USER MOD reduce.3.24.130724 H: found=0, std=0, add=820, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 815 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 MET CE :methyl 165:sc= -0.0769 (180deg=-0.441) USER MOD Single : A 10 GLN : amide:sc= 0.0702 K(o=0.07,f=-1.8!) USER MOD Single : A 14 LYS NZ :NH3+ -103:sc= -1.16 (180deg=-3.15!) USER MOD Single : A 15 THR OG1 : rot -79:sc= 0.716 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot -76:sc= 0.118 USER MOD Single : A 28 SER OG : rot 180:sc= 0.0221 USER MOD Single : A 30 THR OG1 : rot -179:sc= -1.08 USER MOD Single : A 33 ASN : amide:sc= -0.0658 X(o=-0.066,f=0) USER MOD Single : A 35 LYS NZ :NH3+ 147:sc= -0.028 (180deg=-0.501) USER MOD Single : A 37 LYS NZ :NH3+ -167:sc= 0.712 (180deg=0.322) USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN : amide:sc= -2.45 K(o=-2.5,f=-8.9!) USER MOD Single : A 49 GLN : amide:sc= -2.89 K(o=-2.9,f=-3.9!) USER MOD Single : A 56 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0324) USER MOD Single : A 57 GLN : amide:sc= -0.0284 X(o=-0.028,f=0) USER MOD Single : A 63 THR OG1 : rot 57:sc= 0.714 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -0.0377 X(o=-0.038,f=-0.038) USER MOD Single : A 70 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 71 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0248) USER MOD Single : A 73 SER OG : rot -110:sc= -0.0658 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 HIS : no HD1:sc= 0 X(o=0,f=-0.0042) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 HIS : no HD1:sc= 0 X(o=0,f=-0.071) USER MOD Single : A 97 HIS : no HD1:sc= -0.172 X(o=-0.17,f=-0.35) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.489 21.048 -12.580 1.00 0.00 N ATOM 2 CA GLY A 1 8.015 21.237 -11.240 1.00 0.00 C ATOM 3 C GLY A 1 7.951 19.972 -10.408 1.00 0.00 C ATOM 4 O GLY A 1 8.982 19.393 -10.067 1.00 0.00 O ATOM 0 H1 GLY A 1 7.555 21.941 -13.108 1.00 0.00 H new ATOM 0 H2 GLY A 1 8.041 20.315 -13.069 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.494 20.752 -12.524 1.00 0.00 H new ATOM 0 HA2 GLY A 1 9.050 21.574 -11.303 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.453 22.026 -10.740 1.00 0.00 H new ATOM 8 N SER A 2 6.737 19.543 -10.079 1.00 0.00 N ATOM 9 CA SER A 2 6.543 18.341 -9.276 1.00 0.00 C ATOM 10 C SER A 2 5.502 17.425 -9.913 1.00 0.00 C ATOM 11 O SER A 2 4.656 16.854 -9.224 1.00 0.00 O ATOM 12 CB SER A 2 6.110 18.715 -7.857 1.00 0.00 C ATOM 13 OG SER A 2 7.160 19.358 -7.156 1.00 0.00 O ATOM 0 H SER A 2 5.873 20.009 -10.356 1.00 0.00 H new ATOM 0 HA SER A 2 7.492 17.807 -9.230 1.00 0.00 H new ATOM 0 HB2 SER A 2 5.241 19.372 -7.900 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.805 17.818 -7.318 1.00 0.00 H new ATOM 0 HG SER A 2 6.857 19.588 -6.253 1.00 0.00 H new ATOM 19 N LEU A 3 5.572 17.289 -11.232 1.00 0.00 N ATOM 20 CA LEU A 3 4.636 16.442 -11.964 1.00 0.00 C ATOM 21 C LEU A 3 5.380 15.404 -12.799 1.00 0.00 C ATOM 22 O LEU A 3 6.420 15.696 -13.389 1.00 0.00 O ATOM 23 CB LEU A 3 3.744 17.296 -12.868 1.00 0.00 C ATOM 24 CG LEU A 3 4.451 18.030 -14.008 1.00 0.00 C ATOM 25 CD1 LEU A 3 4.509 17.157 -15.251 1.00 0.00 C ATOM 26 CD2 LEU A 3 3.748 19.346 -14.310 1.00 0.00 C ATOM 0 H LEU A 3 6.267 17.754 -11.817 1.00 0.00 H new ATOM 0 HA LEU A 3 4.013 15.919 -11.238 1.00 0.00 H new ATOM 0 HB2 LEU A 3 2.975 16.654 -13.298 1.00 0.00 H new ATOM 0 HB3 LEU A 3 3.234 18.034 -12.249 1.00 0.00 H new ATOM 0 HG LEU A 3 5.472 18.249 -13.696 1.00 0.00 H new ATOM 0 HD11 LEU A 3 5.016 17.697 -16.051 1.00 0.00 H new ATOM 0 HD12 LEU A 3 5.057 16.241 -15.027 1.00 0.00 H new ATOM 0 HD13 LEU A 3 3.496 16.906 -15.567 1.00 0.00 H new ATOM 0 HD21 LEU A 3 4.264 19.856 -15.124 1.00 0.00 H new ATOM 0 HD22 LEU A 3 2.716 19.149 -14.601 1.00 0.00 H new ATOM 0 HD23 LEU A 3 3.760 19.977 -13.421 1.00 0.00 H new ATOM 38 N VAL A 4 4.839 14.191 -12.845 1.00 0.00 N ATOM 39 CA VAL A 4 5.449 13.110 -13.610 1.00 0.00 C ATOM 40 C VAL A 4 4.543 12.668 -14.754 1.00 0.00 C ATOM 41 O VAL A 4 3.326 12.851 -14.722 1.00 0.00 O ATOM 42 CB VAL A 4 5.758 11.895 -12.715 1.00 0.00 C ATOM 43 CG1 VAL A 4 7.014 12.143 -11.893 1.00 0.00 C ATOM 44 CG2 VAL A 4 4.574 11.582 -11.814 1.00 0.00 C ATOM 0 H VAL A 4 3.979 13.932 -12.361 1.00 0.00 H new ATOM 0 HA VAL A 4 6.382 13.498 -14.019 1.00 0.00 H new ATOM 0 HB VAL A 4 5.936 11.031 -13.355 1.00 0.00 H new ATOM 0 HG11 VAL A 4 7.217 11.274 -11.267 1.00 0.00 H new ATOM 0 HG12 VAL A 4 7.858 12.314 -12.561 1.00 0.00 H new ATOM 0 HG13 VAL A 4 6.868 13.019 -11.261 1.00 0.00 H new ATOM 0 HG21 VAL A 4 4.810 10.721 -11.189 1.00 0.00 H new ATOM 0 HG22 VAL A 4 4.361 12.443 -11.180 1.00 0.00 H new ATOM 0 HG23 VAL A 4 3.700 11.357 -12.426 1.00 0.00 H new ATOM 54 N PRO A 5 5.149 12.070 -15.791 1.00 0.00 N ATOM 55 CA PRO A 5 4.417 11.588 -16.965 1.00 0.00 C ATOM 56 C PRO A 5 3.548 10.376 -16.648 1.00 0.00 C ATOM 57 O PRO A 5 3.979 9.233 -16.805 1.00 0.00 O ATOM 58 CB PRO A 5 5.529 11.207 -17.945 1.00 0.00 C ATOM 59 CG PRO A 5 6.706 10.904 -17.084 1.00 0.00 C ATOM 60 CD PRO A 5 6.597 11.820 -15.896 1.00 0.00 C ATOM 0 HA PRO A 5 3.728 12.339 -17.352 1.00 0.00 H new ATOM 0 HB2 PRO A 5 5.247 10.344 -18.548 1.00 0.00 H new ATOM 0 HB3 PRO A 5 5.744 12.022 -18.636 1.00 0.00 H new ATOM 0 HG2 PRO A 5 6.703 9.859 -16.773 1.00 0.00 H new ATOM 0 HG3 PRO A 5 7.638 11.074 -17.623 1.00 0.00 H new ATOM 0 HD2 PRO A 5 6.991 11.355 -14.992 1.00 0.00 H new ATOM 0 HD3 PRO A 5 7.155 12.744 -16.048 1.00 0.00 H new ATOM 68 N ARG A 6 2.322 10.632 -16.203 1.00 0.00 N ATOM 69 CA ARG A 6 1.393 9.561 -15.864 1.00 0.00 C ATOM 70 C ARG A 6 0.036 9.789 -16.524 1.00 0.00 C ATOM 71 O ARG A 6 -0.198 10.826 -17.142 1.00 0.00 O ATOM 72 CB ARG A 6 1.224 9.465 -14.346 1.00 0.00 C ATOM 73 CG ARG A 6 0.787 10.769 -13.698 1.00 0.00 C ATOM 74 CD ARG A 6 0.619 10.615 -12.195 1.00 0.00 C ATOM 75 NE ARG A 6 -0.389 9.614 -11.857 1.00 0.00 N ATOM 76 CZ ARG A 6 -0.649 9.224 -10.614 1.00 0.00 C ATOM 77 NH1 ARG A 6 0.020 9.749 -9.597 1.00 0.00 N ATOM 78 NH2 ARG A 6 -1.581 8.307 -10.386 1.00 0.00 N ATOM 0 H ARG A 6 1.949 11.572 -16.069 1.00 0.00 H new ATOM 0 HA ARG A 6 1.806 8.624 -16.237 1.00 0.00 H new ATOM 0 HB2 ARG A 6 0.490 8.692 -14.119 1.00 0.00 H new ATOM 0 HB3 ARG A 6 2.168 9.148 -13.903 1.00 0.00 H new ATOM 0 HG2 ARG A 6 1.524 11.545 -13.905 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -0.154 11.098 -14.139 1.00 0.00 H new ATOM 0 HD2 ARG A 6 1.573 10.333 -11.751 1.00 0.00 H new ATOM 0 HD3 ARG A 6 0.337 11.574 -11.762 1.00 0.00 H new ATOM 0 HE ARG A 6 -0.922 9.191 -12.617 1.00 0.00 H new ATOM 0 HH11 ARG A 6 0.737 10.454 -9.768 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -0.182 9.448 -8.644 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -2.098 7.901 -11.166 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -1.780 8.008 -9.431 1.00 0.00 H new ATOM 92 N GLY A 7 -0.854 8.811 -16.388 1.00 0.00 N ATOM 93 CA GLY A 7 -2.176 8.924 -16.977 1.00 0.00 C ATOM 94 C GLY A 7 -3.210 9.427 -15.989 1.00 0.00 C ATOM 95 O GLY A 7 -3.155 9.100 -14.803 1.00 0.00 O ATOM 0 H GLY A 7 -0.684 7.943 -15.881 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -2.134 9.601 -17.830 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.485 7.951 -17.358 1.00 0.00 H new ATOM 99 N SER A 8 -4.153 10.225 -16.477 1.00 0.00 N ATOM 100 CA SER A 8 -5.201 10.779 -15.627 1.00 0.00 C ATOM 101 C SER A 8 -6.210 11.570 -16.454 1.00 0.00 C ATOM 102 O SER A 8 -5.862 12.167 -17.473 1.00 0.00 O ATOM 103 CB SER A 8 -4.592 11.677 -14.550 1.00 0.00 C ATOM 104 OG SER A 8 -3.799 12.700 -15.127 1.00 0.00 O ATOM 0 H SER A 8 -4.214 10.503 -17.457 1.00 0.00 H new ATOM 0 HA SER A 8 -5.721 9.950 -15.147 1.00 0.00 H new ATOM 0 HB2 SER A 8 -5.387 12.123 -13.952 1.00 0.00 H new ATOM 0 HB3 SER A 8 -3.982 11.077 -13.874 1.00 0.00 H new ATOM 0 HG SER A 8 -3.422 13.261 -14.418 1.00 0.00 H new ATOM 110 N MET A 9 -7.462 11.569 -16.008 1.00 0.00 N ATOM 111 CA MET A 9 -8.522 12.287 -16.706 1.00 0.00 C ATOM 112 C MET A 9 -9.524 12.873 -15.716 1.00 0.00 C ATOM 113 O MET A 9 -9.944 12.201 -14.775 1.00 0.00 O ATOM 114 CB MET A 9 -9.239 11.356 -17.685 1.00 0.00 C ATOM 115 CG MET A 9 -10.504 11.956 -18.278 1.00 0.00 C ATOM 116 SD MET A 9 -11.199 10.944 -19.599 1.00 0.00 S ATOM 117 CE MET A 9 -11.536 9.422 -18.719 1.00 0.00 C ATOM 0 H MET A 9 -7.767 11.079 -15.167 1.00 0.00 H new ATOM 0 HA MET A 9 -8.067 13.106 -17.263 1.00 0.00 H new ATOM 0 HB2 MET A 9 -8.556 11.097 -18.494 1.00 0.00 H new ATOM 0 HB3 MET A 9 -9.492 10.428 -17.172 1.00 0.00 H new ATOM 0 HG2 MET A 9 -11.247 12.079 -17.490 1.00 0.00 H new ATOM 0 HG3 MET A 9 -10.283 12.951 -18.665 1.00 0.00 H new ATOM 0 HE1 MET A 9 -12.201 8.797 -19.315 1.00 0.00 H new ATOM 0 HE2 MET A 9 -10.601 8.890 -18.541 1.00 0.00 H new ATOM 0 HE3 MET A 9 -12.011 9.651 -17.765 1.00 0.00 H new ATOM 127 N GLN A 10 -9.902 14.128 -15.936 1.00 0.00 N ATOM 128 CA GLN A 10 -10.854 14.803 -15.062 1.00 0.00 C ATOM 129 C GLN A 10 -12.260 14.756 -15.650 1.00 0.00 C ATOM 130 O GLN A 10 -12.437 14.808 -16.867 1.00 0.00 O ATOM 131 CB GLN A 10 -10.431 16.256 -14.838 1.00 0.00 C ATOM 132 CG GLN A 10 -10.417 17.089 -16.110 1.00 0.00 C ATOM 133 CD GLN A 10 -9.013 17.360 -16.614 1.00 0.00 C ATOM 134 OE1 GLN A 10 -8.432 16.548 -17.335 1.00 0.00 O ATOM 135 NE2 GLN A 10 -8.459 18.507 -16.238 1.00 0.00 N ATOM 0 H GLN A 10 -9.564 14.698 -16.712 1.00 0.00 H new ATOM 0 HA GLN A 10 -10.862 14.282 -14.104 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -11.109 16.716 -14.120 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -9.436 16.272 -14.393 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -10.984 16.572 -16.885 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -10.922 18.037 -15.925 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -8.976 19.151 -15.640 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -7.516 18.744 -16.548 1.00 0.00 H new ATOM 144 N ILE A 11 -13.257 14.656 -14.777 1.00 0.00 N ATOM 145 CA ILE A 11 -14.648 14.602 -15.210 1.00 0.00 C ATOM 146 C ILE A 11 -15.512 15.567 -14.405 1.00 0.00 C ATOM 147 O ILE A 11 -15.065 16.134 -13.408 1.00 0.00 O ATOM 148 CB ILE A 11 -15.225 13.180 -15.075 1.00 0.00 C ATOM 149 CG1 ILE A 11 -15.339 12.789 -13.600 1.00 0.00 C ATOM 150 CG2 ILE A 11 -14.356 12.183 -15.827 1.00 0.00 C ATOM 151 CD1 ILE A 11 -15.898 11.400 -13.384 1.00 0.00 C ATOM 0 H ILE A 11 -13.127 14.611 -13.766 1.00 0.00 H new ATOM 0 HA ILE A 11 -14.663 14.893 -16.260 1.00 0.00 H new ATOM 0 HB ILE A 11 -16.223 13.166 -15.513 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -14.353 12.851 -13.139 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -15.976 13.511 -13.089 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -14.776 11.183 -15.722 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -14.322 12.454 -16.882 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -13.347 12.197 -15.416 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -15.950 11.191 -12.316 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -16.897 11.339 -13.815 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -15.250 10.668 -13.866 1.00 0.00 H new ATOM 163 N PHE A 12 -16.753 15.748 -14.844 1.00 0.00 N ATOM 164 CA PHE A 12 -17.682 16.643 -14.164 1.00 0.00 C ATOM 165 C PHE A 12 -18.816 15.859 -13.512 1.00 0.00 C ATOM 166 O PHE A 12 -19.449 15.016 -14.148 1.00 0.00 O ATOM 167 CB PHE A 12 -18.253 17.664 -15.150 1.00 0.00 C ATOM 168 CG PHE A 12 -17.206 18.526 -15.794 1.00 0.00 C ATOM 169 CD1 PHE A 12 -16.593 19.545 -15.082 1.00 0.00 C ATOM 170 CD2 PHE A 12 -16.833 18.318 -17.112 1.00 0.00 C ATOM 171 CE1 PHE A 12 -15.630 20.340 -15.673 1.00 0.00 C ATOM 172 CE2 PHE A 12 -15.870 19.110 -17.709 1.00 0.00 C ATOM 173 CZ PHE A 12 -15.267 20.122 -16.988 1.00 0.00 C ATOM 0 H PHE A 12 -17.139 15.287 -15.668 1.00 0.00 H new ATOM 0 HA PHE A 12 -17.134 17.169 -13.383 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -18.806 17.137 -15.927 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -18.966 18.302 -14.628 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -16.871 19.720 -14.053 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -17.300 17.527 -17.680 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -15.161 21.132 -15.107 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -15.590 18.938 -18.738 1.00 0.00 H new ATOM 0 HZ PHE A 12 -14.513 20.742 -17.451 1.00 0.00 H new ATOM 183 N VAL A 13 -19.068 16.142 -12.238 1.00 0.00 N ATOM 184 CA VAL A 13 -20.126 15.463 -11.499 1.00 0.00 C ATOM 185 C VAL A 13 -21.061 16.467 -10.832 1.00 0.00 C ATOM 186 O VAL A 13 -20.626 17.513 -10.350 1.00 0.00 O ATOM 187 CB VAL A 13 -19.547 14.525 -10.423 1.00 0.00 C ATOM 188 CG1 VAL A 13 -20.648 13.677 -9.806 1.00 0.00 C ATOM 189 CG2 VAL A 13 -18.455 13.647 -11.015 1.00 0.00 C ATOM 0 H VAL A 13 -18.554 16.837 -11.696 1.00 0.00 H new ATOM 0 HA VAL A 13 -20.687 14.871 -12.222 1.00 0.00 H new ATOM 0 HB VAL A 13 -19.105 15.134 -9.634 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -20.220 13.021 -9.048 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -21.392 14.326 -9.345 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -21.122 13.075 -10.582 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -18.057 12.990 -10.241 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -18.870 13.045 -11.823 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -17.654 14.275 -11.405 1.00 0.00 H new ATOM 199 N LYS A 14 -22.349 16.141 -10.808 1.00 0.00 N ATOM 200 CA LYS A 14 -23.347 17.012 -10.199 1.00 0.00 C ATOM 201 C LYS A 14 -23.805 16.457 -8.854 1.00 0.00 C ATOM 202 O LYS A 14 -24.092 15.266 -8.726 1.00 0.00 O ATOM 203 CB LYS A 14 -24.550 17.174 -11.132 1.00 0.00 C ATOM 204 CG LYS A 14 -24.368 18.264 -12.174 1.00 0.00 C ATOM 205 CD LYS A 14 -23.304 17.891 -13.192 1.00 0.00 C ATOM 206 CE LYS A 14 -23.360 18.794 -14.414 1.00 0.00 C ATOM 207 NZ LYS A 14 -22.074 18.793 -15.164 1.00 0.00 N ATOM 0 H LYS A 14 -22.726 15.280 -11.203 1.00 0.00 H new ATOM 0 HA LYS A 14 -22.889 17.987 -10.033 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -24.737 16.227 -11.638 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -25.435 17.397 -10.535 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -25.314 18.442 -12.684 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -24.091 19.196 -11.682 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -22.318 17.961 -12.732 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -23.440 16.854 -13.498 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -24.164 18.465 -15.072 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -23.598 19.811 -14.