USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 949 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 17 SER OG : rot 36:sc= 0.26 USER MOD Set 1.2: A 50 ASN : amide:sc= -1.34 K(o=-1.1,f=-4.4!) USER MOD Set 2.1: A 18 ASN : amide:sc= 0.19 X(o=0.39,f=0.69) USER MOD Set 2.2: A 124 THR OG1 : rot 180:sc= 0.195 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl -157:sc= -0.317 (180deg=-1.24) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 154:sc= -0.0851 (180deg=-0.532) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ -179:sc= 0 (180deg=-6.92e-05) USER MOD Single : A 39 LYS NZ :NH3+ 144:sc= -0.0098 (180deg=-1.05) USER MOD Single : A 40 LYS NZ :NH3+ 147:sc= 0.0013 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ -167:sc= -0.0117 (180deg=-0.159) USER MOD Single : A 42 THR OG1 : rot 136:sc= 2 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ -125:sc= 1.25 (180deg=-0.0975) USER MOD Single : A 47 ASN : amide:sc= 0.684 K(o=0.68,f=-5.3!) USER MOD Single : A 54 ASN : amide:sc= -6.63! C(o=-6.6!,f=-3.2!) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= -0.236 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot -53:sc= 0.0894 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 153:sc= 1.13 (180deg=0.617) USER MOD Single : A 99 THR OG1 : rot -108:sc= 1.1 USER MOD Single : A 102 GLN : amide:sc= -0.165 K(o=-0.16,f=-2!) USER MOD Single : A 103 SER OG : rot 49:sc= 0.351 USER MOD Single : A 105 SER OG : rot 41:sc= 0.395 USER MOD Single : A 108 TYR OH : rot 165:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= -0.597 K(o=-0.6,f=-9.9!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 GLN : amide:sc= -0.706 K(o=-0.71,f=-3.4!) USER MOD Single : A 121 THR OG1 : rot -55:sc= 1.19 USER MOD Single : A 131 TYR OH : rot 173:sc= 0.00364 USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 6 -7.758 -22.441 2.909 1.00 0.00 N ATOM 49 CA SER A 6 -7.734 -22.594 1.459 1.00 0.00 C ATOM 50 C SER A 6 -6.905 -21.489 0.810 1.00 0.00 C ATOM 51 O SER A 6 -7.326 -20.875 -0.169 1.00 0.00 O ATOM 52 CB SER A 6 -9.158 -22.574 0.899 1.00 0.00 C ATOM 53 OG SER A 6 -9.788 -23.832 1.063 1.00 0.00 O ATOM 0 HA SER A 6 -7.273 -23.554 1.227 1.00 0.00 H new ATOM 0 HB2 SER A 6 -9.740 -21.804 1.405 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.133 -22.312 -0.159 1.00 0.00 H new ATOM 0 HG SER A 6 -10.697 -23.793 0.699 1.00 0.00 H new ATOM 59 N GLY A 7 -5.723 -21.242 1.365 1.00 0.00 N ATOM 60 CA GLY A 7 -4.852 -20.212 0.829 1.00 0.00 C ATOM 61 C GLY A 7 -5.488 -18.837 0.868 1.00 0.00 C ATOM 62 O GLY A 7 -6.538 -18.614 0.266 1.00 0.00 O ATOM 0 H GLY A 7 -5.353 -21.737 2.176 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -3.922 -20.195 1.397 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -4.592 -20.460 -0.200 1.00 0.00 H new ATOM 66 N MET A 8 -4.852 -17.913 1.580 1.00 