USER MOD reduce.3.24.130724 H: found=0, std=0, add=1136, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1137 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 5 THR OG1 : rot -30:sc= -0.999 USER MOD Set 1.2: A 126 THR OG1 : rot 59:sc= -0.0667 USER MOD Set 2.1: A 114 MET CE :methyl 161:sc= -0.198 (180deg=-1.12) USER MOD Set 2.2: A 125 MET CE :methyl 149:sc= -0.465 (180deg=-2.29!) USER MOD Set 3.1: A 106 MET CE :methyl -165:sc= -2.98! (180deg=-1.5!) USER MOD Set 3.2: A 137 MET CE :methyl 159:sc= -1.34 (180deg=-0.28) USER MOD Set 4.1: A 22 THR OG1 : rot -80:sc= 1.27 USER MOD Set 4.2: A 97 TYR OH : rot 104:sc= 0.84 USER MOD Set 5.1: A 81 GLN : amide:sc=-0.00838 X(o=-0.068,f=-0.42) USER MOD Set 5.2: A 90 TYR OH : rot 180:sc= -0.06 USER MOD Set 6.1: A 53 THR OG1 : rot 180:sc= 0.973 USER MOD Set 6.2: A 64 SER OG : rot 108:sc= 0.277 USER MOD Single : A 4 HIS : no HD1:sc= 0.628 K(o=0.63,f=-3.6!) USER MOD Single : A 7 ASN : amide:sc= -0.974 K(o=-0.97,f=-3!) USER MOD Single : A 10 THR OG1 : rot 180:sc= -0.833 USER MOD Single : A 15 MET CE :methyl 160:sc= -0.151 (180deg=-0.776) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 MET CE :methyl -162:sc= -0.0668 (180deg=-0.46) USER MOD Single : A 23 ASN : amide:sc= -0.0634 K(o=-0.063,f=-2.6!) USER MOD Single : A 27 LYS NZ :NH3+ 170:sc= 1.12 (180deg=1.02) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 153:sc= 1.15 (180deg=0.415) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 MET CE :methyl 176:sc= -0.665 (180deg=-0.682) USER MOD Single : A 55 HIS : no HE2:sc= -1.11 K(o=-1.1,f=-2.2!) USER MOD Single : A 61 LYS NZ :NH3+ -160:sc= -0.0447 (180deg=-0.324) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot -81:sc= 1.07 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 THR OG1 : rot 140:sc= 0.205 USER MOD Single : A 89 GLN : amide:sc= 0 K(o=0,f=-0.94) USER MOD Single : A 91 MET CE :methyl -133:sc= 0 (180deg=-0.0452) USER MOD Single : A 92 ASN : amide:sc= -2.82! K(o=-2.8!,f=-0.48) USER MOD Single : A 100 THR OG1 : rot -150:sc= -0.0648 USER MOD Single : A 104 THR OG1 : rot 82:sc= -0.626 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= -2.14 K(o=-2.1,f=-5!) USER MOD Single : A 115 LYS NZ :NH3+ 160:sc= -0.193 (180deg=-0.73) USER MOD Single : A 128 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 130 ASN : amide:sc= 0.586 K(o=0.59,f=-6.1!) USER MOD Single : A 132 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot 79:sc= 1.24 USER MOD Single : A 136 GLN : amide:sc= -0.18 X(o=-0.18,f=-0.038) USER MOD Single : A 146 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD ----------------------------------------------------------------- ATOM 20 N ALA A 2 -4.100 -11.737 16.255 1.00 0.00 N ATOM 21 CA ALA A 2 -3.769 -10.946 15.085 1.00 0.00 C ATOM 22 C ALA A 2 -5.013 -10.667 14.258 1.00 0.00 C ATOM 23 O ALA A 2 -5.739 -11.589 13.878 1.00 0.00 O ATOM 24 CB ALA A 2 -2.718 -11.658 14.245 1.00 0.00 C ATOM 0 HA ALA A 2 -3.359 -9.992 15.418 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -2.480 -11.052 13.371 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.817 -11.807 14.840 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -3.104 -12.625 13.922 1.00 0.00 H new ATOM 30 N GLY A 3 -5.255 -9.396 13.989 1.00 0.00 N ATOM 31 CA GLY A 3 -6.388 -9.010 13.181 1.00 0.00 C ATOM 32 C GLY A 3 -6.095 -9.185 11.710 1.00 0.00 C ATOM 33 O GLY A 3 -4.936 -9.117 11.292 1.00 0.00 O ATOM 0 H GLY A 3 -4.682 -8.619 14.319 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -7.255 -9.610 13.456 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -6.644 -7.970 13.382 1.00 0.00 H new ATOM 37 N HIS A 4 -7.127 -9.419 10.922 1.00 0.00 N ATOM 38 CA HIS A 4 -6.943 -9.671 9.500 1.00 0.00 C ATOM 39 C HIS A 4 -7.994 -8.954 8.671 1.00 0.00 C ATOM 40 O HIS A 4 -9.179 -9.274 8.734 1.00 0.00 O ATOM 41 CB HIS A 4 -6.971 -11.174 9.211 1.00 0.00 C ATOM 42 CG HIS A 4 -5.752 -11.887 9.710 1.00 0.00 C ATOM 43 ND1 HIS A 4 -5.707 -12.566 10.906 1.00 0.00 N ATOM 44 CD2 HIS A 4 -4.515 -11.992 9.174 1.00 0.00 C ATOM 45 CE1 HIS A 4 -4.494 -13.054 11.086 1.00 0.00 C ATOM 46 NE2 HIS A 4 -3.749 -12.719 10.049 1.00 0.00 N ATOM 0 H HIS A 4 -8.097 -9.441 11.237 1.00 0.00 H new ATOM 0 HA HIS A 4 -5.966 -9.278 9.217 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -7.856 -11.611 9.673 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -7.063 -11.330 8.136 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -4.190 -11.579 8.230 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -4.166 -13.630 11.938 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -2.767 -12.961 9.920 1.00 0.00 H new ATOM 55 N THR A 5 -7.552 -7.977 7.900 1.00 0.00 N ATOM 56 CA THR A 5 -8.443 -7.240 7.027 1.00 0.00 C ATOM 57 C THR A 5 -7.953 -7.316 5.587 1.00 0.00 C ATOM 58 O THR A 5 -6.888 -6.793 5.262 1.00 0.00 O ATOM 59 CB THR A 5 -8.540 -5.766 7.452 1.00 0.00 C ATOM 60 OG1 THR A 5 -8.848 -5.693 8.848 1.00 0.00 O ATOM 61 CG2 THR A 5 -9.607 -5.039 6.646 1.00 0.00 C ATOM 0 H THR A 5 -6.578 -7.676 7.862 1.00 0.00 H new ATOM 0 HA THR A 5 -9.432 -7.693 7.102 1.00 0.00 H new ATOM 0 HB THR A 5 -7.582 -5.283 7.262 1.00 0.00 H new ATOM 0 HG1 THR A 5 -9.378 -6.475 9.107 1.00 0.00 H new ATOM 0 HG21 THR A 5 -9.657 -3.998 6.965 1.00 0.00 H new ATOM 0 HG22 THR A 5 -9.355 -5.083 5.586 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.574 -5.515 6.809 1.00 0.00 H new ATOM 69 N ASP A 6 -8.709 -7.997 4.741 1.00 0.00 N ATOM 70 CA ASP A 6 -8.367 -8.096 3.330 1.00 0.00 C ATOM 71 C ASP A 6 -9.327 -7.260 2.490 1.00 0.00 C ATOM 72 O ASP A 6 -10.527 -7.525 2.444 1.00 0.00 O ATOM 73 CB ASP A 6 -8.367 -9.562 2.861 1.00 0.00 C ATOM 74 CG ASP A 6 -9.720 -10.245 2.983 1.00 0.00 C ATOM 75 OD1 ASP A 6 -10.106 -10.618 4.114 1.00 0.00 O ATOM 76 OD2 ASP A 6 -10.397 -10.426 1.952 1.00 0.00 O ATOM 0 H ASP A 6 -9.562 -8.489 5.006 1.00 0.00 H new ATOM 0 HA ASP A 6 -7.359 -7.704 3.197 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -8.043 -9.601 1.821 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -7.635 -10.120 3.444 1.00 0.00 H new ATOM 81 N ASN A 7 -8.800 -6.218 1.866 1.00 0.00 N ATOM 82 CA ASN A 7 -9.594 -5.393 0.965 1.00 0.00 C ATOM 83 C ASN A 7 -9.176 -5.640 -0.478 1.00 0.00 C ATOM 84 O ASN A 7 -8.089 -5.245 -0.901 1.00 0.00 O ATOM 85 CB ASN A 7 -9.459 -3.906 1.308 1.00 0.00 C ATOM 86 CG ASN A 7 -10.215 -3.016 0.333 1.00 0.00 C ATOM 87 OD1 ASN A 7 -11.415 -2.799 0.478 1.00 0.00 O ATOM 88 ND2 ASN A 7 -9.514 -2.487 -0.661 1.00 0.00 N ATOM 0 H ASN A 7 -7.829 -5.923 1.966 1.00 0.00 H new ATOM 0 HA ASN A 7 -10.641 -5.672 1.087 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -9.832 -3.733 2.318 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -8.405 -3.629 1.306 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -9.971 -1.876 -1.338 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -8.518 -2.691 -0.748 1.00 0.00 H new ATOM 95 N GLU A 8 -10.037 -6.309 -1.222 1.00 0.00 N ATOM 96 CA GLU A 8 -9.759 -6.648 -2.608 1.00 0.00 C ATOM 97 C GLU A 8 -10.276 -5.560 -3.542 1.00 0.00 C ATOM 98 O GLU A 8 -11.477 -5.281 -3.572 1.00 0.00 O ATOM 99 CB GLU A 8 -10.425 -7.978 -2.951 1.00 0.00 C ATOM 100 CG GLU A 8 -10.053 -9.100 -2.000 1.00 0.00 C ATOM 101 CD GLU A 8 -11.059 -10.229 -2.025 1.00 0.00 C ATOM 102 OE1 GLU A 8 -12.130 -10.082 -1.399 1.00 0.00 O ATOM 103 OE2 GLU A 8 -10.792 -11.261 -2.669 1.00 0.00 O ATOM 0 H GLU A 8 -10.944 -6.632 -0.886 1.00 0.00 H new ATOM 0 HA GLU A 8 -8.680 -6.732 -2.737 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -11.507 -7.847 -2.942 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -10.147 -8.264 -3.965 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -9.069 -9.487 -2.265 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -9.978 -8.705 -0.987 1.00 0.00 H new ATOM 110 N ILE A 9 -9.377 -4.940 -4.293 1.00 0.00 N ATOM 111 CA ILE A 9 -9.778 -3.946 -5.273 1.00 0.00 C ATOM 112 C ILE A 9 -9.201 -4.280 -6.647 1.00 0.00 C ATOM 113 O ILE A 9 -7.991 -4.463 -6.809 1.00 0.00 O ATOM 114 CB ILE A 9 -9.384 -2.503 -4.852 1.00 0.00 C ATOM 115 CG1 ILE A 9 -9.911 -1.491 -5.877 1.00 0.00 C ATOM 116 CG2 ILE A 9 -7.874 -2.354 -4.683 1.00 0.00 C ATOM 117 CD1 ILE A 9 -9.681 -0.046 -5.487 1.00 0.00 C ATOM 0 H ILE A 9 -8.372 -5.107 -4.242 1.00 0.00 H new ATOM 0 HA ILE A 9 -10.866 -3.977 -5.328 1.00 0.00 H new ATOM 0 HB ILE A 9 -9.842 -2.303 -3.883 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -9.431 -1.679 -6.838 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -10.980 -1.654 -6.017 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -7.640 -1.331 -4.388 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -7.524 -3.042 -3.913 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -7.378 -2.582 -5.626 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -10.081 0.608 -6.262 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -10.184 0.160 -4.542 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -8.612 0.135 -5.376 1.00 0.00 H new ATOM 129 N THR A 10 -10.084 -4.406 -7.619 1.00 0.00 N ATOM 130 CA THR A 10 -9.688 -4.680 -8.985 1.00 0.00 C ATOM 131 C THR A 10 -9.376 -3.377 -9.713 1.00 0.00 C ATOM 132 O THR A 10 -10.243 -2.515 -9.858 1.00 0.00 O ATOM 133 CB THR A 10 -10.805 -5.429 -9.736 1.00 0.00 C ATOM 134 OG1 THR A 10 -11.254 -6.542 -8.952 1.00 0.00 O ATOM 135 CG2 THR A 10 -10.314 -5.921 -11.090 1.00 0.00 C ATOM 0 H THR A 10 -11.091 -4.322 -7.484 1.00 0.00 H new ATOM 0 HA THR A 10 -8.796 -5.306 -8.960 1.00 0.00 H new ATOM 0 HB THR A 10 -11.632 -4.738 -9.899 1.00 0.00 H new ATOM 0 HG1 THR A 10 -11.966 -7.015 -9.432 1.00 0.00 H new ATOM 0 HG21 THR A 10 -11.121 -6.447 -11.601 1.00 0.00 H new ATOM 0 HG22 THR A 10 -9.996 -5.070 -11.693 1.00 0.00 H new ATOM 0 HG23 THR A 10 -9.473 -6.599 -10.947 1.00 0.00 H new ATOM 143 N ILE A 11 -8.138 -3.225 -10.147 1.00 0.00 N ATOM 144 CA ILE A 11 -7.731 -2.030 -10.864 1.00 0.00 C ATOM 145 C ILE A 11 -7.746 -2.281 -12.363 1.00 0.00 C ATOM 146 O ILE A 11 -7.111 -3.217 -12.853 1.00 0.00 O ATOM 147 CB ILE A 11 -6.329 -1.558 -10.432 1.00 0.00 C ATOM 148 CG1 ILE A 11 -6.315 -1.269 -8.930 1.00 0.00 C ATOM 149 CG2 ILE A 11 -5.911 -0.322 -11.221 1.00 0.00 C ATOM 150 CD1 ILE A 11 -4.982 -0.773 -8.422 1.00 0.00 C ATOM 0 H ILE A 11 -7.397 -3.914 -10.016 1.00 0.00 H new ATOM 0 HA ILE A 11 -8.445 -1.244 -10.620 1.00 0.00 H new ATOM 0 HB ILE A 11 -5.612 -2.351 -10.643 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -7.080 -0.526 -8.704 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -6.585 -2.177 -8.391 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -4.919 -0.005 -10.901 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -5.891 -0.559 -12.285 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -6.624 0.482 -11.042 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -5.047 -0.589 -7.350 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -4.216 -1.524 -8.616 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -4.719 0.153 -8.934 1.00 0.00 H new ATOM 162 N ALA A 12 -8.471 -1.441 -13.086 1.00 0.00 N ATOM 163 CA ALA A 12 -8.606 -1.602 -14.523 1.00 0.00 C ATOM 164 C ALA A 12 -7.416 -0.986 -15.241 1.00 0.00 C ATOM 165 O ALA A 12 -7.484 0.142 -15.733 1.00 0.00 O ATOM 166 CB ALA A 12 -9.908 -0.992 -15.012 1.00 0.00 C ATOM 0 H ALA A 12 -8.974 -0.642 -12.700 1.00 0.00 H new ATOM 0 HA ALA A 12 -8.627 -2.668 -14.750 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -9.989 -1.124 -16.091 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -10.748 -1.485 -14.522 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -9.923 0.072 -14.774 1.00 0.00 H new ATOM 172 N ALA A 13 -6.319 -1.722 -15.253 1.00 0.00 N ATOM 173 CA ALA A 13 -5.089 -1.277 -15.876 1.00 0.00 C ATOM 174 C ALA A 13 -4.164 -2.466 -16.092 1.00 0.00 C ATOM 175 O ALA A 13 -4.242 -3.453 -15.354 1.00 0.00 O ATOM 176 CB ALA A 13 -4.408 -0.226 -15.008 1.00 0.00 C ATOM 0 H ALA A 13 -6.258 -2.648 -14.829 1.00 0.00 H new ATOM 0 HA ALA A 13 -5.321 -0.828 -16.842 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -3.485 0.100 -15.488 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -5.073 0.629 -14.882 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -4.178 -0.653 -14.032 1.00 0.00 H new ATOM 182 N PRO A 14 -3.298 -2.399 -17.115 1.00 0.00 N ATOM 183 CA PRO A 14 -2.312 -3.450 -17.394 1.00 0.00 C ATOM 184 C PRO A 14 -1.409 -3.721 -16.195 1.00 0.00 C ATOM 185 O PRO A 14 -0.912 -2.783 -15.563 1.00 0.00 O ATOM 186 CB PRO A 14 -1.492 -2.872 -18.551 1.00 0.00 C ATOM 187 CG PRO A 14 -2.394 -1.885 -19.201 1.00 0.00 C ATOM 188 CD PRO A 14 -3.220 -1.300 -18.093 1.00 0.00 C ATOM 0 HA PRO A 14 -2.787 -4.404 -17.624 1.00 0.00 H new ATOM 0 HB2 PRO A 14 -0.580 -2.397 -18.190 1.00 0.00 H new ATOM 0 HB3 PRO A 14 -1.190 -3.652 -19.250 1.00 0.00 H new ATOM 0 HG2 PRO A 14 -1.823 -1.111 -19.714 1.00 0.00 H new ATOM 0 HG3 PRO A 14 -3.025 -2.365 -19.949 1.00 0.00 H new ATOM 0 HD2 PRO A 14 -2.751 -0.414 -17.666 1.00 0.00 H new ATOM 0 HD3 PRO A 14 -4.208 -1.001 -18.442 1.00 0.00 H new ATOM 196 N MET A 15 -1.190 -5.002 -15.897 1.00 0.00 N ATOM 197 CA MET A 15 -0.377 -5.409 -14.751 1.00 0.00 C ATOM 198 C MET A 15 1.009 -4.783 -14.814 1.00 0.00 C ATOM 199 O MET A 15 1.608 -4.476 -13.780 1.00 0.00 O ATOM 200 CB MET A 15 -0.242 -6.933 -14.691 1.00 0.00 C ATOM 201 CG MET A 15 -1.559 -7.664 -14.489 1.00 0.00 C ATOM 202 SD MET A 15 -1.350 -9.449 -14.359 1.00 0.00 S ATOM 203 CE MET A 15 -0.336 -9.568 -12.885 1.00 0.00 C ATOM 0 H MET A 15 -1.567 -5.780 -16.438 1.00 0.00 H new ATOM 0 HA MET A 15 -0.884 -5.059 -13.852 1.00 0.00 H new ATOM 0 HB2 MET A 15 0.218 -7.283 -15.615 1.00 0.00 H new ATOM 0 HB3 MET A 15 0.436 -7.196 -13.879 1.00 0.00 H new ATOM 0 HG2 MET A 15 -2.042 -7.292 -13.585 1.00 0.00 H new ATOM 0 HG3 MET A 15 -2.226 -7.440 -15.322 1.00 0.00 H new ATOM 0 HE1 MET A 15 -0.412 -10.574 -12.471 1.00 0.00 H new ATOM 0 HE2 MET A 15 0.703 -9.358 -13.140 1.00 0.00 H new ATOM 0 HE3 MET A 15 -0.681 -8.845 -12.146 1.00 0.00 H new ATOM 213 N GLU A 16 1.506 -4.596 -16.036 1.00 0.00 N ATOM 214 CA GLU A 16 2.799 -3.964 -16.263 1.00 0.00 C ATOM 215 C GLU A 16 2.876 -2.630 -15.524 1.00 0.00 C ATOM 216 O GLU A 16 3.834 -2.355 -14.798 1.00 0.00 O ATOM 217 CB GLU A 16 3.041 -3.728 -17.764 1.00 0.00 C ATOM 218 CG GLU A 16 2.829 -4.955 -18.646 1.00 0.00 C ATOM 219 CD GLU A 16 1.401 -5.090 -19.146 1.00 0.00 C ATOM 220 OE1 GLU A 16 0.526 -5.510 -18.362 1.00 0.00 O ATOM 221 OE2 GLU A 16 1.145 -4.781 -20.330 1.00 0.00 O ATOM 0 H GLU A 16 1.025 -4.878 -16.890 1.00 0.00 H new ATOM 0 HA GLU A 16 3.569 -4.636 -15.883 1.00 0.00 H new ATOM 0 HB2 GLU A 16 2.377 -2.934 -18.105 1.00 0.00 H new ATOM 0 HB3 GLU A 16 4.062 -3.371 -17.902 1.00 0.00 H new ATOM 0 HG2 GLU A 16 3.503 -4.902 -19.501 1.00 0.00 H new ATOM 0 HG3 GLU A 16 3.097 -5.850 -18.084 1.00 0.00 H new ATOM 228 N LEU A 17 1.842 -1.817 -15.690 1.00 0.00 N ATOM 229 CA LEU A 17 1.820 -0.491 -15.096 1.00 0.00 C ATOM 230 C LEU A 17 1.317 -0.533 -13.665 1.00 0.00 C ATOM 231 O LEU A 17 1.760 0.253 -12.836 1.00 0.00 O ATOM 232 CB LEU A 17 0.980 0.481 -15.925 1.00 0.00 C ATOM 233 CG LEU A 17 1.667 1.027 -17.179 1.00 0.00 C ATOM 234 CD1 LEU A 17 1.800 -0.047 -18.247 1.00 0.00 C ATOM 235 CD2 LEU A 17 0.908 2.223 -17.714 1.00 0.00 C ATOM 0 H LEU A 17 1.010 -2.053 -16.230 1.00 0.00 H new ATOM 0 HA LEU A 17 2.848 -0.129 -15.087 1.00 0.00 H new ATOM 0 HB2 LEU A 17 0.060 -0.022 -16.223 1.00 0.00 H new ATOM 0 HB3 LEU A 17 0.694 1.321 -15.292 1.00 0.00 H new ATOM 0 HG LEU A 17 2.672 1.345 -16.903 1.00 0.00 H new ATOM 0 HD11 LEU A 17 2.292 0.372 -19.125 1.00 0.00 H new ATOM 0 HD12 LEU A 17 2.394 -0.875 -17.859 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.810 -0.409 -18.524 1.00 0.00 H new ATOM 0 HD21 LEU A 17 1.407 2.602 -18.606 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.110 1.925 -17.967 1.00 0.00 H new ATOM 0 HD23 LEU A 17 0.879 3.005 -16.955 1.00 0.00 H new ATOM 247 N VAL A 18 0.403 -1.447 -13.370 1.00 0.00 N ATOM 248 CA VAL A 18 -0.094 -1.599 -12.008 1.00 0.00 C ATOM 249 C VAL A 18 1.066 -1.845 -11.049 1.00 0.00 C ATOM 250 O VAL A 18 1.183 -1.181 -10.019 1.00 0.00 O ATOM 251 CB VAL A 18 -1.117 -2.749 -11.892 1.00 0.00 C ATOM 252 CG1 VAL A 18 -1.532 -2.960 -10.442 1.00 0.00 C ATOM 253 CG2 VAL A 18 -2.337 -2.467 -12.750 1.00 0.00 C ATOM 0 H VAL A 18 -0.007 -2.090 -14.048 1.00 0.00 H new ATOM 0 HA VAL A 18 -0.601 -0.672 -11.742 1.00 0.00 H new ATOM 0 HB VAL A 18 -0.641 -3.661 -12.251 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -2.253 -3.775 -10.385 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.655 -3.209 -9.845 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -1.986 -2.047 -10.057 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -3.047 -3.289 -12.655 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -2.808 -1.541 -12.420 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -2.034 -2.368 -13.792 1.00 0.00 H new ATOM 263 N TRP A 19 1.943 -2.774 -11.416 1.00 0.00 N ATOM 264 CA TRP A 19 3.102 -3.087 -10.595 1.00 0.00 C ATOM 265 C TRP A 19 4.090 -1.925 -10.604 1.00 0.00 C ATOM 266 O TRP A 19 4.592 -1.529 -9.559 1.00 0.00 O ATOM 267 CB TRP A 19 3.791 -4.364 -11.094 1.00 0.00 C ATOM 268 CG TRP A 19 4.753 -4.962 -10.104 1.00 0.00 C ATOM 269 CD1 TRP A 19 5.984 -4.480 -9.750 1.00 0.00 C ATOM 270 CD2 TRP A 19 4.565 -6.165 -9.348 1.00 0.00 C ATOM 271 NE1 TRP A 19 6.565 -5.304 -8.819 1.00 0.00 N ATOM 272 CE2 TRP A 19 5.716 -6.345 -8.556 1.00 0.00 C ATOM 273 CE3 TRP A 19 3.535 -7.106 -9.263 1.00 0.00 C ATOM 274 CZ2 TRP A 19 5.862 -7.426 -7.691 1.00 0.00 C ATOM 275 CZ3 TRP A 19 3.682 -8.178 -8.405 1.00 0.00 C ATOM 276 CH2 TRP A 19 4.837 -8.330 -7.627 1.00 0.00 C ATOM 0 H TRP A 19 1.872 -3.320 -12.274 1.00 0.00 H new ATOM 0 HA TRP A 19 2.760 -3.252 -9.573 1.00 0.00 H new ATOM 0 HB2 TRP A 19 3.029 -5.104 -11.339 1.00 0.00 H new ATOM 0 HB3 TRP A 19 4.326 -4.140 -12.017 1.00 0.00 H new ATOM 0 HD1 TRP A 19 6.433 -3.581 -10.146 1.00 0.00 H new ATOM 0 HE1 TRP A 19 7.481 -5.164 -8.392 1.00 0.00 H new ATOM 0 HE3 TRP A 19 2.640 -6.997 -9.858 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 6.752 -7.547 -7.092 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 2.893 -8.912 -8.333 1.00 0.00 H new ATOM 0 HH2 TRP A 19 4.920 -9.178 -6.963 1.00 0.00 H new ATOM 287 N THR A 20 4.352 -1.362 -11.780 1.00 0.00 N ATOM 288 CA THR A 20 5.359 -0.315 -11.903 1.00 0.00 C ATOM 289 C THR A 20 4.931 0.973 -11.183 1.00 0.00 C ATOM 290 O THR A 20 5.773 1.787 -10.812 1.00 0.00 O ATOM 291 CB THR A 20 5.700 -0.015 -13.388 1.00 0.00 C ATOM 292 OG1 THR A 20 7.025 0.523 -13.492 1.00 0.00 O ATOM 293 CG2 THR A 20 4.715 0.967 -14.011 1.00 0.00 C ATOM 0 H THR A 20 3.886 -1.610 -12.653 1.00 0.00 H new ATOM 0 HA THR A 20 6.260 -0.692 -11.418 1.00 0.00 H new ATOM 0 HB THR A 20 5.634 -0.958 -13.930 1.00 0.00 H new ATOM 0 HG1 THR A 20 7.230 0.707 -14.432 1.00 0.00 H new ATOM 0 HG21 THR A 20 4.990 1.149 -15.050 1.00 0.00 H new ATOM 0 HG22 THR A 20 3.709 0.549 -13.970 1.00 0.00 H new ATOM 0 HG23 THR A 20 4.740 1.907 -13.459 1.00 0.00 H new ATOM 301 N MET A 21 3.628 1.152 -10.982 1.00 0.00 N ATOM 302 CA MET A 21 3.126 2.328 -10.271 1.00 0.00 C ATOM 303 C MET A 21 3.209 2.134 -8.760 1.00 0.00 C ATOM 304 O MET A 21 3.572 3.054 -8.029 1.00 0.00 O ATOM 305 CB MET A 21 1.684 2.644 -10.681 1.00 0.00 C ATOM 306 CG MET A 21 1.550 3.170 -12.104 1.00 0.00 C ATOM 307 SD MET A 21 2.291 4.800 -12.329 1.00 0.00 S ATOM 308 CE MET A 21 1.179 5.811 -11.350 1.00 0.00 C ATOM 0 H MET A 21 2.905 0.505 -11.297 1.00 0.00 H new ATOM 0 HA MET A 21 3.759 3.172 -10.547 1.00 0.00 H new ATOM 0 HB2 MET A 21 1.081 1.742 -10.579 1.00 0.00 H new ATOM 0 HB3 MET A 21 1.273 3.381 -9.991 1.00 0.00 H new ATOM 0 HG2 MET A 21 2.020 2.466 -12.791 1.00 0.00 H new ATOM 0 HG3 MET A 21 0.494 3.218 -12.369 1.00 0.00 H new ATOM 0 HE1 MET A 21 1.295 6.857 -11.633 1.00 0.00 H new ATOM 0 HE2 MET A 21 0.150 5.498 -11.529 1.00 0.00 H new ATOM 0 HE3 MET A 21 1.415 5.692 -10.293 1.00 0.00 H new ATOM 318 N THR A 22 2.878 0.937 -8.290 1.00 0.00 N ATOM 319 CA THR A 22 2.903 0.655 -6.863 1.00 0.00 C ATOM 320 C THR A 22 4.326 0.391 -6.376 1.00 0.00 C ATOM 321 O THR A 22 4.690 0.760 -5.257 1.00 0.00 O ATOM 322 CB THR A 22 2.006 -0.547 -6.509 1.00 0.00 C ATOM 323 OG1 THR A 22 2.344 -1.673 -7.327 1.00 0.00 O ATOM 324 CG2 THR A 22 0.535 -0.201 -6.696 1.00 0.00 C ATOM 0 H THR A 22 2.591 0.151 -8.874 1.00 0.00 H new ATOM 0 HA THR A 22 2.515 1.540 -6.359 1.00 0.00 H new ATOM 0 HB THR A 22 2.174 -0.798 -5.462 1.00 0.00 H new ATOM 0 HG1 THR A 22 1.922 -1.577 -8.206 1.00 0.00 H new ATOM 0 HG21 THR A 22 -0.078 -1.065 -6.440 1.00 0.00 H new ATOM 0 HG22 THR A 22 0.273 0.635 -6.047 1.00 0.00 H new ATOM 0 HG23 THR A 22 0.356 0.076 -7.735 1.00 0.00 H new ATOM 332 N ASN A 23 5.126 -0.246 -7.222 1.00 0.00 N ATOM 333 CA ASN A 23 6.512 -0.555 -6.888 1.00 0.00 C ATOM 334 C ASN A 23 7.349 0.715 -6.812 1.00 0.00 C ATOM 335 O ASN A 23 8.255 0.823 -5.983 1.00 0.00 O ATOM 336 CB ASN A 23 7.108 -1.512 -7.926 1.00 0.00 C ATOM 337 CG ASN A 23 8.506 -1.979 -7.572 1.00 0.00 C ATOM 338 OD1 ASN A 23 8.855 -2.112 -6.400 1.00 0.00 O ATOM 339 ND2 ASN A 23 9.315 -2.235 -8.587 1.00 0.00 N ATOM 0 H ASN A 23 4.838 -0.560 -8.149 1.00 0.00 H new ATOM 0 HA ASN A 23 6.525 -1.036 -5.910 1.00 0.00 H new ATOM 0 HB2 ASN A 23 6.456 -2.380 -8.027 1.00 0.00 H new ATOM 0 HB3 ASN A 23 7.132 -1.016 -8.897 1.00 0.00 H new ATOM 0 HD21 ASN A 23 10.267 -2.556 -8.412 1.00 0.00 H new ATOM 0 HD22 ASN A 23 8.986 -2.112 -9.545 1.00 0.00 H new ATOM 346 N ASP A 24 7.030 1.679 -7.661 1.00 0.00 N ATOM 347 CA ASP A 24 7.766 2.938 -7.702 1.00 0.00 C ATOM 348 C ASP A 24 7.347 3.819 -6.530 1.00 0.00 C ATOM 349 O ASP A 24 6.399 4.598 -6.626 1.00 0.00 O ATOM 350 CB ASP A 24 7.507 3.660 -9.026 1.00 0.00 C ATOM 351 CG ASP A 24 8.595 4.649 -9.393 1.00 0.00 C ATOM 352 OD1 ASP A 24 9.136 5.324 -8.494 1.00 0.00 O ATOM 353 OD2 ASP A 24 8.916 4.752 -10.599 1.00 0.00 O ATOM 0 H ASP A 24 6.265 1.616 -8.333 1.00 0.00 H new ATOM 0 HA ASP A 24 8.833 2.728 -7.625 1.00 0.00 H new ATOM 0 HB2 ASP A 24 7.414 2.921 -9.822 1.00 0.00 H new ATOM 0 HB3 ASP A 24 6.554 4.185 -8.965 1.00 0.00 H new ATOM 358 N ILE A 25 8.051 3.676 -5.413 1.00 0.00 N ATOM 359 CA ILE A 25 7.701 4.386 -4.189 1.00 0.00 C ATOM 360 C ILE A 25 8.033 5.868 -4.294 1.00 0.00 C ATOM 361 O ILE A 25 7.520 6.686 -3.532 1.00 0.00 O ATOM 362 CB ILE A 25 8.411 3.786 -2.958 1.00 0.00 C ATOM 363 CG1 ILE A 25 9.930 3.843 -3.119 1.00 0.00 C ATOM 364 CG2 ILE A 25 7.960 2.352 -2.735 1.00 0.00 C ATOM 365 CD1 ILE A 25 10.671 3.255 -1.941 1.00 0.00 C ATOM 0 H ILE A 25 8.870 3.073 -5.330 1.00 0.00 H new ATOM 0 HA ILE A 25 6.625 4.272 -4.059 1.00 0.00 H new ATOM 0 HB ILE A 25 8.138 4.382 -2.087 1.00 0.00 H new ATOM 0 HG12 ILE A 25 10.214 3.307 -4.024 1.00 0.00 H new ATOM 0 HG13 ILE A 25 10.237 4.880 -3.253 1.00 0.00 H new ATOM 0 HG21 ILE A 25 8.469 1.942 -1.863 1.00 0.00 H new ATOM 0 HG22 ILE A 25 6.883 2.331 -2.569 1.00 0.00 H new ATOM 0 HG23 ILE A 25 8.204 1.753 -3.613 1.00 0.00 H new ATOM 0 HD11 ILE A 25 11.745 3.325 -2.115 1.00 0.00 H new ATOM 0 HD12 ILE A 25 10.413 3.807 -1.037 1.00 0.00 H new ATOM 0 HD13 ILE A 25 10.390 2.209 -1.820 1.00 0.00 H new ATOM 377 N GLU A 26 8.863 6.210 -5.266 1.00 0.00 N ATOM 378 CA GLU A 26 9.260 7.592 -5.487 1.00 0.00 C ATOM 379 C GLU A 26 8.102 8.393 -6.069 1.00 0.00 C ATOM 380 O GLU A 26 8.150 9.620 -6.143 1.00 0.00 O ATOM 381 CB GLU A 26 10.467 7.635 -6.422 1.00 0.00 C ATOM 382 CG GLU A 26 11.701 6.967 -5.838 1.00 0.00 C ATOM 383 CD GLU A 26 12.787 6.729 -6.867 1.00 0.00 C ATOM 384 OE1 GLU A 26 12.934 7.553 -7.794 1.00 0.00 O ATOM 385 OE2 GLU A 26 13.510 5.714 -6.744 1.00 0.00 O ATOM 0 H GLU A 26 9.278 5.545 -5.919 1.00 0.00 H new ATOM 0 HA GLU A 26 9.535 8.041 -4.533 1.00 0.00 H new ATOM 0 HB2 GLU A 26 10.208 7.147 -7.362 1.00 0.00 H new ATOM 0 HB3 GLU A 26 10.700 8.674 -6.656 1.00 0.00 H new ATOM 0 HG2 GLU A 26 12.098 7.588 -5.035 1.00 0.00 H new ATOM 0 HG3 GLU A 26 11.415 6.014 -5.392 1.00 0.00 H new ATOM 392 N LYS A 27 7.047 7.687 -6.459 1.00 0.00 N ATOM 393 CA LYS A 27 5.883 8.316 -7.065 1.00 0.00 C ATOM 394 C LYS A 27 4.694 8.333 -6.111 1.00 0.00 C ATOM 395 O LYS A 27 3.633 8.855 -6.448 1.00 0.00 O ATOM 396 CB LYS A 27 5.501 7.598 -8.357 1.00 0.00 C ATOM 397 CG LYS A 27 6.489 7.817 -9.487 1.00 0.00 C ATOM 398 CD LYS A 27 6.098 7.032 -10.726 1.00 0.00 C ATOM 399 CE LYS A 27 6.984 7.380 -11.909 1.00 0.00 C ATOM 400 NZ LYS A 27 8.428 7.166 -11.620 1.00 0.00 N ATOM 0 H LYS A 27 6.975 6.674 -6.365 1.00 0.00 H new ATOM 0 HA LYS A 27 6.150 9.348 -7.292 1.00 0.00 H new ATOM 0 HB2 LYS A 27 5.419 6.529 -8.159 1.00 0.00 H new ATOM 0 HB3 LYS A 27 4.516 7.939 -8.675 1.00 0.00 H new ATOM 0 HG2 LYS A 27 6.539 8.879 -9.728 1.00 0.00 H new ATOM 0 HG3 LYS A 27 7.486 7.517 -9.164 1.00 0.00 H new ATOM 0 HD2 LYS A 27 6.169 5.964 -10.519 1.00 0.00 H new ATOM 0 HD3 LYS A 27 5.058 7.240 -10.976 1.00 0.00 H new ATOM 0 HE2 LYS A 27 6.694 6.773 -12.767 1.00 0.00 H new ATOM 0 HE3 LYS A 27 6.822 8.422 -12.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 8.975 7.253 -12.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 8.755 7.880 -10.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 8.565 6.216 -11.220 1.00 0.00 H new ATOM 414 N TRP A 28 4.882 7.780 -4.918 1.00 0.00 N ATOM 415 CA TRP A 28 3.819 7.736 -3.912 1.00 0.00 C ATOM 416 C TRP A 28 3.358 9.132 -3.466 1.00 0.00 C ATOM 417 O TRP A 28 2.171 9.321 -3.224 1.00 0.00 O ATOM 418 CB TRP A 28 4.246 6.906 -2.706 1.00 0.00 C ATOM 419 CG TRP A 28 4.268 5.432 -2.975 1.00 0.00 C ATOM 420 CD1 TRP A 28 4.030 4.806 -4.166 1.00 0.00 C ATOM 421 CD2 TRP A 28 4.536 4.396 -2.027 1.00 0.00 C ATOM 422 NE1 TRP A 28 4.139 3.446 -4.015 1.00 0.00 N ATOM 423 CE2 TRP A 28 4.448 3.169 -2.711 1.00 0.00 C ATOM 424 CE3 TRP A 28 4.846 4.388 -0.665 1.00 0.00 C ATOM 425 CZ2 TRP A 28 4.659 1.949 -2.077 1.00 0.00 C ATOM 426 CZ3 TRP A 28 5.055 3.176 -0.039 1.00 0.00 C ATOM 427 CH2 TRP A 28 4.962 1.971 -0.745 1.00 0.00 C ATOM 0 H TRP A 28 5.760 7.355 -4.621 1.00 0.00 H new ATOM 0 HA TRP A 28 2.964 7.258 -4.389 1.00 0.00 H new ATOM 0 HB2 TRP A 28 5.239 7.225 -2.388 1.00 0.00 H new ATOM 0 HB3 TRP A 28 3.567 7.106 -1.878 1.00 0.00 H new ATOM 0 HD1 TRP A 28 3.791 5.308 -5.092 1.00 0.00 H new ATOM 0 HE1 TRP A 28 4.011 2.755 -4.754 1.00 0.00 H new ATOM 0 HE3 TRP A 28 4.921 5.313 -0.112 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 4.586 1.017 -2.618 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 5.294 3.157 1.014 1.00 0.00 H new ATOM 0 HH2 TRP A 28 5.133 1.039 -0.226 1.00 0.00 H new ATOM 438 N PRO A 29 4.259 10.136 -3.324 1.00 0.00 N ATOM 439 CA PRO A 29 3.835 11.520 -3.055 1.00 0.00 C ATOM 440 C PRO A 29 2.809 12.024 -4.076 1.00 0.00 C ATOM 441 O PRO A 29 1.960 12.856 -3.759 1.00 0.00 O ATOM 442 CB PRO A 29 5.134 12.319 -3.164 1.00 0.00 C ATOM 443 CG PRO A 29 6.203 11.343 -2.821 1.00 0.00 C ATOM 444 CD PRO A 29 5.733 10.015 -3.345 1.00 0.00 C ATOM 0 HA PRO A 29 3.343 11.613 -2.087 1.00 0.00 H new ATOM 0 HB2 PRO A 29 5.270 12.720 -4.168 1.00 0.00 H new ATOM 0 HB3 PRO A 29 5.137 13.167 -2.479 1.00 0.00 H new ATOM 0 HG2 PRO A 29 7.152 11.628 -3.275 1.00 0.00 H new ATOM 0 HG3 PRO A 29 6.364 11.303 -1.744 1.00 0.00 H new ATOM 0 HD2 PRO A 29 6.106 9.826 -4.352 1.00 0.00 H new ATOM 0 HD3 PRO A 29 6.077 9.192 -2.718 1.00 0.00 H new ATOM 452 N GLY A 30 2.886 11.498 -5.295 1.00 0.00 N ATOM 453 CA GLY A 30 1.944 11.871 -6.335 1.00 0.00 C ATOM 454 C GLY A 30 0.945 10.764 -6.608 1.00 0.00 C ATOM 455 O GLY A 30 0.361 10.685 -7.691 1.00 0.00 O ATOM 0 H GLY A 30 3.588 10.816 -5.582 1.00 0.00 H new ATOM 0 HA2 GLY A 30 1.413 12.776 -6.038 1.00 0.00 H new ATOM 0 HA3 GLY A 30 2.487 12.106 -7.251 1.00 0.00 H new ATOM 459 N LEU A 31 0.767 9.902 -5.618 1.00 0.00 N ATOM 460 CA LEU A 31 -0.151 8.775 -5.715 1.00 0.00 C ATOM 461 C LEU A 31 -1.048 8.742 -4.482 1.00 0.00 C ATOM 462 O LEU A 31 -2.255 8.517 -4.574 1.00 0.00 O ATOM 463 CB LEU A 31 0.645 7.469 -5.825 1.00 0.00 C ATOM 464 CG LEU A 31 -0.174 6.214 -6.130 1.00 0.00 C ATOM 465 CD1 LEU A 31 -0.776 6.294 -7.522 1.00 0.00 C ATOM 466 CD2 LEU A 31 0.691 4.971 -5.993 1.00 0.00 C ATOM 0 H LEU A 31 1.255 9.963 -4.724 1.00 0.00 H new ATOM 0 HA LEU A 31 -0.772 8.885 -6.604 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.396 7.588 -6.606 1.00 0.00 H new ATOM 0 HB3 LEU A 31 1.180 7.312 -4.889 1.00 0.00 H new ATOM 0 HG LEU A 31 -0.989 6.150 -5.409 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -1.355 5.392 -7.720 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -1.428 7.165 -7.587 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.022 6.382 -8.259 1.00 0.00 H new ATOM 0 HD21 LEU A 31 0.094 4.086 -6.213 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.525 5.029 -6.692 1.00 0.00 H new ATOM 0 HD23 LEU A 31 1.075 4.905 -4.975 1.00 0.00 H new ATOM 478 N PHE A 32 -0.436 8.976 -3.331 1.00 0.00 N ATOM 479 CA PHE A 32 -1.148 9.046 -2.069 1.00 0.00 C ATOM 480 C PHE A 32 -1.524 10.483 -1.739 1.00 0.00 C ATOM 481 O PHE A 32 -1.313 11.396 -2.541 1.00 0.00 O ATOM 482 CB PHE A 32 -0.293 8.469 -0.942 1.00 0.00 C ATOM 483 CG PHE A 32 -0.554 7.019 -0.669 1.00 0.00 C ATOM 484 CD1 PHE A 32 -1.716 6.639 -0.023 1.00 0.00 C ATOM 485 CD2 PHE A 32 0.356 6.044 -1.043 1.00 0.00 C ATOM 486 CE1 PHE A 32 -1.972 5.313 0.246 1.00 0.00 C ATOM 487 CE2 PHE A 32 0.106 4.710 -0.775 1.00 0.00 C ATOM 488 CZ PHE A 32 -1.061 4.345 -0.129 1.00 0.00 C ATOM 0 H PHE A 32 0.570 9.123 -3.248 1.00 0.00 H new ATOM 0 HA PHE A 32 -2.060 8.457 -2.165 1.00 0.00 H new ATOM 0 HB2 PHE A 32 0.760 8.598 -1.194 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -0.475 9.039 -0.031 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -2.432 7.391 0.274 1.00 0.00 H new ATOM 0 HD2 PHE A 32 1.268 6.327 -1.548 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -2.884 5.030 0.750 1.00 0.00 H new ATOM 0 HE2 PHE A 32 0.820 3.956 -1.070 1.00 0.00 H new ATOM 0 HZ PHE A 32 -1.260 3.305 0.082 1.00 0.00 H new ATOM 498 N SER A 33 -2.079 10.675 -0.552 1.00 0.00 N ATOM 499 CA SER A 33 -2.515 11.990 -0.117 1.00 0.00 C ATOM 500 C SER A 33 -1.801 12.425 1.164 1.00 0.00 C ATOM 501 O SER A 33 -1.430 13.587 1.311 1.00 0.00 O ATOM 502 CB SER A 33 -4.025 11.973 0.111 1.00 0.00 C ATOM 503 OG SER A 33 -4.712 11.535 -1.049 1.00 0.00 O ATOM 0 H SER A 33 -2.238 9.932 0.129 1.00 0.00 H new ATOM 0 HA SER A 33 -2.263 12.708 -0.897 1.00 0.00 H new ATOM 0 HB2 SER A 33 -4.262 11.316 0.948 1.00 0.00 H new ATOM 0 HB3 SER A 33 -4.366 12.972 0.384 1.00 0.00 H new ATOM 0 HG SER A 33 -5.677 11.532 -0.876 1.00 0.00 H new ATOM 509 N GLU A 34 -1.609 11.487 2.088 1.00 0.00 N ATOM 510 CA GLU A 34 -1.036 11.806 3.393 1.00 0.00 C ATOM 511 C GLU A 34 0.489 11.767 3.362 1.00 0.00 C ATOM 512 O GLU A 34 1.153 12.458 4.134 1.00 0.00 O ATOM 513 CB GLU A 34 -1.555 10.829 4.448 1.00 0.00 C ATOM 514 CG GLU A 34 -3.069 10.780 4.532 1.00 0.00 C ATOM 515 CD GLU A 34 -3.561 9.866 5.633 1.00 0.00 C ATOM 516 OE1 GLU A 34 -3.548 10.284 6.809 1.00 0.00 O ATOM 517 OE2 GLU A 34 -3.969 8.727 5.325 1.00 0.00 O ATOM 0 H GLU A 34 -1.841 10.502 1.958 1.00 0.00 H new ATOM 0 HA GLU A 34 -1.343 12.820 3.650 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -1.179 9.831 4.224 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -1.154 11.110 5.422 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -3.453 11.786 4.701 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -3.472 10.442 3.577 1.00 0.00 H new ATOM 524 N TYR A 35 1.038 10.968 2.463 1.00 0.00 N ATOM 525 CA TYR A 35 2.481 10.793 2.389 1.00 0.00 C ATOM 526 C TYR A 35 3.086 11.838 1.468 1.00 0.00 C ATOM 527 O TYR A 35 2.901 11.790 0.252 1.00 0.00 O ATOM 528 CB TYR A 35 2.826 9.385 1.901 1.00 0.00 C ATOM 529 CG TYR A 35 2.184 8.296 2.728 1.00 0.00 C ATOM 530 CD1 TYR A 35 2.682 7.967 3.979 1.00 0.00 C ATOM 531 CD2 TYR A 35 1.076 7.607 2.261 1.00 0.00 C ATOM 532 CE1 TYR A 35 2.094 6.978 4.741 1.00 0.00 C ATOM 533 CE2 TYR A 35 0.481 6.616 3.016 1.00 0.00 C ATOM 534 CZ TYR A 35 0.995 6.306 4.257 1.00 0.00 C ATOM 535 OH TYR A 35 0.407 5.320 5.015 1.00 0.00 O ATOM 0 H TYR A 35 0.509 10.431 1.775 1.00 0.00 H new ATOM 0 HA TYR A 35 2.900 10.921 3.387 1.00 0.00 H new ATOM 0 HB2 TYR A 35 2.509 9.279 0.863 1.00 0.00 H new ATOM 0 HB3 TYR A 35 3.908 9.256 1.919 1.00 0.00 H new ATOM 0 HD1 TYR A 35 3.544 8.493 4.363 1.00 0.00 H new ATOM 0 HD2 TYR A 35 0.671 7.849 1.290 1.00 0.00 H new ATOM 0 HE1 TYR A 35 2.495 6.732 5.713 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -0.381 6.087 2.637 1.00 0.00 H new ATOM 0 HH TYR A 35 -0.358 4.946 4.529 1.00 0.00 H new ATOM 545 N ALA A 36 3.792 12.789 2.058 1.00 0.00 N ATOM 546 CA ALA A 36 4.377 13.883 1.301 1.00 0.00 C ATOM 547 C ALA A 36 5.752 13.505 0.776 1.00 0.00 C ATOM 548 O ALA A 36 6.158 13.936 -0.305 1.00 0.00 O ATOM 549 CB ALA A 36 4.465 15.127 2.167 1.00 0.00 C ATOM 0 H ALA A 36 3.974 12.825 3.061 1.00 0.00 H new ATOM 0 HA ALA A 36 3.734 14.092 0.446 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.905 15.941 1.591 1.00 0.00 H new ATOM 0 HB2 ALA A 36 3.466 15.413 2.495 1.00 0.00 H new ATOM 0 HB3 ALA A 36 5.088 14.921 3.037 1.00 0.00 H new ATOM 555 N SER A 37 6.461 12.689 1.537 1.00 0.00 N ATOM 556 CA SER A 37 7.796 12.280 1.154 1.00 0.00 C ATOM 557 C SER A 37 8.003 10.803 1.435 1.00 0.00 C ATOM 558 O SER A 37 7.515 10.266 2.434 1.00 0.00 O ATOM 559 CB SER A 37 8.842 13.108 1.903 1.00 0.00 C ATOM 560 OG SER A 37 10.140 12.912 1.361 1.00 0.00 O ATOM 0 H SER A 37 6.133 12.299 2.421 1.00 0.00 H new ATOM 0 HA SER A 37 7.912 12.450 0.084 1.00 0.00 H new ATOM 0 HB2 SER A 37 8.579 14.164 1.850 1.00 0.00 H new ATOM 0 HB3 SER A 37 8.840 12.832 2.957 1.00 0.00 H new ATOM 0 HG SER A 37 10.787 13.455 1.858 1.00 0.00 H new ATOM 566 N VAL A 38 8.721 10.158 0.536 1.00 0.00 N ATOM 567 CA VAL A 38 9.078 8.761 0.684 1.00 0.00 C ATOM 568 C VAL A 38 10.593 8.651 0.749 1.00 0.00 C ATOM 569 O VAL A 38 11.277 8.655 -0.273 1.00 0.00 O ATOM 570 CB VAL A 38 8.525 7.912 -0.482 1.00 0.00 C ATOM 571 CG1 VAL A 38 8.951 6.457 -0.367 1.00 0.00 C ATOM 572 CG2 VAL A 38 7.012 8.015 -0.529 1.00 0.00 C ATOM 0 H VAL A 38 9.074 10.589 -0.319 1.00 0.00 H new ATOM 0 HA VAL A 38 8.636 8.375 1.603 1.00 0.00 H new ATOM 0 HB VAL A 38 8.941 8.306 -1.409 1.00 0.00 H new ATOM 0 HG11 VAL A 38 8.543 5.891 -1.205 1.00 0.00 H new ATOM 0 HG12 VAL A 