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -21.551 19.668 -14.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -21.504 17.972 -14.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -22.267 18.738 -16.184 1.00 0.00 H new ATOM 221 N THR A 15 -23.874 17.328 -7.852 1.00 0.00 N ATOM 222 CA THR A 15 -24.297 16.926 -6.517 1.00 0.00 C ATOM 223 C THR A 15 -25.796 17.132 -6.330 1.00 0.00 C ATOM 224 O THR A 15 -26.447 17.794 -7.139 1.00 0.00 O ATOM 225 CB THR A 15 -23.543 17.711 -5.427 1.00 0.00 C ATOM 226 OG1 THR A 15 -23.805 19.112 -5.563 1.00 0.00 O ATOM 227 CG2 THR A 15 -22.045 17.459 -5.518 1.00 0.00 C ATOM 0 H THR A 15 -23.642 18.317 -7.940 1.00 0.00 H new ATOM 0 HA THR A 15 -24.063 15.866 -6.418 1.00 0.00 H new ATOM 0 HB THR A 15 -23.895 17.369 -4.454 1.00 0.00 H new ATOM 0 HG1 THR A 15 -23.249 19.481 -6.281 1.00 0.00 H new ATOM 0 HG21 THR A 15 -21.533 18.024 -4.739 1.00 0.00 H new ATOM 0 HG22 THR A 15 -21.846 16.395 -5.386 1.00 0.00 H new ATOM 0 HG23 THR A 15 -21.681 17.777 -6.495 1.00 0.00 H new ATOM 235 N LEU A 16 -26.338 16.563 -5.259 1.00 0.00 N ATOM 236 CA LEU A 16 -27.761 16.685 -4.965 1.00 0.00 C ATOM 237 C LEU A 16 -28.116 18.117 -4.578 1.00 0.00 C ATOM 238 O LEU A 16 -29.221 18.590 -4.849 1.00 0.00 O ATOM 239 CB LEU A 16 -28.154 15.728 -3.838 1.00 0.00 C ATOM 240 CG LEU A 16 -27.553 16.027 -2.464 1.00 0.00 C ATOM 241 CD1 LEU A 16 -28.430 17.007 -1.700 1.00 0.00 C ATOM 242 CD2 LEU A 16 -27.370 14.741 -1.671 1.00 0.00 C ATOM 0 H LEU A 16 -25.813 16.012 -4.580 1.00 0.00 H new ATOM 0 HA LEU A 16 -28.316 16.423 -5.866 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -29.240 15.733 -3.746 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -27.863 14.718 -4.128 1.00 0.00 H new ATOM 0 HG LEU A 16 -26.574 16.484 -2.608 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -27.987 17.208 -0.725 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -28.510 17.938 -2.261 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -29.423 16.578 -1.566 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -26.941 14.973 -0.696 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -28.337 14.256 -1.536 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -26.701 14.072 -2.212 1.00 0.00 H new ATOM 254 N THR A 17 -27.172 18.805 -3.945 1.00 0.00 N ATOM 255 CA THR A 17 -27.384 20.184 -3.522 1.00 0.00 C ATOM 256 C THR A 17 -27.476 21.119 -4.722 1.00 0.00 C ATOM 257 O THR A 17 -28.070 22.193 -4.640 1.00 0.00 O ATOM 258 CB THR A 17 -26.253 20.667 -2.594 1.00 0.00 C ATOM 259 OG1 THR A 17 -26.451 22.045 -2.257 1.00 0.00 O ATOM 260 CG2 THR A 17 -24.896 20.492 -3.259 1.00 0.00 C ATOM 0 H THR A 17 -26.252 18.430 -3.714 1.00 0.00 H new ATOM 0 HA THR A 17 -28.327 20.206 -2.975 1.00 0.00 H new ATOM 0 HB THR A 17 -26.275 20.065 -1.686 1.00 0.00 H new ATOM 0 HG1 THR A 17 -25.729 22.344 -1.666 1.00 0.00 H new ATOM 0 HG21 THR A 17 -24.113 20.840 -2.585 1.00 0.00 H new ATOM 0 HG22 THR A 17 -24.736 19.438 -3.488 1.00 0.00 H new ATOM 0 HG23 THR A 17 -24.865 21.072 -4.181 1.00 0.00 H new ATOM 268 N GLY A 18 -26.884 20.703 -5.838 1.00 0.00 N ATOM 269 CA GLY A 18 -26.912 21.516 -7.040 1.00 0.00 C ATOM 270 C GLY A 18 -25.557 22.113 -7.367 1.00 0.00 C ATOM 271 O GLY A 18 -25.465 23.100 -8.098 1.00 0.00 O ATOM 0 H GLY A 18 -26.386 19.818 -5.931 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -27.250 20.907 -7.879 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -27.639 22.319 -6.915 1.00 0.00 H new ATOM 275 N LYS A 19 -24.502 21.515 -6.824 1.00 0.00 N ATOM 276 CA LYS A 19 -23.145 21.994 -7.061 1.00 0.00 C ATOM 277 C LYS A 19 -22.383 21.038 -7.974 1.00 0.00 C ATOM 278 O LYS A 19 -22.491 19.818 -7.842 1.00 0.00 O ATOM 279 CB LYS A 19 -22.399 22.152 -5.734 1.00 0.00 C ATOM 280 CG LYS A 19 -20.922 22.465 -5.901 1.00 0.00 C ATOM 281 CD LYS A 19 -20.073 21.209 -5.807 1.00 0.00 C ATOM 282 CE LYS A 19 -19.638 20.935 -4.375 1.00 0.00 C ATOM 283 NZ LYS A 19 -18.385 21.662 -4.028 1.00 0.00 N ATOM 0 H LYS A 19 -24.560 20.698 -6.217 1.00 0.00 H new ATOM 0 HA LYS A 19 -23.209 22.965 -7.552 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -22.868 22.948 -5.156 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -22.504 21.234 -5.156 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -20.758 22.945 -6.866 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -20.610 23.174 -5.134 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -20.638 20.357 -6.186 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -19.193 21.315 -6.442 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -20.432 21.233 -3.691 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -19.486 19.864 -4.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -18.121 21.450 -3.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -17.620 21.359 -4.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -18.537 22.686 -4.132 1.00 0.00 H new ATOM 297 N THR A 20 -21.612 21.600 -8.900 1.00 0.00 N ATOM 298 CA THR A 20 -20.832 20.798 -9.834 1.00 0.00 C ATOM 299 C THR A 20 -19.379 20.688 -9.384 1.00 0.00 C ATOM 300 O THR A 20 -18.667 21.690 -9.306 1.00 0.00 O ATOM 301 CB THR A 20 -20.875 21.390 -11.255 1.00 0.00 C ATOM 302 OG1 THR A 20 -22.136 22.030 -11.481 1.00 0.00 O ATOM 303 CG2 THR A 20 -20.656 20.307 -12.300 1.00 0.00 C ATOM 0 H THR A 20 -21.511 22.608 -9.023 1.00 0.00 H new ATOM 0 HA THR A 20 -21.281 19.805 -9.849 1.00 0.00 H new ATOM 0 HB THR A 20 -20.074 22.124 -11.343 1.00 0.00 H new ATOM 0 HG1 THR A 20 -22.155 22.405 -12.386 1.00 0.00 H new ATOM 0 HG21 THR A 20 -20.691 20.750 -13.295 1.00 0.00 H new ATOM 0 HG22 THR A 20 -19.683 19.842 -12.143 1.00 0.00 H new ATOM 0 HG23 THR A 20 -21.437 19.552 -12.211 1.00 0.00 H new ATOM 311 N ILE A 21 -18.946 19.467 -9.091 1.00 0.00 N ATOM 312 CA ILE A 21 -17.577 19.228 -8.651 1.00 0.00 C ATOM 313 C ILE A 21 -16.823 18.356 -9.650 1.00 0.00 C ATOM 314 O ILE A 21 -17.339 17.340 -10.117 1.00 0.00 O ATOM 315 CB ILE A 21 -17.540 18.554 -7.267 1.00 0.00 C ATOM 316 CG1 ILE A 21 -16.099 18.215 -6.880 1.00 0.00 C ATOM 317 CG2 ILE A 21 -18.403 17.301 -7.265 1.00 0.00 C ATOM 318 CD1 ILE A 21 -15.697 16.798 -7.227 1.00 0.00 C ATOM 0 H ILE A 21 -19.523 18.628 -9.150 1.00 0.00 H new ATOM 0 HA ILE A 21 -17.092 20.202 -8.584 1.00 0.00 H new ATOM 0 HB ILE A 21 -17.941 19.249 -6.529 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -15.424 18.909 -7.381 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -15.974 18.367 -5.808 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -18.367 16.836 -6.280 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -19.433 17.568 -7.502 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -18.029 16.600 -8.011 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -14.664 16.628 -6.924 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -16.348 16.097 -6.705 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -15.789 16.647 -8.302 1.00 0.00 H new ATOM 330 N THR A 22 -15.598 18.758 -9.972 1.00 0.00 N ATOM 331 CA THR A 22 -14.772 18.013 -10.914 1.00 0.00 C ATOM 332 C THR A 22 -13.945 16.951 -10.200 1.00 0.00 C ATOM 333 O THR A 22 -13.210 17.250 -9.258 1.00 0.00 O ATOM 334 CB THR A 22 -13.825 18.947 -11.691 1.00 0.00 C ATOM 335 OG1 THR A 22 -14.563 20.044 -12.243 1.00 0.00 O ATOM 336 CG2 THR A 22 -13.117 18.194 -12.807 1.00 0.00 C ATOM 0 H THR A 22 -15.156 19.596 -9.594 1.00 0.00 H new ATOM 0 HA THR A 22 -15.451 17.530 -11.616 1.00 0.00 H new ATOM 0 HB THR A 22 -13.075 19.326 -10.997 1.00 0.00 H new ATOM 0 HG1 THR A 22 -15.058 19.741 -13.033 1.00 0.00 H new ATOM 0 HG21 THR A 22 -12.454 18.874 -13.341 1.00 0.00 H new ATOM 0 HG22 THR A 22 -12.533 17.378 -12.382 1.00 0.00 H new ATOM 0 HG23 THR A 22 -13.856 17.790 -13.499 1.00 0.00 H new ATOM 344 N LEU A 23 -14.069 15.708 -10.653 1.00 0.00 N ATOM 345 CA LEU A 23 -13.331 14.599 -10.057 1.00 0.00 C ATOM 346 C LEU A 23 -12.244 14.098 -11.002 1.00 0.00 C ATOM 347 O LEU A 23 -12.317 14.306 -12.213 1.00 0.00 O ATOM 348 CB LEU A 23 -14.286 13.456 -9.708 1.00 0.00 C ATOM 349 CG LEU A 23 -13.847 12.542 -8.562 1.00 0.00 C ATOM 350 CD1 LEU A 23 -13.775 13.320 -7.257 1.00 0.00 C ATOM 351 CD2 LEU A 23 -14.797 11.361 -8.430 1.00 0.00 C ATOM 0 H LEU A 23 -14.673 15.443 -11.431 1.00 0.00 H new ATOM 0 HA LEU A 23 -12.855 14.959 -9.145 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -15.256 13.884 -9.454 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -14.431 12.845 -10.599 1.00 0.00 H new ATOM 0 HG LEU A 23 -12.852 12.159 -8.788 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -13.461 12.654 -6.453 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -13.055 14.132 -7.357 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -14.757 13.732 -7.024 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -14.470 10.721 -7.610 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -15.804 11.725 -8.227 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -14.798 10.790 -9.358 1.00 0.00 H new ATOM 363 N GLU A 24 -11.238 13.436 -10.440 1.00 0.00 N ATOM 364 CA GLU A 24 -10.136 12.904 -11.234 1.00 0.00 C ATOM 365 C GLU A 24 -10.150 11.378 -11.231 1.00 0.00 C ATOM 366 O GLU A 24 -10.009 10.747 -10.184 1.00 0.00 O ATOM 367 CB GLU A 24 -8.798 13.414 -10.695 1.00 0.00 C ATOM 368 CG GLU A 24 -8.399 14.773 -11.244 1.00 0.00 C ATOM 369 CD GLU A 24 -7.081 15.267 -10.677 1.00 0.00 C ATOM 370 OE1 GLU A 24 -6.302 14.431 -10.174 1.00 0.00 O ATOM 371 OE2 GLU A 24 -6.830 16.489 -10.737 1.00 0.00 O ATOM 0 H GLU A 24 -11.163 13.255 -9.439 1.00 0.00 H new ATOM 0 HA GLU A 24 -10.262 13.249 -12.260 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -8.852 13.472 -9.608 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -8.019 12.691 -10.937 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -8.324 14.714 -12.330 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -9.182 15.497 -11.017 1.00 0.00 H new ATOM 378 N VAL A 25 -10.323 10.792 -12.411 1.00 0.00 N ATOM 379 CA VAL A 25 -10.355 9.340 -12.546 1.00 0.00 C ATOM 380 C VAL A 25 -9.706 8.895 -13.852 1.00 0.00 C ATOM 381 O VAL A 25 -9.807 9.578 -14.871 1.00 0.00 O ATOM 382 CB VAL A 25 -11.798 8.804 -12.494 1.00 0.00 C ATOM 383 CG1 VAL A 25 -12.652 9.464 -13.566 1.00 0.00 C ATOM 384 CG2 VAL A 25 -11.809 7.291 -12.648 1.00 0.00 C ATOM 0 H VAL A 25 -10.443 11.300 -13.287 1.00 0.00 H new ATOM 0 HA VAL A 25 -9.793 8.931 -11.707 1.00 0.00 H new ATOM 0 HB VAL A 25 -12.224 9.051 -11.522 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -13.668 9.073 -13.514 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.669 10.542 -13.405 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -12.231 9.251 -14.549 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -12.836 6.929 -12.609 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.365 7.020 -13.606 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -11.234 6.839 -11.840 1.00 0.00 H new ATOM 394 N GLU A 26 -9.040 7.745 -13.814 1.00 0.00 N ATOM 395 CA GLU A 26 -8.374 