0.00 N ATOM 67 CA MET A 8 -5.364 -16.552 1.696 1.00 0.00 C ATOM 68 C MET A 8 -4.221 -15.552 1.842 1.00 0.00 C ATOM 69 O MET A 8 -3.314 -15.744 2.653 1.00 0.00 O ATOM 70 CB MET A 8 -6.310 -16.440 2.893 1.00 0.00 C ATOM 71 CG MET A 8 -6.651 -15.007 3.266 1.00 0.00 C ATOM 72 SD MET A 8 -8.206 -14.875 4.169 1.00 0.00 S ATOM 73 CE MET A 8 -9.343 -14.510 2.834 1.00 0.00 C ATOM 0 H MET A 8 -3.982 -18.081 2.085 1.00 0.00 H new ATOM 0 HA MET A 8 -5.914 -16.319 0.784 1.00 0.00 H new ATOM 0 HB2 MET A 8 -7.231 -16.977 2.669 1.00 0.00 H new ATOM 0 HB3 MET A 8 -5.855 -16.932 3.753 1.00 0.00 H new ATOM 0 HG2 MET A 8 -5.846 -14.593 3.873 1.00 0.00 H new ATOM 0 HG3 MET A 8 -6.709 -14.404 2.360 1.00 0.00 H new ATOM 0 HE1 MET A 8 -10.225 -14.010 3.234 1.00 0.00 H new ATOM 0 HE2 MET A 8 -8.855 -13.860 2.108 1.00 0.00 H new ATOM 0 HE3 MET A 8 -9.642 -15.438 2.347 1.00 0.00 H new ATOM 83 N LEU A 9 -4.270 -14.485 1.052 1.00 0.00 N ATOM 84 CA LEU A 9 -3.238 -13.455 1.093 1.00 0.00 C ATOM 85 C LEU A 9 -3.785 -12.159 1.683 1.00 0.00 C ATOM 86 O LEU A 9 -4.670 -11.527 1.105 1.00 0.00 O ATOM 87 CB LEU A 9 -2.690 -13.198 -0.312 1.00 0.00 C ATOM 88 CG LEU A 9 -1.524 -12.214 -0.408 1.00 0.00 C ATOM 89 CD1 LEU A 9 -0.205 -12.922 -0.137 1.00 0.00 C ATOM 90 CD2 LEU A 9 -1.501 -11.545 -1.774 1.00 0.00 C ATOM 0 H LEU A 9 -5.013 -14.311 0.375 1.00 0.00 H new ATOM 0 HA LEU A 9 -2.430 -13.811 1.732 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -2.371 -14.150 -0.736 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -3.504 -12.828 -0.936 1.00 0.00 H new ATOM 0 HG LEU A 9 -1.662 -11.442 0.349 1.00 0.00 H new ATOM 0 HD11 LEU A 9 0.614 -12.206 -0.210 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.222 -13.353 0.864 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -0.060 -13.715 -0.871 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -0.664 -10.848 -1.824 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -1.388 -12.303 -2.549 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -2.434 -11.003 -1.930 1.00 0.00 H new ATOM 102 N ARG A 10 -3.252 -11.769 2.836 1.00 0.00 N ATOM 103 CA ARG A 10 -3.686 -10.548 3.504 1.00 0.00 C ATOM 104 C ARG A 10 -2.741 -9.392 3.192 1.00 0.00 C ATOM 105 O ARG A 10 -1.524 -9.516 3.332 1.00 0.00 O ATOM 106 CB ARG A 10 -3.760 -10.767 5.016 1.00 0.00 C ATOM 107 CG ARG A 10 -5.109 -11.280 5.493 1.00 0.00 C ATOM 108 CD ARG A 10 -5.207 -11.263 7.010 1.00 0.00 C ATOM 109 NE ARG A 10 -6.351 -12.033 7.493 1.00 0.00 N ATOM 110 CZ ARG A 10 -6.580 -12.281 8.778 1.00 0.00 C ATOM 111 NH1 ARG A 10 -5.749 -11.823 9.703 1.00 0.00 N ATOM 112 NH2 ARG A 10 -7.643 -12.989 9.139 1.00 0.00 N ATOM 0 H ARG A 10 -2.519 -12.281 3.327 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.678 -10.293 3.132 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -2.987 -11.477 5.310 