 55.10 C ATOM 1200 O GLY A 76 -8.595 -6.005 -9.574 1.00 14.44 O ATOM 0 H GLY A 76 -11.039 -2.593 -10.437 1.00 24.23 H new ATOM 0 HA2 GLY A 76 -11.185 -4.395 -9.105 1.00 75.45 H new ATOM 0 HA3 GLY A 76 -10.809 -5.338 -10.533 1.00 75.45 H new ATOM 1204 N ILE A 77 -8.580 -4.064 -8.435 1.00 42.42 N ATOM 1205 CA ILE A 77 -7.306 -4.333 -7.779 1.00 72.12 C ATOM 1206 C ILE A 77 -7.396 -4.079 -6.278 1.00 71.51 C ATOM 1207 O ILE A 77 -8.216 -3.293 -5.804 1.00 33.30 O ATOM 1208 CB ILE A 77 -6.176 -3.468 -8.368 1.00 1.34 C ATOM 1209 CG1 ILE A 77 -6.586 -1.993 -8.378 1.00 23.34 C ATOM 1210 CG2 ILE A 77 -5.828 -3.935 -9.772 1.00 70.15 C ATOM 1211 CD1 ILE A 77 -5.648 -1.101 -7.595 1.00 44.12 C ATOM 0 H ILE A 77 -9.003 -3.170 -8.185 1.00 42.42 H new ATOM 0 HA ILE A 77 -7.077 -5.384 -7.954 1.00 72.12 H new ATOM 0 HB ILE A 77 -5.291 -3.576 -7.741 1.00 1.34 H new ATOM 0 HG12 ILE A 77 -6.631 -1.643 -9.409 1.00 23.34 H new ATOM 0 HG13 ILE A 77 -7.591 -1.901 -7.966 1.00 23.34 H new ATOM 0 HG21 ILE A 77 -5.028 -3.314 -10.174 1.00 70.15 H new ATOM 0 HG22 ILE A 77 -5.499 -4.974 -9.739 1.00 70.15 H new ATOM 0 HG23 ILE A 77 -6.707 -3.853 -10.411 1.00 70.15 H new ATOM 0 HD11 ILE A 77 -5.999 -0.070 -7.645 1.00 44.12 H new ATOM 0 HD12 ILE A 77 -5.621 -1.425 -6.555 1.00 44.12 H new ATOM 0 HD13 ILE A 77 -4.646 -1.164 -8.020 1.00 44.12 H new ATOM 1223 N PRO A 78 -6.532 -4.759 -5.511 1.00 22.22 N ATOM 1224 CA PRO A 78 -6.491 -4.622 -4.052 1.00 32.24 C ATOM 1225 C PRO A 78 -5.964 -3.261 -3.611 1.00 32.21 C ATOM 1226 O PRO A 78 -4.754 -3.038 -3.568 1.00 15.01 O ATOM 1227 CB PRO A 78 -5.533 -5.733 -3.618 1.00 25.03 C ATOM 1228 CG PRO A 78 -4.661 -5.967 -4.804 1.00 12.32 C ATOM 1229 CD PRO A 78 -5.525 -5.712 -6.008 1.00 20.50 C ATOM 0 HA PRO A 78 -7.483 -4.699 -3.608 1.00 32.24 H new ATOM 0 HB2 PRO A 78 -4.947 -5.433 -2.749 1.00 25.03 H new ATOM 0 HB3 PRO A 78 -6.075 -6.637 -3.341 1.00 25.03 H new ATOM 0 HG2 PRO A 78 -3.799 -5.299 -4.793 1.00 12.32 H new ATOM 0 HG3 PRO A 78 -4.274 -6.986 -4.810 1.00 12.32 H new ATOM 0 HD2 PRO A 78 -4.950 -5.294 -6.834 1.00 20.50 H new ATOM 0 HD3 PRO A 78 -5.986 -6.630 -6.373 1.00 20.50 H new ATOM 1237 N ILE A 79 -6.880 -2.355 -3.283 1.00 44.15 N ATOM 1238 CA ILE A 79 -6.505 -1.016 -2.845 1.00 32.13 C ATOM 1239 C ILE A 79 -6.913 -0.779 -1.395 1.00 12.03 C ATOM 1240 O ILE A 79 -8.039 -1.080 -1.000 1.00 72.12 O ATOM 1241 CB ILE A 79 -7.148 0.067 -3.731 1.00 74.34 C ATOM 1242 CG1 ILE A 79 -6.620 1.451 -3.347 1.00 71.13 C ATOM 1243 CG2 ILE A 79 -8.664 0.021 -3.608 1.00 73.12 C ATOM 1244 CD1 ILE A 79 -5.216 1.719 -3.841 1.00 41.43 C ATOM 0 H ILE A 79 -7.886 -2.524 -3.312 1.00 44.15 H new ATOM 0 HA ILE A 79 -5.421 -0.947 -2.931 1.00 32.13 H new ATOM 0 HB ILE A 79 -6.881 -0.129 -4.769 1.00 74.34 H new ATOM 0 HG12 ILE A 79 -7.290 2.211 -3.749 1.00 71.13 H new ATOM 0 HG13 ILE A 79 -6.640 1.551 -2.262 1.00 71.13 H new ATOM 0 HG21 ILE A 79 -9.104 0.792 -4.240 1.00 73.12 H new ATOM 0 HG22 ILE A 79 -9.025 -0.957 -3.925 1.00 73.12 H new ATOM 0 HG23 ILE A 79 -8.950 0.195 -2.571 1.00 73.12 H new ATOM 0 HD11 ILE A 79 -4.906 2.718 -3.533 1.00 41.43 H new ATOM 0 HD12 ILE A 79 -4.534 0.981 -3.418 1.00 41.43 H new ATOM 0 HD13 ILE A 79 -5.194 1.652 -4.929 1.00 41.43 H new ATOM 1256 N GLU A 80 -5.991 -0.236 -0.608 1.00 1.44 N ATOM 1257 CA GLU A 80 -6.256 0.043 0.800 1.00 63.12 C ATOM 1258 C GLU A 80 -6.106 1.531 1.097 1.00 