7.209 -14.995 1.00 0.00 C ATOM 396 C GLU A 26 -9.376 6.520 -15.918 1.00 0.00 C ATOM 397 O GLU A 26 -10.427 6.044 -15.491 1.00 0.00 O ATOM 398 CB GLU A 26 -7.279 6.222 -14.586 1.00 0.00 C ATOM 399 CG GLU A 26 -6.451 6.689 -13.401 1.00 0.00 C ATOM 400 CD GLU A 26 -5.377 5.692 -13.011 1.00 0.00 C ATOM 401 OE1 GLU A 26 -4.519 5.381 -13.863 1.00 0.00 O ATOM 402 OE2 GLU A 26 -5.394 5.224 -11.853 1.00 0.00 O ATOM 0 H GLU A 26 -8.947 7.167 -12.979 1.00 0.00 H new ATOM 0 HA GLU A 26 -7.921 8.041 -15.534 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -7.738 5.264 -14.343 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -6.618 6.053 -15.436 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -5.985 7.644 -13.642 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -7.108 6.862 -12.549 1.00 0.00 H new ATOM 409 N PRO A 27 -9.042 6.466 -17.216 1.00 0.00 N ATOM 410 CA PRO A 27 -9.898 5.838 -18.228 1.00 0.00 C ATOM 411 C PRO A 27 -9.955 4.322 -18.078 1.00 0.00 C ATOM 412 O PRO A 27 -10.851 3.669 -18.613 1.00 0.00 O ATOM 413 CB PRO A 27 -9.225 6.221 -19.548 1.00 0.00 C ATOM 414 CG PRO A 27 -7.797 6.454 -19.193 1.00 0.00 C ATOM 415 CD PRO A 27 -7.804 7.013 -17.797 1.00 0.00 C ATOM 0 HA PRO A 27 -10.933 6.170 -18.150 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -9.324 5.427 -20.288 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -9.677 7.115 -19.978 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -7.227 5.526 -19.239 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -7.330 7.150 -19.890 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -6.924 6.700 -17.235 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -7.809 8.103 -17.801 1.00 0.00 H new ATOM 423 N SER A 28 -8.993 3.767 -17.348 1.00 0.00 N ATOM 424 CA SER A 28 -8.933 2.327 -17.131 1.00 0.00 C ATOM 425 C SER A 28 -9.454 1.964 -15.743 1.00 0.00 C ATOM 426 O SER A 28 -9.739 0.800 -15.460 1.00 0.00 O ATOM 427 CB SER A 28 -7.497 1.824 -17.296 1.00 0.00 C ATOM 428 OG SER A 28 -6.562 2.826 -16.935 1.00 0.00 O ATOM 0 H SER A 28 -8.245 4.293 -16.897 1.00 0.00 H new ATOM 0 HA SER A 28 -9.567 1.846 -17.876 1.00 0.00 H new ATOM 0 HB2 SER A 28 -7.345 0.940 -16.677 1.00 0.00 H new ATOM 0 HB3 SER A 28 -7.330 1.522 -18.330 1.00 0.00 H new ATOM 0 HG SER A 28 -5.652 2.480 -17.047 1.00 0.00 H new ATOM 434 N ASP A 29 -9.577 2.969 -14.883 1.00 0.00 N ATOM 435 CA ASP A 29 -10.064 2.758 -13.525 1.00 0.00 C ATOM 436 C ASP A 29 -11.529 2.330 -13.534 1.00 0.00 C ATOM 437 O ASP A 29 -12.194 2.375 -14.569 1.00 0.00 O ATOM 438 CB ASP A 29 -9.897 4.032 -12.696 1.00 0.00 C ATOM 439 CG ASP A 29 -8.541 4.111 -12.023 1.00 0.00 C ATOM 440 OD1 ASP A 29 -7.630 3.363 -12.436 1.00 0.00 O ATOM 441 OD2 ASP A 29 -8.390 4.921 -11.084 1.00 0.00 O ATOM 0 H ASP A 29 -9.346 3.938 -15.102 1.00 0.00 H new ATOM 0 HA ASP A 29 -9.474 1.961 -13.073 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -10.031 4.901 -13.340 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -10.679 4.074 -11.938 1.00 0.00 H new ATOM 446 N THR A 30 -12.026 1.915 -12.373 1.00 0.00 N ATOM 447 CA THR A 30 -13.410 1.477 -12.247 1.00 0.00 C ATOM 448 C THR A 30 -14.197 2.401 -11.325 1.00 0.00 C ATOM 449 O THR A 30 -13.628 3.284 -10.682 1.00 0.00 O ATOM 450 CB THR A 30 -13.497 0.037 -11.708 1.00 0.00 C ATOM 451 OG1 THR A 30 -12.585 -0.134 -10.617 1.00 0.00 O ATOM 452 CG2 THR A 30 -13.181 -0.971 -12.803 1.00 0.00 C ATOM 0 H THR A 30 -11.490 1.873 -11.506 1.00 0.00 H new ATOM 0 HA THR A 30 -13.844 1.509 -13.246 1.00 0.00 H new ATOM 0 HB THR A 30 -14.515 -0.136 -11.360 1.00 0.00 H new ATOM 0 HG1 THR A 30 -12.636 -1.056 -10.289 1.00 0.00 H new ATOM 0 HG21 THR A 30 -13.249 -1.981 -12.398 1.00 0.00 H new ATOM 0 HG22 THR A 30 -13.895 -0.858 -13.619 1.00 0.00 H new ATOM 0 HG23 THR A 30 -12.172 -0.797 -13.177 1.00 0.00 H new ATOM 460 N ILE A 31 -15.508 2.192 -11.264 1.00 0.00 N ATOM 461 CA ILE A 31 -16.372 3.006 -10.419 1.00 0.00 C ATOM 462 C ILE A 31 -15.861 3.042 -8.983 1.00 0.00 C ATOM 463 O ILE A 31 -15.828 4.098 -8.352 1.00 0.00 O ATOM 464 CB ILE A 31 -17.820 2.481 -10.423 1.00 0.00 C ATOM 465 CG1 ILE A 31 -18.351 2.397 -11.855 1.00 0.00 C ATOM 466 CG2 ILE A 31 -18.710 3.376 -9.574 1.00 0.00 C ATOM 467 CD1 ILE A 31 -18.304 3.716 -12.596 1.00 0.00 C ATOM 0 H ILE A 31 -15.995 1.466 -11.790 1.00 0.00 H new ATOM 0 HA ILE A 31 -16.358 4.014 -10.833 1.00 0.00 H new ATOM 0 HB ILE A 31 -17.829 1.479 -9.993 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -17.769 1.659 -12.407 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -19.380 2.039 -11.832 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -19.730 2.992 -9.587 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -18.340 3.390 -8.549 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -18.698 4.389 -9.977 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -18.696 3.581 -13.604 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -18.909 4.452 -12.067 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -17.273 4.066 -12.651 1.00 0.00 H new ATOM 479 N GLU A 32 -15.460 1.881 -8.474 1.00 0.00 N ATOM 480 CA GLU A 32 -14.948 1.781 -7.112 1.00 0.00 C ATOM 481 C GLU A 32 -13.831 2.793 -6.875 1.00 0.00 C ATOM 482 O GLU A 32 -13.672 3.310 -5.770 1.00 0.00 O ATOM 483 CB GLU A 32 -14.436 0.365 -6.839 1.00 0.00 C ATOM 484 CG GLU A 32 -13.430 -0.126 -7.865 1.00 0.00 C ATOM 485 CD GLU A 32 -12.703 -1.379 -7.416 1.00 0.00 C ATOM 486 OE1 GLU A 32 -13.377 -2.316 -6.939 1.00 0.00 O ATOM 487 OE2 GLU A 32 -11.462 -1.423 -7.542 1.00 0.00 O ATOM 0 H GLU A 32 -15.480 0.998 -8.984 1.00 0.00 H new ATOM 0 HA GLU A 32 -15.766 2.002 -6.426 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -13.977 0.338 -5.851 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -15.283 -0.321 -6.816 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -13.944 -0.326 -8.805 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -12.702 0.662 -8.060 1.00 0.00 H new ATOM 494 N ASN A 33 -13.059 3.069 -7.921 1.00 0.00 N ATOM 495 CA ASN A 33 -11.955 4.017 -7.827 1.00 0.00 C ATOM 496 C ASN A 33 -12.468 5.454 -7.850 1.00 0.00 C ATOM 497 O ASN A 33 -11.860 6.351 -7.267 1.00 0.00 O ATOM 498 CB ASN A 33 -10.968 3.798 -8.975 1.00 0.00 C ATOM 499 CG ASN A 33 -9.652 3.212 -8.502 1.00 0.00 C ATOM 500 OD1 ASN A 33 -9.544 2.008 -8.268 1.00 0.00 O ATOM 501 ND2 ASN A 33 -8.642 4.063 -8.360 1.00 0.00 N ATOM 0 H ASN A 33 -13.178 2.650 -8.843 1.00 0.00 H new ATOM 0 HA ASN A 33 -11.444 3.848 -6.879 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -11.415 3.132 -9.713 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -10.781 4.748 -9.476 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -7.732 3.726 -8.046 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -8.777 5.053 -8.565 1.00 0.00 H new ATOM 508 N VAL A 34 -13.593 5.664 -8.527 1.00 0.00 N ATOM 509 CA VAL A 34 -14.190 6.990 -8.625 1.00 0.00 C ATOM 510 C VAL A 34 -14.661 7.483 -7.261 1.00 0.00 C ATOM 511 O VAL A 34 -14.273 8.561 -6.810 1.00 0.00 O ATOM 512 CB VAL A 34 -15.382 6.999 -9.600 1.00 0.00 C ATOM 513 CG1 VAL A 34 -16.011 8.382 -9.663 1.00 0.00 C ATOM 514 CG2 VAL A 34 -14.941 6.542 -10.983 1.00 0.00 C ATOM 0 H VAL A 34 -14.109 4.932 -9.016 1.00 0.00 H new ATOM 0 HA VAL A 34 -13.416 7.658 -9.003 1.00 0.00 H new ATOM 0 HB VAL A 34 -16.134 6.301 -9.233 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -16.851 8.368 -10.357 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -16.364 8.667 -8.672 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -15.269 9.104 -10.005 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -15.795 6.554 -11.660 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -14.170 7.214 -11.360 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -14.541 5.530 -10.921 1.00 0.00 H new ATOM 524 N LYS A 35 -15.499 6.686 -6.607 1.00 0.00 N ATOM 525 CA LYS A 35 -16.022 7.039 -5.292 1.00 0.00 C ATOM 526 C LYS A 35 -14.889 7.356 -4.322 1.00 0.00 C ATOM 527 O LYS A 35 -15.064 8.127 -3.380 1.00 0.00 O ATOM 528 CB LYS A 35 -16.877 5.897 -4.738 1.00 0.00 C ATOM 529 CG LYS A 35 -16.063 4.750 -4.164 1.00 0.00 C ATOM 530 CD LYS A 35 -16.774 3.419 -4.339 1.00 0.00 C ATOM 531 CE LYS A 35 -15.964 2.273 -3.754 1.00 0.00 C ATOM 532 NZ LYS A 35 -16.544 0.947 -4.105 1.00 0.00 N ATOM 0 H LYS A 35 -15.831 5.791 -6.966 1.00 0.00 H new ATOM 0 HA LYS A 35 -16.641 7.929 -5.402 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -17.533 6.290 -3.961 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -17.517 5.515 -5.533 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -15.091 4.711 -4.655 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -15.878 4.928 -3.105 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -17.750 3.460 -3.855 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -16.951 3.237 -5.399 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -14.939 2.329 -4.120 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -15.921 2.375 -2.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -15.779 0.250 -4.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -17.191 0.640 -3.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -17.068 1.023 -5.000 1.00 0.00 H new ATOM 546 N ALA A 36 -13.727 6.757 -4.561 1.00 0.00 N ATOM 547 CA ALA A 36 -12.564 6.979 -3.711 1.00 0.00 C ATOM 548 C ALA A 36 -12.241 8.465 -3.599 1.00 0.00 C ATOM 549 O ALA A 36 -11.920 8.962 -2.520 1.00 0.00 O ATOM 550 CB ALA A 36 -11.363 6.214 -4.248 1.00 0.00 C ATOM 0 H ALA A 36 -13.566 6.114 -5.336 1.00 0.00 H new ATOM 0 HA ALA A 36 -12.799 6.609 -2.713 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -10.502 6.389 -3.603 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -11.590 5.148 -4.268 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -11.136 6.556 -5.258 1.00 0.00 H new ATOM 556 N LYS A 37 -12.327 9.170 -4.722 1.00 0.00 N ATOM 557 CA LYS A 37 -12.044 10.600 -4.752 1.00 0.00 C ATOM 558 C LYS A 37 -13.200 11.396 -4.154 1.00 0.00 C ATOM 559 O LYS A 37 -12.999 12.471 -3.590 1.00 0.00 O ATOM 560 CB LYS A 37 -11.784 11.060 -6.188 1.00 0.00 C ATOM 561 CG LYS A 37 -10.646 10.318 -6.868 1.00 0.00 C ATOM 562 CD LYS A 37 -9.302 10.680 -6.258 1.00 0.00 C ATOM 563 CE LYS A 37 -8.675 11.875 -6.960 1.00 0.00 C ATOM 564 NZ LYS A 37 -7.989 11.481 -8.221 1.00 0.00 N ATOM 0 H LYS A 37 -12.591 8.774 -5.624 1.00 0.00 H new ATOM 0 HA LYS A 37 -11.152 10.781 -4.152 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -12.694 10.928 -6.773 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -11.560 12.127 -6.184 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -10.808 9.244 -6.782 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -10.640 10.555 -7.932 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -9.431 10.905 -5.199 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -8.630 9.825 -6.323 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -9.447 12.612 -7.182 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -7.959 12.354 -6.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -7.394 12.267 -8.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -7.394 10.646 -8.