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -3.539 -9.827 5.522 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -5.904 -10.666 5.069 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.263 -12.296 5.129 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -4.290 -11.669 7.437 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -5.291 -10.233 7.356 1.00 0.00 H new ATOM 0 HE ARG A 10 -7.010 -12.400 6.806 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -4.931 -11.279 9.429 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -5.927 -12.015 10.689 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -8.285 -13.343 8.430 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -7.818 -13.179 10.126 1.00 0.00 H new ATOM 126 N VAL A 11 -3.309 -8.267 2.769 1.00 0.00 N ATOM 127 CA VAL A 11 -2.517 -7.088 2.438 1.00 0.00 C ATOM 128 C VAL A 11 -2.942 -5.888 3.276 1.00 0.00 C ATOM 129 O VAL A 11 -3.894 -5.185 2.934 1.00 0.00 O ATOM 130 CB VAL A 11 -2.643 -6.729 0.945 1.00 0.00 C ATOM 131 CG1 VAL A 11 -1.748 -5.548 0.602 1.00 0.00 C ATOM 132 CG2 VAL A 11 -2.308 -7.933 0.078 1.00 0.00 C ATOM 0 H VAL A 11 -4.315 -8.147 2.647 1.00 0.00 H new ATOM 0 HA VAL A 11 -1.478 -7.332 2.659 1.00 0.00 H new ATOM 0 HB VAL A 11 -3.675 -6.441 0.744 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -1.851 -5.309 -0.457 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -2.041 -4.684 1.199 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -0.710 -5.803 0.818 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -2.402 -7.662 -0.973 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -1.286 -8.254 0.280 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -2.996 -8.748 0.305 1.00 0.00 H new ATOM 142 N ILE A 12 -2.231 -5.658 4.374 1.00 0.00 N ATOM 143 CA ILE A 12 -2.533 -4.541 5.260 1.00 0.00 C ATOM 144 C ILE A 12 -1.938 -3.242 4.729 1.00 0.00 C ATOM 145 O ILE A 12 -0.787 -3.206 4.293 1.00 0.00 O ATOM 146 CB ILE A 12 -2.002 -4.792 6.684 1.00 0.00 C ATOM 147 CG1 ILE A 12 -2.585 -6.089 7.248 1.00 0.00 C ATOM 148 CG2 ILE A 12 -2.336 -3.616 7.589 1.00 0.00 C ATOM 149 CD1 ILE A 12 -1.814 -6.635 8.429 1.00 0.00 C ATOM 0 H ILE A 12 -1.441 -6.231 4.672 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.619 -4.452 5.297 1.00 0.00 H new ATOM 0 HB ILE A 12 -0.918 -4.893 6.639 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -3.618 -5.913 7.549 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -2.607 -6.841 6.459 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -1.954 -3.809 8.592 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -1.876 -2.710 7.193 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -3.417 -3.485 7.631 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.284 -7.555 8.777 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -0.787 -6.843 8.128 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.814 -5.901 9.235 1.00 0.00 H new ATOM 161 N VAL A 13 -2.729 -2.174 4.771 1.00 0.00 N ATOM 162 CA VAL A 13 -2.280 -0.871 4.297 1.00 0.00 C ATOM 163 C VAL A 13 -2.225 0.140 5.438 1.00 0.00 C ATOM 164 O VAL A 13 -3.254 0.657 5.871 1.00 0.00 O ATOM 165 CB VAL A 13 -3.203 -0.328 3.189 1.00 0.00 C ATOM 166 CG1 VAL A 13 -2.653 0.974 2.627 1.00 0.00 C ATOM 167 CG2 VAL A 13 -3.378 -1.363 2.088 1.00 0.00 C ATOM 0 H VAL A 13 -3.684 -2.186 5.129 1.00 0.00 H new ATOM 0 HA VAL A 13 -1.279 -1.010 3.890 1.00 0.00 H new ATOM 0 HB VAL A 13 -4.182 -0.123 3.622 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.318 1.343 1.846 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -2.584 1.714 3.424 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -1.662 0.799 2.208 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -4.033 -0.963 1.314 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -2.407 -1.601 1.655 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -3.820 -2.267 2.506 1.00 0.00 H new ATOM 177 N GLU A 14 -1.017 0.415 5.919 1.00 0.00 N ATOM 178 CA GLU A 14 -0.828 1.364 7.010 1.00 0.00 C ATOM 179 C GLU A 14 -1.120 2.789 6.548 1.00 0.00 C ATOM 180 O GLU A 14 -2.157 3.361 6.882 1.00 0.00 O ATOM 181 CB GLU A 14 0.600 1.274 7.552 1.00 0.00 C ATOM 182 CG GLU A 14 0.853 0.037 8.398 1.00 0.00 C ATOM 183 CD GLU A 14 -0.040 -0.026 9.622 1.00 0.00 C ATOM 184 OE1 GLU A 14 0.328 0.571 10.655 1.00 0.00 O ATOM 185 OE2 GLU A 14 -1.107 -0.670 9.546 1.00 0.00 O ATOM 0 H GLU A 14 -0.155 -0.005 5.571 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.528 1.108 7.806 1.00 0.00 H new ATOM 0 HB2 GLU A 14 1.298 1.281 6.715 1.00 0.00 H new ATOM 0 HB3 GLU A 14 0.810 2.161 8.149 1.00 0.00 H new ATOM 0 HG2 GLU A 14 0.693 -0.853 7.790 1.00 0.00 H new ATOM 0 HG3 GLU A 14 1.896 0.024 8.713 1.00 0.00 H new ATOM 192 N SER A 15 -0.196 3.356 5.779 1.00 0.00 N ATOM 193 CA SER A 15 -0.350 4.716 5.275 1.00 0.00 C ATOM 194 C SER A 15 0.787 5.075 4.324 1.00 0.00 C ATOM 195 O SER A 15 1.752 4.324 4.181 1.00 0.00 O ATOM 196 CB SER A 15 -0.394 5.711 6.436 1.00 0.00 C ATOM 197 OG SER A 15 0.805 5.667 7.191 1.00 0.00 O ATOM 0 H SER A 15 0.667 2.895 5.491 1.00 0.00 H new ATOM 0 HA SER A 15 -1.290 4.769 4.725 1.00 0.00 H new ATOM 0 HB2 SER A 15 -0.548 6.719 6.050 1.00 0.00 H new ATOM 0 HB3 SER A 15 -1.243 5.484 7.082 1.00 0.00 H new ATOM 0 HG SER A 15 0.753 6.313 7.926 1.00 0.00 H new ATOM 203 N ALA A 16 0.667 6.230 3.677 1.00 0.00 N ATOM 204 CA ALA A 16 1.685 6.691 2.742 1.00 0.00 C ATOM 205 C ALA A 16 2.228 8.056 3.150 1.00 0.00 C ATOM 206 O ALA A 16 1.623 8.758 3.961 1.00 0.00 O ATOM 207 CB ALA A 16 1.119 6.747 1.330 1.00 0.00 C ATOM 0 H ALA A 16 -0.125 6.863 3.784 1.00 0.00 H new ATOM 0 HA ALA A 16 2.510 5.980 2.763 1.00 0.00 H new ATOM 0 HB1 ALA A 16 1.891 7.093 0.642 1.00 0.00 H new ATOM 0 HB2 ALA A 