38 10.039 6.394 -0.382 1.00 0.00 H new ATOM 0 HG13 VAL A 38 8.577 6.041 0.568 1.00 0.00 H new ATOM 0 HG21 VAL A 38 6.632 7.413 -1.354 1.00 0.00 H new ATOM 0 HG22 VAL A 38 6.593 7.651 0.409 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.723 9.056 -0.675 1.00 0.00 H new ATOM 582 N GLU A 39 11.113 8.581 1.962 1.00 0.00 N ATOM 583 CA GLU A 39 12.546 8.642 2.168 1.00 0.00 C ATOM 584 C GLU A 39 13.135 7.245 2.241 1.00 0.00 C ATOM 585 O GLU A 39 13.024 6.557 3.253 1.00 0.00 O ATOM 586 CB GLU A 39 12.854 9.424 3.446 1.00 0.00 C ATOM 587 CG GLU A 39 14.331 9.700 3.655 1.00 0.00 C ATOM 588 CD GLU A 39 14.573 10.690 4.774 1.00 0.00 C ATOM 589 OE1 GLU A 39 14.246 11.882 4.589 1.00 0.00 O ATOM 590 OE2 GLU A 39 15.079 10.284 5.840 1.00 0.00 O ATOM 0 H GLU A 39 10.564 8.482 2.816 1.00 0.00 H new ATOM 0 HA GLU A 39 13.002 9.157 1.322 1.00 0.00 H new ATOM 0 HB2 GLU A 39 12.317 10.372 3.419 1.00 0.00 H new ATOM 0 HB3 GLU A 39 12.473 8.867 4.302 1.00 0.00 H new ATOM 0 HG2 GLU A 39 14.845 8.766 3.881 1.00 0.00 H new ATOM 0 HG3 GLU A 39 14.761 10.086 2.731 1.00 0.00 H new ATOM 597 N VAL A 40 13.736 6.820 1.142 1.00 0.00 N ATOM 598 CA VAL A 40 14.371 5.517 1.084 1.00 0.00 C ATOM 599 C VAL A 40 15.659 5.532 1.893 1.00 0.00 C ATOM 600 O VAL A 40 16.642 6.161 1.502 1.00 0.00 O ATOM 601 CB VAL A 40 14.688 5.097 -0.369 1.00 0.00 C ATOM 602 CG1 VAL A 40 15.143 3.645 -0.420 1.00 0.00 C ATOM 603 CG2 VAL A 40 13.485 5.322 -1.271 1.00 0.00 C ATOM 0 H VAL A 40 13.797 7.360 0.279 1.00 0.00 H new ATOM 0 HA VAL A 40 13.672 4.793 1.503 1.00 0.00 H new ATOM 0 HB VAL A 40 15.503 5.721 -0.735 1.00 0.00 H new ATOM 0 HG11 VAL A 40 15.361 3.368 -1.451 1.00 0.00 H new ATOM 0 HG12 VAL A 40 16.041 3.524 0.186 1.00 0.00 H new ATOM 0 HG13 VAL A 40 14.353 3.002 -0.031 1.00 0.00 H new ATOM 0 HG21 VAL A 40 13.732 5.019 -2.289 1.00 0.00 H new ATOM 0 HG22 VAL A 40 12.644 4.730 -0.910 1.00 0.00 H new ATOM 0 HG23 VAL A 40 13.216 6.378 -1.262 1.00 0.00 H new ATOM 613 N LEU A 41 15.635 4.865 3.038 1.00 0.00 N ATOM 614 CA LEU A 41 16.816 4.752 3.880 1.00 0.00 C ATOM 615 C LEU A 41 17.816 3.820 3.211 1.00 0.00 C ATOM 616 O LEU A 41 19.032 3.985 3.318 1.00 0.00 O ATOM 617 CB LEU A 41 16.431 4.217 5.264 1.00 0.00 C ATOM 618 CG LEU A 41 15.322 4.996 5.980 1.00 0.00 C ATOM 619 CD1 LEU A 41 15.024 4.374 7.334 1.00 0.00 C ATOM 620 CD2 LEU A 41 15.707 6.458 6.140 1.00 0.00 C ATOM 0 H LEU A 41 14.809 4.393 3.405 1.00 0.00 H new ATOM 0 HA LEU A 41 17.268 5.736 4.009 1.00 0.00 H new ATOM 0 HB2 LEU A 41 16.115 3.179 5.159 1.00 0.00 H new ATOM 0 HB3 LEU A 41 17.319 4.217 5.896 1.00 0.00 H new ATOM 0 HG LEU A 41 14.421 4.945 5.369 1.00 0.00 H new ATOM 0 HD11 LEU A 41 14.234 4.940 7.828 1.00 0.00 H new ATOM 0 HD12 LEU A 41 14.700 3.342 7.197 1.00 0.00 H new ATOM 0 HD13 LEU A 41 15.924 4.393 7.949 1.00 0.00 H new ATOM 0 HD21 LEU A 41 14.905 6.992 6.651 1.00 0.00 H new ATOM 0 HD22 LEU A 41 16.623 6.531 6.727 1.00 0.00 H new ATOM 0 HD23 LEU A 41 15.869 6.901 5.157 1.00 0.00 H new ATOM 632 N GLY A 42 17.275 2.847 2.501 1.00 0.00 N ATOM 633 CA GLY A 42 18.079 1.913 1.753 1.00 0.00 C ATOM 634 C GLY A 42 17.210 0.854 1.136 1.00 0.00 C ATOM 635 O GLY A 42 16.042 0.732 1.501 1.00 0.00 O ATOM 0 H GLY A 42 16.270 2.687 2.430 1.00 0.00 H new ATOM 0 HA2 GLY A 42 18.630 2.440 0.974 1.00 0.00 H new ATOM 0 HA3 GLY A 42 18.817 1.451 2.409 1.00 0.00 H new ATOM 639 N ARG A 43 17.738 0.093 0.200 1.00 0.00 N ATOM 640 CA ARG A 43 16.945 -0.954 -0.415 1.00 0.00 C ATOM 641 C ARG A 43 17.812 -2.083 -0.939 1.00 0.00 C ATOM 642 O ARG A 43 18.869 -1.863 -1.532 1.00 0.00 O ATOM 643 CB ARG A 43 16.047 -0.393 -1.525 1.00 0.00 C ATOM 644 CG ARG A 43 16.781 0.172 -2.731 1.00 0.00 C ATOM 645 CD ARG A 43 15.797 0.779 -3.717 1.00 0.00 C ATOM 646 NE ARG A 43 16.420 1.126 -4.991 1.00 0.00 N ATOM 647 CZ ARG A 43 16.060 2.170 -5.735 1.00 0.00 C ATOM 648 NH1 ARG A 43 15.128 3.010 -5.302 1.00 0.00 N ATOM 649 NH2 ARG A 43 16.639 2.384 -6.908 1.00 0.00 N ATOM 0 H ARG A 43 18.694 0.175 -0.147 1.00 0.00 H new ATOM 0 HA ARG A 43 16.303 -1.368 0.362 1.00 0.00 H new ATOM 0 HB2 ARG A 43 15.380 -1.185 -1.865 1.00 0.00 H new ATOM 0 HB3 ARG A 43 15.421 0.392 -1.101 1.00 0.00 H new ATOM 0 HG2 ARG A 43 17.495 0.930 -2.408 1.00 0.00 H new ATOM 0 HG3 ARG A 43 17.353 -0.617 -3.219 1.00 0.00 H new ATOM 0 HD2 ARG A 43 14.985 0.074 -3.894 1.00 0.00 H new ATOM 0 HD3 ARG A 43 15.354 1.673 -3.278 1.00 0.00 H new ATOM 0 HE ARG A 43 17.177 0.533 -5.332 1.00 0.00 H new ATOM 0 HH11 ARG A 43 14.685 2.857 -4.396 1.00 0.00 H new ATOM 0 HH12 ARG A 43 14.855 3.809 -5.875 1.00 0.00 H new ATOM 0 HH21 ARG A 43 17.363 1.748 -7.243 1.00 0.00 H new ATOM 0 HH22 ARG A 43 16.361 3.185 -7.475 1.00 0.00 H new ATOM 663 N ASP A 44 17.359 -3.290 -0.673 1.00 0.00 N ATOM 664 CA ASP A 44 17.999 -4.497 -1.152 1.00 0.00 C ATOM 665 C ASP A 44 17.333 -4.933 -2.446 1.00 0.00 C ATOM 666 O ASP A 44 16.309 -4.364 -2.832 1.00 0.00 O ATOM 667 CB ASP A 44 17.877 -5.606 -0.105 1.00 0.00 C ATOM 668 CG ASP A 44 18.554 -5.257 1.207 1.00 0.00 C ATOM 669 OD1 ASP A 44 17.960 -4.505 2.011 1.00 0.00 O ATOM 670 OD2 ASP A 44 19.677 -5.748 1.446 1.00 0.00 O ATOM 0 H ASP A 44 16.525 -3.463 -0.111 1.00 0.00 H new ATOM 0 HA ASP A 44 19.056 -4.301 -1.332 1.00 0.00 H new ATOM 0 HB2 ASP A 44 16.822 -5.810 0.079 1.00 0.00 H new ATOM 0 HB3 ASP A 44 18.314 -6.522 -0.501 1.00 0.00 H new ATOM 675 N ASP A 45 17.886 -5.958 -3.087 1.00 0.00 N ATOM 676 CA ASP A 45 17.399 -6.420 -4.392 1.00 0.00 C ATOM 677 C ASP A 45 15.896 -6.687 -4.382 1.00 0.00 C ATOM 678 O ASP A 45 15.215 -6.454 -5.379 1.00 0.00 O ATOM 679 CB ASP A 45 18.143 -7.683 -4.846 1.00 0.00 C ATOM 680 CG ASP A 45 19.578 -7.406 -5.249 1.00 0.00 C ATOM 681 OD1 ASP A 45 19.794 -6.789 -6.308 1.00 0.00 O ATOM 682 OD2 ASP A 45 20.500 -7.802 -4.503 1.00 0.00 O ATOM 0 H ASP A 45 18.677 -6.491 -2.725 1.00 0.00 H new ATOM 0 HA ASP A 45 17.597 -5.615 -5.099 1.00 0.00 H new ATOM 0 HB2 ASP A 45 18.132 -8.416 -4.039 1.00 0.00 H new ATOM 0 HB3 ASP A 45 17.613 -8.128 -5.688 1.00 0.00 H new ATOM 687 N ASP A 46 15.379 -7.167 -3.261 1.00 0.00 N ATOM 688 CA ASP A 46 13.950 -7.450 -3.147 1.00 0.00 C ATOM 689 C ASP A 46 13.359 -6.847 -1.875 1.00 0.00 C ATOM 690 O ASP A 46 12.182 -7.045 -1.576 1.00 0.00 O ATOM 691 CB ASP A 46 13.697 -8.964 -3.166 1.00 0.00 C ATOM 692 CG ASP A 46 14.352 -9.690 -2.005 1.00 0.00 C ATOM 693 OD1 ASP A 46 15.548 -10.035 -2.113 1.00 0.00 O ATOM 694 OD2 ASP A 46 13.681 -9.932 -0.985 1.00 0.00 O ATOM 0 H ASP A 46 15.921 -7.369 -2.421 1.00 0.00 H new ATOM 0 HA ASP A 46 13.458 -6.991 -4.005 1.00 0.00 H new ATOM 0 HB2 ASP A 46 12.623 -9.147 -3.142 1.00 0.00 H new ATOM 0 HB3 ASP A 46 14.070 -9.377 -4.103 1.00 0.00 H new ATOM 699 N LYS A 47 14.159 -6.076 -1.146 1.00 0.00 N ATOM 700 CA LYS A 47 13.737 -5.574 0.162 1.00 0.00 C ATOM 701 C LYS A 47 14.005 -4.081 0.290 1.00 0.00 C ATOM 702 O LYS A 47 15.114 -3.669 0.610 1.00 0.00 O ATOM 703 CB LYS A 47 14.470 -6.323 1.281 1.00 0.00 C ATOM 704 CG LYS A 47 14.231 -7.822 1.278 1.00 0.00 C ATOM 705 CD LYS A 47 15.047 -8.518 2.353 1.00 0.00 C ATOM 706 CE LYS A 47 14.847 -10.026 2.317 1.00 0.00 C ATOM 707 NZ LYS A 47 15.286 -10.619 1.023 1.00 0.00 N ATOM 0 H LYS A 47 15.094 -5.786 -1.432 1.00 0.00 H new ATOM 0 HA LYS A 47 12.664 -5.744 0.253 1.00 0.00 H new ATOM 0 HB2 LYS A 47 15.540 -6.136 1.190 1.00 0.00 H new ATOM 0 HB3 LYS A 47 14.156 -5.917 2.243 1.00 0.00 H new ATOM 0 HG2 LYS A 47 13.172 -8.023 1.437 1.00 0.00 H new ATOM 0 HG3 LYS A 47 14.490 -8.231 0.301 1.00 0.00 H new ATOM 0 HD2 LYS A 47 16.103 -8.287 2.216 1.00 0.00 H new ATOM 0 HD3 LYS A 47 14.761 -8.135 3.333 1.00 0.00 H new ATOM 0 HE2 LYS A 47 15.405 -10.485 3.133 1.00 0.00 H new ATOM 0 HE3 LYS A 47 13.794 -10.256 2.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 15.569 -11.609 1.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 14.502 -10.583 0.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 16.094 -10.081 0.651 1.00 0.00 H new ATOM 721 N VAL A 48 12.994 -3.269 0.048 1.00 0.00 N ATOM 722 CA VAL A 48 13.167 -1.826 0.104 1.00 0.00 C ATOM 723 C VAL A 48 12.761 -1.277 1.473 1.00 0.00 C ATOM 724 O VAL A 48 11.649 -1.512 1.949 1.00 0.00 O ATOM 725 CB VAL A 48 12.391 -1.105 -1.026 1.00 0.00 C ATOM 726 CG1 VAL A 48 10.912 -1.458 -1.004 1.00 0.00 C ATOM 727 CG2 VAL A 48 12.585 0.403 -0.935 1.00 0.00 C ATOM 0 H VAL A 48 12.051 -3.578 -0.188 1.00 0.00 H new ATOM 0 HA VAL A 48 14.227 -1.625 -0.048 1.00 0.00 H new ATOM 0 HB VAL A 48 12.798 -1.451 -1.976 1.00 0.00 H new ATOM 0 HG11 VAL A 48 10.401 -0.933 -1.811 1.00 0.00 H new ATOM 0 HG12 VAL A 48 10.793 -2.533 -1.137 1.00 0.00 H new ATOM 0 HG13 VAL A 48 10.481 -1.161 -0.048 1.00 0.00 H new ATOM 0 HG21 VAL A 48 12.032 0.890 -1.738 1.00 0.00 H new ATOM 0 HG22 VAL A 48 12.218 0.760 0.027 1.00 0.00 H new ATOM 0 HG23 VAL A 48 13.645 0.640 -1.029 1.00 0.00 H new ATOM 737 N THR A 49 13.683 -0.571 2.109 1.00 0.00 N ATOM 738 CA THR A 49 13.430 0.040 3.401 1.00 0.00 C ATOM 739 C THR A 49 13.215 1.542 3.236 1.00 0.00 C ATOM 740 O THR A 49 14.170 2.306 3.076 1.00 0.00 O ATOM 741 CB THR A 49 14.603 -0.199 4.371 1.00 0.00 C ATOM 742 OG1 THR A 49 15.024 -1.570 4.305 1.00 0.00 O ATOM 743 CG2 THR A 49 14.200 0.139 5.796 1.00 0.00 C ATOM 0 H THR A 49 14.622 -0.407 1.745 1.00 0.00 H new ATOM 0 HA THR A 49 12.534 -0.420 3.817 1.00 0.00 H new ATOM 0 HB THR A 49 15.427 0.450 4.076 1.00 0.00 H new ATOM 0 HG1 THR A 49 15.771 -1.713 4.923 1.00 0.00 H new ATOM 0 HG21 THR A 49 15.043 -0.037 6.464 1.00 0.00 H new ATOM 0 HG22 THR A 49 13.905 1.187 5.852 1.00 0.00 H new ATOM 0 HG23 THR A 49 13.362 -0.490 6.096 1.00 0.00 H new ATOM 751 N PHE A 50 11.965 1.958 3.255 1.00 0.00 N ATOM 752 CA PHE A 50 11.630 3.357 3.057 1.00 0.00 C ATOM 753 C PHE A 50 10.932 3.917 4.284 1.00 0.00 C ATOM 754 O PHE A 50 10.308 3.180 5.046 1.00 0.00 O ATOM 755 CB PHE A 50 10.742 3.526 1.818 1.00 0.00 C ATOM 756 CG PHE A 50 9.507 2.668 1.833 1.00 0.00 C ATOM 757 CD1 PHE A 50 8.353 3.094 2.471 1.00 0.00 C ATOM 758 CD2 PHE A 50 9.502 1.433 1.207 1.00 0.00 C ATOM 759 CE1 PHE A 50 7.222 2.302 2.489 1.00 0.00 C ATOM 760 CE2 PHE A 50 8.374 0.638 1.222 1.00 0.00 C ATOM 761 CZ PHE A 50 7.232 1.073 1.862 1.00 0.00 C ATOM 0 H PHE A 50 11.162 1.348 3.406 1.00 0.00 H new ATOM 0 HA PHE A 50 12.555 3.912 2.901 1.00 0.00 H new ATOM 0 HB2 PHE A 50 10.445 4.572 1.735 1.00 0.00 H new ATOM 0 HB3 PHE A 50 11.326 3.289 0.929 1.00 0.00 H new ATOM 0 HD1 PHE A 50 8.338 4.057 2.960 1.00 0.00 H new ATOM 0 HD2 PHE A 50 10.391 1.088 0.701 1.00 0.00 H new ATOM 0 HE1 PHE A 50 6.330 2.644 2.993 1.00 0.00 H new ATOM 0 HE2 PHE A 50 8.385 -0.325 0.733 1.00 0.00 H new ATOM 0 HZ PHE A 50 6.348 0.453 1.872 1.00 0.00 H new ATOM 771 N ARG A 51 11.057 5.212 4.485 1.00 0.00 N ATOM 772 CA ARG A 51 10.372 5.870 5.574 1.00 0.00 C ATOM 773 C ARG A 51 9.292 6.793 5.024 1.00 0.00 C ATOM 774 O ARG A 51 9.577 7.699 4.237 1.00 0.00 O ATOM 775 CB ARG A 51 11.362 6.648 6.437 1.00 0.00 C ATOM 776 CG ARG A 51 10.837 6.923 7.830 1.00 0.00 C ATOM 777 CD ARG A 51 11.908 7.499 8.733 1.00 0.00 C ATOM 778 NE ARG A 51 11.516 7.424 10.139 1.00 0.00 N ATOM 779 CZ ARG A 51 12.258 7.855 11.152 1.00 0.00 C ATOM 780 NH1 ARG A 51 13.412 8.476 10.927 1.00 0.00 N ATOM 781 NH2 ARG A 51 11.832 7.673 12.396 1.00 0.00 N ATOM 0 H ARG A 51 11.628 5.829 3.907 1.00 0.00 H new ATOM 0 HA ARG A 51 9.899 5.115 6.202 1.00 0.00 H new ATOM 0 HB2 ARG A 51 12.293 6.086 6.509 1.00 0.00 H new ATOM 0 HB3 ARG A 51 11.597 7.594 5.949 1.00 0.00 H new ATOM 0 HG2 ARG A 51 9.999 7.618 7.772 1.00 0.00 H new ATOM 0 HG3 ARG A 51 10.455 5.999 8.263 1.00 0.00 H new ATOM 0 HD2 ARG A 51 12.842 6.957 8.584 1.00 0.00 H new ATOM 0 HD3 ARG A 51 12.096 8.538 8.461 1.00 0.00 H new ATOM 0 HE ARG A 51 10.609 7.012 10.357 1.00 0.00 H new ATOM 0 HH11 ARG A 51 13.733 8.624 9.970 1.00 0.00 H new ATOM 0 HH12 ARG A 51 13.976 8.804 11.711 1.00 0.00 H new ATOM 0 HH21 ARG A 51 10.942 7.206 12.567 1.00 0.00 H new ATOM 0 HH22 ARG A 51 12.395 8.001 13.181 1.00 0.00 H new ATOM 795 N LEU A 52 8.056 6.542 5.423 1.00 0.00 N ATOM 796 CA LEU A 52 6.917 7.303 4.926 1.00 0.00 C ATOM 797 C LEU A 52 6.685 8.540 5.775 1.00 0.00 C ATOM 798 O LEU A 52 6.240 8.444 6.917 1.00 0.00 O ATOM 799 CB LEU A 52 5.665 6.427 4.913 1.00 0.00 C ATOM 800 CG LEU A 52 5.641 5.350 3.828 1.00 0.00 C ATOM 801 CD1 LEU A 52 4.479 4.393 4.045 1.00 0.00 C ATOM 802 CD2 LEU A 52 5.550 5.995 2.455 1.00 0.00 C ATOM 0 H LEU A 52 7.813 5.813 6.094 1.00 0.00 H new ATOM 0 HA LEU A 52 7.135 7.624 3.907 1.00 0.00 H new ATOM 0 HB2 LEU A 52 5.568 5.944 5.885 1.00 0.00 H new ATOM 0 HB3 LEU A 52 4.793 7.068 4.787 1.00 0.00 H new ATOM 0 HG LEU A 52 6.567 4.778 3.887 1.00 0.00 H new ATOM 0 HD11 LEU A 52 4.481 3.635 3.262 1.00 0.00 H new ATOM 0 HD12 LEU A 52 4.582 3.911 5.017 1.00 0.00 H new ATOM 0 HD13 LEU A 52 3.541 4.947 4.012 1.00 0.00 H new ATOM 0 HD21 LEU A 52 5.534 5.220 1.689 1.00 0.00 H new ATOM 0 HD22 LEU A 52 4.637 6.588 2.391 1.00 0.00 H new ATOM 0 HD23 LEU A 52 6.414 6.641 2.299 1.00 0.00 H new ATOM 814 N THR A 53 6.991 9.698 5.210 1.00 0.00 N ATOM 815 CA THR A 53 6.897 10.951 5.937 1.00 0.00 C ATOM 816 C THR A 53 5.587 11.680 5.637 1.00 0.00 C ATOM 817 O THR A 53 5.311 12.054 4.491 1.00 0.00 O ATOM 818 CB THR A 53 8.087 11.870 5.592 1.00 0.00 C ATOM 819 OG1 THR A 53 9.319 11.171 5.821 1.00 0.00 O ATOM 820 CG2 THR A 53 8.063 13.140 6.431 1.00 0.00 C ATOM 0 H THR A 53 7.308 9.794 4.245 1.00 0.00 H new ATOM 0 HA THR A 53 6.921 10.709 7.000 1.00 0.00 H new ATOM 0 HB THR A 53 8.007 12.150 4.542 1.00 0.00 H new ATOM 0 HG1 THR A 53 10.073 11.756 5.600 1.00 0.00 H new ATOM 0 HG21 THR A 53 8.914 13.768 6.165 1.00 0.00 H new ATOM 0 HG22 THR A 53 7.138 13.684 6.241 1.00 0.00 H new ATOM 0 HG23 THR A 53 8.120 12.879 7.488 1.00 0.00 H new ATOM 828 N MET A 54 4.781 11.857 6.674 1.00 0.00 N ATOM 829 CA MET A 54 3.564 12.649 6.584 1.00 0.00 C ATOM 830 C MET A 54 3.850 14.079 7.025 1.00 0.00 C ATOM 831 O MET A 54 5.005 14.505 7.071 1.00 0.00 O ATOM 832 CB MET A 54 2.462 12.053 7.465 1.00 0.00 C ATOM 833 CG MET A 54 1.968 10.692 7.010 1.00 0.00 C ATOM 834 SD MET A 54 0.559 10.117 7.977 1.00 0.00 S ATOM 835 CE MET A 54 0.124 8.627 7.086 1.00 0.00 C ATOM 0 H MET A 54 4.951 11.458 7.597 1.00 0.00 H new ATOM 0 HA MET A 54 3.223 12.643 5.549 1.00 0.00 H new ATOM 0 HB2 MET A 54 2.835 11.969 8.486 1.00 0.00 H new ATOM 0 HB3 MET A 54 1.619 12.743 7.489 1.00 0.00 H new ATOM 0 HG2 MET A 54 1.687 10.743 5.958 1.00 0.00 H new ATOM 0 HG3 MET A 54 2.779 9.968 7.089 1.00 0.00 H new ATOM 0 HE1 MET A 54 -0.688 8.117 7.604 1.00 0.00 H new ATOM 0 HE2 MET A 54 -0.196 8.887 6.077 1.00 0.00 H new ATOM 0 HE3 MET A 54 0.991 7.968 7.033 1.00 0.00 H new ATOM 845 N HIS A 55 2.801 14.815 7.353 1.00 0.00 N ATOM 846 CA HIS A 55 2.950 16.180 7.830 1.00 0.00 C ATOM 847 C HIS A 55 2.797 16.208 9.348 1.00 0.00 C ATOM 848 O HIS A 55 2.260 15.264 9.929 1.00 0.00 O ATOM 849 CB HIS A 55 1.916 17.097 7.165 1.00 0.00 C ATOM 850 CG HIS A 55 2.101 17.235 5.683 1.00 0.00 C ATOM 851 ND1 HIS A 55 2.884 18.212 5.109 1.00 0.00 N ATOM 852 CD2 HIS A 55 1.597 16.509 4.657 1.00 0.00 C ATOM 853 CE1 HIS A 55 2.854 18.082 3.794 1.00 0.00 C ATOM 854 NE2 HIS A 55 2.081 17.057 3.495 1.00 0.00 N ATOM 0 H HIS A 55 1.836 14.490 7.298 1.00 0.00 H new ATOM 0 HA HIS A 55 3.943 16.545 7.566 1.00 0.00 H new ATOM 0 HB2 HIS A 55 0.917 16.708 7.363 1.00 0.00 H new ATOM 0 HB3 HIS A 55 1.971 18.085 7.623 1.00 0.00 H new ATOM 0 HD1 HIS A 55 3.406 18.925 5.619 1.00 0.00 H new ATOM 0 HD2 HIS A 55 0.937 15.658 4.738 1.00 0.00 H new ATOM 0 HE1 HIS A 55 3.374 18.709 3.085 1.00 0.00 H new ATOM 863 N PRO A 56 3.303 17.263 10.014 1.00 0.00 N ATOM 864 CA PRO A 56 3.171 17.419 11.468 1.00 0.00 C ATOM 865 C PRO A 56 1.722 17.288 11.938 1.00 0.00 C ATOM 866 O PRO A 56 0.859 18.089 11.573 1.00 0.00 O ATOM 867 CB PRO A 56 3.698 18.831 11.727 1.00 0.00 C ATOM 868 CG PRO A 56 4.635 19.092 10.601 1.00 0.00 C ATOM 869 CD PRO A 56 4.059 18.376 9.412 1.00 0.00 C ATOM 0 HA PRO A 56 3.714 16.645 12.011 1.00 0.00 H new ATOM 0 HB2 PRO A 56 2.888 19.560 11.746 1.00 0.00 H new ATOM 0 HB3 PRO A 56 4.206 18.895 12.689 1.00 0.00 H new ATOM 0 HG2 PRO A 56 4.725 20.161 10.407 1.00 0.00 H new ATOM 0 HG3 PRO A 56 5.635 18.725 10.832 1.00 0.00 H new ATOM 0 HD2 PRO A 56 3.413 19.029 8.825 1.00 0.00 H new ATOM 0 HD3 PRO A 56 4.841 18.015 8.743 1.00 0.00 H new ATOM 877 N ASP A 57 1.469 16.260 12.737 1.00 0.00 N ATOM 878 CA ASP A 57 0.133 15.975 13.241 1.00 0.00 C ATOM 879 C ASP A 57 -0.200 16.915 14.404 1.00 0.00 C ATOM 880 O ASP A 57 0.580 17.812 14.717 1.00 0.00 O ATOM 881 CB ASP A 57 0.059 14.507 13.683 1.00 0.00 C ATOM 882 CG ASP A 57 -1.362 13.986 13.786 1.00 0.00 C ATOM 883 OD1 ASP A 57 -1.898 13.493 12.773 1.00 0.00 O ATOM 884 OD2 ASP A 57 -1.949 14.063 14.883 1.00 0.00 O ATOM 0 H ASP A 57 2.182 15.602 13.053 1.00 0.00 H new ATOM 0 HA ASP A 57 -0.601 16.141 12.452 1.00 0.00 H new ATOM 0 HB2 ASP A 57 0.614 13.892 12.974 1.00 0.00 H new ATOM 0 HB3 ASP A 57 0.550 14.400 14.651 1.00 0.00 H new ATOM 889 N ALA A 58 -1.335 16.693 15.055 1.00 0.00 N ATOM 890 CA ALA A 58 -1.815 17.587 16.107 1.00 0.00 C ATOM 891 C ALA A 58 -0.852 17.630 17.290 1.00 0.00 C ATOM 892 O ALA A 58 -0.728 18.649 17.967 1.00 0.00 O ATOM 893 CB ALA A 58 -3.195 17.154 16.569 1.00 0.00 C ATOM 0 H ALA A 58 -1.946 15.896 14.873 1.00 0.00 H new ATOM 0 HA ALA A 58 -1.874 18.593 15.691 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -3.544 17.826 17.353 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -3.887 17.187 15.728 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -3.146 16.137 16.959 1.00 0.00 H new ATOM 899 N ASP A 59 -0.166 16.521 17.523 1.00 0.00 N ATOM 900 CA ASP A 59 0.800 16.422 18.614 1.00 0.00 C ATOM 901 C ASP A 59 2.088 17.167 18.290 1.00 0.00 C ATOM 902 O ASP A 59 2.977 17.286 19.132 1.00 0.00 O ATOM 903 CB ASP A 59 1.136 14.955 18.894 1.00 0.00 C ATOM 904 CG ASP A 59 -0.024 14.184 19.484 1.00 0.00 C ATOM 905 OD1 ASP A 59 -0.999 13.917 18.757 1.00 0.00 O ATOM 906 OD2 ASP A 59 0.046 13.821 20.675 1.00 0.00 O ATOM 0 H ASP A 59 -0.260 15.670 16.969 1.00 0.00 H new ATOM 0 HA ASP A 59 0.343 16.876 19.493 1.00 0.00 H new ATOM 0 HB2 ASP A 59 1.448 14.476 17.966 1.00 0.00 H new ATOM 0 HB3 ASP A 59 1.983 14.906 19.579 1.00 0.00 H new ATOM 911 N GLY A 60 2.193 17.661 17.064 1.00 0.00 N ATOM 912 CA GLY A 60 3.430 18.263 16.609 1.00 0.00 C ATOM 913 C GLY A 60 4.388 17.214 16.086 1.00 0.00 C ATOM 914 O GLY A 60 5.509 17.516 15.675 1.00 0.00 O ATOM 0 H GLY A 60 1.441 17.655 16.375 1.00 0.00 H new ATOM 0 HA2 GLY A 60 3.217 18.989 15.824 1.00 0.00 H new ATOM 0 HA3 GLY A 60 3.896 18.808 17.430 1.00 0.00 H new ATOM 918 N LYS A 61 3.930 15.971 16.113 1.00 0.00 N ATOM 919 CA LYS A 61 4.705 14.844 15.623 1.00 0.00 C ATOM 920 C LYS A 61 4.664 14.787 14.108 1.00 0.00 C ATOM 921 O LYS A 61 3.589 14.775 13.513 1.00 0.00 O ATOM 922 CB LYS A 61 4.151 13.528 16.177 1.00 0.00 C ATOM 923 CG LYS A 61 4.461 13.274 17.641 1.00 0.00 C ATOM 924 CD LYS A 61 3.832 11.969 18.107 1.00 0.00 C ATOM 925 CE LYS A 61 4.425 11.494 19.422 1.00 0.00 C ATOM 926 NZ LYS A 61 5.850 11.093 19.273 1.00 0.00 N ATOM 0 H LYS A 61 3.011 15.717 16.475 1.00 0.00 H new ATOM 0 HA LYS A 61 5.734 14.979 15.958 1.00 0.00 H new ATOM 0 HB2 LYS A 61 3.069 13.520 16.042 1.00 0.00 H new ATOM 0 HB3 LYS A 61 4.552 12.704 15.587 1.00 0.00 H new ATOM 0 HG2 LYS A 61 5.540 13.236 17.788 1.00 0.00 H new ATOM 0 HG3 LYS A 61 4.086 14.100 18.246 1.00 0.00 H new ATOM 0 HD2 LYS A 61 2.757 12.105 18.221 1.00 0.00 H new ATOM 0 HD3 LYS A 61 3.977 11.203 17.345 1.00 0.00 H new ATOM 0 HE2 LYS A 61 4.347 12.289 20.164 1.00 0.00 H new ATOM 0 HE3 LYS A 61 3.847 10.649 19.