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -8.699 11.254 -8.946 1.00 0.00 H new ATOM 578 N ILE A 38 -14.409 10.859 -4.280 1.00 0.00 N ATOM 579 CA ILE A 38 -15.596 11.518 -3.749 1.00 0.00 C ATOM 580 C ILE A 38 -15.518 11.652 -2.232 1.00 0.00 C ATOM 581 O ILE A 38 -16.066 12.590 -1.654 1.00 0.00 O ATOM 582 CB ILE A 38 -16.879 10.752 -4.121 1.00 0.00 C ATOM 583 CG1 ILE A 38 -17.035 10.681 -5.641 1.00 0.00 C ATOM 584 CG2 ILE A 38 -18.094 11.415 -3.489 1.00 0.00 C ATOM 585 CD1 ILE A 38 -17.091 12.038 -6.307 1.00 0.00 C ATOM 0 H ILE A 38 -14.592 9.970 -4.745 1.00 0.00 H new ATOM 0 HA ILE A 38 -15.633 12.511 -4.197 1.00 0.00 H new ATOM 0 HB ILE A 38 -16.802 9.736 -3.735 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -16.202 10.115 -6.058 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -17.945 10.130 -5.879 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -18.993 10.862 -3.761 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -17.984 11.418 -2.405 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -18.177 12.441 -3.848 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -17.202 11.911 -7.384 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -17.941 12.599 -5.918 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -16.170 12.583 -6.099 1.00 0.00 H new ATOM 597 N GLN A 39 -14.833 10.709 -1.595 1.00 0.00 N ATOM 598 CA GLN A 39 -14.682 10.722 -0.145 1.00 0.00 C ATOM 599 C GLN A 39 -14.105 12.051 0.331 1.00 0.00 C ATOM 600 O GLN A 39 -14.433 12.529 1.417 1.00 0.00 O ATOM 601 CB GLN A 39 -13.782 9.571 0.307 1.00 0.00 C ATOM 602 CG GLN A 39 -14.451 8.208 0.229 1.00 0.00 C ATOM 603 CD GLN A 39 -13.751 7.164 1.076 1.00 0.00 C ATOM 604 OE1 GLN A 39 -14.327 6.628 2.023 1.00 0.00 O ATOM 605 NE2 GLN A 39 -12.500 6.870 0.739 1.00 0.00 N ATOM 0 H GLN A 39 -14.374 9.926 -2.060 1.00 0.00 H new ATOM 0 HA GLN A 39 -15.670 10.596 0.298 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -12.883 9.561 -0.309 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -13.463 9.752 1.334 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -15.488 8.298 0.553 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -14.469 7.875 -0.809 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -12.062 7.339 -0.054 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -11.978 6.175 1.273 1.00 0.00 H new ATOM 614 N ASP A 40 -13.244 12.643 -0.490 1.00 0.00 N ATOM 615 CA ASP A 40 -12.621 13.918 -0.154 1.00 0.00 C ATOM 616 C ASP A 40 -13.592 15.073 -0.375 1.00 0.00 C ATOM 617 O ASP A 40 -13.448 16.143 0.217 1.00 0.00 O ATOM 618 CB ASP A 40 -11.358 14.129 -0.991 1.00 0.00 C ATOM 619 CG ASP A 40 -10.507 15.274 -0.477 1.00 0.00 C ATOM 620 OD1 ASP A 40 -10.837 16.440 -0.779 1.00 0.00 O ATOM 621 OD2 ASP A 40 -9.512 15.004 0.227 1.00 0.00 O ATOM 0 H ASP A 40 -12.962 12.260 -1.392 1.00 0.00 H new ATOM 0 HA ASP A 40 -12.348 13.894 0.901 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -10.768 13.213 -0.990 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -11.640 14.326 -2.025 1.00 0.00 H new ATOM 626 N LYS A 41 -14.583 14.850 -1.233 1.00 0.00 N ATOM 627 CA LYS A 41 -15.579 15.871 -1.533 1.00 0.00 C ATOM 628 C LYS A 41 -16.672 15.895 -0.469 1.00 0.00 C ATOM 629 O LYS A 41 -17.001 16.951 0.071 1.00 0.00 O ATOM 630 CB LYS A 41 -16.199 15.618 -2.910 1.00 0.00 C ATOM 631 CG LYS A 41 -15.183 15.236 -3.973 1.00 0.00 C ATOM 632 CD LYS A 41 -14.219 16.375 -4.258 1.00 0.00 C ATOM 633 CE LYS A 41 -13.001 15.894 -5.032 1.00 0.00 C ATOM 634 NZ LYS A 41 -11.991 16.975 -5.205 1.00 0.00 N ATOM 0 H LYS A 41 -14.717 13.971 -1.732 1.00 0.00 H new ATOM 0 HA LYS A 41 -15.080 16.840 -1.538 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -16.940 14.823 -2.825 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -16.729 16.515 -3.231 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -14.625 14.359 -3.645 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -15.702 14.959 -4.891 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -14.730 17.152 -4.827 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -13.900 16.826 -3.319 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -12.547 15.053 -4.508 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -13.313 15.529 -6.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -11.177 16.607 -5.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -12.417 17.767 -5.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -11.674 17.306 -4.272 1.00 0.00 H new ATOM 648 N GLU A 42 -17.229 14.725 -0.173 1.00 0.00 N ATOM 649 CA GLU A 42 -18.283 14.614 0.828 1.00 0.00 C ATOM 650 C GLU A 42 -17.880 13.648 1.939 1.00 0.00 C ATOM 651 O GLU A 42 -18.215 13.852 3.105 1.00 0.00 O ATOM 652 CB GLU A 42 -19.586 14.144 0.178 1.00 0.00 C ATOM 653 CG GLU A 42 -20.218 15.180 -0.736 1.00 0.00 C ATOM 654 CD GLU A 42 -20.551 16.470 -0.013 1.00 0.00 C ATOM 655 OE1 GLU A 42 -20.640 16.446 1.232 1.00 0.00 O ATOM 656 OE2 GLU A 42 -20.723 17.504 -0.692 1.00 0.00 O ATOM 0 H GLU A 42 -16.968 13.842 -0.612 1.00 0.00 H new ATOM 0 HA GLU A 42 -18.438 15.600 1.266 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -19.390 13.238 -0.395 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -20.298 13.879 0.960 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -19.538 15.395 -1.560 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -21.128 14.767 -1.173 1.00 0.00 H new ATOM 663 N GLY A 43 -17.157 12.596 1.567 1.00 0.00 N ATOM 664 CA GLY A 43 -16.720 11.615 2.543 1.00 0.00 C ATOM 665 C GLY A 43 -17.840 10.692 2.979 1.00 0.00 C ATOM 666 O GLY A 43 -18.197 10.651 4.157 1.00 0.00 O ATOM 0 H GLY A 43 -16.866 12.406 0.608 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -15.909 11.022 2.120 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -16.317 12.130 3.415 1.00 0.00 H new ATOM 670 N ILE A 44 -18.397 9.949 2.028 1.00 0.00 N ATOM 671 CA ILE A 44 -19.484 9.023 2.321 1.00 0.00 C ATOM 672 C ILE A 44 -19.147 7.613 1.849 1.00 0.00 C ATOM 673 O ILE A 44 -18.391 7.414 0.898 1.00 0.00 O ATOM 674 CB ILE A 44 -20.800 9.473 1.659 1.00 0.00 C ATOM 675 CG1 ILE A 44 -20.566 9.810 0.185 1.00 0.00 C ATOM 676 CG2 ILE A 44 -21.382 10.670 2.396 1.00 0.00 C ATOM 677 CD1 ILE A 44 -21.818 10.251 -0.540 1.00 0.00 C ATOM 0 H ILE A 44 -18.113 9.970 1.048 1.00 0.00 H new ATOM 0 HA ILE A 44 -19.613 9.020 3.403 1.00 0.00 H new ATOM 0 HB ILE A 44 -21.516 8.653 1.715 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -19.818 10.600 0.116 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -20.153 8.936 -0.318 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -22.312 10.976 1.916 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -21.581 10.397 3.432 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -20.671 11.495 2.368 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -21.577 10.473 -1.580 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -22.560 9.454 -0.502 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -22.220 11.144 -0.062 1.00 0.00 H new ATOM 689 N PRO A 45 -19.721 6.609 2.527 1.00 0.00 N ATOM 690 CA PRO A 45 -19.498 5.199 2.194 1.00 0.00 C ATOM 691 C PRO A 45 -20.147 4.806 0.871 1.00 0.00 C ATOM 692 O PRO A 45 -20.986 5.524 0.326 1.00 0.00 O ATOM 693 CB PRO A 45 -20.158 4.451 3.355 1.00 0.00 C ATOM 694 CG PRO A 45 -21.192 5.391 3.872 1.00 0.00 C ATOM 695 CD PRO A 45 -20.633 6.773 3.672 1.00 0.00 C ATOM 0 HA PRO A 45 -18.439 4.973 2.070 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -20.606 3.515 3.020 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -19.431 4.198 4.127 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -22.133 5.269 3.336 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -21.399 5.202 4.925 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -21.419 7.498 3.459 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -20.106 7.126 4.559 1.00 0.00 H new ATOM 703 N PRO A 46 -19.751 3.640 0.340 1.00 0.00 N ATOM 704 CA PRO A 46 -20.283 3.125 -0.925 1.00 0.00 C ATOM 705 C PRO A 46 -21.740 2.690 -0.808 1.00 0.00 C ATOM 706 O PRO A 46 -22.490 2.733 -1.783 1.00 0.00 O ATOM 707 CB PRO A 46 -19.387 1.920 -1.222 1.00 0.00 C ATOM 708 CG PRO A 46 -18.887 1.482 0.111 1.00 0.00 C ATOM 709 CD PRO A 46 -18.755 2.733 0.935 1.00 0.00 C ATOM 0 HA PRO A 46 -20.276 3.883 -1.709 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -19.944 1.125 -1.717 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -18.564 2.192 -1.884 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -19.579 0.780 0.576 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -17.928 0.972 0.020 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -18.962 2.544 1.988 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -17.749 3.148 0.877 1.00 0.00 H new ATOM 717 N ASP A 47 -22.133 2.273 0.390 1.00 0.00 N ATOM 718 CA ASP A 47 -23.501 1.831 0.635 1.00 0.00 C ATOM 719 C ASP A 47 -24.479 2.995 0.504 1.00 0.00 C ATOM 720 O ASP A 47 -25.584 2.833 -0.013 1.00 0.00 O ATOM 721 CB ASP A 47 -23.617 1.206 2.025 1.00 0.00 C ATOM 722 CG ASP A 47 -22.652 0.053 2.224 1.00 0.00 C ATOM 723 OD1 ASP A 47 -21.426 0.290 2.176 1.00 0.00 O ATOM 724 OD2 ASP A 47 -23.122 -1.086 2.427 1.00 0.00 O ATOM 0 H ASP A 47 -21.524 2.232 1.207 1.00 0.00 H new ATOM 0 HA ASP A 47 -23.754 1.080 -0.114 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -23.428 1.969 2.780 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -24.637 0.853 2.177 1.00 0.00 H new ATOM 729 N GLN A 48 -24.064 4.166 0.977 1.00 0.00 N ATOM 730 CA GLN A 48 -24.905 5.355 0.914 1.00 0.00 C ATOM 731 C GLN A 48 -24.647 6.137 -0.370 1.00 0.00 C ATOM 732 O GLN A 48 -25.512 6.875 -0.843 1.00 0.00 O ATOM 733 CB GLN A 48 -24.652 6.250 2.128 1.00 0.00 C ATOM 734 CG GLN A 48 -25.448 5.845 3.358 1.00 0.00 C ATOM 735 CD GLN A 48 -25.118 4.444 3.833 1.00 0.00 C ATOM 736 OE1 GLN A 48 -23.979 3.990 3.719 1.00 0.00 O ATOM 737 NE2 GLN A 48 -26.114 3.751 4.371 1.00 0.00 N ATOM 0 H GLN A 48 -23.152 4.316 1.407 1.00 0.00 H new ATOM 0 HA GLN A 48 -25.946 5.033 0.919 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -23.589 6.229 2.370 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -24.899 7.279 1.868 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -25.251 6.553 4.163 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -26.513 5.907 3.133 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -27.042 4.167 4.446 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -25.951 2.803 4.710 1.00 0.00 H new ATOM 746 N GLN A 49 -23.453 5.970 -0.930 1.00 0.00 N ATOM 747 CA GLN A 49 -23.082 6.661 -2.159 1.00 0.00 C ATOM 748 C GLN A 49 -23.449 5.829 -3.383 1.00 0.00 C ATOM 749 O GLN A 49 -23.373 4.600 -3.356 1.00 0.00 O ATOM 750 CB GLN A 49 -21.583 6.966 -2.165 1.00 0.00 C ATOM 751 CG GLN A 49 -21.190 8.066 -3.137 1.00 0.00 C ATOM 752 CD GLN A 49 -19.690 8.270 -3.212 1.00 0.00 C ATOM 753 OE1 GLN A 49 -18.996 8.242 -2.195 1.00 0.00 O ATOM 754 NE2 GLN A 49 -19.180 8.478 -4.420 1.00 0.00 N ATOM 0 H GLN A 49 -22.726 5.362 -0.552 1.00 0.00 H new ATOM 0 HA GLN A 49 -23.636 7.599 -2.201 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -21.275 7.254 -1.160 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -21.037 6.057 -2.418 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -21.570 7.822 -4.129 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -21.665 8.999 -2.835 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -19.792 8.493 -5.236 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -18.177 8.622 -4.532 1.00 0.00 H new ATOM 763 N ARG A 50 -23.846 6.506 -4.455 1.00 0.00 N ATOM 764 CA ARG A 50 -24.226 5.828 -5.689 1.00 0.00 C ATOM 765 C ARG A 50 -24.080 6.761 -6.888 1.00 0.00 C ATOM 766 O ARG A 50 -24.586 7.884 -6.881 1.00 0.00 O ATOM 767 CB ARG A 50 -25.667 5.323 -5.595 1.00 0.00 C ATOM 768 CG ARG A 50 -25.787 3.934 -4.990 1.00 0.00 C ATOM 769 CD ARG A 50 -26.832 3.099 -5.714 1.00 0.00 C ATOM 770 NE ARG A 50 -26.243 2.285 -6.774 1.00 0.00 N ATOM 771 CZ ARG A 50 -25.469 1.230 -6.546 1.00 0.00 C ATOM 772 NH1 ARG A 50 -25.192 0.863 -5.303 1.00 0.00 N ATOM 773 NH2 ARG A 50 -24.971 0.539 -7.564 1.00 0.00 N ATOM 0 H ARG A 50 -23.913 7.523 -4.494 1.00 0.00 H new ATOM 0 HA ARG A 50 -23.558 4.978 -5.828 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -26.250 6.023 -4.996 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -26.106 5.315 -6.593 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -24.821 3.431 -5.037 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -26.052 4.017 -3.936 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -27.338 2.451 -4.998 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -27.590 3.756 -6.140 1.00 0.00 H new ATOM 0 HE ARG A 50 -26.437 2.541 -7.742 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -25.574 1.391 -4.518 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -24.597 0.052 -5.131 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -25.183 0.818 -8.522 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -24.377 -0.271 -7.388 1.00 0.00 H new ATOM 787 N LEU A 51 -23.385 6.288 -7.917 1.00 0.00 N ATOM 788 CA LEU A 51 -23.171 7.079 -9.124 1.00 0.00 C ATOM 789 C LEU A 51 -24.193 6.720 -10.198 1.00 0.00 C ATOM 790 O LEU A 51 -24.520 5.548 -10.391 1.00 0.00 O ATOM 791 CB LEU A 51 -21.755 6.858 -9.658 1.00 0.00 C ATOM 792 CG LEU A 51 -20.617 7.375 -8.776 1.00 0.00 C ATOM 793 CD1 LEU A 51 -19.279 7.202 -9.476 1.00 0.00 C ATOM 794 CD2 LEU A 51 -20.846 8.835 -8.412 1.00 0.00 C ATOM 0 H LEU A 51 -22.960 5.361 -7.940 1.00 0.00 H new ATOM 0 HA LEU A 51 -23.296 8.131 -8.866 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -21.610 5.789 -9.814 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -21.677 7.336 -10.634 1.00 0.00 H new ATOM 0 HG LEU A 51 -20.601 6.790 -7.856 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -18.481 7.575 -8.834 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -19.112 6.145 -9.685 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -19.283 7.761 -10.412 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -20.027 9.186 -7.784 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -20.889 9.434 -9.321 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -21.786 8.931 -7.869 1.00 0.00 H new ATOM 806 N ILE A 52 -24.693 7.735 -10.895 1.00 0.00 N ATOM 807 CA ILE A 52 -25.675 7.526 -11.952 1.00 0.00 C ATOM 808 C ILE A 52 -25.126 7.961 -13.306 1.00 0.00 C ATOM 809 O ILE A 52 -24.417 8.962 -13.408 1.00 0.00 O ATOM 