16 0.786 5.753 1.032 1.00 0.00 H new ATOM 0 HB3 ALA A 16 0.274 7.435 1.304 1.00 0.00 H new ATOM 213 N SER A 17 3.372 8.427 2.585 1.00 0.00 N ATOM 214 CA SER A 17 3.999 9.706 2.894 1.00 0.00 C ATOM 215 C SER A 17 4.962 10.122 1.786 1.00 0.00 C ATOM 216 O SER A 17 5.366 9.304 0.960 1.00 0.00 O ATOM 217 CB SER A 17 4.744 9.624 4.228 1.00 0.00 C ATOM 218 OG SER A 17 3.846 9.721 5.320 1.00 0.00 O ATOM 0 H SER A 17 3.884 7.859 1.910 1.00 0.00 H new ATOM 0 HA SER A 17 3.214 10.458 2.970 1.00 0.00 H new ATOM 0 HB2 SER A 17 5.291 8.683 4.285 1.00 0.00 H new ATOM 0 HB3 SER A 17 5.481 10.425 4.287 1.00 0.00 H new ATOM 0 HG SER A 17 3.005 9.271 5.093 1.00 0.00 H new ATOM 224 N ASN A 18 5.325 11.400 1.774 1.00 0.00 N ATOM 225 CA ASN A 18 6.239 11.926 0.767 1.00 0.00 C ATOM 226 C ASN A 18 5.596 11.906 -0.616 1.00 0.00 C ATOM 227 O ASN A 18 6.255 11.615 -1.614 1.00 0.00 O ATOM 228 CB ASN A 18 7.535 11.113 0.751 1.00 0.00 C ATOM 229 CG ASN A 18 8.161 10.995 2.127 1.00 0.00 C ATOM 230 OD1 ASN A 18 8.574 11.991 2.721 1.00 0.00 O ATOM 231 ND2 ASN A 18 8.235 9.773 2.641 1.00 0.00 N ATOM 0 H ASN A 18 5.000 12.091 2.450 1.00 0.00 H new ATOM 0 HA ASN A 18 6.469 12.960 1.026 1.00 0.00 H new ATOM 0 HB2 ASN A 18 7.330 10.116 0.361 1.00 0.00 H new ATOM 0 HB3 ASN A 18 8.246 11.581 0.070 1.00 0.00 H new ATOM 0 HD21 ASN A 18 8.647 9.632 3.563 1.00 0.00 H new ATOM 0 HD22 ASN A 18 7.880 8.975 2.113 1.00 0.00 H new ATOM 238 N ILE A 19 4.305 12.218 -0.666 1.00 0.00 N ATOM 239 CA ILE A 19 3.573 12.238 -1.927 1.00 0.00 C ATOM 240 C ILE A 19 3.766 13.564 -2.654 1.00 0.00 C ATOM 241 O ILE A 19 3.749 14.638 -2.052 1.00 0.00 O ATOM 242 CB ILE A 19 2.068 11.999 -1.707 1.00 0.00 C ATOM 243 CG1 ILE A 19 1.837 10.644 -1.035 1.00 0.00 C ATOM 244 CG2 ILE A 19 1.321 12.074 -3.031 1.00 0.00 C ATOM 245 CD1 ILE A 19 0.385 10.219 -1.016 1.00 0.00 C ATOM 0 H ILE A 19 3.745 12.460 0.151 1.00 0.00 H new ATOM 0 HA ILE A 19 3.975 11.430 -2.539 1.00 0.00 H new ATOM 0 HB ILE A 19 1.683 12.779 -1.050 1.00 0.00 H new ATOM 0 HG12 ILE A 19 2.423 9.885 -1.554 1.00 0.00 H new ATOM 0 HG13 ILE A 19 2.208 10.687 -0.011 1.00 0.00 H new ATOM 0 HG21 ILE A 19 0.258 11.903 -2.859 1.00 0.00 H new ATOM 0 HG22 ILE A 19 1.463 13.060 -3.474 1.00 0.00 H new ATOM 0 HG23 ILE A 19 1.706 11.313 -3.710 1.00 0.00 H new ATOM 0 HD11 ILE A 19 0.296 9.250 -0.525 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -0.203 10.957 -0.471 1.00 0.00 H new ATOM 0 HD13 ILE A 19 0.015 10.143 -2.038 1.00 0.00 H new ATOM 257 N PRO A 20 3.951 13.491 -3.980 1.00 0.00 N ATOM 258 CA PRO A 20 4.147 14.677 -4.819 1.00 0.00 C ATOM 259 C PRO A 20 2.880 15.515 -4.944 1.00 0.00 C ATOM 260 O PRO A 20 1.968 15.174 -5.698 1.00 0.00 O ATOM 261 CB PRO A 20 4.536 14.089 -6.178 1.00 0.00 C ATOM 262 CG PRO A 20 3.936 12.726 -6.187 1.00 0.00 C ATOM 263 CD PRO A 20 3.982 12.244 -4.763 1.00 