40.31 C ATOM 1259 O GLU A 80 -5.295 2.221 0.478 1.00 73.45 O ATOM 1260 CB GLU A 80 -5.307 -0.764 1.689 1.00 34.02 C ATOM 1261 CG GLU A 80 -5.500 -2.268 1.579 1.00 53.51 C ATOM 1262 CD GLU A 80 -4.576 -2.900 0.556 1.00 15.34 C ATOM 1263 OE1 GLU A 80 -3.355 -2.650 0.624 1.00 52.35 O ATOM 1264 OE2 GLU A 80 -5.076 -3.646 -0.312 1.00 24.32 O ATOM 0 H GLU A 80 -5.054 0.020 -0.920 1.00 1.44 H new ATOM 0 HA GLU A 80 -7.283 -0.251 1.016 1.00 63.12 H new ATOM 0 HB2 GLU A 80 -4.278 -0.518 1.425 1.00 34.02 H new ATOM 0 HB3 GLU A 80 -5.451 -0.463 2.727 1.00 34.02 H new ATOM 0 HG2 GLU A 80 -5.325 -2.725 2.553 1.00 53.51 H new ATOM 0 HG3 GLU A 80 -6.535 -2.479 1.309 1.00 53.51 H new ATOM 1271 N ILE A 81 -6.894 2.021 2.048 1.00 35.22 N ATOM 1272 CA ILE A 81 -6.851 3.427 2.428 1.00 43.41 C ATOM 1273 C ILE A 81 -6.391 3.592 3.872 1.00 5.40 C ATOM 1274 O ILE A 81 -7.111 3.244 4.808 1.00 73.44 O ATOM 1275 CB ILE A 81 -8.225 4.100 2.259 1.00 41.43 C ATOM 1276 CG1 ILE A 81 -8.808 3.780 0.881 1.00 63.21 C ATOM 1277 CG2 ILE A 81 -8.107 5.604 2.452 1.00 41.31 C ATOM 1278 CD1 ILE A 81 -7.928 4.225 -0.267 1.00 15.14 C ATOM 0 H ILE A 81 -7.571 1.464 2.570 1.00 35.22 H new ATOM 0 HA ILE A 81 -6.136 3.911 1.763 1.00 43.41 H new ATOM 0 HB ILE A 81 -8.900 3.708 3.020 1.00 41.43 H new ATOM 0 HG12 ILE A 81 -8.973 2.705 0.806 1.00 63.21 H new ATOM 0 HG13 ILE A 81 -9.783 4.259 0.788 1.00 63.21 H new ATOM 0 HG21 ILE A 81 -9.087 6.065 2.329 1.00 41.31 H new ATOM 0 HG22 ILE A 81 -7.730 5.814 3.453 1.00 41.31 H new ATOM 0 HG23 ILE A 81 -7.419 6.013 1.712 1.00 41.31 H new ATOM 0 HD11 ILE A 81 -8.404 3.966 -1.212 1.00 15.14 H new ATOM 0 HD12 ILE A 81 -7.784 5.304 -0.218 1.00 15.14 H new ATOM 0 HD13 ILE A 81 -6.961 3.726 -0.199 1.00 15.14 H new ATOM 1290 N ILE A 82 -5.187 4.127 4.046 1.00 12.44 N ATOM 1291 CA ILE A 82 -4.632 4.342 5.377 1.00 3.13 C ATOM 1292 C ILE A 82 -5.325 5.503 6.082 1.00 55.22 C ATOM 1293 O ILE A 82 -5.032 6.668 5.816 1.00 30.43 O ATOM 1294 CB ILE A 82 -3.118 4.622 5.318 1.00 74.14 C ATOM 1295 CG1 ILE A 82 -2.418 3.575 4.451 1.00 63.01 C ATOM 1296 CG2 ILE A 82 -2.528 4.639 6.720 1.00 74.33 C ATOM 1297 CD1 ILE A 82 -0.935 3.823 4.285 1.00 61.31 C ATOM 0 H ILE A 82 -4.577 4.419 3.282 1.00 12.44 H new ATOM 0 HA ILE A 82 -4.802 3.425 5.941 1.00 3.13 H new ATOM 0 HB ILE A 82 -2.961 5.602 4.868 1.00 74.14 H new ATOM 0 HG12 ILE A 82 -2.566 2.590 4.894 1.00 63.01 H new ATOM 0 HG13 ILE A 82 -2.888 3.556 3.468 1.00 63.01 H new ATOM 0 HG21 ILE A 82 -1.458 4.838 6.662 1.00 74.33 H new ATOM 0 HG22 ILE A 82 -3.011 5.419 7.308 1.00 74.33 H new ATOM 0 HG23 ILE A 82 -2.692 3.672 7.196 1.00 74.33 H new ATOM 0 HD11 ILE A 82 -0.503 3.042 3.659 1.00 61.31 H new ATOM 0 HD12 ILE A 82 -0.779 4.794 3.814 1.00 61.31 H new ATOM 0 HD13 ILE A 82 -0.453 3.812 5.262 1.00 61.31 H new ATOM 1309 N ASN A 83 -6.246 5.176 6.983 1.00 54.24 N ATOM 1310 CA ASN A 83 -6.982 6.193 7.727 1.00 71.00 C ATOM 1311 C ASN A 83 -6.025 7.185 8.381 1.00 14.33 C ATOM 1312 O ASN A 83 -4.873 6.859 8.667 1.00 75.30 O ATOM 1313 CB ASN A 83 -7.863 5.537 8.792 1.00 4.21 C ATOM 1314 CG ASN A 83 -9.261 5.243 8.286 1.00 54.33 C ATOM 1315 OD1 ASN A 83 -9.478 4.280 7.551 1.00 71.33 O ATOM 1316 ND2 ASN A 83 -10.219 6.077 8.676 1.00 31.44 N ATOM 0 H ASN A 83 -6.500 4.216 7.216 1.00 54.24 H new ATOM 0 HA ASN A 83 -7.616 6.735 7.026 1.00 71.00 H new ATOM 0 HB2 ASN A 83 -7.397 4.609 