810 CB ILE A 52 -26.979 8.294 -11.668 1.00 0.00 C ATOM 811 CG1 ILE A 52 -27.432 8.058 -10.226 1.00 0.00 C ATOM 812 CG2 ILE A 52 -28.065 7.872 -12.646 1.00 0.00 C ATOM 813 CD1 ILE A 52 -27.676 6.601 -9.900 1.00 0.00 C ATOM 0 H ILE A 52 -24.434 8.710 -10.747 1.00 0.00 H new ATOM 0 HA ILE A 52 -25.890 6.458 -11.977 1.00 0.00 H new ATOM 0 HB ILE A 52 -26.792 9.360 -11.800 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -26.676 8.452 -9.547 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -28.348 8.621 -10.045 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -28.981 8.423 -12.433 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -27.741 8.087 -13.664 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -28.253 6.803 -12.543 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -27.994 6.509 -8.862 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -28.454 6.207 -10.554 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -26.756 6.036 -10.049 1.00 0.00 H new ATOM 825 N PHE A 53 -25.460 7.203 -14.345 1.00 0.00 N ATOM 826 CA PHE A 53 -25.001 7.510 -15.695 1.00 0.00 C ATOM 827 C PHE A 53 -26.095 7.223 -16.719 1.00 0.00 C ATOM 828 O PHE A 53 -26.541 6.085 -16.864 1.00 0.00 O ATOM 829 CB PHE A 53 -23.748 6.697 -16.028 1.00 0.00 C ATOM 830 CG PHE A 53 -23.105 7.092 -17.327 1.00 0.00 C ATOM 831 CD1 PHE A 53 -22.137 8.083 -17.362 1.00 0.00 C ATOM 832 CD2 PHE A 53 -23.469 6.473 -18.511 1.00 0.00 C ATOM 833 CE1 PHE A 53 -21.545 8.449 -18.556 1.00 0.00 C ATOM 834 CE2 PHE A 53 -22.879 6.834 -19.708 1.00 0.00 C ATOM 835 CZ PHE A 53 -21.915 7.823 -19.730 1.00 0.00 C ATOM 0 H PHE A 53 -26.047 6.371 -14.278 1.00 0.00 H new ATOM 0 HA PHE A 53 -24.758 8.572 -15.737 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -23.023 6.815 -15.222 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -24.011 5.640 -16.068 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -21.842 8.574 -16.447 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -24.222 5.699 -18.499 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -20.793 9.224 -18.571 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -23.171 6.343 -20.625 1.00 0.00 H new ATOM 0 HZ PHE A 53 -21.452 8.106 -20.664 1.00 0.00 H new ATOM 845 N ALA A 54 -26.522 8.263 -17.427 1.00 0.00 N ATOM 846 CA ALA A 54 -27.561 8.124 -18.439 1.00 0.00 C ATOM 847 C ALA A 54 -28.799 7.443 -17.865 1.00 0.00 C ATOM 848 O ALA A 54 -29.435 6.627 -18.530 1.00 0.00 O ATOM 849 CB ALA A 54 -27.034 7.343 -19.634 1.00 0.00 C ATOM 0 H ALA A 54 -26.164 9.212 -17.318 1.00 0.00 H new ATOM 0 HA ALA A 54 -27.847 9.123 -18.769 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -27.821 7.247 -20.382 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -26.184 7.870 -20.067 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -26.719 6.351 -19.310 1.00 0.00 H new ATOM 855 N GLY A 55 -29.134 7.784 -16.624 1.00 0.00 N ATOM 856 CA GLY A 55 -30.294 7.195 -15.981 1.00 0.00 C ATOM 857 C GLY A 55 -30.061 5.754 -15.570 1.00 0.00 C ATOM 858 O GLY A 55 -31.010 4.998 -15.364 1.00 0.00 O ATOM 0 H GLY A 55 -28.623 8.457 -16.053 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -30.555 7.783 -15.101 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -31.145 7.243 -16.660 1.00 0.00 H new ATOM 862 N LYS A 56 -28.793 5.373 -15.452 1.00 0.00 N ATOM 863 CA LYS A 56 -28.436 4.013 -15.064 1.00 0.00 C ATOM 864 C LYS A 56 -27.460 4.020 -13.892 1.00 0.00 C ATOM 865 O LYS A 56 -26.405 4.650 -13.957 1.00 0.00 O ATOM 866 CB LYS A 56 -27.821 3.267 -16.250 1.00 0.00 C ATOM 867 CG LYS A 56 -27.930 1.756 -16.142 1.00 0.00 C ATOM 868 CD LYS A 56 -27.854 1.092 -17.507 1.00 0.00 C ATOM 869 CE LYS A 56 -26.425 1.053 -18.028 1.00 0.00 C ATOM 870 NZ LYS A 56 -25.615 0.004 -17.348 1.00 0.00 N ATOM 0 H LYS A 56 -27.996 5.987 -15.619 1.00 0.00 H new ATOM 0 HA LYS A 56 -29.346 3.500 -14.753 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -28.311 3.593 -17.167 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -26.770 3.542 -16.335 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -27.129 1.377 -15.507 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -28.871 1.492 -15.660 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -28.247 0.077 -17.442 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -28.485 1.633 -18.212 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -26.435 0.865 -19.102 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -25.957 2.026 -17.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -24.680 -0.060 -17.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -25.499 0.251 -16.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -26.100 -0.913 -17.425 1.00 0.00 H new ATOM 884 N GLN A 57 -27.820 3.316 -12.824 1.00 0.00 N ATOM 885 CA GLN A 57 -26.974 3.242 -11.639 1.00 0.00 C ATOM 886 C GLN A 57 -25.687 2.479 -11.935 1.00 0.00 C ATOM 887 O GLN A 57 -25.721 1.317 -12.342 1.00 0.00 O ATOM 888 CB GLN A 57 -27.727 2.568 -10.490 1.00 0.00 C ATOM 889 CG GLN A 57 -28.224 1.171 -10.826 1.00 0.00 C ATOM 890 CD GLN A 57 -29.385 0.739 -9.952 1.00 0.00 C ATOM 891 OE1 GLN A 57 -29.265 -0.195 -9.158 1.00 0.00 O ATOM 892 NE2 GLN A 57 -30.517 1.417 -10.094 1.00 0.00 N ATOM 0 H GLN A 57 -28.691 2.789 -12.755 1.00 0.00 H new ATOM 0 HA GLN A 57 -26.713 4.259 -11.346 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -27.072 2.512 -9.620 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -28.577 3.190 -10.210 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -28.530 1.140 -11.872 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -27.405 0.461 -10.713 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -30.571 2.184 -10.764 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -31.333 1.171 -9.533 1.00 0.00 H new ATOM 901 N LEU A 58 -24.553 3.140 -11.729 1.00 0.00 N ATOM 902 CA LEU A 58 -23.253 2.524 -11.974 1.00 0.00 C ATOM 903 C LEU A 58 -22.864 1.598 -10.826 1.00 0.00 C ATOM 904 O LEU A 58 -23.552 1.534 -9.808 1.00 0.00 O ATOM 905 CB LEU A 58 -22.184 3.602 -12.161 1.00 0.00 C ATOM 906 CG LEU A 58 -22.495 4.685 -13.194 1.00 0.00 C ATOM 907 CD1 LEU A 58 -21.444 5.783 -13.150 1.00 0.00 C ATOM 908 CD2 LEU A 58 -22.581 4.082 -14.589 1.00 0.00 C ATOM 0 H LEU A 58 -24.507 4.102 -11.393 1.00 0.00 H new ATOM 0 HA LEU A 58 -23.325 1.931 -12.885 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -22.012 4.085 -11.199 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -21.251 3.115 -12.445 1.00 0.00 H new ATOM 0 HG LEU A 58 -23.461 5.126 -12.950 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -21.682 6.545 -13.892 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -21.431 6.235 -12.158 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -20.464 5.358 -13.368 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -22.803 4.867 -15.312 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -21.630 3.614 -14.842 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -23.372 3.332 -14.613 1.00 0.00 H new ATOM 920 N GLU A 59 -21.755 0.885 -10.998 1.00 0.00 N ATOM 921 CA GLU A 59 -21.274 -0.036 -9.975 1.00 0.00 C ATOM 922 C GLU A 59 -19.945 -0.662 -10.388 1.00 0.00 C ATOM 923 O GLU A 59 -19.536 -0.568 -11.546 1.00 0.00 O ATOM 924 CB GLU A 59 -22.309 -1.133 -9.717 1.00 0.00 C ATOM 925 CG GLU A 59 -22.883 -1.739 -10.987 1.00 0.00 C ATOM 926 CD GLU A 59 -23.945 -2.784 -10.706 1.00 0.00 C ATOM 927 OE1 GLU A 59 -25.080 -2.397 -10.355 1.00 0.00 O ATOM 928 OE2 GLU A 59 -23.642 -3.988 -10.838 1.00 0.00 O ATOM 0 H GLU A 59 -21.174 0.928 -11.835 1.00 0.00 H new ATOM 0 HA GLU A 59 -21.119 0.530 -9.057 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -21.849 -1.923 -9.123 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -23.123 -0.720 -9.121 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -23.311 -0.947 -11.602 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -22.078 -2.191 -11.566 1.00 0.00 H new ATOM 935 N ASP A 60 -19.277 -1.300 -9.434 1.00 0.00 N ATOM 936 CA ASP A 60 -17.995 -1.943 -9.698 1.00 0.00 C ATOM 937 C ASP A 60 -18.138 -3.025 -10.764 1.00 0.00 C ATOM 938 O ASP A 60 -19.209 -3.606 -10.933 1.00 0.00 O ATOM 939 CB ASP A 60 -17.429 -2.548 -8.412 1.00 0.00 C ATOM 940 CG ASP A 60 -18.262 -3.708 -7.903 1.00 0.00 C ATOM 941 OD1 ASP A 60 -19.363 -3.460 -7.370 1.00 0.00 O ATOM 942 OD2 ASP A 60 -17.813 -4.865 -8.040 1.00 0.00 O ATOM 0 H ASP A 60 -19.602 -1.386 -8.471 1.00 0.00 H new ATOM 0 HA ASP A 60 -17.306 -1.184 -10.067 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -16.409 -2.888 -8.592 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -17.377 -1.777 -7.643 1.00 0.00 H new ATOM 947 N GLY A 61 -17.051 -3.289 -11.482 1.00 0.00 N ATOM 948 CA GLY A 61 -17.077 -4.300 -12.523 1.00 0.00 C ATOM 949 C GLY A 61 -16.533 -3.787 -13.842 1.00 0.00 C ATOM 950 O GLY A 61 -15.694 -4.435 -14.469 1.00 0.00 O ATOM 0 H GLY A 61 -16.153 -2.821 -11.362 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -16.492 -5.162 -12.203 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -18.101 -4.645 -12.665 1.00 0.00 H new ATOM 954 N ARG A 62 -17.012 -2.622 -14.265 1.00 0.00 N ATOM 955 CA ARG A 62 -16.570 -2.025 -15.520 1.00 0.00 C ATOM 956 C ARG A 62 -15.710 -0.791 -15.262 1.00 0.00 C ATOM 957 O ARG A 62 -15.651 -0.285 -14.140 1.00 0.00 O ATOM 958 CB ARG A 62 -17.776 -1.648 -16.382 1.00 0.00 C ATOM 959 CG ARG A 62 -18.501 -2.846 -16.973 1.00 0.00 C ATOM 960 CD ARG A 62 -19.572 -2.416 -17.964 1.00 0.00 C ATOM 961 NE ARG A 62 -20.628 -3.416 -18.096 1.00 0.00 N ATOM 962 CZ ARG A 62 -21.558 -3.383 -19.044 1.00 0.00 C ATOM 963 NH1 ARG A 62 -21.561 -2.405 -19.939 1.00 0.00 N ATOM 964 NH2 ARG A 62 -22.486 -4.329 -19.098 1.00 0.00 N ATOM 0 H ARG A 62 -17.706 -2.073 -13.758 1.00 0.00 H new ATOM 0 HA ARG A 62 -15.968 -2.762 -16.052 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -18.477 -1.071 -15.779 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -17.444 -0.999 -17.192 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -17.783 -3.498 -17.471 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -18.957 -3.428 -16.172 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -20.007 -1.470 -17.640 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -19.115 -2.240 -18.938 1.00 0.00 H new ATOM 0 HE ARG A 62 -20.653 -4.182 -17.423 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -20.848 -1.676 -19.900 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -22.276 -2.381 -20.666 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -22.486 -5.083 -18.411 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -23.200 -4.302 -19.826 1.00 0.00 H new ATOM 978 N THR A 63 -15.044 -0.311 -16.307 1.00 0.00 N ATOM 979 CA THR A 63 -14.186 0.862 -16.194 1.00 0.00 C ATOM 980 C THR A 63 -14.890 2.110 -16.712 1.00 0.00 C ATOM 981 O THR A 63 -15.847 2.021 -17.483 1.00 0.00 O ATOM 982 CB THR A 63 -12.868 0.670 -16.968 1.00 0.00 C ATOM 983 OG1 THR A 63 -12.185 1.923 -17.088 1.00 0.00 O ATOM 984 CG2 THR A 63 -13.131 0.095 -18.351 1.00 0.00 C ATOM 0 H THR A 63 -15.082 -0.717 -17.242 1.00 0.00 H new ATOM 0 HA THR A 63 -13.961 0.989 -15.135 1.00 0.00 H new ATOM 0 HB THR A 63 -12.245 -0.032 -16.414 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.036 2.301 -16.196 1.00 0.00 H new ATOM 0 HG21 THR A 63 -12.185 -0.032 -18.878 1.00 0.00 H new ATOM 0 HG22 THR A 63 -13.625 -0.872 -18.255 1.00 0.00 H new ATOM 0 HG23 THR A 63 -13.771 0.776 -18.912 1.00 0.00 H new ATOM 992 N LEU A 64 -14.411 3.274 -16.286 1.00 0.00 N ATOM 993 CA LEU A 64 -14.995 4.542 -16.708 1.00 0.00 C ATOM 994 C LEU A 64 -15.077 4.624 -18.229 1.00 0.00 C ATOM 995 O LEU A 64 -16.008 5.212 -18.780 1.00 0.00 O ATOM 996 CB LEU A 64 -14.170 5.711 -16.167 1.00 0.00 C ATOM 997 CG LEU A 64 -14.373 6.049 -14.690 1.00 0.00 C ATOM 998 CD1 LEU A 64 -15.846 6.289 -14.395 1.00 0.00 C ATOM 999 CD2 LEU A 64 -13.825 4.937 -13.808 1.00 0.00 C ATOM 0 H LEU A 64 -13.620 3.366 -15.649 1.00 0.00 H new ATOM 0 HA LEU A 64 -16.006 4.601 -16.304 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -13.115 5.489 -16.327 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -14.402 6.597 -16.757 1.00 0.00 H new ATOM 0 HG LEU A 64 -13.825 6.965 -14.468 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -15.971 6.528 -13.339 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -16.208 7.120 -15.001 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -16.416 5.391 -14.634 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -13.978 5.195 -12.760 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -14.345 4.005 -14.032 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -12.759 4.813 -13.999 1.00 0.00 H new ATOM 1011 N SER A 65 -14.098 4.028 -18.903 1.00 0.00 N ATOM 1012 CA SER A 65 -14.059 4.035 -20.360 1.00 0.00 C ATOM 1013 C SER A 65 -15.143 3.130 -20.937 1.00 0.00 C ATOM 1014 O SER A 65 -15.665 3.383 -22.023 1.00 0.00 O ATOM 1015 CB SER A 65 -12.684 3.584 -20.857 1.00 0.00 C ATOM 1016 OG SER A 65 -12.669 3.453 -22.268 1.00 0.00 O ATOM 0 H SER A 65 -13.322 3.534 -18.463 1.00 0.00 H new ATOM 0 HA SER A 65 -14.243 5.055 -20.699 1.00 0.00 H new ATOM 0 HB2 SER A 65 -11.928 4.305 -20.548 1.00 0.00 H new ATOM 0 HB3 SER A 65 -12.422 2.631 -20.397 1.00 0.00 H new ATOM 0 HG SER A 65 -11.779 3.165 -22.560 1.00 0.00 H new ATOM 1022 N GLU A 66 -15.476 2.073 -20.203 1.00 0.00 N ATOM 1023 CA GLU A 66 -16.496 1.129 -20.642 1.00 0.00 C ATOM 1024 C GLU A 66 -17.892 1.726 -20.487 1.00 0.00 C ATOM 1025 O GLU A 66 -18.828 1.335 -21.186 1.00 0.00 O ATOM 1026 CB GLU A 66 -16.396 -0.173 -19.844 1.00 0.00 C ATOM 1027 CG GLU A 66 -15.383 -1.155 -20.408 1.00 0.00 C ATOM 1028 CD GLU A 66 -15.825 -1.757 -21.727 1.00 0.00 C ATOM 1029 OE1 GLU A 66 -16.890 -2.408 -21.754 1.00 0.00 O ATOM 1030 OE2 GLU A 66 -15.106 -1.576 -22.733 1.00 0.00 O ATOM 0 H GLU A 66 -15.054 1.849 -19.302 1.00 0.00 H new ATOM 0 HA GLU A 66 -16.325 0.914 -21.697 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -16.128 0.062 -18.814 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -17.376 -0.650 -19.818 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -14.429 -0.647 -20.547 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -15.217 -1.954 -19.686 1.00 0.00 H new ATOM 1037 N TYR A 67 -18.024 2.675 -19.567 1.00 0.00 N ATOM 1038 CA TYR A 67 -19.306 3.325 -19.318 1.00 0.00 C ATOM 1039 C TYR A 67 -19.458 4.576 -20.177 1.00 0.00 C ATOM 1040 O TYR A 67 -20.351 5.392 -19.951 1.00 0.00 O ATOM 1041 CB TYR A 67 -19.437 3.690 -17.838 1.00 0.00 C ATOM 1042 CG TYR A 67 -19.973 2.564 -16.982 1.00 0.00 C ATOM 1043 CD1 TYR A 67 -21.155 1.914 -17.315 1.00 0.00 C ATOM 1044 CD2 TYR A 67 -19.298 2.152 -15.840 1.00 0.00 C ATOM 1045 CE1 TYR A 67 -21.649 0.886 -16.536 1.00 0.00 C ATOM 1046 CE2 TYR A 67 -19.784 1.123 -15.056 1.00 0.00 C ATOM 1047 CZ TYR A 67 -20.960 0.494 -15.408 1.00 0.00 C ATOM 1048 OH TYR A 67 -21.448 -0.530 -14.628 1.00 0.00 O ATOM 0 H TYR A 67 -17.260 3.011 -18.981 1.00 0.00 H new ATOM 0 HA TYR A 67 -20.098 2.625 -19.584 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -18.460 3.990 -17.459 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -20.096 4.553 -17.742 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -21.697 2.218 -18.198 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -18.378 2.644 -15.560 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -22.570 0.392 -16.809 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -19.246 0.813 -14.172 1.00 0.00 H new ATOM 0 HH TYR A 67 -20.843 -0.682 -13.872 1.00 0.00 H new ATOM 1058 N ASN A 68 -18.580 4.719 -21.164 1.00 0.00 N ATOM 1059 CA ASN A 68 -18.616 5.870 -22.059 1.00 0.00 C ATOM 1060 C ASN A 68 -18.438 7.170 -21.280 1.00 0.00 C ATOM 1061 O ASN A 68 -18.867 8.235 -21.725 1.00 0.00 O ATOM 1062 CB ASN A 68 -19.936 5.901 -22.831 1.00 0.00 C ATOM 1063 CG ASN A 68 -20.339 4.532 -23.343 1.00 0.00 C ATOM 1064 OD1 ASN A 68 -21.319 3.947 -22.881 1.00 0.00 O ATOM 1065 ND2 ASN A 68 -19.582 4.013 -24.303 1.00 0.00 N ATOM 0 H ASN A 68 -17.835 4.052 -21.365 1.00 0.00 H new ATOM 0 HA ASN A 68 -17.792 5.775 -22.766 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -20.723 6.290 -22.185 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -19.846 6.588 -23.672 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -19.804 3.094 -24.687 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -18.779 4.533 -24.656 1.00 0.00 H new ATOM 1072 N ILE A 69 -17.804 7.074 -20.116 1.00 0.00 N ATOM 1073 CA ILE A 69 -17.569 8.242 -19.277 1.00 0.00 C ATOM 1074 C ILE A 69 -16.300 8.975 -19.698 1.00 0.00 C ATOM 1075 O ILE A 69 -15.192 8.568 -19.350 1.00 0.00 O ATOM 1076 CB ILE A 69 -17.454 7.853 -17.791 1.00 0.00 C ATOM 1077 CG1 ILE A 69 -18.738 7.168 -17.320 1.00 0.00 C ATOM 1078 CG2 ILE A 69 -17.161 9.082 -16.943 1.00 0.00 C ATOM 1079 CD1 ILE A 69 -18.539 6.271 -16.118 1.00 0.00 C ATOM 0 H ILE A 69 -17.444 6.200 -19.733 1.00 0.00 H new ATOM 0 HA ILE A 69 -18.427 8.902 -19.407 1.00 0.00 H new ATOM 0 HB ILE A 69 -16.628 7.152 -17.677 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -19.478 7.930 -17.076 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -19.147 6.578 -18.140 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -17.083 8.791 -15.895 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -16.222 9.532 -17.266 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -17.968 9.805 -17.059 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -19.491 5.819 -15.840 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -17.823 5.487 -16.364 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -18.159 6.860 -15.283 1.00 0.00 H new ATOM 1091 N GLN A 70 -16.471 10.059 -20.448 1.00 0.00 N ATOM 1092 CA GLN A 70 -15.339 10.850 -20.916 1.00 0.00 C ATOM 1093 C GLN A 70 -14.943 11.898 -19.882 1.00 0.00 C ATOM 1094 O GLN A 70 -15.420 11.878 -18.747 1.00 0.00 O ATOM 1095 CB GLN A 70 -15.679 11.530 -22.244 1.00 0.00 C ATOM 1096 CG GLN A 70 -16.296 10.591 -23.268 1.00 0.00 C ATOM 1097 CD GLN A 70 -16.786 11.317 -24.505 1.00 0.00 C ATOM 1098 OE1 GLN A 70 -16.909 12.542 -24.512 1.00 0.00 O ATOM 1099 NE2 GLN A 70 -17.068 10.563 -25.561 1.00 0.00 N ATOM 0 H GLN A 70 -17.382 10.409 -20.744 1.00 0.00 H new ATOM 0 HA GLN A 70 -14.495 10.177 -21.066 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -16.369 12.352 -22.055 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -14.772 11.965 -22.663 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -15.559 9.842 -23.559 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -17.129 10.058 -22.811 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -16.951 9.551 -25.511 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -17.401 10.996 -26.422 1.00 0.00 H new ATOM 1108 N LYS A 71 -14.067 12.814 -20.280 1.00 0.00 N ATOM 1109 CA LYS A 71 -13.605 13.872 -19.389 1.00 0.00 C ATOM 1110 C LYS A 71 -14.654 14.972 -19.263 1.00 0.00 C ATOM 1111 O LYS A 71 -14.589 15.803 -18.357 1.00 0.00 O ATOM 1112 CB LYS A 71 -12.290 14.462 -19.902 1.00 0.00 C ATOM 1113 CG LYS A 71 -12.458 15.352 -21.122 1.00 0.00 C ATOM 1114 CD LYS A 71 -11.124 15.903 -21.598 1.00 0.00 C ATOM 1115 CE LYS A 71 -11.155 16.231 -23.083 1.00 0.00 C ATOM 1116 NZ LYS A 71 -11.071 15.005 -23.924 1.00 0.00 N ATOM 0 H LYS A 71 -13.662 12.845 -21.216 1.00 0.00 H new ATOM 0 HA LYS A 71 -13.440 13.437 -18.403 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -11.824 15.039 -19.103 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -11.608 13.648 -20.147 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -12.926 14.784 -21.926 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -13.129 16.177 -20.882 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -10.877 16.800 -21.031 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -10.337 15.175 -21.401 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -12.073 16.769 -23.317 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -10.326 16.895 -23.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -10.925 15.275 -24.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -10.274 14.418 -23.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -11.955 14.464 -23.839 1.00 0.00 H new ATOM 1130 N GLU A 72 -15.620 14.971 -20.176 1.00 0.00 N ATOM 1131 CA GLU A 72 -16.682 15.970 -20.165 1.00 0.00 C ATOM 1132 C GLU A 72 -18.014 15.343 -19.763 1.00 0.00 C ATOM 1133 O GLU A 72 -19.026 16.034 -19.640 1.00 0.00 O ATOM 1134 CB GLU A 72 -16.809 16.627 -21.541 1.00 0.00 C ATOM 1135 CG GLU A 72 -15.502 17.192 -22.068 1.00 0.00 C ATOM 1136 CD GLU A 72 -15.711 18.237 -23.148 1.00 0.00 C ATOM 1137 OE1 GLU A 72 -16.496 17.974 -24.082 1.00 0.00 O ATOM 1138 OE2 GLU A 72 -15.089 19.316 -23.058 1.00 0.00 O ATOM 0 H GLU A 72 -15.689 14.290 -20.932 1.00 0.00 H new ATOM 0 HA GLU A 72 -16.422 16.732 -19.430 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -17.190 15.893 -22.251 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -17.545 17.429 -21.485 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -14.943 17.634 -21.243 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -14.894 16.380 -22.466 1.00 0.00 H new ATOM 1145 N SER A 73 -18.006 14.029 -19.561 1.00 0.00 N ATOM 1146 CA SER A 73 -19.214 13.307 -19.178 1.00 0.00 C ATOM 1147 C SER A 73 -19.878 13.961 -17.970 1.00 0.00 C ATOM 1148 O SER A 73 -19.266 14.770 -17.272 1.00 0.00 O ATOM 1149 CB SER A 73 -18.883 11.847 -18.864 1.00 0.00 C ATOM 1150 OG SER A 73 -19.054 11.028 -20.007 1.00 0.00 O ATOM 0 H SER A 73 -17.177 13.443 -19.656 1.00 0.00 H new ATOM 0 HA SER A 73 -19.910 13.342 -20.016 1.00 0.00 H new ATOM 0 HB2 SER A 73 -17.855 11.772 -18.510 1.00 0.00 H new ATOM 0 HB3 SER A 73 -19.525 11.491 -18.058 1.00 0.00 H new ATOM 0 HG SER A 73 -19.832 10.445 -19.879 1.00 0.00 H new ATOM 1156 N THR A 74 -21.136 13.605 -17.729 1.00 0.00 N ATOM 1157 CA THR A 74 -21.884 14.157 -16.607 1.00 0.00 C ATOM 1158 C THR A 74 -22.308 13.061 -15.636 1.00 0.00 C ATOM 1159 O THR A 74 -23.074 12.164 -15.992 1.00 0.00 O ATOM 1160 CB THR A 74 -23.137 14.915 -17.086 1.00 0.00 C ATOM 1161 OG1 THR A 74 -22.876 15.546 -18.345 1.00 0.00 O ATOM 1162 CG2 THR A 74 -23.559 15.962 -16.066 1.00 0.00 C ATOM 0 H THR A 74 -21.658 12.937 -18.296 1.00 0.00 H new ATOM 0 HA THR A 74 -21.219 14.854 -16.096 1.00 0.00 H new ATOM 0 HB THR A 74 -23.948 14.196 -17.202 1.00 0.00 H new ATOM 0 HG1 THR A 74 -23.678 16.024 -18.644 1.00 0.00 H new ATOM 0 HG21 THR A 74 -24.445 16.484 -16.426 1.00 0.00 H new ATOM 0 HG22 THR A 74 -23.785 15.475 -15.117 1.00 0.00 H new ATOM 0 HG23 THR A 74 -22.749 16.678 -15.923 1.00 0.00 H new ATOM 1170 N LEU A 75 -21.807 13.138 -14.408 1.00 0.00 N ATOM 1171 CA LEU A 75 -22.135 12.151 -13.385 1.00 0.00 C ATOM 1172 C LEU A 75 -23.155 12.709 -12.398 1.00 0.00 C ATOM 1173 O LEU A 75 -23.249 13.922 -12.205 1.00 0.00 O ATOM 1174 CB LEU A 75 -20.870 11.721 -12.640 1.00 0.00 C ATOM 1175 CG LEU A 75 -20.243 10.401 -13.088 1.00 0.00 C ATOM 1176 CD1 LEU A 75 -21.182 9.239 -12.801 1.00 0.00 C ATOM 1177 CD2 LEU A 75 -19.893 10.452 -14.568 1.00 0.00 C ATOM 0 H LEU A 75 -21.172 13.873 -14.097 1.00 0.00 H new ATOM 0 HA LEU A 75 -22.572 11.283 -13.879 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -20.124 12.509 -12.747 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -21.105 11.646 -11.578 1.00 0.00 H new ATOM 0 HG LEU A 75 -19.324 10.247 -12.522 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -20.719 8.308 -13.127 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -21.383 9.189 -11.731 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -22.118 9.386 -13.340 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -19.448 9.504 -14.869 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -20.797 10.629 -15.150 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -19.183 11.259 -14.746 1.00 0.00 H new ATOM 1189 N HIS A 76 -23.916 11.816 -11.774 1.00 0.00 N ATOM 1190 CA HIS A 76 -24.928 12.219 -10.803 1.00 0.00 C ATOM 1191 C HIS A 76 -24.860 11.347 -9.553 1.00 0.00 C ATOM 1192 O HIS A 76 -25.079 10.137 -9.615 1.00 0.00 O ATOM 1193 CB HIS A 76 -26.323 12.132 -11.424 1.00 0.00 C ATOM 1194 CG HIS A 76 -26.704 13.347 -12.213 1.00 0.00 C ATOM 1195 ND1 HIS A 76 -26.674 13.389 -13.591 1.00 0.00 N ATOM 1196 CD2 HIS A 76 -27.127 14.568 -11.810 1.00 0.00 C ATOM 1197 CE1 HIS A 76 -27.060 14.584 -14.002 1.00 0.00 C ATOM 1198 NE2 HIS A 76 -27.341 15.318 -12.940 1.00 0.00 N ATOM 0 H HIS A 76 -23.852 10.809 -11.923 1.00 0.00 H new ATOM 0 HA HIS A 76 -24.729 13.251 -10.515 1.00 0.00 H new ATOM 0 HB2 HIS A 76 -26.369 11.258 -12.074 1.00 0.00 H new ATOM 0 HB3 HIS A 76 -27.056 11.979 -10.632 1.00 0.00 H new ATOM 0 HD2 HIS A 76 -27.270 14.892 -10.790 1.00 0.00 H new ATOM 0 HE1 HIS A 76 -27.133 14.906 -15.030 1.00 0.00 H new ATOM 0 HE2 HIS A 76 -27.665 16.285 -12.957 1.00 0.00 H new ATOM 1206 N LEU A 77 -24.554 11.970 -8.420 1.00 0.00 N ATOM 1207 CA LEU A 77 -24.456 11.251 -7.155 1.00 0.00 C ATOM 1208 C LEU A 77 -25.755 11.363 -6.363 1.00 0.00 C ATOM 1209 O LEU A 77 -26.173 12.458 -5.986 1.00 0.00 O ATOM 1210 CB LEU A 77 -23.291 11.794 -6.325 1.00 0.00 C ATOM 1211 CG LEU A 77 -23.391 13.263 -5.910 1.00 0.00 C ATOM 1212 CD1 LEU A 77 -23.799 13.377 -4.449 1.00 0.00 C ATOM 1213 CD2 LEU A 77 -22.070 13.977 -6.155 1.00 0.00 C ATOM 0 H LEU A 77 -24.370 12.971 -8.352 1.00 0.00 H new ATOM 0 HA LEU A 77 -24.276 10.199 -7.377 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -23.199 11.188 -5.424 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -22.371 11.660 -6.894 1.00 0.00 H new ATOM 0 HG LEU A 77 -24.158 13.742 -6.519 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -23.865 