0.00 C ATOM 0 HA PRO A 20 4.894 15.353 -4.402 1.00 0.00 H new ATOM 0 HB2 PRO A 20 4.151 14.696 -6.997 1.00 0.00 H new ATOM 0 HB3 PRO A 20 5.619 14.046 -6.295 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.911 12.753 -6.557 1.00 0.00 H new ATOM 0 HG3 PRO A 20 4.494 12.058 -6.843 1.00 0.00 H new ATOM 0 HD2 PRO A 20 3.134 11.601 -4.529 1.00 0.00 H new ATOM 0 HD3 PRO A 20 4.884 11.666 -4.563 1.00 0.00 H new ATOM 271 N LYS A 21 2.828 16.615 -4.199 1.00 0.00 N ATOM 272 CA LYS A 21 1.673 17.504 -4.227 1.00 0.00 C ATOM 273 C LYS A 21 1.357 17.942 -5.654 1.00 0.00 C ATOM 274 O LYS A 21 2.038 17.547 -6.601 1.00 0.00 O ATOM 275 CB LYS A 21 1.927 18.732 -3.350 1.00 0.00 C ATOM 276 CG LYS A 21 3.190 19.491 -3.718 1.00 0.00 C ATOM 277 CD LYS A 21 3.733 20.276 -2.536 1.00 0.00 C ATOM 278 CE LYS A 21 4.705 19.444 -1.714 1.00 0.00 C ATOM 279 NZ LYS A 21 5.942 19.120 -2.477 1.00 0.00 N ATOM 0 H LYS A 21 3.573 16.912 -3.568 1.00 0.00 H new ATOM 0 HA LYS A 21 0.816 16.956 -3.836 1.00 0.00 H new ATOM 0 HB2 LYS A 21 1.073 19.405 -3.426 1.00 0.00 H new ATOM 0 HB3 LYS A 21 1.993 18.417 -2.309 1.00 0.00 H new ATOM 0 HG2 LYS A 21 3.947 18.790 -4.069 1.00 0.00 H new ATOM 0 HG3 LYS A 21 2.979 20.172 -4.542 1.00 0.00 H new ATOM 0 HD2 LYS A 21 4.235 21.175 -2.894 1.00 0.00 H new ATOM 0 HD3 LYS A 21 2.907 20.602 -1.904 1.00 0.00 H new ATOM 0 HE2 LYS A 21 4.970 19.987 -0.807 1.00 0.00 H new ATOM 0 HE3 LYS A 21 4.218 18.520 -1.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 6.727 18.962 -1.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 5.787 18.260 -3.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 6.177 19.911 -3.109 1.00 0.00 H new ATOM 293 N THR A 22 0.322 18.763 -5.801 1.00 0.00 N ATOM 294 CA THR A 22 -0.083 19.255 -7.112 1.00 0.00 C ATOM 295 C THR A 22 -0.249 20.770 -7.103 1.00 0.00 C ATOM 296 O THR A 22 -0.405 21.382 -6.046 1.00 0.00 O ATOM 297 CB THR A 22 -1.403 18.608 -7.572 1.00 0.00 C ATOM 298 OG1 THR A 22 -2.462 18.965 -6.676 1.00 0.00 O ATOM 299 CG2 THR A 22 -1.272 17.093 -7.631 1.00 0.00 C ATOM 0 H THR A 22 -0.251 19.101 -5.028 1.00 0.00 H new ATOM 0 HA THR A 22 0.709 18.983 -7.810 1.00 0.00 H new ATOM 0 HB THR A 22 -1.633 18.976 -8.572 1.00 0.00 H new ATOM 0 HG1 THR A 22 -3.298 18.551 -6.976 1.00 0.00 H new ATOM 0 HG21 THR A 22 -2.217 16.659 -7.958 1.00 0.00 H new ATOM 0 HG22 THR A 22 -0.485 16.823 -8.335 1.00 0.00 H new ATOM 0 HG23 THR A 22 -1.020 16.711 -6.642 1.00 0.00 H new ATOM 356 N LYS A 26 -3.183 19.620 -2.645 1.00 0.00 N ATOM 357 CA LYS A 26 -2.999 18.225 -2.264 1.00 0.00 C ATOM 358 C LYS A 26 -4.033 17.334 -2.946 1.00 0.00 C ATOM 359 O LYS A 26 -5.237 17.451 -2.717 1.00 0.00 O ATOM 360 CB LYS A 26 -3.101 18.072 -0.745 1.00 0.00 C ATOM 361 CG LYS A 26 -2.249 19.067 0.025 1.00 0.00 C ATOM 362 CD LYS A 26 -2.298 18.802 1.520 1.00 0.00 C ATOM 363 CE LYS A 26 -1.036 