9.123 1.00 4.21 H new ATOM 0 HB3 ASN A 83 -7.925 6.191 9.662 1.00 4.21 H new ATOM 0 HD21 ASN A 83 -11.180 5.931 8.365 1.00 31.44 H new ATOM 0 HD22 ASN A 83 -9.994 6.863 9.286 1.00 31.44 H new ATOM 1323 N THR A 84 -6.512 8.400 8.618 1.00 74.41 N ATOM 1324 CA THR A 84 -5.702 9.441 9.238 1.00 34.42 C ATOM 1325 C THR A 84 -5.062 8.942 10.528 1.00 42.50 C ATOM 1326 O THR A 84 -3.963 9.365 10.890 1.00 2.42 O ATOM 1327 CB THR A 84 -6.541 10.696 9.546 1.00 22.21 C ATOM 1328 OG1 THR A 84 -7.916 10.456 9.230 1.00 52.10 O ATOM 1329 CG2 THR A 84 -6.034 11.892 8.756 1.00 64.34 C ATOM 0 H THR A 84 -7.464 8.687 8.390 1.00 74.41 H new ATOM 0 HA THR A 84 -4.920 9.702 8.525 1.00 34.42 H new ATOM 0 HB THR A 84 -6.447 10.917 10.609 1.00 22.21 H new ATOM 0 HG1 THR A 84 -8.442 11.258 9.430 1.00 52.10 H new ATOM 0 HG21 THR A 84 -6.641 12.766 8.990 1.00 64.34 H new ATOM 0 HG22 THR A 84 -4.996 12.090 9.022 1.00 64.34 H new ATOM 0 HG23 THR A 84 -6.101 11.678 7.689 1.00 64.34 H new ATOM 1337 N ILE A 85 -5.753 8.041 11.218 1.00 12.22 N ATOM 1338 CA ILE A 85 -5.249 7.485 12.467 1.00 60.23 C ATOM 1339 C ILE A 85 -4.037 6.593 12.222 1.00 24.22 C ATOM 1340 O ILE A 85 -2.950 6.847 12.743 1.00 72.13 O ATOM 1341 CB ILE A 85 -6.332 6.670 13.198 1.00 72.35 C ATOM 1342 CG1 ILE A 85 -7.585 7.522 13.412 1.00 41.02 C ATOM 1343 CG2 ILE A 85 -5.802 6.156 14.528 1.00 2.31 C ATOM 1344 CD1 ILE A 85 -7.352 8.729 14.291 1.00 3.32 C ATOM 0 H ILE A 85 -6.664 7.681 10.933 1.00 12.22 H new ATOM 0 HA ILE A 85 -4.956 8.328 13.092 1.00 60.23 H new ATOM 0 HB ILE A 85 -6.599 5.813 12.580 1.00 72.35 H new ATOM 0 HG12 ILE A 85 -7.958 7.855 12.443 1.00 41.02 H new ATOM 0 HG13 ILE A 85 -8.364 6.903 13.858 1.00 41.02 H new ATOM 0 HG21 ILE A 85 -6.580 5.582 15.032 1.00 2.31 H new ATOM 0 HG22 ILE A 85 -4.936 5.518 14.352 1.00 2.31 H new ATOM 0 HG23 ILE A 85 -5.510 6.999 15.154 1.00 2.31 H new ATOM 0 HD11 ILE A 85 -8.283 9.286 14.399 1.00 3.32 H new ATOM 0 HD12 ILE A 85 -7.008 8.403 15.273 1.00 3.32 H new ATOM 0 HD13 ILE A 85 -6.596 9.370 13.836 1.00 3.32 H new ATOM 1356 N ASP A 86 -4.230 5.547 11.425 1.00 11.34 N ATOM 1357 CA ASP A 86 -3.151 4.619 11.108 1.00 71.32 C ATOM 1358 C ASP A 86 -1.922 5.366 10.600 1.00 34.44 C ATOM 1359 O ASP A 86 -0.805 5.130 11.062 1.00 31.21 O ATOM 1360 CB ASP A 86 -3.615 3.604 10.060 1.00 33.15 C ATOM 1361 CG ASP A 86 -4.303 2.404 10.682 1.00 3.15 C ATOM 1362 OD1 ASP A 86 -3.623 1.631 11.387 1.00 5.14 O ATOM 1363 OD2 ASP A 86 -5.520 2.239 10.462 1.00 34.43 O ATOM 0 H ASP A 86 -5.123 5.321 10.987 1.00 11.34 H new ATOM 0 HA ASP A 86 -2.880 4.090 12.022 1.00 71.32 H new ATOM 0 HB2 ASP A 86 -4.298 4.091 9.364 1.00 33.15 H new ATOM 0 HB3 ASP A 86 -2.756 3.267 9.480 1.00 33.15 H new ATOM 1368 N TYR A 87 -2.136 6.266 9.648 1.00 44.33 N ATOM 1369 CA TYR A 87 -1.044 7.046 9.075 1.00 72.15 C ATOM 1370 C TYR A 87 -0.400 7.938 10.130 1.00 4.44 C ATOM 1371 O TYR A 87 0.823 8.050 10.204 1.00 23.42 O ATOM 1372 CB TYR A 87 -1.555 7.899 7.912 1.00 44.43 C ATOM 1373 CG TYR A 87 -0.455 8.603 7.149 1.00 23.42 C ATOM 1374 CD1 TYR A 87 0.580 7.885 6.563 1.00 13.21 C ATOM 1375 CD2 TYR A 87 -0.450 9.986 7.016 1.00 11.01 C ATOM 1376 CE1 TYR A 87 1.587 8.524 5.865 1.00 73.40 C ATOM 1377 CE2 TYR A 87 0.552 10.633 6.319 1.00 20.23 C ATOM 1378 CZ TYR A 87 1.568 9.898 5.746 1.00 74.01 C ATOM 1379 OH TYR A 87 2.569 10.539 5.052 1.00 23.34 O ATOM 0 H TYR A 87 -3.054 6.474 9.256 1.00 44.33 H new ATOM 0 HA TYR A 87 -0.290 6.351 8.704 1.00 72.15 H new ATOM 0 HB2 TYR A 87 -2.114 7.264 7.225 1.00 44.43 H new ATOM 0 HB3 TYR A 87 -2.252 8.643 8.297 1.00 44.43 H new ATOM 0 HD1 TYR A 87 0.598 6.809 6.655 1.00 13.21 H new ATOM 0 HD2 TYR A 87 -1.243 10.565 7.465 1.00 11.01 H new ATOM 0 HE1 TYR A 87 2.384 7.951 5.415 1.00 73.40 H new ATOM 0 HE2 TYR A 87 0.540 11.709 6.223 1.00 20.23 H new ATOM 0 HH TYR A 87 2.317 10.612 4.108 1.00 23.34 H new ATOM 1389 N GLY A 88 -1.234 8.574 10.948 1.00 1.42 N ATOM 1390 CA GLY A 88 -0.728 9.449 11.990 1.00 61.42 C ATOM 1391 C GLY A 88 0.123 8.711 13.005 1.00 64.23 C ATOM 1392 O GLY A 88 1.201 9.175 13.377 1.00 62.13 O ATOM 0 H GLY A 88 -2.250 8.499 10.908 1.00 1.42 H new ATOM 0 HA2 GLY A 88 -0.138 10.245 11.536 1.00 61.42 H new ATOM 0 HA3 GLY A 88 -1.566 9.924 12.500 1.00 61.42 H new ATOM 1396 N THR A 89 -0.362 7.558 13.455 1.00 12.44 N ATOM 1397 CA THR A 89 0.359 6.756 14.435 1.00 4.42 C ATOM 1398 C THR A 89 1.576 6.086 13.807 1.00 1.41 C ATOM 1399 O THR A 89 2.526 5.727 14.503 1.00 40.31 O ATOM 1400 CB THR A 89 -0.547 5.674 15.052 1.00 41.40 C ATOM 1401 OG1 THR A 89 -0.758 4.616 14.111 1.00 51.40 O ATOM 1402 CG2 THR A 89 -1.887 6.263 15.470 1.00 45.13 C ATOM 0 H THR A 89 -1.252 7.159 13.156 1.00 12.44 H new ATOM 0 HA THR A 89 0.686 7.436 15.221 1.00 4.42 H new ATOM 0 HB THR A 89 -0.050 5.278 15.938 1.00 41.40 H new ATOM 0 HG1 THR A 89 -0.354 3.791 14.451 1.00 51.40 H new ATOM 0 HG21 THR A 89 -2.510 5.480 15.903 1.00 45.13 H new ATOM 0 HG22 THR A 89 -1.725 7.048 16.209 1.00 45.13 H new ATOM 0 HG23 THR A 89 -2.387 6.684 14.598 1.00 45.13 H new ATOM 1410 N MET A 90 1.541 5.920 12.489 1.00 13.14 N ATOM 1411 CA MET A 90 2.643 5.295 11.768 1.00 21.23 C ATOM 1412 C MET A 90 2.906 3.887 12.294 1.00 65.40 C ATOM 1413 O MET A 90 3.905 3.645 12.970 1.00 63.40 O ATOM 1414 CB MET A 90 3.909 6.143 11.893 1.00 45.21 C ATOM 1415 CG MET A 90 3.912 7.367 10.991 1.00 71.04 C ATOM 1416 SD MET A 90 5.537 7.707 10.286 1.00 14.12 S ATOM 1417 CE MET A 90 6.585 7.452 11.715 1.00 5.24 C ATOM 0 H MET A 90 0.761 6.210 11.899 1.00 13.14 H new ATOM 0 HA MET A 90 2.364 5.226 10.717 1.00 21.23 H new ATOM 0 HB2 MET A 90 4.020 6.465 12.929 1.00 45.21 H new ATOM 0 HB3 MET A 90 4.775 5.525 11.656 1.00 45.21 H new ATOM 0 HG2 MET A 90 3.194 7.221 10.184 1.00 71.04 H new ATOM 0 HG3 MET A 90 3.579 8.234 11.561 1.00 71.04 H new ATOM 0 HE1 MET A 90 7.428 8.142 11.676 1.00 5.24 H new ATOM 0 HE2 MET A 90 6.011 7.632 12.624 1.00 5.24 H new ATOM 0 HE3 MET A 90 6.955 6.427 11.717 1.00 5.24 H new ATOM 1427 N ASN A 91 2.005 2.964 11.977 1.00 14.02 N ATOM 1428 CA ASN A 91 2.140 1.580 12.419 1.00 54.11 C ATOM 1429 C ASN A 91 2.533 0.675 11.256 1.00 31.54 C ATOM 1430 O ASN A 91 1.686 0.253 10.469 1.00 3.52 O ATOM 1431 CB ASN A 91 0.831 1.091 13.041 1.00 1.34 C ATOM 1432 CG ASN A 91 0.843 1.174 14.555 1.00 51.04 C ATOM 1433 OD1 ASN A 91 0.441 2.183 15.136 1.00 73.41 O ATOM 1434 ND2 ASN A 91 1.307 0.111 15.202 1.00 10.42 N ATOM 0 H ASN A 91 1.173 3.148 11.416 1.00 14.02 H new ATOM 0 HA ASN A 91 2.928 1.540 13.171 1.00 54.11 H new ATOM 0 HB2 ASN A 91 0.004 1.686 12.654 1.00 1.34 H new ATOM 0 HB3 ASN A 91 0.651 0.060 12.738 1.00 1.34 H new ATOM 0 HD21 ASN A 91 1.341 0.109 16.221 1.00 10.42 H new ATOM 0 HD22 ASN A 91 1.630 -0.703 14.679 1.00 10.42 H new ATOM 1441 N GLY A 92 3.826 