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 6.121 10.475 20.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 5.975 10.582 18.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 6.451 11.941 19.275 1.00 0.00 H new ATOM 940 N VAL A 62 5.825 14.760 13.486 1.00 0.00 N ATOM 941 CA VAL A 62 5.901 14.517 12.059 1.00 0.00 C ATOM 942 C VAL A 62 5.938 13.013 11.829 1.00 0.00 C ATOM 943 O VAL A 62 6.978 12.379 12.002 1.00 0.00 O ATOM 944 CB VAL A 62 7.143 15.179 11.426 1.00 0.00 C ATOM 945 CG1 VAL A 62 7.133 15.010 9.914 1.00 0.00 C ATOM 946 CG2 VAL A 62 7.211 16.652 11.802 1.00 0.00 C ATOM 0 H VAL A 62 6.726 14.903 13.943 1.00 0.00 H new ATOM 0 HA VAL A 62 5.026 14.958 11.582 1.00 0.00 H new ATOM 0 HB VAL A 62 8.032 14.683 11.816 1.00 0.00 H new ATOM 0 HG11 VAL A 62 8.018 15.484 9.489 1.00 0.00 H new ATOM 0 HG12 VAL A 62 7.136 13.948 9.667 1.00 0.00 H new ATOM 0 HG13 VAL A 62 6.238 15.476 9.502 1.00 0.00 H new ATOM 0 HG21 VAL A 62 8.093 17.103 11.347 1.00 0.00 H new ATOM 0 HG22 VAL A 62 6.317 17.161 11.443 1.00 0.00 H new ATOM 0 HG23 VAL A 62 7.272 16.748 12.886 1.00 0.00 H new ATOM 956 N TRP A 63 4.792 12.443 11.483 1.00 0.00 N ATOM 957 CA TRP A 63 4.661 10.999 11.381 1.00 0.00 C ATOM 958 C TRP A 63 5.421 10.461 10.184 1.00 0.00 C ATOM 959 O TRP A 63 4.958 10.517 9.048 1.00 0.00 O ATOM 960 CB TRP A 63 3.188 10.587 11.330 1.00 0.00 C ATOM 961 CG TRP A 63 2.513 10.684 12.666 1.00 0.00 C ATOM 962 CD1 TRP A 63 2.557 11.740 13.527 1.00 0.00 C ATOM 963 CD2 TRP A 63 1.700 9.688 13.296 1.00 0.00 C ATOM 964 NE1 TRP A 63 1.825 11.462 14.656 1.00 0.00 N ATOM 965 CE2 TRP A 63 1.288 10.209 14.537 1.00 0.00 C ATOM 966 CE3 TRP A 63 1.280 8.407 12.935 1.00 0.00 C ATOM 967 CZ2 TRP A 63 0.478 9.494 15.414 1.00 0.00 C ATOM 968 CZ3 TRP A 63 0.475 7.698 13.806 1.00 0.00 C ATOM 969 CH2 TRP A 63 0.081 8.244 15.032 1.00 0.00 C ATOM 0 H TRP A 63 3.940 12.960 11.268 1.00 0.00 H new ATOM 0 HA TRP A 63 5.102 10.560 12.276 1.00 0.00 H new ATOM 0 HB2 TRP A 63 2.662 11.220 10.615 1.00 0.00 H new ATOM 0 HB3 TRP A 63 3.114 9.563 10.964 1.00 0.00 H new ATOM 0 HD1 TRP A 63 3.090 12.662 13.348 1.00 0.00 H new ATOM 0 HE1 TRP A 63 1.702 12.087 15.452 1.00 0.00 H new ATOM 0 HE3 TRP A 63 1.579 7.977 11.991 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 0.174 9.912 16.362 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 0.145 6.706 13.536 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -0.550 7.665 15.690 1.00 0.00 H new ATOM 980 N SER A 64 6.613 9.977 10.462 1.00 0.00 N ATOM 981 CA SER A 64 7.460 9.373 9.457 1.00 0.00 C ATOM 982 C SER A 64 7.914 8.007 9.951 1.00 0.00 C ATOM 983 O SER A 64 8.800 7.910 10.797 1.00 0.00 O ATOM 984 CB SER A 64 8.662 10.281 9.171 1.00 0.00 C ATOM 985 OG SER A 64 9.481 9.758 8.140 1.00 0.00 O ATOM 0 H SER A 64 7.023 9.992 11.396 1.00 0.00 H new ATOM 0 HA SER A 64 6.905 9.248 8.527 1.00 0.00 H new ATOM 0 HB2 SER A 64 8.309 11.273 8.888 1.00 0.00 H new ATOM 0 HB3 SER A 64 9.252 10.400 10.080 1.00 0.00 H new ATOM 0 HG SER A 64 9.368 10.295 7.328 1.00 0.00 H new ATOM 991 N TRP A 65 7.282 6.954 9.449 1.00 0.00 N ATOM 992 CA TRP A 65 7.557 5.613 9.945 1.00 0.00 C ATOM 993 C TRP A 65 8.357 4.780 8.948 1.00 0.00 C ATOM 994 O TRP A 65 8.103 4.801 7.742 1.00 0.00 O ATOM 995 CB TRP A 65 6.260 4.891 10.339 1.00 0.00 C ATOM 996 CG TRP A 65 5.149 4.971 9.326 1.00 0.00 C ATOM 997 CD1 TRP A 65 5.203 4.634 8.005 1.00 0.00 C ATOM 998 CD2 TRP A 65 3.801 5.385 9.575 1.00 0.00 C ATOM 999 NE1 TRP A 65 3.978 4.831 7.416 1.00 0.00 N ATOM 1000 CE2 TRP A 65 3.100 5.290 8.358 1.00 0.00 C ATOM 1001 CE3 TRP A 65 3.119 5.833 10.708 1.00 0.00 C ATOM 1002 CZ2 TRP A 65 1.754 5.624 8.245 1.00 0.00 C ATOM 1003 CZ3 TRP A 65 1.782 6.162 10.595 1.00 0.00 C ATOM 1004 CH2 TRP A 65 1.113 6.055 9.371 1.00 0.00 C ATOM 0 H TRP A 65 6.583 7.001 8.707 1.00 0.00 H new ATOM 0 HA TRP A 65 8.173 5.728 10.837 1.00 0.00 H new ATOM 0 HB2 TRP A 65 6.489 3.841 10.522 1.00 0.00 H new ATOM 0 HB3 TRP A 65 5.902 5.308 11.280 1.00 0.00 H new ATOM 0 HD1 TRP A 65 6.082 4.266 7.496 1.00 0.00 H new ATOM 0 HE1 TRP A 65 3.759 4.662 6.434 1.00 0.00 H new ATOM 0 HE3 TRP A 65 3.628 5.921 11.656 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 1.235 5.545 7.301 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 1.245 6.507 11.466 1.00 0.00 H new ATOM 0 HH2 TRP A 65 0.067 6.319 9.315 1.00 0.00 H new ATOM 1015 N VAL A 66 9.345 4.067 9.468 1.00 0.00 N ATOM 1016 CA VAL A 66 10.145 3.153 8.669 1.00 0.00 C ATOM 1017 C VAL A 66 9.337 1.911 8.312 1.00 0.00 C ATOM 1018 O VAL A 66 8.772 1.252 9.189 1.00 0.00 O ATOM 1019 CB VAL A 66 11.425 2.722 9.419 1.00 0.00 C ATOM 1020 CG1 VAL A 66 12.287 1.819 8.552 1.00 0.00 C ATOM 1021 CG2 VAL A 66 12.215 3.937 9.873 1.00 0.00 C ATOM 0 H VAL A 66 9.613 4.106 10.451 1.00 0.00 H new ATOM 0 HA VAL A 66 10.431 3.681 7.760 1.00 0.00 H new ATOM 0 HB VAL A 66 11.123 2.157 10.301 1.00 0.00 H new ATOM 0 HG11 VAL A 66 13.181 1.530 9.104 1.00 0.00 H new ATOM 0 HG12 VAL A 66 11.723 0.926 8.283 1.00 0.00 H new ATOM 0 HG13 VAL A 66 12.576 2.352 7.646 1.00 0.00 H new ATOM 0 HG21 VAL A 66 13.113 3.612 10.399 1.00 0.00 H new ATOM 0 HG22 VAL A 66 12.499 4.532 9.005 1.00 0.00 H new ATOM 0 HG23 VAL A 66 11.601 4.541 10.542 1.00 0.00 H new ATOM 1031 N SER A 67 9.269 1.605 7.028 1.00 0.00 N ATOM 1032 CA SER A 67 8.541 0.441 6.561 1.00 0.00 C ATOM 1033 C SER A 67 9.381 -0.343 5.554 1.00 0.00 C ATOM 1034 O SER A 67 9.954 0.230 4.625 1.00 0.00 O ATOM 1035 CB SER A 67 7.218 0.873 5.929 1.00 0.00 C ATOM 1036 OG SER A 67 6.483 1.703 6.816 1.00 0.00 O ATOM 0 H SER A 67 9.712 2.150 6.288 1.00 0.00 H new ATOM 0 HA SER A 67 8.330 -0.207 7.411 1.00 0.00 H new ATOM 0 HB2 SER A 67 7.411 1.408 4.999 1.00 0.00 H new ATOM 0 HB3 SER A 67 6.627 -0.007 5.673 1.00 0.00 H new ATOM 0 HG SER A 67 5.641 1.970 6.392 1.00 0.00 H new ATOM 1042 N GLU A 68 9.461 -1.649 5.753 1.00 0.00 N ATOM 1043 CA GLU A 68 10.216 -2.517 4.864 1.00 0.00 C ATOM 1044 C GLU A 68 9.265 -3.259 3.941 1.00 0.00 C ATOM 1045 O GLU A 68 8.320 -3.902 4.397 1.00 0.00 O ATOM 1046 CB GLU A 68 11.051 -3.515 5.666 1.00 0.00 C ATOM 1047 CG GLU A 68 12.103 -2.863 6.547 1.00 0.00 C ATOM 1048 CD GLU A 68 12.832 -3.862 7.418 1.00 0.00 C ATOM 1049 OE1 GLU A 68 13.479 -4.776 6.870 1.00 0.00 O ATOM 1050 OE2 GLU A 68 12.745 -3.748 8.660 1.00 0.00 O ATOM 0 H GLU A 68 9.009 -2.134 6.528 1.00 0.00 H new ATOM 0 HA GLU A 68 10.892 -1.903 4.268 1.00 0.00 H new ATOM 0 HB2 GLU A 68 10.386 -4.112 6.290 1.00 0.00 H new ATOM 0 HB3 GLU A 68 11.542 -4.201 4.976 1.00 0.00 H new ATOM 0 HG2 GLU A 68 12.824 -2.340 5.919 1.00 0.00 H new ATOM 0 HG3 GLU A 68 11.628 -2.113 7.180 1.00 0.00 H new ATOM 1057 N ARG A 69 9.504 -3.166 2.648 1.00 0.00 N ATOM 1058 CA ARG A 69 8.618 -3.782 1.682 1.00 0.00 C ATOM 1059 C ARG A 69 9.367 -4.777 0.806 1.00 0.00 C ATOM 1060 O ARG A 69 10.339 -4.425 0.137 1.00 0.00 O ATOM 1061 CB ARG A 69 7.965 -2.712 0.815 1.00 0.00 C ATOM 1062 CG ARG A 69 6.862 -3.240 -0.080 1.00 0.00 C ATOM 1063 CD ARG A 69 6.432 -2.193 -1.092 1.00 0.00 C ATOM 1064 NE ARG A 69 7.521 -1.852 -2.002 1.00 0.00 N ATOM 1065 CZ ARG A 69 7.375 -1.102 -3.091 1.00 0.00 C ATOM 1066 NH1 ARG A 69 6.181 -0.619 -3.411 1.00 0.00 N ATOM 1067 NH2 ARG A 69 8.425 -0.844 -3.859 1.00 0.00 N ATOM 0 H ARG A 69 10.300 -2.672 2.244 1.00 0.00 H new ATOM 0 HA ARG A 69 7.846 -4.324 2.228 1.00 0.00 H new ATOM 0 HB2 ARG A 69 7.556 -1.934 1.460 1.00 0.00 H new ATOM 0 HB3 ARG A 69 8.729 -2.243 0.196 1.00 0.00 H new ATOM 0 HG2 ARG A 69 7.208 -4.133 -0.600 1.00 0.00 H new ATOM 0 HG3 ARG A 69 6.007 -3.536 0.527 1.00 0.00 H new ATOM 0 HD2 ARG A 69 5.582 -2.565 -1.663 1.00 0.00 H new ATOM 0 HD3 ARG A 69 6.098 -1.296 -0.570 1.00 0.00 H new ATOM 0 HE ARG A 69 8.452 -2.211 -1.790 1.00 0.00 H new ATOM 0 HH11 ARG A 69 5.374 -0.823 -2.822 1.00 0.00 H new ATOM 0 HH12 ARG A 69 6.071 -0.044 -4.246 1.00 0.00 H new ATOM 0 HH21 ARG A 69 9.341 -1.220 -3.614 1.00 0.00 H new ATOM 0 HH22 ARG A 69 8.317 -0.269 -4.695 1.00 0.00 H new ATOM 1081 N VAL A 70 8.904 -6.015 0.818 1.00 0.00 N ATOM 1082 CA VAL A 70 9.468 -7.057 -0.021 1.00 0.00 C ATOM 1083 C VAL A 70 8.579 -7.272 -1.241 1.00 0.00 C ATOM 1084 O VAL A 70 7.425 -7.689 -1.113 1.00 0.00 O ATOM 1085 CB VAL A 70 9.613 -8.388 0.749 1.00 0.00 C ATOM 1086 CG1 VAL A 70 10.238 -9.460 -0.131 1.00 0.00 C ATOM 1087 CG2 VAL A 70 10.434 -8.186 2.015 1.00 0.00 C ATOM 0 H VAL A 70 8.131 -6.325 1.406 1.00 0.00 H new ATOM 0 HA VAL A 70 10.461 -6.734 -0.334 1.00 0.00 H new ATOM 0 HB VAL A 70 8.617 -8.725 1.035 1.00 0.00 H new ATOM 0 HG11 VAL A 70 10.329 -10.387 0.435 1.00 0.00 H new ATOM 0 HG12 VAL A 70 9.607 -9.628 -1.004 1.00 0.00 H new ATOM 0 HG13 VAL A 70 11.226 -9.134 -0.455 1.00 0.00 H new ATOM 0 HG21 VAL A 70 10.526 -9.134 2.544 1.00 0.00 H new ATOM 0 HG22 VAL A 70 11.426 -7.821 1.751 1.00 0.00 H new ATOM 0 HG23 VAL A 70 9.939 -7.458 2.658 1.00 0.00 H new ATOM 1097 N ALA A 71 9.107 -6.965 -2.415 1.00 0.00 N ATOM 1098 CA ALA A 71 8.353 -7.117 -3.650 1.00 0.00 C ATOM 1099 C ALA A 71 8.853 -8.326 -4.425 1.00 0.00 C ATOM 1100 O ALA A 71 9.908 -8.277 -5.060 1.00 0.00 O ATOM 1101 CB ALA A 71 8.451 -5.855 -4.500 1.00 0.00 C ATOM 0 H ALA A 71 10.055 -6.609 -2.539 1.00 0.00 H new ATOM 0 HA ALA A 71 7.304 -7.275 -3.399 1.00 0.00 H new ATOM 0 HB1 ALA A 71 7.880 -5.990 -5.419 1.00 0.00 H new ATOM 0 HB2 ALA A 71 8.048 -5.009 -3.943 1.00 0.00 H new ATOM 0 HB3 ALA A 71 9.495 -5.663 -4.747 1.00 0.00 H new ATOM 1107 N ASP A 72 8.105 -9.418 -4.351 1.00 0.00 N ATOM 1108 CA ASP A 72 8.480 -10.642 -5.045 1.00 0.00 C ATOM 1109 C ASP A 72 7.630 -10.816 -6.298 1.00 0.00 C ATOM 1110 O ASP A 72 6.434 -11.112 -6.212 1.00 0.00 O ATOM 1111 CB ASP A 72 8.322 -11.851 -4.122 1.00 0.00 C ATOM 1112 CG ASP A 72 8.807 -13.136 -4.763 1.00 0.00 C ATOM 1113 OD1 ASP A 72 10.011 -13.441 -4.657 1.00 0.00 O ATOM 1114 OD2 ASP A 72 7.986 -13.851 -5.373 1.00 0.00 O ATOM 0 H ASP A 72 7.237 -9.482 -3.819 1.00 0.00 H new ATOM 0 HA ASP A 72 9.527 -10.569 -5.339 1.00 0.00 H new ATOM 0 HB2 ASP A 72 8.877 -11.676 -3.201 1.00 0.00 H new ATOM 0 HB3 ASP A 72 7.273 -11.959 -3.846 1.00 0.00 H new ATOM 1119 N PRO A 73 8.237 -10.613 -7.478 1.00 0.00 N ATOM 1120 CA PRO A 73 7.537 -10.681 -8.765 1.00 0.00 C ATOM 1121 C PRO A 73 7.128 -12.101 -9.140 1.00 0.00 C ATOM 1122 O PRO A 73 6.217 -12.299 -9.944 1.00 0.00 O ATOM 1123 CB PRO A 73 8.563 -10.139 -9.775 1.00 0.00 C ATOM 1124 CG PRO A 73 9.652 -9.532 -8.953 1.00 0.00 C ATOM 1125 CD PRO A 73 9.655 -10.283 -7.656 1.00 0.00 C ATOM 0 HA PRO A 73 6.606 -10.115 -8.738 1.00 0.00 H new ATOM 0 HB2 PRO A 73 8.949 -10.937 -10.409 1.00 0.00 H new ATOM 0 HB3 PRO A 73 8.111 -9.399 -10.435 1.00 0.00 H new ATOM 0 HG2 PRO A 73 10.615 -9.618 -9.456 1.00 0.00 H new ATOM 0 HG3 PRO A 73 9.472 -8.470 -8.789 1.00 0.00 H new ATOM 0 HD2 PRO A 73 10.277 -11.177 -7.706 1.00 0.00 H new ATOM 0 HD3 PRO A 73 10.036 -9.675 -6.836 1.00 0.00 H new ATOM 1133 N VAL A 74 7.796 -13.084 -8.549 1.00 0.00 N ATOM 1134 CA VAL A 74 7.512 -14.484 -8.837 1.00 0.00 C ATOM 1135 C VAL A 74 6.157 -14.881 -8.262 1.00 0.00 C ATOM 1136 O VAL A 74 5.282 -15.364 -8.979 1.00 0.00 O ATOM 1137 CB VAL A 74 8.607 -15.413 -8.269 1.00 0.00 C ATOM 1138 CG1 VAL A 74 8.306 -16.868 -8.594 1.00 0.00 C ATOM 1139 CG2 VAL A 74 9.973 -15.020 -8.807 1.00 0.00 C ATOM 0 H VAL A 74 8.539 -12.937 -7.866 1.00 0.00 H new ATOM 0 HA VAL A 74 7.495 -14.598 -9.921 1.00 0.00 H new ATOM 0 HB VAL A 74 8.617 -15.301 -7.185 1.00 0.00 H new ATOM 0 HG11 VAL A 74 9.091 -17.503 -8.183 1.00 0.00 H new ATOM 0 HG12 VAL A 74 7.348 -17.148 -8.156 1.00 0.00 H new ATOM 0 HG13 VAL A 74 8.263 -16.998 -9.675 1.00 0.00 H new ATOM 0 HG21 VAL A 74 10.731 -15.686 -8.395 1.00 0.00 H new ATOM 0 HG22 VAL A 74 9.972 -15.099 -9.894 1.00 0.00 H new ATOM 0 HG23 VAL A 74 10.196 -13.993 -8.518 1.00 0.00 H new ATOM 1149 N THR A 75 5.988 -14.654 -6.968 1.00 0.00 N ATOM 1150 CA THR A 75 4.732 -14.952 -6.296 1.00 0.00 C ATOM 1151 C THR A 75 3.707 -13.853 -6.554 1.00 0.00 C ATOM 1152 O THR A 75 2.521 -14.016 -6.261 1.00 0.00 O ATOM 1153 CB THR A 75 4.936 -15.109 -4.777 1.00 0.00 C ATOM 1154 OG1 THR A 75 5.614 -13.957 -4.251 1.00 0.00 O ATOM 1155 CG2 THR A 75 5.739 -16.361 -4.464 1.00 0.00 C ATOM 0 H THR A 75 6.708 -14.263 -6.360 1.00 0.00 H new ATOM 0 HA THR A 75 4.362 -15.894 -6.702 1.00 0.00 H new ATOM 0 HB THR A 75 3.956 -15.200 -4.309 1.00 0.00 H new ATOM 0 HG1 THR A 75 6.577 -14.041 -4.415 1.00 0.00 H new ATOM 0 HG21 THR A 75 5.869 -16.449 -3.385 1.00 0.00 H new ATOM 0 HG22 THR A 75 5.209 -17.237 -4.838 1.00 0.00 H new ATOM 0 HG23 THR A 75 6.716 -16.296 -4.943 1.00 0.00 H new ATOM 1163 N ARG A 76 4.186 -12.733 -7.102 1.00 0.00 N ATOM 1164 CA ARG A 76 3.347 -11.570 -7.384 1.00 0.00 C ATOM 1165 C ARG A 76 2.739 -11.032 -6.099 1.00 0.00 C ATOM 1166 O ARG A 76 1.628 -10.497 -6.086 1.00 0.00 O ATOM 1167 CB ARG A 76 2.256 -11.918 -8.397 1.00 0.00 C ATOM 1168 CG ARG A 76 2.802 -12.204 -9.782 1.00 0.00 C ATOM 1169 CD ARG A 76 1.700 -12.583 -10.749 1.00 0.00 C ATOM 1170 NE ARG A 76 2.192 -12.693 -12.118 1.00 0.00 N ATOM 1171 CZ ARG A 76 1.499 -13.241 -13.112 1.00 0.00 C ATOM 1172 NH1 ARG A 76 0.325 -13.806 -12.868 1.00 0.00 N ATOM 1173 NH2 ARG A 76 1.992 -13.240 -14.343 1.00 0.00 N ATOM 0 H ARG A 76 5.165 -12.609 -7.361 1.00 0.00 H new ATOM 0 HA ARG A 76 3.974 -10.792 -7.821 1.00 0.00 H new ATOM 0 HB2 ARG A 76 1.704 -12.789 -8.043 1.00 0.00 H new ATOM 0 HB3 ARG A 76 1.546 -11.093 -8.456 1.00 0.00 H new ATOM 0 HG2 ARG A 76 3.328 -11.325 -10.155 1.00 0.00 H new ATOM 0 HG3 ARG A 76 3.532 -13.012 -9.726 1.00 0.00 H new ATOM 0 HD2 ARG A 76 1.260 -13.532 -10.444 1.00 0.00 H new ATOM 0 HD3 ARG A 76 0.907 -11.836 -10.707 1.00 0.00 H new ATOM 0 HE ARG A 76 3.122 -12.328 -12.325 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -0.047 -13.820 -11.918 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -0.207 -14.226 -13.630 1.00 0.00 H new ATOM 0 HH21 ARG A 76 2.903 -12.819 -14.527 1.00 0.00 H new ATOM 0 HH22 ARG A 76 1.461 -13.660 -15.106 1.00 0.00 H new ATOM 1187 N THR A 77 3.500 -11.152 -5.026 1.00 0.00 N ATOM 1188 CA THR A 77 3.047 -10.732 -3.717 1.00 0.00 C ATOM 1189 C THR A 77 4.027 -9.733 -3.111 1.00 0.00 C ATOM 1190 O THR A 77 5.220 -10.018 -2.970 1.00 0.00 O ATOM 1191 CB THR A 77 2.887 -11.943 -2.779 1.00 0.00 C ATOM 1192 OG1 THR A 77 2.046 -12.926 -3.399 1.00 0.00 O ATOM 1193 CG2 THR A 77 2.287 -11.524 -1.447 1.00 0.00 C ATOM 0 H THR A 77 4.443 -11.541 -5.039 1.00 0.00 H new ATOM 0 HA THR A 77 2.076 -10.251 -3.833 1.00 0.00 H new ATOM 0 HB THR A 77 3.874 -12.367 -2.594 1.00 0.00 H new ATOM 0 HG1 THR A 77 1.947 -13.696 -2.801 1.00 0.00 H new ATOM 0 HG21 THR A 77 2.185 -12.398 -0.803 1.00 0.00 H new ATOM 0 HG22 THR A 77 2.939 -10.794 -0.967 1.00 0.00 H new ATOM 0 HG23 THR A 77 1.306 -11.079 -1.614 1.00 0.00 H new ATOM 1201 N VAL A 78 3.521 -8.557 -2.777 1.00 0.00 N ATOM 1202 CA VAL A 78 4.338 -7.501 -2.201 1.00 0.00 C ATOM 1203 C VAL A 78 3.966 -7.289 -0.737 1.00 0.00 C ATOM 1204 O VAL A 78 2.842 -6.913 -0.426 1.00 0.00 O ATOM 1205 CB VAL A 78 4.157 -6.177 -2.973 1.00 0.00 C ATOM 1206 CG1 VAL A 78 5.090 -5.108 -2.436 1.00 0.00 C ATOM 1207 CG2 VAL A 78 4.385 -6.385 -4.462 1.00 0.00 C ATOM 0 H VAL A 78 2.539 -8.308 -2.896 1.00 0.00 H new ATOM 0 HA VAL A 78 5.382 -7.807 -2.273 1.00 0.00 H new ATOM 0 HB VAL A 78 3.131 -5.840 -2.828 1.00 0.00 H new ATOM 0 HG11 VAL A 78 4.945 -4.184 -2.995 1.00 0.00 H new ATOM 0 HG12 VAL A 78 4.874 -4.932 -1.382 1.00 0.00 H new ATOM 0 HG13 VAL A 78 6.123 -5.439 -2.544 1.00 0.00 H new ATOM 0 HG21 VAL A 78 4.252 -5.439 -4.986 1.00 0.00 H new ATOM 0 HG22 VAL A 78 5.398 -6.752 -4.627 1.00 0.00 H new ATOM 0 HG23 VAL A 78 3.669 -7.114 -4.842 1.00 0.00 H new ATOM 1217 N ARG A 79 4.903 -7.539 0.160 1.00 0.00 N ATOM 1218 CA ARG A 79 4.634 -7.402 1.585 1.00 0.00 C ATOM 1219 C ARG A 79 5.287 -6.145 2.142 1.00 0.00 C ATOM 1220 O ARG A 79 6.510 -6.029 2.148 1.00 0.00 O ATOM 1221 CB ARG A 79 5.149 -8.616 2.357 1.00 0.00 C ATOM 1222 CG ARG A 79 4.484 -9.929 1.982 1.00 0.00 C ATOM 1223 CD ARG A 79 4.999 -11.056 2.860 1.00 0.00 C ATOM 1224 NE ARG A 79 4.455 -12.360 2.491 1.00 0.00 N ATOM 1225 CZ ARG A 79 4.727 -13.485 3.150 1.00 0.00 C ATOM 1226 NH1 ARG A 79 5.427 -13.451 4.278 1.00 0.00 N ATOM 1227 NH2 ARG A 79 4.260 -14.639 2.707 1.00 0.00 N ATOM 0 H ARG A 79 5.852 -7.836 -0.068 1.00 0.00 H new ATOM 0 HA ARG A 79 3.553 -7.331 1.707 1.00 0.00 H new ATOM 0 HB2 ARG A 79 6.223 -8.707 2.192 1.00 0.00 H new ATOM 0 HB3 ARG A 79 5.004 -8.441 3.423 1.00 0.00 H new ATOM 0 HG2 ARG A 79 3.403 -9.840 2.091 1.00 0.00 H new ATOM 0 HG3 ARG A 79 4.681 -10.157 0.935 1.00 0.00 H new ATOM 0 HD2 ARG A 79 6.087 -11.091 2.796 1.00 0.00 H new ATOM 0 HD3 ARG A 79 4.747 -10.844 3.899 1.00 0.00 H new ATOM 0 HE ARG A 79 3.833 -12.412 1.684 1.00 0.00 H new ATOM 0 HH11 ARG A 79 5.760 -12.559 4.645 1.00 0.00 H new ATOM 0 HH12 ARG A 79 5.632 -14.316 4.778 1.00 0.00 H new ATOM 0 HH21 ARG A 79 3.691 -14.668 1.861 1.00 0.00 H new ATOM 0 HH22 ARG A 79 4.468 -15.501 3.211 1.00 0.00 H new ATOM 1241 N ALA A 80 4.473 -5.212 2.603 1.00 0.00 N ATOM 1242 CA ALA A 80 4.980 -4.002 3.227 1.00 0.00 C ATOM 1243 C ALA A 80 4.747 -4.049 4.730 1.00 0.00 C ATOM 1244 O ALA A 80 3.615 -3.922 5.195 1.00 0.00 O ATOM 1245 CB ALA A 80 4.316 -2.775 2.619 1.00 0.00 C ATOM 0 H ALA A 80 3.456 -5.269 2.557 1.00 0.00 H new ATOM 0 HA ALA A 80 6.053 -3.936 3.046 1.00 0.00 H new ATOM 0 HB1 ALA A 80 4.706 -1.876 3.097 1.00 0.00 H new ATOM 0 HB2 ALA A 80 4.527 -2.739 1.550 1.00 0.00 H new ATOM 0 HB3 ALA A 80 3.238 -2.830 2.774 1.00 0.00 H new ATOM 1251 N GLN A 81 5.808 -4.266 5.489 1.00 0.00 N ATOM 1252 CA GLN A 81 5.694 -4.329 6.936 1.00 0.00 C ATOM 1253 C GLN A 81 6.139 -3.013 7.563 1.00 0.00 C ATOM 1254 O GLN A 81 7.226 -2.505 7.278 1.00 0.00 O ATOM 1255 CB GLN A 81 6.503 -5.501 7.510 1.00 0.00 C ATOM 1256 CG GLN A 81 7.996 -5.435 7.226 1.00 0.00 C ATOM 1257 CD GLN A 81 8.779 -6.524 7.936 1.00 0.00 C ATOM 1258 OE1 GLN A 81 8.272 -7.622 8.174 1.00 0.00 O ATOM 1259 NE2 GLN A 81 10.020 -6.225 8.286 1.00 0.00 N ATOM 0 H GLN A 81 6.753 -4.401 5.130 1.00 0.00 H new ATOM 0 HA GLN A 81 4.646 -4.497 7.182 1.00 0.00 H new ATOM 0 HB2 GLN A 81 6.352 -5.536 8.589 1.00 0.00 H new ATOM 0 HB3 GLN A 81 6.109 -6.432 7.103 1.00 0.00 H new ATOM 0 HG2 GLN A 81 8.161 -5.517 6.152 1.00 0.00 H new ATOM 0 HG3 GLN A 81 8.377 -4.461 7.533 1.00 0.00 H new ATOM 0 HE21 GLN A 81 10.403 -5.304 8.071 1.00 0.00 H new ATOM 0 HE22 GLN A 81 10.593 -6.915 8.771 1.00 0.00 H new ATOM 1268 N ARG A 82 5.283 -2.452 8.397 1.00 0.00 N ATOM 1269 CA ARG A 82 5.596 -1.214 9.079 1.00 0.00 C ATOM 1270 C ARG A 82 6.286 -1.513 10.402 1.00 0.00 C ATOM 1271 O ARG A 82 5.693 -2.102 11.305 1.00 0.00 O ATOM 1272 CB ARG A 82 4.333 -0.373 9.295 1.00 0.00 C ATOM 1273 CG ARG A 82 4.570 0.844 10.170 1.00 0.00 C ATOM 1274 CD ARG A 82 3.555 1.947 9.919 1.00 0.00 C ATOM 1275 NE ARG A 82 2.171 1.530 10.139 1.00 0.00 N ATOM 1276 CZ ARG A 82 1.473 1.822 11.239 1.00 0.00 C ATOM 1277 NH1 ARG A 82 2.078 2.354 12.298 1.00 0.00 N ATOM 1278 NH2 ARG A 82 0.173 1.560 11.286 1.00 0.00 N ATOM 0 H ARG A 82 4.364 -2.836 8.617 1.00 0.00 H new ATOM 0 HA ARG A 82 6.275 -0.632 8.455 1.00 0.00 H new ATOM 0 HB2 ARG A 82 3.950 -0.048 8.327 1.00 0.00 H new ATOM 0 HB3 ARG A 82 3.563 -0.996 9.750 1.00 0.00 H new ATOM 0 HG2 ARG A 82 4.528 0.548 11.218 1.00 0.00 H new ATOM 0 HG3 ARG A 82 5.573 1.229 9.987 1.00 0.00 H new ATOM 0 HD2 ARG A 82 3.779 2.791 10.571 1.00 0.00 H new ATOM 0 HD3 ARG A 82 3.661 2.300 8.893 1.00 0.00 H new ATOM 0 HE ARG A 82 1.712 0.984 9.410 1.00 0.00 H new ATOM 0 HH11 ARG A 82 3.080 2.541 12.272 1.00 0.00 H new ATOM 0 HH12 ARG A 82 1.539 2.575 13.136 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -0.291 1.136 10.483 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -0.362 1.782 12.125 1.00 0.00 H new ATOM 1292 N VAL A 83 7.545 -1.112 10.495 1.00 0.00 N ATOM 1293 CA VAL A 83 8.363 -1.405 11.661 1.00 0.00 C ATOM 1294 C VAL A 83 7.980 -0.504 12.828 1.00 0.00 C ATOM 1295 O VAL A 83 7.859 -0.963 13.964 1.00 0.00 O ATOM 1296 CB VAL A 83 9.861 -1.240 11.340 1.00 0.00 C ATOM 1297 CG1 VAL A 83 10.720 -1.708 12.505 1.00 0.00 C ATOM 1298 CG2 VAL A 83 10.216 -2.000 10.071 1.00 0.00 C ATOM 0 H VAL A 83 8.025 -0.578 9.770 1.00 0.00 H new ATOM 0 HA VAL A 83 8.181 -2.442 11.942 1.00 0.00 H new ATOM 0 HB VAL A 83 10.063 -0.181 11.178 1.00 0.00 H new ATOM 0 HG11 VAL A 83 11.773 -1.582 12.254 1.00 0.00 H new ATOM 0 HG12 VAL A 83 10.484 -1.118 13.391 1.00 0.00 H new ATOM 0 HG13 VAL A 83 10.519 -2.760 12.706 1.00 0.00 H new ATOM 0 HG21 VAL A 83 11.277 -1.874 9.857 1.00 0.00 H new ATOM 0 HG22 VAL A 83 9.996 -3.059 10.208 1.00 0.00 H new ATOM 0 HG23 VAL A 83 9.629 -1.612 9.238 1.00 0.00 H new ATOM 1308 N GLU A 84 7.788 0.779 12.546 1.00 0.00 N ATOM 1309 CA GLU A 84 7.328 1.711 13.565 1.00 0.00 C ATOM 1310 C GLU A 84 5.819 1.573 13.736 1.00 0.00 C ATOM 1311 O GLU A 84 5.030 2.148 12.980 1.00 0.00 O ATOM 1312 CB GLU A 84 7.715 3.147 13.209 1.00 0.00 C ATOM 1313 CG GLU A 84 9.219 3.351 13.107 1.00 0.00 C ATOM 1314 CD GLU A 84 9.609 4.810 12.983 1.00 0.00 C ATOM 1315 OE1 GLU A 84 9.651 5.504 14.021 1.00 0.00 O ATOM 1316 OE2 GLU A 84 9.891 5.259 11.858 1.00 0.00 O ATOM 0 H GLU A 84 7.943 1.194 11.627 1.00 0.00 H new ATOM 0 HA GLU A 84 7.813 1.471 14.511 1.00 0.00 H new ATOM 0 HB2 GLU A 84 7.252 3.417 12.260 1.00 0.00 H new ATOM 0 HB3 GLU A 84 7.313 3.823 13.963 1.00 0.00 H new ATOM 0 HG2 GLU A 84 9.699 2.925 13.988 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.597 2.804 12.243 1.00 0.00 H new ATOM 1323 N THR A 85 5.435 0.783 14.723 1.00 0.00 N ATOM 1324 CA THR A 85 4.052 0.382 14.904 1.00 0.00 C ATOM 1325 C THR A 85 3.276 1.356 15.788 1.00 0.00 C ATOM 1326 O THR A 85 2.373 2.053 15.319 1.00 0.00 O ATOM 1327 CB THR A 85 3.994 -1.027 15.520 1.00 0.00 C ATOM 1328 OG1 THR A 85 4.928 -1.114 16.606 1.00 0.00 O ATOM 1329 CG2 THR A 85 4.313 -2.091 14.482 1.00 0.00 C ATOM 0 H THR A 85 6.073 0.402 15.421 1.00 0.00 H new ATOM 0 HA THR A 85 3.583 0.384 13.920 1.00 0.00 H new ATOM 0 HB THR A 85 2.983 -1.202 15.887 1.00 0.00 H new ATOM 0 HG1 THR A 85 4.530 -1.627 17.340 1.00 0.00 H new ATOM 0 HG21 THR A 85 4.265 -3.077 14.945 1.00 0.00 H new ATOM 0 HG22 THR A 85 3.588 -2.036 13.670 1.00 0.00 H new ATOM 0 HG23 THR A 85 5.315 -1.925 14.086 1.00 0.00 H new ATOM 1337 N GLY A 86 3.634 1.395 17.062 1.00 0.00 N ATOM 1338 CA GLY A 86 2.896 2.189 18.024 1.00 0.00 C ATOM 1339 C GLY A 86 2.007 1.316 18.887 1.00 0.00 C ATOM 1340 O GLY A 86 2.497 0.628 19.787 1.00 0.00 O ATOM 0 H GLY A 86 4.429 0.887 17.450 1.00 0.00 H new ATOM 0 HA2 GLY A 86 3.593 2.740 18.656 1.00 0.00 H new ATOM 0 HA3 GLY A 86 2.288 2.927 17.501 1.00 0.00 H new ATOM 1344 N PRO A 87 0.691 1.313 18.632 1.00 0.00 N ATOM 1345 CA PRO A 87 -0.246 0.429 19.325 1.00 0.00 C ATOM 1346 C PRO A 87 -0.110 -1.006 18.831 1.00 0.00 C ATOM 1347 O PRO A 87 -0.324 -1.964 19.578 1.00 0.00 O ATOM 1348 CB PRO A 87 -1.630 0.990 18.959 1.00 0.00 C ATOM 1349 CG PRO A 87 -1.378 2.274 18.234 1.00 0.00 C ATOM 1350 CD PRO A 87 0.006 2.176 17.665 1.00 0.00 C ATOM 0 HA PRO A 87 -0.069 0.401 20.400 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -2.181 0.290 18.331 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -2.231 1.158 19.853 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -2.113 2.424 17.443 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -1.460 3.124 18.911 1.00 0.00 H new ATOM 0 HD2 PRO A 87 0.003 1.742 16.665 1.00 0.00 H new ATOM 0 HD3 PRO A 87 0.482 3.154 17.586 1.00 0.00 H new ATOM 1358 N PHE A 88 0.271 -1.137 17.565 1.00 0.00 N ATOM 1359 CA PHE A 88 0.410 -2.437 16.926 1.00 0.00 C ATOM 1360 C PHE A 88 1.615 -3.192 17.469 1.00 0.00 C ATOM 1361 O PHE A 88 2.616 -2.597 17.867 1.00 0.00 O ATOM 1362 CB PHE A 88 0.561 -2.279 15.407 1.00 0.00 C ATOM 1363 CG PHE A 88 -0.651 -1.725 14.714 1.00 0.00 C ATOM 1364 CD1 PHE A 88 -0.893 -0.363 14.693 1.00 0.00 C ATOM 1365 CD2 PHE A 88 -1.542 -2.570 14.073 1.00 0.00 C ATOM 1366 CE1 PHE A 88 -2.001 0.148 14.048 1.00 0.00 C ATOM 1367 CE2 PHE A 88 -2.652 -2.065 13.424 1.00 0.00 C ATOM 1368 CZ PHE A 88 -2.882 -0.703 13.412 1.00 0.00 C ATOM 0 H PHE A 88 0.491 -0.348 16.957 1.00 0.00 H new ATOM 0 HA PHE A 88 -0.493 -3.006 17.147 1.00 0.00 H new ATOM 0 HB2 PHE A 88 1.410 -1.625 15.205 1.00 0.00 H new ATOM 0 HB3 PHE A 88 0.798 -3.251 14.975 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -0.207 0.308 15.187 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -1.367 -3.636 14.081 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -2.179 1.213 14.041 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -3.339 -2.734 12.927 1.00 0.00 H new ATOM 0 HZ PHE A 88 -3.749 -0.305 12.906 1.00 0.00 H new ATOM 1378 N GLN A 89 1.505 -4.506 17.487 1.00 0.00 N ATOM 1379 CA GLN A 89 2.623 -5.366 17.825 1.00 0.00 C ATOM 1380 C GLN A 89 3.380 -5.706 16.549 1.00 0.00 C ATOM 1381 O GLN A 89 4.607 -5.637 16.492 1.00 0.00 O ATOM 1382 CB GLN A 89 2.119 -6.639 18.512 1.00 0.00 C ATOM 1383 CG GLN A 89 1.355 -6.367 19.796 1.00 0.00 C ATOM 1384 CD GLN A 89 0.645 -7.593 20.339 1.00 0.00 C ATOM 1385 OE1 GLN A 89 0.216 -8.468 19.586 1.00 0.00 O ATOM 1386 NE2 GLN A 89 0.517 -7.662 21.653 1.00 0.00 N ATOM 0 H GLN A 89 0.643 -5.006 17.269 1.00 0.00 H new ATOM 0 HA GLN A 89 3.292 -4.854 18.517 1.00 0.00 H new ATOM 0 HB2 GLN A 89 1.475 -7.185 17.823 1.00 0.00 H new ATOM 0 HB3 GLN A 89 2.969 -7.285 18.733 1.00 0.00 H new ATOM 0 HG2 GLN A 89 2.047 -5.992 20.550 1.00 0.00 H new ATOM 0 HG3 GLN A 89 0.622 -5.581 19.616 1.00 0.00 H new ATOM 0 HE21 GLN A 89 0.887 -6.915 22.241 1.00 0.00 H new ATOM 0 HE22 GLN A 89 0.048 -8.462 22.078 1.00 0.00 H new ATOM 1395 N TYR A 90 2.619 -6.036 15.517 1.00 0.00 N ATOM 1396 CA TYR A 90 3.165 -6.319 14.200 1.00 0.00 C ATOM 1397 C TYR A 90 2.187 -5.823 13.141 1.00 0.00 C ATOM 1398 O TYR A 90 0.979 -5.941 13.318 1.00 0.00 O ATOM 1399 CB TYR A 90 3.421 -7.823 14.042 1.00 0.00 C ATOM 1400 CG TYR A 90 3.957 -8.223 12.685 1.00 0.00 C ATOM 1401 CD1 TYR A 90 5.219 -7.820 12.265 1.00 0.00 C ATOM 1402 CD2 TYR A 90 3.202 -9.010 11.827 1.00 0.00 C ATOM 1403 CE1 TYR A 90 5.711 -8.191 11.028 1.00 0.00 C ATOM 1404 CE2 TYR A 90 3.687 -9.385 10.590 1.00 0.00 C ATOM 1405 CZ TYR A 90 4.940 -8.974 10.193 1.00 0.00 C ATOM 1406 OH TYR A 90 5.424 -9.349 8.960 1.00 0.00 O ATOM 0 H TYR A 90 1.603 -6.115 15.570 1.00 0.00 H new ATOM 0 HA TYR A 90 4.117 -5.803 14.079 1.00 0.00 H new ATOM 0 HB2 TYR A 90 4.128 -8.142 14.808 1.00 0.00 H new ATOM 0 HB3 TYR A 90 2.490 -8.360 14.225 1.00 0.00 H new ATOM 0 HD1 TYR A 90 5.825 -7.207 12.916 1.00 0.00 H new ATOM 0 HD2 TYR A 90 2.218 -9.335 12.132 1.00 0.00 H new ATOM 0 HE1 TYR A 90 6.694 -7.870 10.716 1.00 0.00 H new ATOM 0 HE2 TYR A 90 3.086 -9.999 9.936 1.00 0.00 H new ATOM 0 HH TYR A 90 4.756 -9.899 8.500 1.00 0.00 H new ATOM 1416 N MET A 91 2.703 -5.253 12.062 1.00 0.00 N ATOM 1417 CA MET A 91 1.855 -4.691 11.016 1.00 0.00 C ATOM 1418 C MET A 91 2.426 -4.997 9.635 1.00 0.00 C ATOM 1419 O MET A 91 3.408 -4.384 9.213 1.00 0.00 O ATOM 1420 CB MET A 91 1.725 -3.177 11.209 1.00 0.00 C ATOM 1421 CG MET A 91 0.853 -2.491 10.167 1.00 0.00 C ATOM 1422 SD MET A 91 -0.838 -3.112 10.156 1.00 0.00 S ATOM 1423 CE MET A 91 -1.595 -2.020 8.957 1.00 0.00 C ATOM 0 H MET A 91 3.704 -5.166 11.886 1.00 0.00 H new ATOM 0 HA MET A 91 0.868 -5.148 11.087 1.00 0.00 H new ATOM 0 HB2 MET A 91 1.312 -2.982 12.199 1.00 0.00 H new ATOM 0 HB3 MET A 91 2.720 -2.732 11.185 1.00 0.00 H new ATOM 0 HG2 MET A 91 0.840 -1.418 10.359 1.00 0.00 H new ATOM 0 HG3 MET A 91 1.294 -2.633 9.180 1.00 0.00 H new ATOM 0 HE1 MET A 91 -2.541 -1.648 9.350 1.00 0.00 H new ATOM 0 HE2 MET A 91 -0.929 -1.180 8.758 1.00 0.00 H new ATOM 0 HE3 MET A 91 -1.777 -2.566 8.031 1.00 0.00 H new ATOM 1433 N ASN A 92 1.822 -5.948 8.939 1.00 0.00 N ATOM 1434 CA ASN A 92 2.286 -6.333 7.611 1.00 0.00 C ATOM 1435 C ASN A 92 1.157 -6.239 6.592 1.00 0.00 C ATOM 1436 O ASN A 92 0.178 -6.977 6.664 1.00 0.00 O ATOM 1437 CB ASN A 92 2.845 -7.758 7.637 1.00 0.00 C ATOM 1438 CG ASN A 92 3.423 -8.197 6.302 1.00 0.00 C ATOM 1439 OD1 ASN A 92 3.369 -9.376 5.950 1.00 0.00 O ATOM 1440 ND2 ASN A 92 4.004 -7.265 5.559 1.00 0.00 N ATOM 0 H ASN A 92 1.010 -6.468 9.270 1.00 0.00 H new ATOM 0 HA ASN A 92 3.077 -5.643 7.316 1.00 0.00 H new ATOM 0 HB2 ASN A 92 3.620 -7.824 8.401 1.00 0.00 H new ATOM 0 HB3 ASN A 92 2.052 -8.447 7.927 1.00 0.00 H new ATOM 0 HD21 ASN A 92 4.425 -7.515 4.664 1.00 0.00 H new ATOM 0 HD22 ASN A 92 4.030 -6.298 5.882 1.00 0.00 H new ATOM 1447 N ILE A 93 1.298 -5.323 5.647 1.00 0.00 N ATOM 1448 CA ILE A 93 0.319 -5.172 4.585 1.00 0.00 C ATOM 1449 C ILE A 93 0.745 -5.989 3.371 1.00 0.00 C ATOM 1450 O ILE A 93 1.761 -5.699 2.738 1.00 0.00 O ATOM 1451 CB ILE A 93 0.152 -3.694 4.173 1.00 0.00 C ATOM 1452 CG1 ILE A 93 -0.036 -2.813 5.411 1.00 0.00 C ATOM 1453 CG2 ILE A 93 -1.036 -3.544 3.233 1.00 0.00 C ATOM 1454 CD1 ILE A 93 -0.045 -1.330 5.107 1.00 0.00 C ATOM 0 H ILE A 93 2.082 -4.673 5.595 1.00 0.00 H new ATOM 0 HA ILE A 93 -0.639 -5.532 4.961 1.00 0.00 H new ATOM 0 HB ILE A 93 1.054 -3.372 3.653 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.974 -3.081 5.898 1.00 0.00 H new ATOM 0 HG13 ILE A 93 0.763 -3.024 6.121 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -1.145 -2.497 2.948 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.872 -4.148 2.340 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -1.943 -3.879 3.736 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -0.182 -0.770 6.032 1.00 0.00 H new ATOM 0 HD12 ILE A 93 0.902 -1.047 4.648 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -0.862 -1.104 4.421 1.00 0.00 H new ATOM 1466 N VAL A 94 -0.019 -7.024 3.071 1.00 0.00 N ATOM 1467 CA VAL A 94 0.303 -7.930 1.981 1.00 0.00 C ATOM 1468 C VAL A 94 -0.501 -7.583 0.731 1.00 0.00 C ATOM 1469 O VAL A 94 -1.729 -7.677 0.730 1.00 0.00 O ATOM 1470 CB VAL A 94 0.019 -9.395 2.383 1.00 0.00 C ATOM 1471 CG1 VAL A 94 0.426 -10.352 1.275 1.00 0.00 C ATOM 1472 CG2 VAL A 94 0.732 -9.745 3.682 1.00 0.00 C ATOM 0 H VAL A 94 -0.875 -7.260 3.572 1.00 0.00 H new ATOM 0 HA VAL A 94 1.365 -7.819 1.763 1.00 0.00 H new ATOM 0 HB VAL A 94 -1.054 -9.498 2.542 1.00 0.00 H new ATOM 0 HG11 VAL A 94 0.216 -11.376 1.583 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -0.137 -10.122 0.371 1.00 0.00 H new ATOM 0 HG13 VAL A 94 1.492 -10.245 1.075 1.00 0.00 H new ATOM 0 HG21 VAL A 94 0.519 -10.781 3.947 1.00 0.00 H new ATOM 0 HG22 VAL A 94 1.807 -9.618 3.553 1.00 0.00 H new ATOM 0 HG23 VAL A 94 0.382 -9.088 4.478 1.00 0.00 H new ATOM 1482 N TRP A 95 0.198 -7.168 -0.318 1.00 0.00 N ATOM 1483 CA TRP A 95 -0.431 -6.864 -1.598 1.00 0.00 C ATOM 1484 C TRP A 95 -0.332 -8.069 -2.519 1.00 0.00 C ATOM 1485 O TRP A 95 0.760 -8.434 -2.960 1.00 0.00 O ATOM 1486 CB TRP A 95 0.245 -5.667 -2.279 1.00 0.00 C ATOM 1487 CG TRP A 95 0.286 -4.417 -1.453 1.00 0.00 C ATOM 1488 CD1 TRP A 95 -0.445 -4.139 -0.336 1.00 0.00 C ATOM 1489 CD2 TRP A 95 1.100 -3.264 -1.697 1.00 0.00 C ATOM 1490 NE1 TRP A 95 -0.127 -2.890 0.135 1.00 0.00 N ATOM 1491 CE2 TRP A 95 0.818 -2.332 -0.683 1.00 0.00 C ATOM 1492 CE3 TRP A 95 2.046 -2.933 -2.671 1.00 0.00 C ATOM 1493 CZ2 TRP A 95 1.442 -1.089 -0.617 1.00 0.00 C ATOM 1494 CZ3 TRP A 95 2.666 -1.701 -2.605 1.00 0.00 C ATOM 1495 CH2 TRP A 95 2.363 -0.792 -1.584 1.00 0.00 C ATOM 0 H TRP A 95 1.209 -7.033 -0.307 1.00 0.00 H new ATOM 0 HA TRP A 95 -1.475 -6.618 -1.406 1.00 0.00 H new ATOM 0 HB2 TRP A 95 1.265 -5.945 -2.543 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -0.278 -5.453 -3.211 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -1.168 -4.804 0.112 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -0.530 -2.449 0.962 1.00 0.00 H new ATOM 0 HE3 TRP A 95 2.288 -3.628 -3.461 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 1.208 -0.386 0.168 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 