14.429 -4.171 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -24.769 12.901 -4.304 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -23.055 12.883 -3.824 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -22.159 15.021 -5.854 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -21.284 13.497 -5.572 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -21.819 13.925 -7.215 1.00 0.00 H new ATOM 1225 N VAL A 78 -26.389 10.222 -6.111 1.00 0.00 N ATOM 1226 CA VAL A 78 -27.639 10.191 -5.361 1.00 0.00 C ATOM 1227 C VAL A 78 -27.453 9.506 -4.012 1.00 0.00 C ATOM 1228 O VAL A 78 -26.743 8.505 -3.903 1.00 0.00 O ATOM 1229 CB VAL A 78 -28.747 9.463 -6.145 1.00 0.00 C ATOM 1230 CG1 VAL A 78 -29.293 10.355 -7.250 1.00 0.00 C ATOM 1231 CG2 VAL A 78 -28.223 8.154 -6.716 1.00 0.00 C ATOM 0 H VAL A 78 -26.057 9.307 -6.415 1.00 0.00 H new ATOM 0 HA VAL A 78 -27.938 11.227 -5.202 1.00 0.00 H new ATOM 0 HB VAL A 78 -29.563 9.233 -5.459 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -30.075 9.824 -7.793 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -29.708 11.263 -6.813 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -28.488 10.618 -7.937 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -29.019 7.653 -7.267 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -27.389 8.358 -7.388 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -27.885 7.512 -5.903 1.00 0.00 H new ATOM 1241 N LEU A 79 -28.095 10.051 -2.984 1.00 0.00 N ATOM 1242 CA LEU A 79 -28.002 9.492 -1.640 1.00 0.00 C ATOM 1243 C LEU A 79 -29.321 8.849 -1.225 1.00 0.00 C ATOM 1244 O LEU A 79 -30.382 9.465 -1.326 1.00 0.00 O ATOM 1245 CB LEU A 79 -27.616 10.583 -0.639 1.00 0.00 C ATOM 1246 CG LEU A 79 -26.272 10.400 0.068 1.00 0.00 C ATOM 1247 CD1 LEU A 79 -26.350 9.264 1.076 1.00 0.00 C ATOM 1248 CD2 LEU A 79 -25.167 10.140 -0.946 1.00 0.00 C ATOM 0 H LEU A 79 -28.686 10.880 -3.056 1.00 0.00 H new ATOM 0 HA LEU A 79 -27.230 8.722 -1.646 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -27.602 11.539 -1.162 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -28.397 10.646 0.119 1.00 0.00 H new ATOM 0 HG LEU A 79 -26.037 11.319 0.604 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -25.385 9.148 1.569 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -27.113 9.490 1.821 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -26.608 8.338 0.562 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -24.218 10.012 -0.425 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -25.396 9.236 -1.510 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -25.095 10.986 -1.630 1.00 0.00 H new ATOM 1260 N ARG A 80 -29.246 7.608 -0.756 1.00 0.00 N ATOM 1261 CA ARG A 80 -30.435 6.881 -0.325 1.00 0.00 C ATOM 1262 C ARG A 80 -30.630 7.005 1.183 1.00 0.00 C ATOM 1263 O ARG A 80 -31.736 7.270 1.657 1.00 0.00 O ATOM 1264 CB ARG A 80 -30.327 5.406 -0.716 1.00 0.00 C ATOM 1265 CG ARG A 80 -31.667 4.692 -0.774 1.00 0.00 C ATOM 1266 CD ARG A 80 -32.328 4.858 -2.134 1.00 0.00 C ATOM 1267 NE ARG A 80 -31.788 3.928 -3.122 1.00 0.00 N ATOM 1268 CZ ARG A 80 -32.381 3.661 -4.281 1.00 0.00 C ATOM 1269 NH1 ARG A 80 -33.526 4.251 -4.594 1.00 0.00 N ATOM 1270 NH2 ARG A 80 -31.827 2.803 -5.128 1.00 0.00 N ATOM 0 H ARG A 80 -28.375 7.085 -0.665 1.00 0.00 H new ATOM 0 HA ARG A 80 -31.299 7.320 -0.824 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -29.843 5.331 -1.690 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -29.683 4.895 0.000 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -31.525 3.632 -0.564 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -32.324 5.085 0.002 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -33.402 4.700 -2.037 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -32.186 5.881 -2.483 1.00 0.00 H new ATOM 0 HE ARG A 80 -30.908 3.458 -2.911 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -33.954 4.911 -3.945 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -33.979 4.045 -5.484 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -30.946 2.348 -4.890 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -32.282 2.598 -6.017 1.00 0.00 H new ATOM 1284 N LEU A 81 -29.550 6.812 1.932 1.00 0.00 N ATOM 1285 CA LEU A 81 -29.602 6.902 3.388 1.00 0.00 C ATOM 1286 C LEU A 81 -28.728 8.045 3.894 1.00 0.00 C ATOM 1287 O LEU A 81 -27.508 7.913 3.986 1.00 0.00 O ATOM 1288 CB LEU A 81 -29.151 5.583 4.016 1.00 0.00 C ATOM 1289 CG LEU A 81 -30.237 4.525 4.209 1.00 0.00 C ATOM 1290 CD1 LEU A 81 -31.264 4.993 5.228 1.00 0.00 C ATOM 1291 CD2 LEU A 81 -30.909 4.203 2.882 1.00 0.00 C ATOM 0 H LEU A 81 -28.628 6.592 1.556 1.00 0.00 H new ATOM 0 HA LEU A 81 -30.633 7.102 3.679 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -28.364 5.158 3.393 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -28.706 5.800 4.987 1.00 0.00 H new ATOM 0 HG LEU A 81 -29.769 3.616 4.587 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -32.029 4.227 5.352 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -30.772 5.173 6.184 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -31.728 5.916 4.880 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -31.679 3.448 3.038 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -31.363 5.107 2.476 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -30.166 3.824 2.181 1.00 0.00 H new ATOM 1303 N ARG A 82 -29.362 9.166 4.223 1.00 0.00 N ATOM 1304 CA ARG A 82 -28.642 10.332 4.721 1.00 0.00 C ATOM 1305 C ARG A 82 -28.006 10.040 6.077 1.00 0.00 C ATOM 1306 O ARG A 82 -26.785 10.078 6.222 1.00 0.00 O ATOM 1307 CB ARG A 82 -29.587 11.530 4.837 1.00 0.00 C ATOM 1308 CG ARG A 82 -28.874 12.845 5.108 1.00 0.00 C ATOM 1309 CD ARG A 82 -29.813 13.873 5.717 1.00 0.00 C ATOM 1310 NE ARG A 82 -29.202 15.197 5.791 1.00 0.00 N ATOM 1311 CZ ARG A 82 -29.695 16.196 6.514 1.00 0.00 C ATOM 1312 NH1 ARG A 82 -30.802 16.021 7.223 1.00 0.00 N ATOM 1313 NH2 ARG A 82 -29.081 17.372 6.531 1.00 0.00 N ATOM 0 H ARG A 82 -30.372 9.291 4.154 1.00 0.00 H new ATOM 0 HA ARG A 82 -27.850 10.569 4.011 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -30.160 11.621 3.914 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -30.301 11.342 5.638 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -28.035 12.673 5.782 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -28.461 13.234 4.178 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -30.725 13.928 5.123 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -30.103 13.551 6.717 1.00 0.00 H new ATOM 0 HE ARG A 82 -28.349 15.364 5.258 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -31.276 15.118 7.214 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -31.179 16.789 7.778 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -28.229 17.510 5.988 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -29.461 18.138 7.087 1.00 0.00 H new ATOM 1327 N GLY A 83 -28.843 9.748 7.068 1.00 0.00 N ATOM 1328 CA GLY A 83 -28.344 9.453 8.398 1.00 0.00 C ATOM 1329 C GLY A 83 -27.407 10.527 8.917 1.00 0.00 C ATOM 1330 O GLY A 83 -26.187 10.367 8.878 1.00 0.00 O ATOM 0 H GLY A 83 -29.858 9.711 6.973 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -29.185 9.347 9.083 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -27.822 8.496 8.383 1.00 0.00 H new ATOM 1334 N TYR A 84 -27.978 11.624 9.401 1.00 0.00 N ATOM 1335 CA TYR A 84 -27.186 12.730 9.926 1.00 0.00 C ATOM 1336 C TYR A 84 -27.090 12.657 11.447 1.00 0.00 C ATOM 1337 O TYR A 84 -27.865 13.293 12.160 1.00 0.00 O ATOM 1338 CB TYR A 84 -27.798 14.067 9.506 1.00 0.00 C ATOM 1339 CG TYR A 84 -26.828 15.225 9.575 1.00 0.00 C ATOM 1340 CD1 TYR A 84 -26.409 15.734 10.798 1.00 0.00 C ATOM 1341 CD2 TYR A 84 -26.331 15.810 8.417 1.00 0.00 C ATOM 1342 CE1 TYR A 84 -25.523 16.792 10.865 1.00 0.00 C ATOM 1343 CE2 TYR A 84 -25.444 16.867 8.474 1.00 0.00 C ATOM 1344 CZ TYR A 84 -25.043 17.355 9.701 1.00 0.00 C ATOM 1345 OH TYR A 84 -24.160 18.408 9.764 1.00 0.00 O ATOM 0 H TYR A 84 -28.987 11.771 9.441 1.00 0.00 H new ATOM 0 HA TYR A 84 -26.181 12.652 9.512 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -28.175 13.980 8.487 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -28.654 14.282 10.146 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -26.782 15.295 11.712 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -26.644 15.431 7.455 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -25.208 17.176 11.824 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -25.066 17.309 7.564 1.00 0.00 H new ATOM 0 HH TYR A 84 -23.918 18.687 8.856 1.00 0.00 H new ATOM 1355 N ALA A 85 -26.131 11.878 11.936 1.00 0.00 N ATOM 1356 CA ALA A 85 -25.929 11.723 13.371 1.00 0.00 C ATOM 1357 C ALA A 85 -24.691 10.883 13.664 1.00 0.00 C ATOM 1358 O ALA A 85 -24.677 9.675 13.424 1.00 0.00 O ATOM 1359 CB ALA A 85 -27.158 11.096 14.012 1.00 0.00 C ATOM 0 H ALA A 85 -25.481 11.344 11.359 1.00 0.00 H new ATOM 0 HA ALA A 85 -25.774 12.713 13.800 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -26.993 10.986 15.084 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -28.024 11.736 13.842 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -27.339 10.116 13.570 1.00 0.00 H new ATOM 1365 N ASP A 86 -23.653 11.529 14.184 1.00 0.00 N ATOM 1366 CA ASP A 86 -22.409 10.841 14.510 1.00 0.00 C ATOM 1367 C ASP A 86 -22.108 10.941 16.002 1.00 0.00 C ATOM 1368 O ASP A 86 -22.438 11.937 16.647 1.00 0.00 O ATOM 1369 CB ASP A 86 -21.250 11.427 13.703 1.00 0.00 C ATOM 1370 CG ASP A 86 -20.010 10.555 13.753 1.00 0.00 C ATOM 1371 OD1 ASP A 86 -20.008 9.489 13.102 1.00 0.00 O ATOM 1372 OD2 ASP A 86 -19.043 10.940 14.441 1.00 0.00 O ATOM 0 H ASP A 86 -23.648 12.528 14.389 1.00 0.00 H new ATOM 0 HA ASP A 86 -22.526 9.789 14.251 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -21.560 11.553 12.666 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -21.009 12.419 14.086 1.00 0.00 H new ATOM 1377 N LEU A 87 -21.481 9.904 16.545 1.00 0.00 N ATOM 1378 CA LEU A 87 -21.136 9.874 17.962 1.00 0.00 C ATOM 1379 C LEU A 87 -19.761 9.247 18.175 1.00 0.00 C ATOM 1380 O LEU A 87 -19.109 8.819 17.222 1.00 0.00 O ATOM 1381 CB LEU A 87 -22.191 9.094 18.748 1.00 0.00 C ATOM 1382 CG LEU A 87 -23.647 9.480 18.482 1.00 0.00 C ATOM 1383 CD1 LEU A 87 -24.591 8.519 19.186 1.00 0.00 C ATOM 1384 CD2 LEU A 87 -23.909 10.911 18.928 1.00 0.00 C ATOM 0 H LEU A 87 -21.201 9.072 16.025 1.00 0.00 H new ATOM 0 HA LEU A 87 -21.107 10.901 18.325 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -22.071 8.034 18.526 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -21.991 9.221 19.812 1.00 0.00 H new ATOM 0 HG LEU A 87 -23.830 9.416 17.409 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -25.622 8.809 18.985 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -24.421 7.507 18.818 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -24.408 8.550 20.260 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -24.950 11.169 18.731 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -23.708 11.002 19.995 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -23.257 11.589 18.377 1.00 0.00 H new ATOM 1396 N ARG A 88 -19.328 9.195 19.430 1.00 0.00 N ATOM 1397 CA ARG A 88 -18.032 8.620 19.768 1.00 0.00 C ATOM 1398 C ARG A 88 -18.085 7.916 21.121 1.00 0.00 C ATOM 1399 O ARG A 88 -18.260 8.557 22.157 1.00 0.00 O ATOM 1400 CB ARG A 88 -16.957 9.708 19.789 1.00 0.00 C ATOM 1401 CG ARG A 88 -15.546 9.167 19.951 1.00 0.00 C ATOM 1402 CD ARG A 88 -15.150 9.075 21.417 1.00 0.00 C ATOM 1403 NE ARG A 88 -13.703 8.979 21.588 1.00 0.00 N ATOM 1404 CZ ARG A 88 -13.016 7.854 21.421 1.00 0.00 C ATOM 1405 NH1 ARG A 88 -13.642 6.736 21.080 1.00 0.00 N ATOM 1406 NH2 ARG A 88 -11.701 7.846 21.594 1.00 0.00 N ATOM 0 H ARG A 88 -19.856 9.544 20.230 1.00 0.00 H new ATOM 0 HA ARG A 88 -17.779 7.884 19.005 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -17.013 10.281 18.863 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -17.168 10.399 20.605 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -15.478 8.181 19.492 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -14.844 9.813 19.423 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -15.520 9.952 21.948 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -15.627 8.204 21.867 1.00 0.00 H new ATOM 0 HE ARG A 88 -13.192 9.822 21.850 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -14.653 6.738 20.945 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -13.112 5.874 20.952 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -11.216 8.704 21.856 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -11.175 6.982 21.465 1.00 0.00 H new ATOM 1420 N GLU A 89 -17.934 6.596 21.102 1.00 0.00 N ATOM 1421 CA GLU A 89 -17.967 5.806 22.327 1.00 0.00 C ATOM 1422 C GLU A 89 -17.409 