0.378 11.155 1.00 33.41 N ATOM 1442 CA GLY A 92 4.309 -0.477 10.086 1.00 53.40 C ATOM 1443 C GLY A 92 3.618 -1.826 10.064 1.00 23.24 C ATOM 1444 O GLY A 92 3.133 -2.264 9.022 1.00 31.31 O ATOM 0 H GLY A 92 4.547 0.714 11.794 1.00 33.41 H new ATOM 0 HA2 GLY A 92 4.156 0.022 9.129 1.00 53.40 H new ATOM 0 HA3 GLY A 92 5.383 -0.624 10.200 1.00 53.40 H new ATOM 1448 N GLU A 93 3.575 -2.485 11.218 1.00 72.34 N ATOM 1449 CA GLU A 93 2.940 -3.794 11.326 1.00 70.03 C ATOM 1450 C GLU A 93 1.525 -3.760 10.758 1.00 13.20 C ATOM 1451 O GLU A 93 1.130 -4.639 9.991 1.00 41.43 O ATOM 1452 CB GLU A 93 2.904 -4.249 12.787 1.00 61.14 C ATOM 1453 CG GLU A 93 2.307 -5.633 12.978 1.00 32.01 C ATOM 1454 CD GLU A 93 2.367 -6.100 14.419 1.00 73.32 C ATOM 1455 OE1 GLU A 93 3.386 -5.828 15.088 1.00 73.21 O ATOM 1456 OE2 GLU A 93 1.396 -6.737 14.878 1.00 43.12 O ATOM 0 H GLU A 93 3.972 -2.135 12.090 1.00 72.34 H new ATOM 0 HA GLU A 93 3.529 -4.504 10.746 1.00 70.03 H new ATOM 0 HB2 GLU A 93 3.918 -4.242 13.186 1.00 61.14 H new ATOM 0 HB3 GLU A 93 2.327 -3.530 13.369 1.00 61.14 H new ATOM 0 HG2 GLU A 93 1.269 -5.626 12.645 1.00 32.01 H new ATOM 0 HG3 GLU A 93 2.839 -6.345 12.347 1.00 32.01 H new ATOM 1463 N LYS A 94 0.764 -2.740 11.140 1.00 1.15 N ATOM 1464 CA LYS A 94 -0.608 -2.590 10.670 1.00 51.44 C ATOM 1465 C LYS A 94 -0.646 -2.384 9.159 1.00 64.34 C ATOM 1466 O LYS A 94 -1.492 -2.950 8.467 1.00 55.23 O ATOM 1467 CB LYS A 94 -1.283 -1.409 11.372 1.00 41.10 C ATOM 1468 CG LYS A 94 -1.520 -1.638 12.855 1.00 41.31 C ATOM 1469 CD LYS A 94 -2.669 -2.604 13.094 1.00 42.44 C ATOM 1470 CE LYS A 94 -3.288 -2.403 14.468 1.00 63.31 C ATOM 1471 NZ LYS A 94 -4.706 -2.858 14.509 1.00 22.45 N ATOM 0 H LYS A 94 1.075 -2.004 11.774 1.00 1.15 H new ATOM 0 HA LYS A 94 -1.149 -3.506 10.909 1.00 51.44 H new ATOM 0 HB2 LYS A 94 -0.665 -0.520 11.244 1.00 41.10 H new ATOM 0 HB3 LYS A 94 -2.238 -1.206 10.887 1.00 41.10 H new ATOM 0 HG2 LYS A 94 -0.612 -2.031 13.313 1.00 41.31 H new ATOM 0 HG3 LYS A 94 -1.736 -0.687 13.341 1.00 41.31 H new ATOM 0 HD2 LYS A 94 -3.430 -2.463 12.327 1.00 42.44 H new ATOM 0 HD3 LYS A 94 -2.309 -3.629 13.002 1.00 42.44 H new ATOM 0 HE2 LYS A 94 -2.709 -2.951 15.211 1.00 63.31 H new ATOM 0 HE3 LYS A 94 -3.237 -1.348 14.739 1.00 63.31 H new ATOM 0 HZ1 LYS A 94 -5.092 -2.704 15.462 1.00 22.45 H new ATOM 0 HZ2 LYS A 94 -5.264 -2.317 13.818 1.00 22.45 H new ATOM 0 HZ3 LYS A 94 -4.753 -3.870 14.276 1.00 22.45 H new ATOM 1485 N VAL A 95 0.278 -1.573 8.653 1.00 71.10 N ATOM 1486 CA VAL A 95 0.352 -1.296 7.224 1.00 61.45 C ATOM 1487 C VAL A 95 0.566 -2.578 6.426 1.00 45.15 C ATOM 1488 O VAL A 95 -0.295 -2.989 5.647 1.00 15.42 O ATOM 1489 CB VAL A 95 1.488 -0.308 6.901 1.00 5.12 C ATOM 1490 CG1 VAL A 95 1.568 -0.055 5.403 1.00 12.20 C ATOM 1491 CG2 VAL A 95 1.292 0.995 7.661 1.00 43.44 C ATOM 0 H VAL A 95 0.986 -1.096 9.212 1.00 71.10 H new ATOM 0 HA VAL A 95 -0.600 -0.848 6.939 1.00 61.45 H new ATOM 0 HB VAL A 95 2.432 -0.750 7.220 1.00 5.12 H new ATOM 0 HG11 VAL A 95 2.377 0.646 5.195 1.00 12.20 H new ATOM 0 HG12 VAL A 95 1.760 -0.995 4.885 1.00 12.20 H new ATOM 0 HG13 VAL A 95 0.625 0.366 5.054 1.00 12.20 H new ATOM 0 HG21 VAL A 95 2.104 1.682 7.421 1.00 43.44 H new ATOM 0 HG22 VAL A 95 0.341 1.444 7.375 1.00 43.44 H new ATOM 0 HG23 VAL A 95 1.291 0.795 8.732 1.00 43.44 H new ATOM 1501 N LEU A 96 1.720 -3.206 6.624 1.00 