3.397 -1.434 -3.354 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.867 0.163 -1.559 1.00 0.00 H new ATOM 1506 N GLU A 96 -1.460 -8.692 -2.802 1.00 0.00 N ATOM 1507 CA GLU A 96 -1.480 -9.851 -3.686 1.00 0.00 C ATOM 1508 C GLU A 96 -2.144 -9.500 -5.012 1.00 0.00 C ATOM 1509 O GLU A 96 -3.309 -9.101 -5.045 1.00 0.00 O ATOM 1510 CB GLU A 96 -2.211 -11.016 -3.020 1.00 0.00 C ATOM 1511 CG GLU A 96 -1.571 -11.459 -1.716 1.00 0.00 C ATOM 1512 CD GLU A 96 -2.252 -12.668 -1.116 1.00 0.00 C ATOM 1513 OE1 GLU A 96 -1.874 -13.804 -1.479 1.00 0.00 O ATOM 1514 OE2 GLU A 96 -3.163 -12.491 -0.284 1.00 0.00 O ATOM 0 H GLU A 96 -2.373 -8.420 -2.437 1.00 0.00 H new ATOM 0 HA GLU A 96 -0.451 -10.152 -3.883 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -3.244 -10.726 -2.830 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -2.238 -11.860 -3.709 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -0.520 -11.688 -1.891 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -1.603 -10.636 -1.002 1.00 0.00 H new ATOM 1521 N TYR A 97 -1.397 -9.641 -6.099 1.00 0.00 N ATOM 1522 CA TYR A 97 -1.896 -9.295 -7.426 1.00 0.00 C ATOM 1523 C TYR A 97 -2.352 -10.542 -8.180 1.00 0.00 C ATOM 1524 O TYR A 97 -1.609 -11.518 -8.279 1.00 0.00 O ATOM 1525 CB TYR A 97 -0.811 -8.572 -8.230 1.00 0.00 C ATOM 1526 CG TYR A 97 -0.377 -7.253 -7.629 1.00 0.00 C ATOM 1527 CD1 TYR A 97 0.662 -7.193 -6.707 1.00 0.00 C ATOM 1528 CD2 TYR A 97 -1.004 -6.068 -7.987 1.00 0.00 C ATOM 1529 CE1 TYR A 97 1.058 -5.988 -6.158 1.00 0.00 C ATOM 1530 CE2 TYR A 97 -0.612 -4.860 -7.443 1.00 0.00 C ATOM 1531 CZ TYR A 97 0.419 -4.826 -6.530 1.00 0.00 C ATOM 1532 OH TYR A 97 0.804 -3.622 -5.983 1.00 0.00 O ATOM 0 H TYR A 97 -0.440 -9.994 -6.089 1.00 0.00 H new ATOM 0 HA TYR A 97 -2.752 -8.632 -7.301 1.00 0.00 H new ATOM 0 HB2 TYR A 97 0.058 -9.224 -8.316 1.00 0.00 H new ATOM 0 HB3 TYR A 97 -1.179 -8.396 -9.241 1.00 0.00 H new ATOM 0 HD1 TYR A 97 1.167 -8.102 -6.415 1.00 0.00 H new ATOM 0 HD2 TYR A 97 -1.812 -6.090 -8.703 1.00 0.00 H new ATOM 0 HE1 TYR A 97 1.865 -5.958 -5.441 1.00 0.00 H new ATOM 0 HE2 TYR A 97 -1.111 -3.947 -7.732 1.00 0.00 H new ATOM 0 HH TYR A 97 1.330 -3.118 -6.639 1.00 0.00 H new ATOM 1542 N ALA A 98 -3.574 -10.504 -8.700 1.00 0.00 N ATOM 1543 CA ALA A 98 -4.120 -11.620 -9.461 1.00 0.00 C ATOM 1544 C ALA A 98 -4.561 -11.180 -10.851 1.00 0.00 C ATOM 1545 O ALA A 98 -4.979 -10.035 -11.048 1.00 0.00 O ATOM 1546 CB ALA A 98 -5.289 -12.247 -8.718 1.00 0.00 C ATOM 0 H ALA A 98 -4.206 -9.709 -8.607 1.00 0.00 H new ATOM 0 HA ALA A 98 -3.330 -12.362 -9.575 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -5.686 -13.079 -9.300 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -4.950 -12.611 -7.748 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -6.070 -11.501 -8.573 1.00 0.00 H new ATOM 1552 N GLU A 99 -4.470 -12.098 -11.805 1.00 0.00 N ATOM 1553 CA GLU A 99 -4.879 -11.837 -13.178 1.00 0.00 C ATOM 1554 C GLU A 99 -6.375 -12.078 -13.330 1.00 0.00 C ATOM 1555 O GLU A 99 -6.868 -13.170 -13.045 1.00 0.00 O ATOM 1556 CB GLU A 99 -4.119 -12.747 -14.147 1.00 0.00 C ATOM 1557 CG GLU A 99 -2.609 -12.598 -14.082 1.00 0.00 C ATOM 1558 CD GLU A 99 -1.893 -13.533 -15.032 1.00 0.00 C ATOM 1559 OE1 GLU A 99 -1.689 -13.162 -16.205 1.00 0.00 O ATOM 1560 OE2 GLU A 99 -1.521 -14.648 -14.610 1.00 0.00 O ATOM 0 H GLU A 99 -4.112 -13.040 -11.649 1.00 0.00 H new ATOM 0 HA GLU A 99 -4.650 -10.797 -13.413 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -4.381 -13.784 -13.936 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -4.451 -12.535 -15.163 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -2.338 -11.569 -14.317 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -2.272 -12.791 -13.064 1.00 0.00 H new ATOM 1567 N THR A 100 -7.097 -11.059 -13.756 1.00 0.00 N ATOM 1568 CA THR A 100 -8.526 -11.176 -13.978 1.00 0.00 C ATOM 1569 C THR A 100 -8.924 -10.313 -15.174 1.00 0.00 C ATOM 1570 O THR A 100 -8.215 -9.369 -15.521 1.00 0.00 O ATOM 1571 CB THR A 100 -9.306 -10.759 -12.714 1.00 0.00 C ATOM 1572 OG1 THR A 100 -8.737 -11.411 -11.567 1.00 0.00 O ATOM 1573 CG2 THR A 100 -10.776 -11.133 -12.815 1.00 0.00 C ATOM 0 H THR A 100 -6.714 -10.135 -13.956 1.00 0.00 H new ATOM 0 HA THR A 100 -8.774 -12.215 -14.193 1.00 0.00 H new ATOM 0 HB THR A 100 -9.233 -9.676 -12.616 1.00 0.00 H new ATOM 0 HG1 THR A 100 -9.435 -11.558 -10.895 1.00 0.00 H new ATOM 0 HG21 THR A 100 -11.293 -10.824 -11.907 1.00 0.00 H new ATOM 0 HG22 THR A 100 -11.221 -10.632 -13.675 1.00 0.00 H new ATOM 0 HG23 THR A 100 -10.869 -12.212 -12.936 1.00 0.00 H new ATOM 1581 N ALA A 101 -10.049 -10.634 -15.800 1.00 0.00 N ATOM 1582 CA ALA A 101 -10.453 -9.974 -17.039 1.00 0.00 C ATOM 1583 C ALA A 101 -10.901 -8.541 -16.788 1.00 0.00 C ATOM 1584 O ALA A 101 -10.827 -7.694 -17.676 1.00 0.00 O ATOM 1585 CB ALA A 101 -11.556 -10.764 -17.723 1.00 0.00 C ATOM 0 H ALA A 101 -10.700 -11.348 -15.471 1.00 0.00 H new ATOM 0 HA ALA A 101 -9.584 -9.939 -17.696 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -11.847 -10.260 -18.645 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -11.195 -11.766 -17.956 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -12.418 -10.834 -17.060 1.00 0.00 H new ATOM 1591 N GLU A 102 -11.361 -8.273 -15.573 1.00 0.00 N ATOM 1592 CA GLU A 102 -11.787 -6.931 -15.201 1.00 0.00 C ATOM 1593 C GLU A 102 -10.588 -6.035 -14.929 1.00 0.00 C ATOM 1594 O GLU A 102 -10.718 -4.811 -14.866 1.00 0.00 O ATOM 1595 CB GLU A 102 -12.689 -6.978 -13.968 1.00 0.00 C ATOM 1596 CG GLU A 102 -14.054 -7.581 -14.236 1.00 0.00 C ATOM 1597 CD GLU A 102 -14.812 -6.833 -15.312 1.00 0.00 C ATOM 1598 OE1 GLU A 102 -14.971 -5.601 -15.187 1.00 0.00 O ATOM 1599 OE2 GLU A 102 -15.269 -7.474 -16.279 1.00 0.00 O ATOM 0 H GLU A 102 -11.448 -8.966 -14.830 1.00 0.00 H new ATOM 0 HA GLU A 102 -12.349 -6.515 -16.037 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -12.193 -7.555 -13.187 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -12.817 -5.966 -13.583 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -13.936 -8.622 -14.535 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -14.637 -7.578 -13.315 1.00 0.00 H new ATOM 1606 N GLY A 103 -9.426 -6.650 -14.774 1.00 0.00 N ATOM 1607 CA GLY A 103 -8.230 -5.910 -14.453 1.00 0.00 C ATOM 1608 C GLY A 103 -7.398 -6.625 -13.414 1.00 0.00 C ATOM 1609 O GLY A 103 -7.663 -7.785 -13.089 1.00 0.00 O ATOM 0 H GLY A 103 -9.292 -7.657 -14.866 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -7.638 -5.763 -15.357 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -8.501 -4.920 -14.085 1.00 0.00 H new ATOM 1613 N THR A 104 -6.402 -5.940 -12.889 1.00 0.00 N ATOM 1614 CA THR A 104 -5.522 -6.520 -11.893 1.00 0.00 C ATOM 1615 C THR A 104 -6.174 -6.465 -10.514 1.00 0.00 C ATOM 1616 O THR A 104 -6.376 -5.386 -9.954 1.00 0.00 O ATOM 1617 CB THR A 104 -4.173 -5.776 -11.855 1.00 0.00 C ATOM 1618 OG1 THR A 104 -3.631 -5.682 -13.179 1.00 0.00 O ATOM 1619 CG2 THR A 104 -3.181 -6.496 -10.952 1.00 0.00 C ATOM 0 H THR A 104 -6.181 -4.976 -13.137 1.00 0.00 H new ATOM 0 HA THR A 104 -5.342 -7.560 -12.166 1.00 0.00 H new ATOM 0 HB THR A 104 -4.346 -4.776 -11.456 1.00 0.00 H new ATOM 0 HG1 THR A 104 -4.046 -4.929 -13.650 1.00 0.00 H new ATOM 0 HG21 THR A 104 -2.237 -5.952 -10.942 1.00 0.00 H new ATOM 0 HG22 THR A 104 -3.581 -6.547 -9.939 1.00 0.00 H new ATOM 0 HG23 THR A 104 -3.014 -7.506 -11.327 1.00 0.00 H new ATOM 1627 N VAL A 105 -6.523 -7.628 -9.982 1.00 0.00 N ATOM 1628 CA VAL A 105 -7.131 -7.700 -8.663 1.00 0.00 C ATOM 1629 C VAL A 105 -6.049 -7.681 -7.598 1.00 0.00 C ATOM 1630 O VAL A 105 -5.255 -8.615 -7.492 1.00 0.00 O ATOM 1631 CB VAL A 105 -7.997 -8.967 -8.493 1.00 0.00 C ATOM 1632 CG1 VAL A 105 -8.601 -9.025 -7.095 1.00 0.00 C ATOM 1633 CG2 VAL A 105 -9.090 -9.013 -9.547 1.00 0.00 C ATOM 0 H VAL A 105 -6.396 -8.530 -10.441 1.00 0.00 H new ATOM 0 HA VAL A 105 -7.782 -6.833 -8.554 1.00 0.00 H new ATOM 0 HB VAL A 105 -7.355 -9.838 -8.624 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -9.207 -9.926 -6.998 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -7.802 -9.043 -6.354 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -9.227 -8.147 -6.932 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -9.689 -9.913 -9.411 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -9.727 -8.134 -9.449 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -8.639 -9.025 -10.539 1.00 0.00 H new ATOM 1643 N MET A 106 -6.000 -6.606 -6.835 1.00 0.00 N ATOM 1644 CA MET A 106 -5.011 -6.477 -5.783 1.00 0.00 C ATOM 1645 C MET A 106 -5.665 -6.625 -4.419 1.00 0.00 C ATOM 1646 O MET A 106 -6.591 -5.886 -4.074 1.00 0.00 O ATOM 1647 CB MET A 106 -4.288 -5.136 -5.880 1.00 0.00 C ATOM 1648 CG MET A 106 -3.241 -4.931 -4.797 1.00 0.00 C ATOM 1649 SD MET A 106 -2.488 -3.298 -4.873 1.00 0.00 S ATOM 1650 CE MET A 106 -3.954 -2.277 -4.792 1.00 0.00 C ATOM 0 H MET A 106 -6.632 -5.811 -6.924 1.00 0.00 H new ATOM 0 HA MET A 106 -4.276 -7.273 -5.907 1.00 0.00 H new ATOM 0 HB2 MET A 106 -3.809 -5.060 -6.856 1.00 0.00 H new ATOM 0 HB3 MET A 106 -5.022 -4.332 -5.822 1.00 0.00 H new ATOM 0 HG2 MET A 106 -3.701 -5.071 -3.819 1.00 0.00 H new ATOM 0 HG3 MET A 106 -2.466 -5.691 -4.896 1.00 0.00 H new ATOM 0 HE1 MET A 106 -3.705 -1.259 -5.091 1.00 0.00 H new ATOM 0 HE2 MET A 106 -4.714 -2.677 -5.463 1.00 0.00 H new ATOM 0 HE3 MET A 106 -4.338 -2.272 -3.772 1.00 0.00 H new ATOM 1660 N ARG A 107 -5.187 -7.590 -3.658 1.00 0.00 N ATOM 1661 CA ARG A 107 -5.685 -7.824 -2.316 1.00 0.00 C ATOM 1662 C ARG A 107 -4.861 -7.039 -1.315 1.00 0.00 C ATOM 1663 O ARG A 107 -3.651 -7.228 -1.223 1.00 0.00 O ATOM 1664 CB ARG A 107 -5.615 -9.307 -1.957 1.00 0.00 C ATOM 1665 CG ARG A 107 -6.280 -10.219 -2.966 1.00 0.00 C ATOM 1666 CD ARG A 107 -6.167 -11.672 -2.546 1.00 0.00 C ATOM 1667 NE ARG A 107 -6.654 -12.571 -3.583 1.00 0.00 N ATOM 1668 CZ ARG A 107 -7.719 -13.352 -3.448 1.00 0.00 C ATOM 1669 NH1 ARG A 107 -8.418 -13.329 -2.322 1.00 0.00 N ATOM 1670 NH2 ARG A 107 -8.085 -14.154 -4.436 1.00 0.00 N ATOM 0 H ARG A 107 -4.448 -8.230 -3.949 1.00 0.00 H new ATOM 0 HA ARG A 107 -6.725 -7.499 -2.283 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -4.569 -9.596 -1.856 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -6.083 -9.457 -0.984 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -7.331 -9.948 -3.069 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -5.818 -10.083 -3.944 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -5.127 -11.906 -2.321 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -6.735 -11.831 -1.630 1.00 0.00 H new ATOM 0 HE ARG A 107 -6.146 -12.603 -4.467 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -8.137 -12.712 -1.560 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -9.236 -13.929 -2.217 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -7.548 -14.173 -5.303 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -8.904 -14.753 -4.330 1.00 0.00 H new ATOM 1684 N TRP A 108 -5.508 -6.144 -0.594 1.00 0.00 N ATOM 1685 CA TRP A 108 -4.865 -5.449 0.504 1.00 0.00 C ATOM 1686 C TRP A 108 -5.116 -6.202 1.798 1.00 0.00 C ATOM 1687 O TRP A 108 -6.080 -5.927 2.508 1.00 0.00 O ATOM 1688 CB TRP A 108 -5.376 -4.012 0.615 1.00 0.00 C ATOM 1689 CG TRP A 108 -4.371 -2.996 0.177 1.00 0.00 C ATOM 1690 CD1 TRP A 108 -3.736 -2.938 -1.030 1.00 0.00 C ATOM 1691 CD2 TRP A 108 -3.884 -1.890 0.945 1.00 0.00 C ATOM 1692 NE1 TRP A 108 -2.883 -1.863 -1.057 1.00 0.00 N ATOM 1693 CE2 TRP A 108 -2.956 -1.204 0.142 1.00 0.00 C ATOM 1694 CE3 TRP A 108 -4.143 -1.413 2.232 1.00 0.00 C ATOM 1695 CZ2 TRP A 108 -2.285 -0.067 0.584 1.00 0.00 C ATOM 1696 CZ3 TRP A 108 -3.477 -0.285 2.670 1.00 0.00 C ATOM 1697 CH2 TRP A 108 -2.558 0.378 1.848 1.00 0.00 C ATOM 0 H TRP A 108 -6.481 -5.881 -0.749 1.00 0.00 H new ATOM 0 HA TRP A 108 -3.793 -5.408 0.313 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -6.278 -3.906 0.012 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -5.659 -3.812 1.649 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -3.883 -3.634 -1.843 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -2.290 -1.597 -1.843 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -4.851 -1.917 2.873 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -1.575 0.445 -0.048 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -3.669 0.092 3.664 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -2.055 1.258 2.219 1.00 0.00 H new ATOM 1708 N THR A 109 -4.272 -7.182 2.071 1.00 0.00 N ATOM 1709 CA THR A 109 -4.425 -8.007 3.253 1.00 0.00 C ATOM 1710 C THR A 109 -3.544 -7.487 4.379 1.00 0.00 C ATOM 1711 O THR A 109 -2.323 -7.621 4.334 1.00 0.00 O ATOM 1712 CB THR A 109 -4.054 -9.476 2.966 1.00 0.00 C ATOM 1713 OG1 THR A 109 -4.698 -9.927 1.765 1.00 0.00 O ATOM 1714 CG2 THR A 109 -4.462 -10.369 4.130 1.00 0.00 C ATOM 0 H THR A 109 -3.472 -7.425 1.487 1.00 0.00 H new ATOM 0 HA THR A 109 -5.473 -7.960 3.549 1.00 0.00 H new ATOM 0 HB THR A 109 -2.973 -9.535 2.837 1.00 0.00 H new ATOM 0 HG1 THR A 109 -4.453 -10.860 1.593 1.00 0.00 H new ATOM 0 HG21 THR A 109 -4.192 -11.402 3.909 1.00 0.00 H new ATOM 0 HG22 THR A 109 -3.947 -10.045 5.035 1.00 0.00 H new ATOM 0 HG23 THR A 109 -5.539 -10.300 4.281 1.00 0.00 H new ATOM 1722 N GLN A 110 -4.156 -6.880 5.381 1.00 0.00 N ATOM 1723 CA GLN A 110 -3.405 -6.376 6.513 1.00 0.00 C ATOM 1724 C GLN A 110 -3.325 -7.429 7.608 1.00 0.00 C ATOM 1725 O GLN A 110 -4.338 -7.803 8.206 1.00 0.00 O ATOM 1726 CB GLN A 110 -4.022 -5.087 7.056 1.00 0.00 C ATOM 1727 CG GLN A 110 -4.016 -3.944 6.056 1.00 0.00 C ATOM 1728 CD GLN A 110 -4.411 -2.622 6.683 1.00 0.00 C ATOM 1729 OE1 GLN A 110 -5.165 -2.582 7.650 1.00 0.00 O ATOM 1730 NE2 GLN A 110 -3.901 -1.528 6.136 1.00 0.00 N ATOM 0 H GLN A 110 -5.163 -6.726 5.432 1.00 0.00 H new ATOM 0 HA GLN A 110 -2.395 -6.147 6.172 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -5.049 -5.286 7.362 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -3.477 -4.781 7.949 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -3.021 -3.853 5.620 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -4.702 -4.175 5.241 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -3.277 -1.603 5.332 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -4.132 -0.611 6.519 1.00 0.00 H new ATOM 1739 N ASP A 111 -2.120 -7.929 7.825 1.00 0.00 N ATOM 1740 CA ASP A 111 -1.846 -8.862 8.906 1.00 0.00 C ATOM 1741 C ASP A 111 -1.253 -8.095 10.074 1.00 0.00 C ATOM 1742 O ASP A 111 -0.070 -7.747 10.066 1.00 0.00 O ATOM 1743 CB ASP A 111 -0.876 -9.955 8.436 1.00 0.00 C ATOM 1744 CG ASP A 111 -0.516 -10.949 9.526 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -1.295 -11.901 9.751 1.00 0.00 O ATOM 1746 OD2 ASP A 111 0.567 -10.815 10.131 1.00 0.00 O ATOM 0 H ASP A 111 -1.304 -7.700 7.257 1.00 0.00 H new ATOM 0 HA ASP A 111 -2.772 -9.345 9.217 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -1.322 -10.491 7.598 1.00 0.00 H new ATOM 0 HB3 ASP A 111 0.036 -9.487 8.066 1.00 0.00 H new ATOM 1751 N PHE A 112 -2.084 -7.782 11.051 1.00 0.00 N ATOM 1752 CA PHE A 112 -1.652 -6.950 12.156 1.00 0.00 C ATOM 1753 C PHE A 112 -1.935 -7.605 13.499 1.00 0.00 C ATOM 1754 O PHE A 112 -3.076 -7.881 13.851 1.00 0.00 O ATOM 1755 CB PHE A 112 -2.299 -5.558 12.083 1.00 0.00 C ATOM 1756 CG PHE A 112 -3.801 -5.555 11.961 1.00 0.00 C ATOM 1757 CD1 PHE A 112 -4.411 -5.664 10.721 1.00 0.00 C ATOM 1758 CD2 PHE A 112 -4.602 -5.425 13.086 1.00 0.00 C ATOM 1759 CE1 PHE A 112 -5.786 -5.650 10.604 1.00 0.00 C ATOM 1760 CE2 PHE A 112 -5.979 -5.407 12.973 1.00 0.00 C ATOM 1761 CZ PHE A 112 -6.573 -5.521 11.733 1.00 0.00 C ATOM 0 H PHE A 112 -3.055 -8.089 11.101 1.00 0.00 H new ATOM 0 HA PHE A 112 -0.572 -6.832 12.069 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -2.022 -4.999 12.977 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -1.880 -5.024 11.230 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -3.802 -5.761 9.834 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -4.145 -5.337 14.060 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -6.247 -5.740 9.631 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -6.591 -5.304 13.857 1.00 0.00 H new ATOM 0 HZ PHE A 112 -7.649 -5.509 11.645 1.00 0.00 H new ATOM 1771 N ALA A 113 -0.875 -7.865 14.241 1.00 0.00 N ATOM 1772 CA ALA A 113 -0.999 -8.358 15.595 1.00 0.00 C ATOM 1773 C ALA A 113 -1.060 -7.169 16.535 1.00 0.00 C ATOM 1774 O ALA A 113 -0.194 -6.298 16.488 1.00 0.00 O ATOM 1775 CB ALA A 113 0.165 -9.270 15.947 1.00 0.00 C ATOM 0 H ALA A 113 0.087 -7.741 13.924 1.00 0.00 H new ATOM 0 HA ALA A 113 -1.911 -8.948 15.690 1.00 0.00 H new ATOM 0 HB1 ALA A 113 0.050 -9.628 16.970 1.00 0.00 H new ATOM 0 HB2 ALA A 113 0.181 -10.120 15.264 1.00 0.00 H new ATOM 0 HB3 ALA A 113 1.100 -8.717 15.859 1.00 0.00 H new ATOM 1781 N MET A 114 -2.088 -7.117 17.362 1.00 0.00 N ATOM 1782 CA MET A 114 -2.296 -5.980 18.249 1.00 0.00 C ATOM 1783 C MET A 114 -3.411 -6.291 19.231 1.00 0.00 C ATOM 1784 O MET A 114 -4.318 -7.063 18.917 1.00 0.00 O ATOM 1785 CB MET A 114 -2.646 -4.727 17.433 1.00 0.00 C ATOM 1786 CG MET A 114 -2.882 -3.484 18.279 1.00 0.00 C ATOM 1787 SD MET A 114 -3.221 -2.022 17.283 1.00 0.00 S ATOM 1788 CE MET A 114 -4.666 -2.561 16.376 1.00 0.00 C ATOM 0 H MET A 114 -2.795 -7.848 17.440 1.00 0.00 H new ATOM 0 HA MET A 114 -1.376 -5.790 18.802 1.00 0.00 H new ATOM 0 HB2 MET A 114 -1.838 -4.527 16.729 1.00 0.00 H new ATOM 0 HB3 MET A 114 -3.540 -4.928 16.843 1.00 0.00 H new ATOM 0 HG2 MET A 114 -3.720 -3.662 18.953 1.00 0.00 H new ATOM 0 HG3 MET A 114 -2.006 -3.300 18.901 1.00 0.00 H new ATOM 0 HE1 MET A 114 -5.193 -1.692 15.981 1.00 0.00 H new ATOM 0 HE2 MET A 114 -4.359 -3.205 15.552 1.00 0.00 H new ATOM 0 HE3 MET A 114 -5.328 -3.115 17.042 1.00 0.00 H new ATOM 1798 N LYS A 115 -3.334 -5.703 20.413 1.00 0.00 N ATOM 1799 CA LYS A 115 -4.347 -5.912 21.432 1.00 0.00 C ATOM 1800 C LYS A 115 -4.367 -4.747 22.431 1.00 0.00 C ATOM 1801 O LYS A 115 -5.435 -4.195 22.707 1.00 0.00 O ATOM 1802 CB LYS A 115 -4.121 -7.253 22.139 1.00 0.00 C ATOM 1803 CG LYS A 115 -5.327 -7.734 22.921 1.00 0.00 C ATOM 1804 CD LYS A 115 -5.259 -9.228 23.171 1.00 0.00 C ATOM 1805 CE LYS A 115 -6.543 -9.744 23.799 1.00 0.00 C ATOM 1806 NZ LYS A 115 -7.746 -9.380 23.000 1.00 0.00 N ATOM 0 H LYS A 115 -2.579 -5.076 20.690 1.00 0.00 H new ATOM 0 HA LYS A 115 -5.324 -5.945 20.950 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -3.855 -8.006 21.397 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -3.272 -7.159 22.816 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -5.381 -7.206 23.873 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -6.238 -7.496 22.372 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -5.078 -9.748 22.230 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -4.417 -9.451 23.826 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -6.488 -10.828 23.896 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -6.641 -9.339 24.