4.406 22.088 1.00 0.00 C ATOM 1423 O GLU A 89 -17.185 4.002 20.946 1.00 0.00 O ATOM 1424 CB GLU A 89 -19.398 5.712 22.861 1.00 0.00 C ATOM 1425 CG GLU A 89 -20.429 5.405 21.789 1.00 0.00 C ATOM 1426 CD GLU A 89 -20.251 4.025 21.186 1.00 0.00 C ATOM 1427 OE1 GLU A 89 -20.704 3.042 21.809 1.00 0.00 O ATOM 1428 OE2 GLU A 89 -19.658 3.927 20.091 1.00 0.00 O ATOM 0 H GLU A 89 -17.788 6.051 20.252 1.00 0.00 H new ATOM 0 HA GLU A 89 -17.342 6.305 23.067 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -19.441 4.937 23.627 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -19.659 6.653 23.345 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -21.428 5.484 22.218 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -20.361 6.154 21.000 1.00 0.00 H new ATOM 1435 N ASP A 90 -17.185 3.672 23.172 1.00 0.00 N ATOM 1436 CA ASP A 90 -16.653 2.317 23.081 1.00 0.00 C ATOM 1437 C ASP A 90 -16.856 1.564 24.392 1.00 0.00 C ATOM 1438 O ASP A 90 -15.910 1.293 25.133 1.00 0.00 O ATOM 1439 CB ASP A 90 -15.167 2.353 22.723 1.00 0.00 C ATOM 1440 CG ASP A 90 -14.675 1.034 22.158 1.00 0.00 C ATOM 1441 OD1 ASP A 90 -15.295 -0.007 22.459 1.00 0.00 O ATOM 1442 OD2 ASP A 90 -13.671 1.044 21.416 1.00 0.00 O ATOM 0 H ASP A 90 -17.363 3.992 24.124 1.00 0.00 H new ATOM 0 HA ASP A 90 -17.195 1.792 22.294 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -14.991 3.145 21.995 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -14.588 2.603 23.612 1.00 0.00 H new ATOM 1447 N PRO A 91 -18.117 1.219 24.688 1.00 0.00 N ATOM 1448 CA PRO A 91 -18.474 0.494 25.912 1.00 0.00 C ATOM 1449 C PRO A 91 -17.979 -0.948 25.895 1.00 0.00 C ATOM 1450 O PRO A 91 -17.222 -1.345 25.009 1.00 0.00 O ATOM 1451 CB PRO A 91 -20.004 0.535 25.915 1.00 0.00 C ATOM 1452 CG PRO A 91 -20.382 0.686 24.482 1.00 0.00 C ATOM 1453 CD PRO A 91 -19.294 1.510 23.851 1.00 0.00 C ATOM 0 HA PRO A 91 -18.021 0.940 26.798 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -20.424 -0.376 26.341 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -20.377 1.367 26.512 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -20.467 -0.286 23.996 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -21.350 1.177 24.383 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -19.128 1.228 22.811 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -19.539 2.572 23.857 1.00 0.00 H new ATOM 1461 N ASP A 92 -18.412 -1.728 26.879 1.00 0.00 N ATOM 1462 CA ASP A 92 -18.014 -3.128 26.977 1.00 0.00 C ATOM 1463 C ASP A 92 -18.657 -3.792 28.191 1.00 0.00 C ATOM 1464 O ASP A 92 -18.200 -3.619 29.320 1.00 0.00 O ATOM 1465 CB ASP A 92 -16.492 -3.243 27.064 1.00 0.00 C ATOM 1466 CG ASP A 92 -15.854 -2.018 27.690 1.00 0.00 C ATOM 1467 OD1 ASP A 92 -16.008 -1.829 28.915 1.00 0.00 O ATOM 1468 OD2 ASP A 92 -15.199 -1.249 26.956 1.00 0.00 O ATOM 0 H ASP A 92 -19.039 -1.415 27.620 1.00 0.00 H new ATOM 0 HA ASP A 92 -18.358 -3.642 26.079 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -16.230 -4.125 27.649 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -16.084 -3.391 26.064 1.00 0.00 H new ATOM 1473 N ARG A 93 -19.721 -4.552 27.949 1.00 0.00 N ATOM 1474 CA ARG A 93 -20.428 -5.240 29.022 1.00 0.00 C ATOM 1475 C ARG A 93 -19.483 -6.153 29.798 1.00 0.00 C ATOM 1476 O ARG A 93 -18.388 -6.467 29.332 1.00 0.00 O ATOM 1477 CB ARG A 93 -21.591 -6.055 28.455 1.00 0.00 C ATOM 1478 CG ARG A 93 -21.153 -7.181 27.532 1.00 0.00 C ATOM 1479 CD ARG A 93 -21.113 -6.728 26.081 1.00 0.00 C ATOM 1480 NE ARG A 93 -21.267 -7.846 25.155 1.00 0.00 N ATOM 1481 CZ ARG A 93 -20.327 -8.760 24.942 1.00 0.00 C ATOM 1482 NH1 ARG A 93 -19.171 -8.688 25.587 1.00 0.00 N ATOM 1483 NH2 ARG A 93 -20.542 -9.748 24.083 1.00 0.00 N ATOM 0 H ARG A 93 -20.112 -4.706 27.020 1.00 0.00 H new ATOM 0 HA ARG A 93 -20.821 -4.487 29.705 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -22.165 -6.476 29.280 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -22.259 -5.388 27.909 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -20.166 -7.535 27.831 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -21.838 -8.023 27.633 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -21.906 -6.001 25.906 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -20.168 -6.222 25.885 1.00 0.00 H new ATOM 0 HE ARG A 93 -22.145 -7.930 24.643 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -19.002 -7.930 26.248 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -18.450 -9.391 25.422 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -21.430 -9.807 23.585 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -19.819 -10.449 23.921 1.00 0.00 H new ATOM 1497 N GLN A 94 -19.916 -6.576 30.981 1.00 0.00 N ATOM 1498 CA GLN A 94 -19.108 -7.452 31.821 1.00 0.00 C ATOM 1499 C GLN A 94 -19.906 -8.677 32.256 1.00 0.00 C ATOM 1500 O GLN A 94 -20.570 -8.661 33.292 1.00 0.00 O ATOM 1501 CB GLN A 94 -18.604 -6.694 33.050 1.00 0.00 C ATOM 1502 CG GLN A 94 -17.864 -7.572 34.046 1.00 0.00 C ATOM 1503 CD GLN A 94 -17.310 -6.786 35.218 1.00 0.00 C ATOM 1504 OE1 GLN A 94 -16.186 -6.286 35.170 1.00 0.00 O ATOM 1505 NE2 GLN A 94 -18.099 -6.673 36.281 1.00 0.00 N ATOM 0 H GLN A 94 -20.821 -6.327 31.379 1.00 0.00 H new ATOM 0 HA GLN A 94 -18.253 -7.788 31.235 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -17.943 -5.891 32.725 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -19.452 -6.226 33.551 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -18.540 -8.343 34.417 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -17.047 -8.083 33.537 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -19.024 -7.104 36.278 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -17.780 -6.156 37.100 1.00 0.00 H new ATOM 1514 N ASP A 95 -19.836 -9.736 31.458 1.00 0.00 N ATOM 1515 CA ASP A 95 -20.552 -10.970 31.760 1.00 0.00 C ATOM 1516 C ASP A 95 -19.584 -12.069 32.189 1.00 0.00 C ATOM 1517 O ASP A 95 -18.646 -12.401 31.464 1.00 0.00 O ATOM 1518 CB ASP A 95 -21.358 -11.429 30.544 1.00 0.00 C ATOM 1519 CG ASP A 95 -22.206 -12.650 30.839 1.00 0.00 C ATOM 1520 OD1 ASP A 95 -23.299 -12.486 31.420 1.00 0.00 O ATOM 1521 OD2 ASP A 95 -21.777 -13.770 30.490 1.00 0.00 O ATOM 0 H ASP A 95 -19.291 -9.765 30.597 1.00 0.00 H new ATOM 0 HA ASP A 95 -21.236 -10.771 32.585 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -22.002 -10.615 30.210 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -20.676 -11.653 29.724 1.00 0.00 H new ATOM 1526 N HIS A 96 -19.817 -12.628 33.372 1.00 0.00 N ATOM 1527 CA HIS A 96 -18.965 -13.688 33.898 1.00 0.00 C ATOM 1528 C HIS A 96 -19.804 -14.802 34.517 1.00 0.00 C ATOM 1529 O HIS A 96 -20.436 -14.612 35.557 1.00 0.00 O ATOM 1530 CB HIS A 96 -17.996 -13.125 34.938 1.00 0.00 C ATOM 1531 CG HIS A 96 -16.729 -12.587 34.347 1.00 0.00 C ATOM 1532 ND1 HIS A 96 -15.806 -13.379 33.696 1.00 0.00 N ATOM 1533 CD2 HIS A 96 -16.235 -11.327 34.309 1.00 0.00 C ATOM 1534 CE1 HIS A 96 -14.799 -12.630 33.286 1.00 0.00 C ATOM 1535 NE2 HIS A 96 -15.035 -11.381 33.645 1.00 0.00 N ATOM 0 H HIS A 96 -20.589 -12.364 33.985 1.00 0.00 H new ATOM 0 HA HIS A 96 -18.393 -14.105 33.069 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -18.494 -12.331 35.494 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -17.749 -13.909 35.654 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -16.699 -10.444 34.724 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -13.930 -12.979 32.748 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -14.424 -10.585 33.459 1.00 0.00 H new ATOM 1543 N HIS A 97 -19.806 -15.964 33.871 1.00 0.00 N ATOM 1544 CA HIS A 97 -20.567 -17.108 34.359 1.00 0.00 C ATOM 1545 C HIS A 97 -19.675 -18.339 34.490 1.00 0.00 C ATOM 1546 O HIS A 97 -18.629 -18.448 33.850 1.00 0.00 O ATOM 1547 CB HIS A 97 -21.735 -17.408 33.419 1.00 0.00 C ATOM 1548 CG HIS A 97 -21.369 -17.343 31.968 1.00 0.00 C ATOM 1549 ND1 HIS A 97 -22.093 -16.624 31.041 1.00 0.00 N ATOM 1550 CD2 HIS A 97 -20.346 -17.911 31.287 1.00 0.00 C ATOM 1551 CE1 HIS A 97 -21.532 -16.753 29.852 1.00 0.00 C ATOM 1552 NE2 HIS A 97 -20.470 -17.529 29.974 1.00 0.00 N ATOM 0 H HIS A 97 -19.289 -16.138 33.009 1.00 0.00 H new ATOM 0 HA HIS A 97 -20.958 -16.859 35.345 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -22.125 -18.401 33.643 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -22.539 -16.699 33.614 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -19.576 -18.546 31.700 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -21.882 -16.301 28.936 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -19.844 -17.800 29.216 1.00 0.00 H new ATOM 1560 N PRO A 98 -20.096 -19.288 35.339 1.00 0.00 N ATOM 1561 CA PRO A 98 -19.349 -20.528 35.574 1.00 0.00 C ATOM 1562 C PRO A 98 -19.376 -21.458 34.366 1.00 0.00 C ATOM 1563 O PRO A 98 -19.864 -21.091 33.298 1.00 0.00 O ATOM 1564 CB PRO A 98 -20.083 -21.165 36.756 1.00 0.00 C ATOM 1565 CG PRO A 98 -21.467 -20.619 36.683 1.00 0.00 C ATOM 1566 CD PRO A 98 -21.333 -19.225 36.135 1.00 0.00 C ATOM 0 HA PRO A 98 -18.292 -20.338 35.763 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -20.082 -22.253 36.682 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -19.606 -20.909 37.702 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -22.095 -21.233 36.038 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -21.935 -20.608 37.667 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -22.191 -18.950 35.522 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -21.260 -18.485 36.932 1.00 0.00 H new ATOM 1574 N GLY A 99 -18.848 -22.666 34.543 1.00 0.00 N ATOM 1575 CA GLY A 99 -18.822 -23.630 33.459 1.00 0.00 C ATOM 1576 C GLY A 99 -20.186 -24.233 33.187 1.00 0.00 C ATOM 1577 O GLY A 99 -21.207 -23.553 33.299 1.00 0.00 O ATOM 0 H GLY A 99 -18.438 -22.994 35.418 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -18.456 -23.145 32.554 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -18.118 -24.426 33.701 1.00 0.00 H new ATOM 1581 N SER A 100 -20.205 -25.512 32.826 1.00 0.00 N ATOM 1582 CA SER A 100 -21.454 -26.205 32.531 1.00 0.00 C ATOM 1583 C SER A 100 -21.509 -27.553 33.244 1.00 0.00 C ATOM 1584 O SER A 100 -20.567 -27.941 33.934 1.00 0.00 O ATOM 1585 CB SER A 100 -21.605 -26.407 31.022 1.00 0.00 C ATOM 1586 OG SER A 100 -22.139 -25.249 30.403 1.00 0.00 O ATOM 0 H SER A 100 -19.370 -26.090 32.731 1.00 0.00 H new ATOM 0 HA SER A 100 -22.277 -25.589 32.892 1.00 0.00 H new ATOM 0 HB2 SER A 100 -20.635 -26.642 30.585 1.00 0.00 H new ATOM 0 HB3 SER A 100 -22.257 -27.259 30.829 1.00 0.00 H new ATOM 0 HG SER A 100 -22.224 -25.403 29.439 1.00 0.00 H new ATOM 1592 N GLY A 101 -22.620 -28.261 33.072 1.00 0.00 N ATOM 1593 CA GLY A 101 -22.779 -29.557 33.705 1.00 0.00 C ATOM 1594 C GLY A 101 -24.096 -30.219 33.351 1.00 0.00 C ATOM 1595 O GLY A 101 -24.138 -31.133 32.528 1.00 0.00 O ATOM 0 H GLY A 101 -23.413 -27.961 32.506 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -21.957 -30.207 33.405 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -22.714 -29.440 34.787 1.00 0.00 H new ATOM 1599 N ALA A 102 -25.175 -29.756 33.973 1.00 0.00 N ATOM 1600 CA ALA A 102 -26.500 -30.309 33.719 1.00 0.00 C ATOM 1601 C ALA A 102 -26.540 -31.802 34.025 1.00 0.00 C ATOM 1602 O ALA A 102 -27.104 -32.586 33.263 1.00 0.00 O ATOM 1603 CB ALA A 102 -26.910 -30.053 32.276 1.00 0.00 C ATOM 0 H ALA A 102 -25.158 -28.999 34.657 1.00 0.00 H new ATOM 0 HA ALA A 102 -27.208 -29.810 34.381 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -27.901 -30.471 32.100 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -26.930 -28.979 32.089 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -26.193 -30.525 31.605 1.00 0.00 H new ATOM 1609 N GLN A 103 -25.939 -32.188 35.146 1.00 0.00 N ATOM 1610 CA GLN A 103 -25.905 -33.588 35.552 1.00 0.00 C ATOM 1611 C GLN A 103 -27.267 -34.036 36.072 1.00 0.00 C ATOM 1612 O GLN A 103 -27.422 -35.163 36.545 1.00 0.00 O ATOM 1613 CB GLN A 103 -24.839 -33.804 36.627 1.00 0.00 C ATOM 1614 CG GLN A 103 -25.105 -33.033 37.911 1.00 0.00 C ATOM 1615 CD GLN A 103 -24.064 -33.303 38.979 1.00 0.00 C ATOM 1616 OE1 GLN A 103 -23.046 -32.615 39.058 1.00 0.00 O ATOM 1617 NE2 GLN A 103 -24.314 -34.309 39.809 1.00 0.00 N ATOM 0 H GLN A 103 -25.469 -31.551 35.789 1.00 0.00 H new ATOM 0 HA GLN A 103 -25.654 -34.188 34.677 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -24.778 -34.868 36.858 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -23.868 -33.508 36.229 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -25.127 -31.966 37.692 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -26.090 -33.300 38.293 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -25.171 -34.853 39.707 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -23.649 -34.537 40.548 1.00 0.00 H new TER 1626 GLN A 103