1.02 N ATOM 1502 CA LEU A 96 2.048 -4.442 5.923 1.00 62.40 C ATOM 1503 C LEU A 96 0.945 -5.480 6.104 1.00 13.12 C ATOM 1504 O LEU A 96 0.540 -6.141 5.148 1.00 52.51 O ATOM 1505 CB LEU A 96 3.379 -5.001 6.431 1.00 34.32 C ATOM 1506 CG LEU A 96 3.527 -5.106 7.949 1.00 74.41 C ATOM 1507 CD1 LEU A 96 3.258 -6.530 8.414 1.00 50.51 C ATOM 1508 CD2 LEU A 96 4.913 -4.655 8.383 1.00 62.22 C ATOM 0 H LEU A 96 2.444 -2.879 7.264 1.00 1.02 H new ATOM 0 HA LEU A 96 2.137 -4.216 4.860 1.00 62.40 H new ATOM 0 HB2 LEU A 96 3.521 -5.993 6.003 1.00 34.32 H new ATOM 0 HB3 LEU A 96 4.183 -4.372 6.050 1.00 34.32 H new ATOM 0 HG LEU A 96 2.792 -4.448 8.413 1.00 74.41 H new ATOM 0 HD11 LEU A 96 3.368 -6.586 9.497 1.00 50.51 H new ATOM 0 HD12 LEU A 96 2.244 -6.818 8.137 1.00 50.51 H new ATOM 0 HD13 LEU A 96 3.969 -7.207 7.942 1.00 50.51 H new ATOM 0 HD21 LEU A 96 5.000 -4.737 9.466 1.00 62.22 H new ATOM 0 HD22 LEU A 96 5.666 -5.286 7.910 1.00 62.22 H new ATOM 0 HD23 LEU A 96 5.069 -3.618 8.084 1.00 62.22 H new ATOM 1520 N GLN A 97 0.463 -5.615 7.336 1.00 72.24 N ATOM 1521 CA GLN A 97 -0.594 -6.572 7.641 1.00 42.14 C ATOM 1522 C GLN A 97 -1.828 -6.311 6.782 1.00 11.25 C ATOM 1523 O GLN A 97 -2.459 -7.243 6.283 1.00 63.20 O ATOM 1524 CB GLN A 97 -0.964 -6.500 9.123 1.00 73.14 C ATOM 1525 CG GLN A 97 -0.030 -7.294 10.022 1.00 73.51 C ATOM 1526 CD GLN A 97 -0.538 -8.696 10.297 1.00 13.45 C ATOM 1527 OE1 GLN A 97 -1.259 -8.928 11.269 1.00 51.53 O ATOM 1528 NE2 GLN A 97 -0.165 -9.640 9.442 1.00 23.22 N ATOM 0 H GLN A 97 0.787 -5.074 8.138 1.00 72.24 H new ATOM 0 HA GLN A 97 -0.222 -7.571 7.416 1.00 42.14 H new ATOM 0 HB2 GLN A 97 -0.960 -5.457 9.440 1.00 73.14 H new ATOM 0 HB3 GLN A 97 -1.981 -6.869 9.253 1.00 73.14 H new ATOM 0 HG2 GLN A 97 0.954 -7.353 9.556 1.00 73.51 H new ATOM 0 HG3 GLN A 97 0.096 -6.765 10.967 1.00 73.51 H new ATOM 0 HE21 GLN A 97 0.433 -9.404 8.650 1.00 23.22 H new ATOM 0 HE22 GLN A 97 -0.476 -10.602 9.577 1.00 23.22 H new ATOM 1537 N LEU A 98 -2.168 -5.037 6.618 1.00 55.12 N ATOM 1538 CA LEU A 98 -3.328 -4.653 5.821 1.00 50.02 C ATOM 1539 C LEU A 98 -3.124 -5.014 4.352 1.00 15.44 C ATOM 1540 O LEU A 98 -3.984 -5.637 3.732 1.00 63.53 O ATOM 1541 CB LEU A 98 -3.591 -3.151 5.957 1.00 64.32 C ATOM 1542 CG LEU A 98 -4.958 -2.757 6.514 1.00 55.33 C ATOM 1543 CD1 LEU A 98 -4.981 -1.281 6.878 1.00 70.32 C ATOM 1544 CD2 LEU A 98 -6.056 -3.076 5.508 1.00 64.32 C ATOM 0 H LEU A 98 -1.658 -4.254 7.026 1.00 55.12 H new ATOM 0 HA LEU A 98 -4.192 -5.202 6.195 1.00 50.02 H new ATOM 0 HB2 LEU A 98 -2.822 -2.725 6.601 1.00 64.32 H new ATOM 0 HB3 LEU A 98 -3.475 -2.692 4.975 1.00 64.32 H new ATOM 0 HG LEU A 98 -5.141 -3.337 7.419 1.00 55.33 H new ATOM 0 HD11 LEU A 98 -5.963 -1.019 7.273 1.00 70.32 H new ATOM 0 HD12 LEU A 98 -4.221 -1.081 7.633 1.00 70.32 H new ATOM 0 HD13 LEU A 98 -4.776 -0.684 5.989 1.00 70.32 H new ATOM 0 HD21 LEU A 98 -7.023 -2.789 5.921 1.00 64.32 H new ATOM 0 HD22 LEU A 98 -5.877 -2.523 4.586 1.00 64.32 H new ATOM 0 HD23 LEU A 98 -6.055 -4.145 5.295 1.00 64.32 H new ATOM 1556 N ALA A 99 -1.979 -4.617 3.804 1.00 33.04 N ATOM 1557 CA ALA A 99 -1.661 -4.902 2.412 1.00 64.35 C ATOM 1558 C ALA A 99 -1.775 -6.395 2.117 1.00 53.43 C ATOM 1559 O ALA A 99 -2.544 -6.807 1.247 1.00 45.41 O ATOM 1560 CB ALA A 99 -0.263 -4.403 2.077 1.00 61.02 C ATOM 0 H ALA A 99 -1.258 -4.097 4.304 1.00 33.04 H new ATOM 0 HA