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -8.534 -10.010 23.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -8.012 -8.395 23.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -7.533 -9.481 21.987 1.00 0.00 H new ATOM 1820 N PRO A 116 -3.203 -4.343 22.993 1.00 0.00 N ATOM 1821 CA PRO A 116 -3.128 -3.170 23.873 1.00 0.00 C ATOM 1822 C PRO A 116 -3.466 -1.879 23.138 1.00 0.00 C ATOM 1823 O PRO A 116 -3.090 -1.707 21.976 1.00 0.00 O ATOM 1824 CB PRO A 116 -1.666 -3.141 24.334 1.00 0.00 C ATOM 1825 CG PRO A 116 -1.154 -4.513 24.074 1.00 0.00 C ATOM 1826 CD PRO A 116 -1.887 -4.995 22.859 1.00 0.00 C ATOM 0 HA PRO A 116 -3.843 -3.241 24.693 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -1.093 -2.395 23.783 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -1.590 -2.885 25.391 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -0.077 -4.504 23.904 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -1.336 -5.167 24.927 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -1.382 -4.702 21.939 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -1.973 -6.081 22.843 1.00 0.00 H new ATOM 1834 N ASP A 117 -4.212 -1.002 23.814 1.00 0.00 N ATOM 1835 CA ASP A 117 -4.582 0.324 23.296 1.00 0.00 C ATOM 1836 C ASP A 117 -5.687 0.226 22.241 1.00 0.00 C ATOM 1837 O ASP A 117 -6.391 1.201 21.973 1.00 0.00 O ATOM 1838 CB ASP A 117 -3.358 1.070 22.738 1.00 0.00 C ATOM 1839 CG ASP A 117 -3.678 2.487 22.296 1.00 0.00 C ATOM 1840 OD1 ASP A 117 -4.092 3.305 23.148 1.00 0.00 O ATOM 1841 OD2 ASP A 117 -3.510 2.797 21.099 1.00 0.00 O ATOM 0 H ASP A 117 -4.581 -1.191 24.746 1.00 0.00 H new ATOM 0 HA ASP A 117 -4.972 0.900 24.135 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -2.579 1.100 23.500 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -2.955 0.514 21.892 1.00 0.00 H new ATOM 1846 N ALA A 118 -5.861 -0.959 21.674 1.00 0.00 N ATOM 1847 CA ALA A 118 -6.882 -1.186 20.665 1.00 0.00 C ATOM 1848 C ALA A 118 -8.076 -1.932 21.254 1.00 0.00 C ATOM 1849 O ALA A 118 -7.998 -3.129 21.532 1.00 0.00 O ATOM 1850 CB ALA A 118 -6.302 -1.958 19.493 1.00 0.00 C ATOM 0 H ALA A 118 -5.303 -1.783 21.899 1.00 0.00 H new ATOM 0 HA ALA A 118 -7.230 -0.216 20.309 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -7.078 -2.121 18.745 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -5.485 -1.388 19.050 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -5.926 -2.920 19.841 1.00 0.00 H new ATOM 1856 N PRO A 119 -9.204 -1.233 21.442 1.00 0.00 N ATOM 1857 CA PRO A 119 -10.424 -1.805 22.007 1.00 0.00 C ATOM 1858 C PRO A 119 -11.288 -2.464 20.937 1.00 0.00 C ATOM 1859 O PRO A 119 -12.515 -2.492 21.032 1.00 0.00 O ATOM 1860 CB PRO A 119 -11.149 -0.583 22.596 1.00 0.00 C ATOM 1861 CG PRO A 119 -10.378 0.628 22.155 1.00 0.00 C ATOM 1862 CD PRO A 119 -9.393 0.177 21.114 1.00 0.00 C ATOM 0 HA PRO A 119 -10.214 -2.586 22.738 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -12.179 -0.536 22.243 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -11.188 -0.643 23.684 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -11.050 1.383 21.747 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -9.862 1.084 23.000 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -9.782 0.309 20.104 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -8.459 0.735 21.172 1.00 0.00 H new ATOM 1870 N VAL A 120 -10.634 -3.015 19.931 1.00 0.00 N ATOM 1871 CA VAL A 120 -11.322 -3.565 18.777 1.00 0.00 C ATOM 1872 C VAL A 120 -11.570 -5.059 18.932 1.00 0.00 C ATOM 1873 O VAL A 120 -11.063 -5.693 19.855 1.00 0.00 O ATOM 1874 CB VAL A 120 -10.520 -3.307 17.488 1.00 0.00 C ATOM 1875 CG1 VAL A 120 -10.337 -1.812 17.272 1.00 0.00 C ATOM 1876 CG2 VAL A 120 -9.173 -4.013 17.540 1.00 0.00 C ATOM 0 H VAL A 120 -9.618 -3.094 19.890 1.00 0.00 H new ATOM 0 HA VAL A 120 -12.286 -3.061 18.708 1.00 0.00 H new ATOM 0 HB VAL A 120 -11.080 -3.713 16.645 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -9.768 -1.643 16.357 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -11.313 -1.335 17.186 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -9.798 -1.385 18.118 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -8.624 -3.817 16.619 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -8.600 -3.642 18.390 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -9.329 -5.086 17.648 1.00 0.00 H new ATOM 1886 N ASP A 121 -12.359 -5.604 18.019 1.00 0.00 N ATOM 1887 CA ASP A 121 -12.689 -7.025 18.017 1.00 0.00 C ATOM 1888 C ASP A 121 -12.329 -7.621 16.656 1.00 0.00 C ATOM 1889 O ASP A 121 -13.010 -8.507 16.143 1.00 0.00 O ATOM 1890 CB ASP A 121 -14.187 -7.200 18.318 1.00 0.00 C ATOM 1891 CG ASP A 121 -14.610 -8.651 18.474 1.00 0.00 C ATOM 1892 OD1 ASP A 121 -14.047 -9.352 19.338 1.00 0.00 O ATOM 1893 OD2 ASP A 121 -15.536 -9.082 17.756 1.00 0.00 O ATOM 0 H ASP A 121 -12.789 -5.077 17.259 1.00 0.00 H new ATOM 0 HA ASP A 121 -12.120 -7.547 18.786 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -14.431 -6.659 19.232 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -14.766 -6.746 17.514 1.00 0.00 H new ATOM 1898 N ASP A 122 -11.234 -7.110 16.084 1.00 0.00 N ATOM 1899 CA ASP A 122 -10.781 -7.484 14.735 1.00 0.00 C ATOM 1900 C ASP A 122 -11.744 -6.975 13.667 1.00 0.00 C ATOM 1901 O ASP A 122 -11.414 -6.054 12.920 1.00 0.00 O ATOM 1902 CB ASP A 122 -10.585 -9.003 14.603 1.00 0.00 C ATOM 1903 CG ASP A 122 -10.405 -9.451 13.161 1.00 0.00 C ATOM 1904 OD1 ASP A 122 -9.334 -9.193 12.576 1.00 0.00 O ATOM 1905 OD2 ASP A 122 -11.340 -10.072 12.615 1.00 0.00 O ATOM 0 H ASP A 122 -10.634 -6.424 16.542 1.00 0.00 H new ATOM 0 HA ASP A 122 -9.813 -7.007 14.579 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -9.713 -9.304 15.184 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -11.446 -9.515 15.033 1.00 0.00 H new ATOM 1910 N ALA A 123 -12.950 -7.536 13.641 1.00 0.00 N ATOM 1911 CA ALA A 123 -13.949 -7.199 12.630 1.00 0.00 C ATOM 1912 C ALA A 123 -14.347 -5.725 12.692 1.00 0.00 C ATOM 1913 O ALA A 123 -14.841 -5.166 11.711 1.00 0.00 O ATOM 1914 CB ALA A 123 -15.175 -8.085 12.785 1.00 0.00 C ATOM 0 H ALA A 123 -13.262 -8.234 14.317 1.00 0.00 H new ATOM 0 HA ALA A 123 -13.501 -7.376 11.652 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -15.912 -7.823 12.025 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -14.887 -9.129 12.666 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -15.607 -7.938 13.775 1.00 0.00 H new ATOM 1920 N TRP A 124 -14.134 -5.095 13.845 1.00 0.00 N ATOM 1921 CA TRP A 124 -14.383 -3.670 13.980 1.00 0.00 C ATOM 1922 C TRP A 124 -13.437 -2.900 13.062 1.00 0.00 C ATOM 1923 O TRP A 124 -13.837 -1.960 12.371 1.00 0.00 O ATOM 1924 CB TRP A 124 -14.198 -3.240 15.439 1.00 0.00 C ATOM 1925 CG TRP A 124 -14.510 -1.796 15.684 1.00 0.00 C ATOM 1926 CD1 TRP A 124 -13.628 -0.820 16.042 1.00 0.00 C ATOM 1927 CD2 TRP A 124 -15.791 -1.165 15.585 1.00 0.00 C ATOM 1928 NE1 TRP A 124 -14.282 0.379 16.181 1.00 0.00 N ATOM 1929 CE2 TRP A 124 -15.610 0.193 15.905 1.00 0.00 C ATOM 1930 CE3 TRP A 124 -17.073 -1.618 15.262 1.00 0.00 C ATOM 1931 CZ2 TRP A 124 -16.663 1.103 15.905 1.00 0.00 C ATOM 1932 CZ3 TRP A 124 -18.117 -0.712 15.261 1.00 0.00 C ATOM 1933 CH2 TRP A 124 -17.906 0.634 15.584 1.00 0.00 C ATOM 0 H TRP A 124 -13.792 -5.549 14.692 1.00 0.00 H new ATOM 0 HA TRP A 124 -15.410 -3.449 13.689 1.00 0.00 H new ATOM 0 HB2 TRP A 124 -14.837 -3.854 16.073 1.00 0.00 H new ATOM 0 HB3 TRP A 124 -13.169 -3.436 15.739 1.00 0.00 H new ATOM 0 HD1 TRP A 124 -12.569 -0.968 16.194 1.00 0.00 H new ATOM 0 HE1 TRP A 124 -13.849 1.264 16.446 1.00 0.00 H new ATOM 0 HE3 TRP A 124 -17.245 -2.656 15.018 1.00 0.00 H new ATOM 0 HZ2 TRP A 124 -16.504 2.143 16.150 1.00 0.00 H new ATOM 0 HZ3 TRP A 124 -19.112 -1.048 15.007 1.00 0.00 H new ATOM 0 HH2 TRP A 124 -18.743 1.316 15.579 1.00 0.00 H new ATOM 1944 N MET A 125 -12.188 -3.342 13.030 1.00 0.00 N ATOM 1945 CA MET A 125 -11.192 -2.742 12.162 1.00 0.00 C ATOM 1946 C MET A 125 -11.362 -3.260 10.744 1.00 0.00 C ATOM 1947 O MET A 125 -11.192 -2.516 9.793 1.00 0.00 O ATOM 1948 CB MET A 125 -9.775 -3.029 12.663 1.00 0.00 C ATOM 1949 CG MET A 125 -9.453 -2.348 13.981 1.00 0.00 C ATOM 1950 SD MET A 125 -7.772 -2.673 14.546 1.00 0.00 S ATOM 1951 CE MET A 125 -6.816 -1.848 13.274 1.00 0.00 C ATOM 0 H MET A 125 -11.842 -4.116 13.597 1.00 0.00 H new ATOM 0 HA MET A 125 -11.338 -1.662 12.171 1.00 0.00 H new ATOM 0 HB2 MET A 125 -9.649 -4.106 12.778 1.00 0.00 H new ATOM 0 HB3 MET A 125 -9.058 -2.703 11.909 1.00 0.00 H new ATOM 0 HG2 MET A 125 -9.593 -1.272 13.872 1.00 0.00 H new ATOM 0 HG3 MET A 125 -10.158 -2.686 14.741 1.00 0.00 H new ATOM 0 HE1 MET A 125 -5.886 -1.475 13.702 1.00 0.00 H new ATOM 0 HE2 MET A 125 -6.590 -2.553 12.474 1.00 0.00 H new ATOM 0 HE3 MET A 125 -7.390 -1.014 12.871 1.00 0.00 H new ATOM 1961 N THR A 126 -11.718 -4.533 10.613 1.00 0.00 N ATOM 1962 CA THR A 126 -11.953 -5.134 9.306 1.00 0.00 C ATOM 1963 C THR A 126 -12.968 -4.324 8.503 1.00 0.00 C ATOM 1964 O THR A 126 -12.747 -4.018 7.334 1.00 0.00 O ATOM 1965 CB THR A 126 -12.453 -6.582 9.449 1.00 0.00 C ATOM 1966 OG1 THR A 126 -11.555 -7.325 10.279 1.00 0.00 O ATOM 1967 CG2 THR A 126 -12.569 -7.258 8.092 1.00 0.00 C ATOM 0 H THR A 126 -11.850 -5.170 11.399 1.00 0.00 H new ATOM 0 HA THR A 126 -11.002 -5.136 8.774 1.00 0.00 H new ATOM 0 HB THR A 126 -13.442 -6.556 9.906 1.00 0.00 H new ATOM 0 HG1 THR A 126 -11.490 -6.895 11.157 1.00 0.00 H new ATOM 0 HG21 THR A 126 -12.924 -8.280 8.224 1.00 0.00 H new ATOM 0 HG22 THR A 126 -13.274 -6.706 7.470 1.00 0.00 H new ATOM 0 HG23 THR A 126 -11.592 -7.273 7.608 1.00 0.00 H new ATOM 1975 N ASP A 127 -14.072 -3.962 9.146 1.00 0.00 N ATOM 1976 CA ASP A 127 -15.108 -3.169 8.496 1.00 0.00 C ATOM 1977 C ASP A 127 -14.596 -1.765 8.179 1.00 0.00 C ATOM 1978 O ASP A 127 -14.682 -1.306 7.039 1.00 0.00 O ATOM 1979 CB ASP A 127 -16.353 -3.089 9.381 1.00 0.00 C ATOM 1980 CG ASP A 127 -17.460 -2.264 8.756 1.00 0.00 C ATOM 1981 OD1 ASP A 127 -17.466 -1.033 8.943 1.00 0.00 O ATOM 1982 OD2 ASP A 127 -18.337 -2.843 8.082 1.00 0.00 O ATOM 0 H ASP A 127 -14.273 -4.205 10.116 1.00 0.00 H new ATOM 0 HA ASP A 127 -15.374 -3.659 7.559 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -16.721 -4.096 9.576 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -16.082 -2.657 10.344 1.00 0.00 H new ATOM 1987 N ASN A 128 -14.049 -1.096 9.192 1.00 0.00 N ATOM 1988 CA ASN A 128 -13.534 0.264 9.029 1.00 0.00 C ATOM 1989 C ASN A 128 -12.440 0.319 7.961 1.00 0.00 C ATOM 1990 O ASN A 128 -12.504 1.118 7.025 1.00 0.00 O ATOM 1991 CB ASN A 128 -12.980 0.781 10.360 1.00 0.00 C ATOM 1992 CG ASN A 128 -12.365 2.164 10.241 1.00 0.00 C ATOM 1993 OD1 ASN A 128 -12.832 3.007 9.474 1.00 0.00 O ATOM 1994 ND2 ASN A 128 -11.306 2.401 10.999 1.00 0.00 N ATOM 0 H ASN A 128 -13.950 -1.473 10.135 1.00 0.00 H new ATOM 0 HA ASN A 128 -14.360 0.898 8.707 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -13.782 0.807 11.097 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -12.228 0.084 10.731 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -10.845 3.310 10.961 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -10.951 1.675 11.621 1.00 0.00 H new ATOM 2001 N ILE A 129 -11.448 -0.549 8.101 1.00 0.00 N ATOM 2002 CA ILE A 129 -10.301 -0.573 7.206 1.00 0.00 C ATOM 2003 C ILE A 129 -10.709 -0.989 5.796 1.00 0.00 C ATOM 2004 O ILE A 129 -10.120 -0.531 4.820 1.00 0.00 O ATOM 2005 CB ILE A 129 -9.198 -1.516 7.739 1.00 0.00 C ATOM 2006 CG1 ILE A 129 -8.637 -0.980 9.059 1.00 0.00 C ATOM 2007 CG2 ILE A 129 -8.079 -1.683 6.721 1.00 0.00 C ATOM 2008 CD1 ILE A 129 -7.649 -1.915 9.722 1.00 0.00 C ATOM 0 H ILE A 129 -11.416 -1.255 8.837 1.00 0.00 H new ATOM 0 HA ILE A 129 -9.901 0.440 7.164 1.00 0.00 H new ATOM 0 HB ILE A 129 -9.645 -2.495 7.913 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -8.151 -0.022 8.875 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -9.463 -0.792 9.745 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -7.318 -2.351 7.123 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -8.484 -2.106 5.802 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -7.633 -0.712 6.508 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -7.294 -1.470 10.651 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -8.136 -2.866 9.938 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -6.804 -2.084 9.055 1.00 0.00 H new ATOM 2020 N ASN A 130 -11.722 -1.845 5.685 1.00 0.00 N ATOM 2021 CA ASN A 130 -12.233 -2.245 4.374 1.00 0.00 C ATOM 2022 C ASN A 130 -12.695 -1.014 3.609 1.00 0.00 C ATOM 2023 O ASN A 130 -12.397 -0.852 2.431 1.00 0.00 O ATOM 2024 CB ASN A 130 -13.399 -3.230 4.510 1.00 0.00 C ATOM 2025 CG ASN A 130 -13.775 -3.880 3.189 1.00 0.00 C ATOM 2026 OD1 ASN A 130 -14.529 -3.315 2.394 1.00 0.00 O ATOM 2027 ND2 ASN A 130 -13.274 -5.084 2.958 1.00 0.00 N ATOM 0 H ASN A 130 -12.202 -2.272 6.477 1.00 0.00 H new ATOM 0 HA ASN A 130 -11.428 -2.740 3.831 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -13.133 -4.005 5.229 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -14.266 -2.707 4.913 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -13.509 -5.577 2.097 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -12.653 -5.518 3.641 1.00 0.00 H new ATOM 2034 N ARG A 131 -13.407 -0.136 4.302 1.00 0.00 N ATOM 2035 CA ARG A 131 -13.898 1.098 3.703 1.00 0.00 C ATOM 2036 C ARG A 131 -12.746 2.072 3.483 1.00 0.00 C ATOM 2037 O ARG A 131 -12.610 2.659 2.408 1.00 0.00 O ATOM 2038 CB ARG A 131 -14.952 1.737 4.604 1.00 0.00 C ATOM 2039 CG ARG A 131 -16.027 0.765 5.050 1.00 0.00 C ATOM 2040 CD ARG A 131 -17.005 1.412 6.012 1.00 0.00 C ATOM 2041 NE ARG A 131 -17.862 0.418 6.649 1.00 0.00 N ATOM 2042 CZ ARG A 131 -19.175 0.327 6.462 1.00 0.00 C ATOM 2043 NH1 ARG A 131 -19.811 1.195 5.677 1.00 0.00 N ATOM 2044 NH2 ARG A 131 -19.854 -0.638 7.064 1.00 0.00 N ATOM 0 H ARG A 131 -13.658 -0.256 5.283 1.00 0.00 H new ATOM 0 HA ARG A 131 -14.350 0.861 2.740 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -14.463 2.156 5.483 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -15.419 2.567 4.073 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -16.566 0.394 4.178 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -15.562 -0.097 5.529 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -16.456 1.964 6.775 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -17.620 2.135 5.476 1.00 0.00 H new ATOM 0 HE ARG A 131 -17.424 -0.253 7.281 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -19.290 1.939 5.212 1.00 0.00 H new ATOM 0 HH12 ARG A 131 -20.819 1.116 5.541 1.00 0.00 H new ATOM 0 HH21 ARG A 131 -19.369 -1.304 7.666 1.00 0.00 H new ATOM 0 HH22 ARG A 131 -20.862 -0.715 6.926 1.00 0.00 H new ATOM 2058 N ASN A 132 -11.917 2.223 4.512 1.00 0.00 N ATOM 2059 CA ASN A 132 -10.762 3.119 4.468 1.00 0.00 C ATOM 2060 C ASN A 132 -9.829 2.766 3.312 1.00 0.00 C ATOM 2061 O ASN A 132 -9.566 3.595 2.440 1.00 0.00 O ATOM 2062 CB ASN A 132 -9.997 3.056 5.795 1.00 0.00 C ATOM 2063 CG ASN A 132 -8.715 3.873 5.780 1.00 0.00 C ATOM 2064 OD1 ASN A 132 -7.655 3.379 5.393 1.00 0.00 O ATOM 2065 ND2 ASN A 132 -8.791 5.117 6.227 1.00 0.00 N ATOM 0 H ASN A 132 -12.025 1.730 5.398 1.00 0.00 H new ATOM 0 HA ASN A 132 -11.129 