ALA A 99 -2.383 -4.377 1.786 1.00 64.35 H new ATOM 0 HB1 ALA A 99 -0.039 -4.623 1.033 1.00 61.02 H new ATOM 0 HB2 ALA A 99 -0.212 -3.326 2.240 1.00 61.02 H new ATOM 0 HB3 ALA A 99 0.465 -4.902 2.717 1.00 61.02 H new ATOM 1566 N ILE A 100 -1.007 -7.198 2.844 1.00 13.14 N ATOM 1567 CA ILE A 100 -1.024 -8.643 2.660 1.00 73.41 C ATOM 1568 C ILE A 100 -2.427 -9.207 2.866 1.00 61.41 C ATOM 1569 O ILE A 100 -2.925 -9.974 2.043 1.00 52.41 O ATOM 1570 CB ILE A 100 -0.054 -9.346 3.627 1.00 22.34 C ATOM 1571 CG1 ILE A 100 1.371 -8.829 3.418 1.00 60.35 C ATOM 1572 CG2 ILE A 100 -0.110 -10.854 3.432 1.00 64.15 C ATOM 1573 CD1 ILE A 100 2.106 -8.541 4.709 1.00 75.31 C ATOM 0 H ILE A 100 -0.365 -6.872 3.566 1.00 13.14 H new ATOM 0 HA ILE A 100 -0.704 -8.834 1.636 1.00 73.41 H new ATOM 0 HB ILE A 100 -0.357 -9.121 4.650 1.00 22.34 H new ATOM 0 HG12 ILE A 100 1.935 -9.565 2.845 1.00 60.35 H new ATOM 0 HG13 ILE A 100 1.334 -7.919 2.820 1.00 60.35 H new ATOM 0 HG21 ILE A 100 0.581 -11.336 4.123 1.00 64.15 H new ATOM 0 HG22 ILE A 100 -1.122 -11.209 3.625 1.00 64.15 H new ATOM 0 HG23 ILE A 100 0.171 -11.099 2.408 1.00 64.15 H new ATOM 0 HD11 ILE A 100 3.109 -8.178 4.484 1.00 75.31 H new ATOM 0 HD12 ILE A 100 1.565 -7.783 5.275 1.00 75.31 H new ATOM 0 HD13 ILE A 100 2.175 -9.454 5.300 1.00 75.31 H new ATOM 1585 N ASN A 101 -3.057 -8.821 3.970 1.00 24.54 N ATOM 1586 CA ASN A 101 -4.402 -9.288 4.285 1.00 54.32 C ATOM 1587 C ASN A 101 -5.347 -9.057 3.109 1.00 34.11 C ATOM 1588 O ASN A 101 -6.109 -9.946 2.729 1.00 50.15 O ATOM 1589 CB ASN A 101 -4.935 -8.574 5.529 1.00 11.35 C ATOM 1590 CG ASN A 101 -6.352 -8.988 5.872 1.00 72.22 C ATOM 1591 OD1 ASN A 101 -6.885 -9.946 5.309 1.00 44.41 O ATOM 1592 ND2 ASN A 101 -6.972 -8.267 6.799 1.00 25.15 N ATOM 0 H ASN A 101 -2.658 -8.186 4.662 1.00 24.54 H new ATOM 0 HA ASN A 101 -4.351 -10.359 4.483 1.00 54.32 H new ATOM 0 HB2 ASN A 101 -4.282 -8.789 6.375 1.00 11.35 H new ATOM 0 HB3 ASN A 101 -4.904 -7.497 5.367 1.00 11.35 H new ATOM 0 HD21 ASN A 101 -7.928 -8.498 7.071 1.00 25.15 H new ATOM 0 HD22 ASN A 101 -6.493 -7.482 7.240 1.00 25.15 H new ATOM 1599 N ALA A 102 -5.290 -7.859 2.538 1.00 3.23 N ATOM 1600 CA ALA A 102 -6.138 -7.511 1.405 1.00 64.34 C ATOM 1601 C ALA A 102 -5.814 -8.378 0.192 1.00 12.23 C ATOM 1602 O ALA A 102 -6.713 -8.880 -0.482 1.00 75.25 O ATOM 1603 CB ALA A 102 -5.981 -6.038 1.059 1.00 41.20 C ATOM 0 H ALA A 102 -4.665 -7.112 2.842 1.00 3.23 H new ATOM 0 HA ALA A 102 -7.174 -7.697 1.688 1.00 64.34 H new ATOM 0 HB1 ALA A 102 -6.621 -5.793 0.211 1.00 41.20 H new ATOM 0 HB2 ALA A 102 -6.268 -5.430 1.917 1.00 41.20 H new ATOM 0 HB3 ALA A 102 -4.942 -5.834 0.801 1.00 41.20 H new ATOM 1609 N PHE A 103 -4.525 -8.550 -0.080 1.00 43.21 N ATOM 1610 CA PHE A 103 -4.083 -9.354 -1.214 1.00 4.34 C ATOM 1611 C PHE A 103 -4.687 -10.754 -1.155 1.00 72.42 C ATOM 1612 O PHE A 103 -5.302 -11.216 -2.114 1.00 73.24 O ATOM 1613 CB PHE A 103 -2.556 -9.447 -1.236 1.00 2.03 C ATOM 1614 CG PHE A 103 -2.018 -10.209 -2.413 1.00 13.51 C ATOM 1615 CD1 PHE A 103 -1.963 -9.624 -3.668 1.00 4.14 C ATOM 1616 CD2 PHE A 103 -1.570 -11.511 -2.265 1.00 24.32 C ATOM 1617 CE1 PHE A 103 -1.469 -10.322 -4.752 1.00 51.15 C ATOM 1618 CE2 PHE A 103 -1.074 -12.215 -3.347 1.00 1.13 C ATOM 1619 CZ PHE A 103 -1.024 -11.620 -4.592 1.00 12.43 C ATOM 0 H PHE A 103 -3.768 -8.143 0.469 1.00 43.21 H new ATOM 0 HA