4.133 4.309 1.00 0.00 H new ATOM 0 HB2 ASN A 132 -10.641 3.416 6.597 1.00 0.00 H new ATOM 0 HB3 ASN A 132 -9.757 2.017 6.021 1.00 0.00 H new ATOM 0 HD21 ASN A 132 -7.954 5.699 6.259 1.00 0.00 H new ATOM 0 HD22 ASN A 132 -9.686 5.493 6.539 1.00 0.00 H new ATOM 2072 N SER A 133 -9.351 1.528 3.299 1.00 0.00 N ATOM 2073 CA SER A 133 -8.397 1.086 2.294 1.00 0.00 C ATOM 2074 C SER A 133 -9.020 1.093 0.905 1.00 0.00 C ATOM 2075 O SER A 133 -8.352 1.419 -0.072 1.00 0.00 O ATOM 2076 CB SER A 133 -7.878 -0.311 2.629 1.00 0.00 C ATOM 2077 OG SER A 133 -7.319 -0.341 3.928 1.00 0.00 O ATOM 0 H SER A 133 -9.611 0.811 3.977 1.00 0.00 H new ATOM 0 HA SER A 133 -7.561 1.785 2.296 1.00 0.00 H new ATOM 0 HB2 SER A 133 -8.693 -1.032 2.562 1.00 0.00 H new ATOM 0 HB3 SER A 133 -7.127 -0.610 1.898 1.00 0.00 H new ATOM 0 HG SER A 133 -6.994 -1.245 4.124 1.00 0.00 H new ATOM 2083 N ARG A 134 -10.299 0.752 0.815 1.00 0.00 N ATOM 2084 CA ARG A 134 -10.980 0.749 -0.471 1.00 0.00 C ATOM 2085 C ARG A 134 -11.040 2.160 -1.032 1.00 0.00 C ATOM 2086 O ARG A 134 -10.725 2.377 -2.196 1.00 0.00 O ATOM 2087 CB ARG A 134 -12.388 0.173 -0.354 1.00 0.00 C ATOM 2088 CG ARG A 134 -13.039 -0.107 -1.696 1.00 0.00 C ATOM 2089 CD ARG A 134 -14.403 -0.755 -1.534 1.00 0.00 C ATOM 2090 NE ARG A 134 -14.337 -1.985 -0.746 1.00 0.00 N ATOM 2091 CZ ARG A 134 -14.905 -3.133 -1.107 1.00 0.00 C ATOM 2092 NH1 ARG A 134 -15.500 -3.240 -2.289 1.00 0.00 N ATOM 2093 NH2 ARG A 134 -14.859 -4.175 -0.291 1.00 0.00 N ATOM 0 H ARG A 134 -10.879 0.477 1.608 1.00 0.00 H new ATOM 0 HA ARG A 134 -10.412 0.113 -1.150 1.00 0.00 H new ATOM 0 HB2 ARG A 134 -12.347 -0.752 0.222 1.00 0.00 H new ATOM 0 HB3 ARG A 134 -13.012 0.870 0.206 1.00 0.00 H new ATOM 0 HG2 ARG A 134 -13.142 0.825 -2.252 1.00 0.00 H new ATOM 0 HG3 ARG A 134 -12.394 -0.759 -2.285 1.00 0.00 H new ATOM 0 HD2 ARG A 134 -15.083 -0.052 -1.052 1.00 0.00 H new ATOM 0 HD3 ARG A 134 -14.818 -0.977 -2.517 1.00 0.00 H new ATOM 0 HE ARG A 134 -13.824 -1.962 0.135 1.00 0.00 H new ATOM 0 HH11 ARG A 134 -15.522 -2.441 -2.923 1.00 0.00 H new ATOM 0 HH12 ARG A 134 -15.935 -4.121 -2.563 1.00 0.00 H new ATOM 0 HH21 ARG A 134 -14.389 -4.096 0.611 1.00 0.00 H new ATOM 0 HH22 ARG A 134 -15.293 -5.056 -0.564 1.00 0.00 H new ATOM 2107 N THR A 135 -11.425 3.113 -0.193 1.00 0.00 N ATOM 2108 CA THR A 135 -11.478 4.509 -0.600 1.00 0.00 C ATOM 2109 C THR A 135 -10.080 5.007 -0.969 1.00 0.00 C ATOM 2110 O THR A 135 -9.887 5.643 -2.006 1.00 0.00 O ATOM 2111 CB THR A 135 -12.056 5.394 0.522 1.00 0.00 C ATOM 2112 OG1 THR A 135 -13.288 4.835 1.001 1.00 0.00 O ATOM 2113 CG2 THR A 135 -12.301 6.813 0.027 1.00 0.00 C ATOM 0 H THR A 135 -11.705 2.944 0.773 1.00 0.00 H new ATOM 0 HA THR A 135 -12.131 4.577 -1.470 1.00 0.00 H new ATOM 0 HB THR A 135 -11.329 5.430 1.333 1.00 0.00 H new ATOM 0 HG1 THR A 135 -13.095 4.096 1.616 1.00 0.00 H new ATOM 0 HG21 THR A 135 -12.709 7.416 0.838 1.00 0.00 H new ATOM 0 HG22 THR A 135 -11.360 7.248 -0.311 1.00 0.00 H new ATOM 0 HG23 THR A 135 -13.009 6.792 -0.801 1.00 0.00 H new ATOM 2121 N GLN A 136 -9.109 4.683 -0.122 1.00 0.00 N ATOM 2122 CA GLN A 136 -7.727 5.089 -0.338 1.00 0.00 C ATOM 2123 C GLN A 136 -7.192 4.532 -1.655 1.00 0.00 C ATOM 2124 O GLN A 136 -6.649 5.268 -2.485 1.00 0.00 O ATOM 2125 CB GLN A 136 -6.849 4.607 0.819 1.00 0.00 C ATOM 2126 CG GLN A 136 -5.399 5.044 0.700 1.00 0.00 C ATOM 2127 CD GLN A 136 -5.235 6.545 0.820 1.00 0.00 C ATOM 2128 OE1 GLN A 136 -5.012 7.070 1.910 1.00 0.00 O ATOM 2129 NE2 GLN A 136 -5.356 7.248 -0.297 1.00 0.00 N ATOM 0 H GLN A 136 -9.257 4.136 0.726 1.00 0.00 H new ATOM 0 HA GLN A 136 -7.699 6.178 -0.385 1.00 0.00 H new ATOM 0 HB2 GLN A 136 -7.258 4.983 1.757 1.00 0.00 H new ATOM 0 HB3 GLN A 136 -6.890 3.519 0.867 1.00 0.00 H new ATOM 0 HG2 GLN A 136 -4.810 4.554 1.476 1.00 0.00 H new ATOM 0 HG3 GLN A 136 -5.001 4.714 -0.259 1.00 0.00 H new ATOM 0 HE21 GLN A 136 -5.541 6.773 -1.181 1.00 0.00 H new ATOM 0 HE22 GLN A 136 -5.264 8.264 -0.273 1.00 0.00 H new ATOM 2138 N MET A 137 -7.360 3.231 -1.849 1.00 0.00 N ATOM 2139 CA MET A 137 -6.829 2.567 -3.027 1.00 0.00 C ATOM 2140 C MET A 137 -7.684 2.849 -4.251 1.00 0.00 C ATOM 2141 O MET A 137 -7.263 2.589 -5.368 1.00 0.00 O ATOM 2142 CB MET A 137 -6.714 1.058 -2.801 1.00 0.00 C ATOM 2143 CG MET A 137 -5.786 0.688 -1.653 1.00 0.00 C ATOM 2144 SD MET A 137 -4.182 1.509 -1.760 1.00 0.00 S ATOM 2145 CE MET A 137 -3.555 0.852 -3.302 1.00 0.00 C ATOM 0 H MET A 137 -7.859 2.617 -1.206 1.00 0.00 H new ATOM 0 HA MET A 137 -5.832 2.969 -3.206 1.00 0.00 H new ATOM 0 HB2 MET A 137 -7.706 0.651 -2.602 1.00 0.00 H new ATOM 0 HB3 MET A 137 -6.354 0.587 -3.716 1.00 0.00 H new ATOM 0 HG2 MET A 137 -6.261 0.951 -0.708 1.00 0.00 H new ATOM 0 HG3 MET A 137 -5.637 -0.392 -1.646 1.00 0.00 H new ATOM 0 HE1 MET A 137 -2.781 1.513 -3.691 1.00 0.00 H new ATOM 0 HE2 MET A 137 -3.134 -0.139 -3.131 1.00 0.00 H new ATOM 0 HE3 MET A 137 -4.368 0.781 -4.025 1.00 0.00 H new ATOM 2155 N ALA A 138 -8.885 3.376 -4.039 1.00 0.00 N ATOM 2156 CA ALA A 138 -9.736 3.793 -5.147 1.00 0.00 C ATOM 2157 C ALA A 138 -9.156 5.037 -5.798 1.00 0.00 C ATOM 2158 O ALA A 138 -9.151 5.170 -7.021 1.00 0.00 O ATOM 2159 CB ALA A 138 -11.157 4.053 -4.675 1.00 0.00 C ATOM 0 H ALA A 138 -9.290 3.524 -3.114 1.00 0.00 H new ATOM 0 HA ALA A 138 -9.771 2.988 -5.881 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -11.771 4.363 -5.521 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -11.569 3.141 -4.242 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -11.152 4.842 -3.923 1.00 0.00 H new ATOM 2165 N LEU A 139 -8.651 5.940 -4.965 1.00 0.00 N ATOM 2166 CA LEU A 139 -7.971 7.129 -5.452 1.00 0.00 C ATOM 2167 C LEU A 139 -6.724 6.722 -6.225 1.00 0.00 C ATOM 2168 O LEU A 139 -6.460 7.226 -7.317 1.00 0.00 O ATOM 2169 CB LEU A 139 -7.597 8.046 -4.286 1.00 0.00 C ATOM 2170 CG LEU A 139 -6.951 9.375 -4.683 1.00 0.00 C ATOM 2171 CD1 LEU A 139 -7.901 10.201 -5.537 1.00 0.00 C ATOM 2172 CD2 LEU A 139 -6.534 10.152 -3.445 1.00 0.00 C ATOM 0 H LEU A 139 -8.701 5.869 -3.949 1.00 0.00 H new ATOM 0 HA LEU A 139 -8.641 7.676 -6.115 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -8.496 8.256 -3.707 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -6.913 7.510 -3.628 1.00 0.00 H new ATOM 0 HG LEU A 139 -6.060 9.161 -5.274 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -7.422 11.142 -5.808 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -8.152 9.647 -6.442 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -8.811 10.407 -4.974 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -6.076 11.095 -3.744 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -7.411 10.354 -2.829 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -5.816 9.566 -2.872 1.00 0.00 H new ATOM 2184 N ILE A 140 -5.971 5.788 -5.653 1.00 0.00 N ATOM 2185 CA ILE A 140 -4.786 5.253 -6.307 1.00 0.00 C ATOM 2186 C ILE A 140 -5.164 4.514 -7.591 1.00 0.00 C ATOM 2187 O ILE A 140 -4.500 4.659 -8.615 1.00 0.00 O ATOM 2188 CB ILE A 140 -4.006 4.316 -5.360 1.00 0.00 C ATOM 2189 CG1 ILE A 140 -3.453 5.124 -4.182 1.00 0.00 C ATOM 2190 CG2 ILE A 140 -2.886 3.596 -6.099 1.00 0.00 C ATOM 2191 CD1 ILE A 140 -2.618 4.311 -3.222 1.00 0.00 C ATOM 0 H ILE A 140 -6.163 5.386 -4.735 1.00 0.00 H new ATOM 0 HA ILE A 140 -4.140 6.092 -6.566 1.00 0.00 H new ATOM 0 HB ILE A 140 -4.687 3.554 -4.980 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -2.849 5.945 -4.569 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -4.285 5.570 -3.637 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -2.354 2.943 -5.407 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -3.308 3.000 -6.908 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -2.193 4.329 -6.512 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -2.263 4.953 -2.416 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -3.223 3.506 -2.805 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -1.765 3.887 -3.751 1.00 0.00 H new ATOM 2203 N ARG A 141 -6.239 3.733 -7.526 1.00 0.00 N ATOM 2204 CA ARG A 141 -6.792 3.068 -8.702 1.00 0.00 C ATOM 2205 C ARG A 141 -7.018 4.072 -9.834 1.00 0.00 C ATOM 2206 O ARG A 141 -6.666 3.810 -10.985 1.00 0.00 O ATOM 2207 CB ARG A 141 -8.102 2.356 -8.319 1.00 0.00 C ATOM 2208 CG ARG A 141 -8.882 1.770 -9.485 1.00 0.00 C ATOM 2209 CD ARG A 141 -9.947 2.735 -9.989 1.00 0.00 C ATOM 2210 NE ARG A 141 -10.609 2.228 -11.186 1.00 0.00 N ATOM 2211 CZ ARG A 141 -10.909 2.978 -12.244 1.00 0.00 C ATOM 2212 NH1 ARG A 141 -10.721 4.293 -12.207 1.00 0.00 N ATOM 2213 NH2 ARG A 141 -11.439 2.417 -13.324 1.00 0.00 N ATOM 0 H ARG A 141 -6.748 3.544 -6.663 1.00 0.00 H new ATOM 0 HA ARG A 141 -6.082 2.324 -9.062 1.00 0.00 H new ATOM 0 HB2 ARG A 141 -7.870 1.554 -7.618 1.00 0.00 H new ATOM 0 HB3 ARG A 141 -8.742 3.064 -7.793 1.00 0.00 H new ATOM 0 HG2 ARG A 141 -8.196 1.528 -10.297 1.00 0.00 H new ATOM 0 HG3 ARG A 141 -9.353 0.837 -9.176 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -10.687 2.902 -9.206 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -9.490 3.700 -10.207 1.00 0.00 H new ATOM 0 HE ARG A 141 -10.857 1.239 -11.214 1.00 0.00 H new ATOM 0 HH11 ARG A 141 -10.346 4.731 -11.366 1.00 0.00 H new ATOM 0 HH12 ARG A 141 -10.952 4.864 -13.020 1.00 0.00 H new ATOM 0 HH21 ARG A 141 -11.616 1.413 -13.342 1.00 0.00 H new ATOM 0 HH22 ARG A 141 -11.669 2.990 -14.136 1.00 0.00 H new ATOM 2227 N ASP A 142 -7.586 5.221 -9.493 1.00 0.00 N ATOM 2228 CA ASP A 142 -7.831 6.280 -10.469 1.00 0.00 C ATOM 2229 C ASP A 142 -6.521 6.839 -11.011 1.00 0.00 C ATOM 2230 O ASP A 142 -6.384 7.062 -12.211 1.00 0.00 O ATOM 2231 CB ASP A 142 -8.661 7.408 -9.854 1.00 0.00 C ATOM 2232 CG ASP A 142 -10.131 7.056 -9.718 1.00 0.00 C ATOM 2233 OD1 ASP A 142 -10.502 5.895 -9.998 1.00 0.00 O ATOM 2234 OD2 ASP A 142 -10.922 7.946 -9.340 1.00 0.00 O ATOM 0 H ASP A 142 -7.887 5.446 -8.545 1.00 0.00 H new ATOM 0 HA ASP A 142 -8.391 5.842 -11.295 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -8.259 7.653 -8.871 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -8.563 8.302 -10.470 1.00 0.00 H new ATOM 2239 N ARG A 143 -5.557 7.058 -10.123 1.00 0.00 N ATOM 2240 CA ARG A 143 -4.249 7.567 -10.524 1.00 0.00 C ATOM 2241 C ARG A 143 -3.556 6.595 -11.474 1.00 0.00 C ATOM 2242 O ARG A 143 -2.942 7.008 -12.461 1.00 0.00 O ATOM 2243 CB ARG A 143 -3.361 7.811 -9.301 1.00 0.00 C ATOM 2244 CG ARG A 143 -3.932 8.785 -8.278 1.00 0.00 C ATOM 2245 CD ARG A 143 -4.109 10.188 -8.840 1.00 0.00 C ATOM 2246 NE ARG A 143 -5.345 10.336 -9.614 1.00 0.00 N ATOM 2247 CZ ARG A 143 -6.253 11.282 -9.380 1.00 0.00 C ATOM 2248 NH1 ARG A 143 -6.083 12.131 -8.372 1.00 0.00 N ATOM 2249 NH2 ARG A 143 -7.332 11.374 -10.147 1.00 0.00 N ATOM 0 H ARG A 143 -5.656 6.891 -9.122 1.00 0.00 H new ATOM 0 HA ARG A 143 -4.407 8.514 -11.040 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -3.176 6.856 -8.808 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -2.396 8.187 -9.640 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -4.895 8.414 -7.927 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -3.271 8.825 -7.412 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -4.111 10.906 -8.020 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -3.257 10.431 -9.474 1.00 0.00 H new ATOM 0 HE ARG A 143 -5.519 9.678 -10.374 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -5.257 12.058 -7.778 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -6.778 12.856 -8.193 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -7.467 10.719 -10.918 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -8.026 12.099 -9.966 1.00 0.00 H new ATOM 2263 N ILE A 144 -3.661 5.304 -11.174 1.00 0.00 N ATOM 2264 CA ILE A 144 -3.070 4.274 -12.020 1.00 0.00 C ATOM 2265 C ILE A 144 -3.783 4.212 -13.367 1.00 0.00 C ATOM 2266 O ILE A 144 -3.135 4.124 -14.408 1.00 0.00 O ATOM 2267 CB ILE A 144 -3.102 2.884 -11.342 1.00 0.00 C ATOM 2268 CG1 ILE A 144 -2.260 2.899 -10.063 1.00 0.00 C ATOM 2269 CG2 ILE A 144 -2.596 1.809 -12.297 1.00 0.00 C ATOM 2270 CD1 ILE A 144 -2.215 1.567 -9.344 1.00 0.00 C ATOM 0 H ILE A 144 -4.149 4.947 -10.353 1.00 0.00 H new ATOM 0 HA ILE A 144 -2.026 4.546 -12.178 1.00 0.00 H new ATOM 0 HB ILE A 144 -4.134 2.652 -11.079 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -1.243 3.201 -10.313 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -2.659 3.654 -9.385 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -2.626 0.839 -11.801 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -3.229 1.783 -13.184 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -1.571 2.035 -12.589 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -1.600 1.657 -8.449 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -3.226 1.272 -9.062 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -1.787 0.812 -10.003 1.00 0.00 H new ATOM 2282 N GLU A 145 -5.112 4.279 -13.347 1.00 0.00 N ATOM 2283 CA GLU A 145 -5.889 4.281 -14.583 1.00 0.00 C ATOM 2284 C GLU A 145 -5.531 5.502 -15.425 1.00 0.00 C ATOM 2285 O GLU A 145 -5.377 5.410 -16.643 1.00 0.00 O ATOM 2286 CB GLU A 145 -7.393 4.277 -14.288 1.00 0.00 C ATOM 2287 CG GLU A 145 -8.241 4.181 -15.545 1.00 0.00 C ATOM 2288 CD GLU A 145 -9.723 4.332 -15.279 1.00 0.00 C ATOM 2289 OE1 GLU A 145 -10.133 5.361 -14.702 1.00 0.00 O ATOM 2290 OE2 GLU A 145 -10.491 3.424 -15.665 1.00 0.00 O ATOM 0 H GLU A 145 -5.670 4.332 -12.495 1.00 0.00 H new ATOM 0 HA GLU A 145 -5.645 3.375 -15.137 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -7.627 3.438 -13.633 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -7.655 5.187 -13.748 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -7.925 4.951 -16.248 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -8.061 3.219 -16.024 1.00 0.00 H new ATOM 2297 N GLN A 146 -5.397 6.644 -14.759 1.00 0.00 N ATOM 2298 CA GLN A 146 -4.990 7.883 -15.410 1.00 0.00 C ATOM 2299 C GLN A 146 -3.650 7.701 -16.119 1.00 0.00 C ATOM 2300 O GLN A 146 -3.469 8.141 -17.256 1.00 0.00 O ATOM 2301 CB GLN A 146 -4.887 9.006 -14.376 1.00 0.00 C ATOM 2302 CG GLN A 146 -4.404 10.325 -14.948 1.00 0.00 C ATOM 2303 CD GLN A 146 -4.168 11.371 -13.878 1.00 0.00 C ATOM 2304 OE1 GLN A 146 -4.842 11.391 -12.848 1.00 0.00 O ATOM 2305 NE2 GLN A 146 -3.191 12.232 -14.104 1.00 0.00 N ATOM 0 H GLN A 146 -5.567 6.736 -13.757 1.00 0.00 H new ATOM 0 HA GLN A 146 -5.742 8.149 -16.153 1.00 0.00 H new ATOM 0 HB2 GLN A 146 -5.865 9.156 -13.918 1.00 0.00 H new ATOM 0 HB3 GLN A 146 -4.208 8.695 -13.582 1.00 0.00 H new ATOM 0 HG2 GLN A 146 -3.479 10.160 -15.501 1.00 0.00 H new ATOM 0 HG3 GLN A 146 -5.139 10.699 -15.661 1.00 0.00 H new ATOM 0 HE21 GLN A 146 -2.656 12.181 -14.971 1.00 0.00 H new ATOM 0 HE22 GLN A 146 -2.972 12.948 -13.411 1.00 0.00 H new ATOM 2314 N ALA A 147 -2.722 7.037 -15.444 1.00 0.00 N ATOM 2315 CA ALA A 147 -1.397 6.793 -15.995 1.00 0.00 C ATOM 2316 C ALA A 147 -1.447 5.755 -17.110 1.00 0.00 C ATOM 2317 O ALA A 147 -0.788 5.908 -18.133 1.00 0.00 O ATOM 2318 CB ALA A 147 -0.443 6.347 -14.898 1.00 0.00 C ATOM 0 H ALA A 147 -2.864 6.656 -14.509 1.00 0.00 H new ATOM 0 HA ALA A 147 -1.031 7.727 -16.422 1.00 0.00 H new ATOM 0 HB1 ALA A 147 0.544 6.168 -15.325 1.00 0.00 H new ATOM 0 HB2 ALA A 147 -0.374 7.125 -14.137 1.00 0.00 H new ATOM 0 HB3 ALA A 147 -0.814 5.428 -14.445 1.00 0.00 H new ATOM 2324 N ALA A 148 -2.245 4.711 -16.908 1.00 0.00 N ATOM 2325 CA ALA A 148 -2.347 3.609 -17.863 1.00 0.00 C ATOM 2326 C ALA A 148 -3.077 4.020 -19.139 1.00 0.00 C ATOM 2327 O ALA A 148 -2.922 3.386 -20.181 1.00 0.00 O ATOM 2328 CB ALA A 148 -3.043 2.421 -17.220 1.00 0.00 C ATOM 0 H ALA A 148 -2.836 4.604 -16.084 1.00 0.00 H new ATOM 0 HA ALA A 148 -1.333 3.326 -18.145 1.00 0.00 H new ATOM 0 HB1 ALA A 148 -3.113 1.606 -17.941 1.00 0.00 H new ATOM 0 HB2 ALA A 148 -2.471 2.090 -16.353 1.00 0.00 H new ATOM 0 HB3 ALA A 148 -4.044 2.713 -16.904 1.00 0.00 H new ATOM 2334 N GLY A 149 -3.901 5.054 -19.049 1.00 0.00 N ATOM 2335 CA GLY A 149 -4.552 5.579 -20.233 1.00 0.00 C ATOM 2336 C GLY A 149 -3.639 6.511 -20.999 1.00 0.00 C ATOM 2337 O GLY A 149 -3.624 6.514 -22.232 1.00 0.00 O ATOM 0 H GLY A 149 -4.130 5.538 -18.181 1.00 0.00 H new ATOM 0 HA2 GLY A 149 -4.857 4.755 -20.878 1.00 0.00 H new ATOM 0 HA3 GLY A 149 -5.459 6.111 -19.946 1.00 0.00 H new ATOM 2341 N GLU A 150 -2.867 7.285 -20.250 1.00 0.00 N ATOM 2342 CA GLU A 150 -1.917 8.238 -20.808 1.00 0.00 C ATOM 2343 C GLU A 150 -0.722 7.517 -21.426 1.00 0.00 C ATOM 2344 O GLU A 150 -0.368 7.736 -22.589 1.00 0.00 O ATOM 2345 CB GLU A 150 -1.438 9.165 -19.692 1.00 0.00 C ATOM 2346 CG GLU A 150 -0.321 10.108 -20.093 1.00 0.00 C ATOM 2347 CD GLU A 150 0.256 10.824 -18.898 1.00 0.00 C ATOM 2348 OE1 GLU A 150 -0.257 11.904 -18.546 1.00 0.00 O ATOM 2349 OE2 GLU A 150 1.208 10.292 -18.287 1.00 0.00 O ATOM 0 H GLU A 150 -2.882 7.270 -19.230 1.00 0.00 H new ATOM 0 HA GLU A 150 -2.409 8.813 -21.592 1.00 0.00 H new ATOM 0 HB2 GLU A 150 -2.284 9.754 -19.338 1.00 0.00 H new ATOM 0 HB3 GLU A 150 -1.100 8.557 -18.853 1.00 0.00 H new ATOM 0 HG2 GLU A 150 0.466 9.547 -20.597 1.00 0.00 H new ATOM 0 HG3 GLU A 150 -0.700 10.839 -20.808 1.00 0.00 H new