PHE A 103 -4.424 -8.867 -2.128 1.00 4.34 H new ATOM 0 HB2 PHE A 103 -2.139 -8.440 -1.244 1.00 2.03 H new ATOM 0 HB3 PHE A 103 -2.216 -9.925 -0.318 1.00 2.03 H new ATOM 0 HD1 PHE A 103 -2.311 -8.610 -3.800 1.00 4.14 H new ATOM 0 HD2 PHE A 103 -1.608 -11.982 -1.294 1.00 24.32 H new ATOM 0 HE1 PHE A 103 -1.431 -9.854 -5.724 1.00 51.15 H new ATOM 0 HE2 PHE A 103 -0.726 -13.229 -3.218 1.00 1.13 H new ATOM 0 HZ PHE A 103 -0.638 -12.168 -5.439 1.00 12.43 H new ATOM 1629 N ASN A 104 -4.507 -11.424 -0.021 1.00 51.43 N ATOM 1630 CA ASN A 104 -5.033 -12.771 0.163 1.00 23.44 C ATOM 1631 C ASN A 104 -6.556 -12.778 0.066 1.00 24.31 C ATOM 1632 O ASN A 104 -7.140 -13.629 -0.604 1.00 54.30 O ATOM 1633 CB ASN A 104 -4.595 -13.332 1.518 1.00 45.01 C ATOM 1634 CG ASN A 104 -3.344 -14.182 1.414 1.00 2.51 C ATOM 1635 OD1 ASN A 104 -3.402 -15.407 1.518 1.00 44.14 O ATOM 1636 ND2 ASN A 104 -2.203 -13.534 1.207 1.00 4.53 N ATOM 0 H ASN A 104 -4.001 -11.056 0.784 1.00 51.43 H new ATOM 0 HA ASN A 104 -4.633 -13.402 -0.631 1.00 23.44 H new ATOM 0 HB2 ASN A 104 -4.415 -12.508 2.208 1.00 45.01 H new ATOM 0 HB3 ASN A 104 -5.403 -13.930 1.939 1.00 45.01 H new ATOM 0 HD21 ASN A 104 -1.329 -14.053 1.128 1.00 4.53 H new ATOM 0 HD22 ASN A 104 -2.201 -12.517 1.127 1.00 4.53 H new ATOM 1643 N ASN A 105 -7.190 -11.824 0.739 1.00 74.12 N ATOM 1644 CA ASN A 105 -8.645 -11.721 0.728 1.00 14.34 C ATOM 1645 C ASN A 105 -9.175 -11.638 -0.700 1.00 64.30 C ATOM 1646 O ASN A 105 -10.170 -12.277 -1.043 1.00 35.33 O ATOM 1647 CB ASN A 105 -9.096 -10.492 1.522 1.00 22.20 C ATOM 1648 CG ASN A 105 -9.453 -10.830 2.956 1.00 5.14 C ATOM 1649 OD1 ASN A 105 -8.869 -11.732 3.558 1.00 32.21 O ATOM 1650 ND2 ASN A 105 -10.417 -10.105 3.512 1.00 62.20 N ATOM 0 H ASN A 105 -6.720 -11.112 1.298 1.00 74.12 H new ATOM 0 HA ASN A 105 -9.051 -12.618 1.196 1.00 14.34 H new ATOM 0 HB2 ASN A 105 -8.301 -9.746 1.514 1.00 22.20 H new ATOM 0 HB3 ASN A 105 -9.960 -10.043 1.032 1.00 22.20 H new ATOM 0 HD21 ASN A 105 -10.700 -10.286 4.475 1.00 62.20 H new ATOM 0 HD22 ASN A 105 -10.874 -9.367 2.976 1.00 62.20 H new ATOM 1657 N LYS A 106 -8.502 -10.850 -1.531 1.00 2.33 N ATOM 1658 CA LYS A 106 -8.902 -10.684 -2.923 1.00 62.11 C ATOM 1659 C LYS A 106 -7.918 -11.381 -3.858 1.00 3.01 C ATOM 1660 O LYS A 106 -7.074 -10.736 -4.479 1.00 4.25 O ATOM 1661 CB LYS A 106 -8.992 -9.198 -3.277 1.00 1.43 C ATOM 1662 CG LYS A 106 -10.118 -8.470 -2.562 1.00 63.20 C ATOM 1663 CD LYS A 106 -10.263 -7.042 -3.060 1.00 24.31 C ATOM 1664 CE LYS A 106 -10.995 -6.172 -2.050 1.00 51.25 C ATOM 1665 NZ LYS A 106 -10.562 -4.749 -2.128 1.00 43.31 N ATOM 0 H LYS A 106 -7.675 -10.315 -1.264 1.00 2.33 H new ATOM 0 HA LYS A 106 -9.884 -11.141 -3.049 1.00 62.11 H new ATOM 0 HB2 LYS A 106 -8.045 -8.716 -3.031 1.00 1.43 H new ATOM 0 HB3 LYS A 106 -9.131 -9.097 -4.353 1.00 1.43 H new ATOM 0 HG2 LYS A 106 -11.054 -9.007 -2.715 1.00 63.20 H new ATOM 0 HG3 LYS A 106 -9.925 -8.464 -1.489 1.00 63.20 H new ATOM 0 HD2 LYS A 106 -9.277 -6.622 -3.256 1.00 24.31 H new ATOM 0 HD3 LYS A 106 -10.805 -7.038 -4.006 1.00 24.31 H new ATOM 0 HE2 LYS A 106 -12.069 -6.235 -2.227 1.00 51.25 H new ATOM 0 HE3 LYS A 106 -10.814 -6.552 -1.045 1.00 51.25 H new ATOM 0 HZ1 LYS A 106 -11.084 -4.188 -1.424 1.00 43.31 H new ATOM 0 HZ2 LYS A 106 -9.542 -4.685 -1.935 1.00 43.31 H new ATOM 0 HZ3 LYS A 106 -10.758 -4.378 -3.080 1.00 43.31 H new