19.291 2.214 1.00 0.00 C ATOM 364 NZ LYS A 26 -1.084 19.056 3.684 1.00 0.00 N ATOM 0 HA LYS A 26 -2.006 17.914 -2.588 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -4.142 18.190 -0.445 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -2.802 17.061 -0.469 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.217 19.010 -0.322 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.598 20.080 -0.178 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -3.167 19.299 1.950 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -2.421 17.734 1.697 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -0.169 18.781 1.793 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -0.905 20.356 2.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -0.206 19.403 4.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -1.896 19.563 4.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -1.184 18.038 3.870 1.00 0.00 H new ATOM 378 N PRO A 27 -3.554 16.420 -3.803 1.00 0.00 N ATOM 379 CA PRO A 27 -4.420 15.490 -4.534 1.00 0.00 C ATOM 380 C PRO A 27 -5.051 14.445 -3.620 1.00 0.00 C ATOM 381 O PRO A 27 -4.766 14.401 -2.423 1.00 0.00 O ATOM 382 CB PRO A 27 -3.466 14.824 -5.529 1.00 0.00 C ATOM 383 CG PRO A 27 -2.122 14.933 -4.896 1.00 0.00 C ATOM 384 CD PRO A 27 -2.131 16.224 -4.125 1.00 0.00 C ATOM 0 HA PRO A 27 -5.260 16.000 -5.005 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -3.739 13.783 -5.703 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -3.490 15.325 -6.497 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -1.931 14.086 -4.237 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.335 14.934 -5.650 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -1.521 16.158 -3.224 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -1.736 17.049 -4.718 1.00 0.00 H new ATOM 392 N ASP A 28 -5.907 13.606 -4.191 1.00 0.00 N ATOM 393 CA ASP A 28 -6.577 12.560 -3.427 1.00 0.00 C ATOM 394 C ASP A 28 -5.973 11.192 -3.732 1.00 0.00 C ATOM 395 O ASP A 28 -6.396 10.492 -4.652 1.00 0.00 O ATOM 396 CB ASP A 28 -8.074 12.551 -3.738 1.00 0.00 C ATOM 397 CG ASP A 28 -8.631 13.946 -3.944 1.00 0.00 C ATOM 398 OD1 ASP A 28 -8.133 14.656 -4.842 1.00 0.00 O ATOM 399 OD2 ASP A 28 -9.565 14.327 -3.207 1.00 0.00 O ATOM 0 H ASP A 28 -6.154 13.629 -5.180 1.00 0.00 H new ATOM 0 HA ASP A 28 -6.435 12.771 -2.367 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -8.252 11.956 -4.634 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -8.609 12.066 -2.921 1.00 0.00 H new ATOM 404 N PRO A 29 -4.960 10.803 -2.944 1.00 0.00 N ATOM 405 CA PRO A 29 -4.276 9.517 -3.112 1.00 0.00 C ATOM 406 C PRO A 29 -5.160 8.336 -2.726 1.00 0.00 C ATOM 407 O PRO A 29 -6.025 8.454 -1.858 1.00 0.00 O ATOM 408 CB PRO A 29 -3.082 9.624 -2.161 1.00 0.00 C ATOM 409 CG PRO A 29 -3.509 10.606 -1.125 1.00 0.00 C ATOM 410 CD PRO A 29 -4.405 11.587 -1.829 1.00 0.00 C ATOM 0 HA PRO A 29 -3.997 9.336 -4.150 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -2.843 8.658 -1.716 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -2.188 9.964 -2.684 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -4.037 10.110 -0.311 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -2.648 11.110 -0.686 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -5.189 11.959 -1.170 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -3.850 12.455 -2.185 1.00 0.00 H new ATOM 418 N ILE A 30 -4.936 7.199 -3.375 1.00 0.00 N ATOM 419 CA ILE A 30 -5.711 5.996 -3.098 1.00 0.00 C ATOM 420 C ILE A 30 -4.941 4.741 -3.496 1.00 0.00 C ATOM 421 O ILE A 30 -4.437 4.637 -4.614 1.00 0.00 O ATOM 422 CB ILE A 30 -7.061 6.013 -3.841 1.00 0.00 C ATOM 423 CG1 ILE A 30 -7.825 4.712 -3.585 1.00 0.00 C ATOM 424 CG2 ILE A 30 -6.843 6.220 -5.332 1.00 0.00 C ATOM 425 CD1 ILE A 30 -9.317 4.836 -3.797 1.00 0.00 C ATOM 0 H ILE A 30 -4.224 7.085 -4.097 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.896 5.980 -2.024 1.00 0.00 H new ATOM 0 HB ILE A 30 -7.657 6.843 -3.462 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.436 3.936 -4.244 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -7.637 4.385 -2.562 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -7.806 6.230 -5.843 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.335 7.170 -5.497 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -6.231 5.409 -5.726 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -9.794 3.876 -3.598 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -9.719 5.589 -3.119 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -9.515 5.132 -4.827 1.00 0.00 H new ATOM 437 N VAL A 31 -4.855 3.789 -2.573 1.00 0.00 N ATOM 438 CA VAL A 31 -4.149 2.539 -2.827 1.00 0.00 C ATOM 439 C VAL A 31 -5.011 1.575 -3.633 1.00 0.00 C ATOM 440 O VAL A 31 -6.211 1.446 -3.389 1.00 0.00 O ATOM 441 CB VAL A 31 -3.725 1.856 -1.513 1.00 0.00 C ATOM 442 CG1 VAL A 31 -2.804 0.679 -1.795 1.00 0.00 C ATOM 443 CG2 VAL A 31 -3.055 2.858 -0.584 1.00 0.00 C ATOM 0 H VAL A 31 -5.266 3.859 -1.642 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.257 2.791 -3.401 1.00 0.00 H new ATOM 0 HB VAL A 31 -4.618 1.476 -1.017 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.515 0.209 -0.855 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.323 -0.048 -2.419 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -1.912 1.031 -2.314 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.762 2.358 0.339 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -2.171 3.270 -1.070 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.752 3.664 -0.355 1.00 0.00 H new ATOM 453 N SER A 32 -4.392 0.897 -4.595 1.00 0.00 N ATOM 454 CA SER A 32 -5.103 -0.054 -5.440 1.00 0.00 C ATOM 455 C SER A 32 -4.321 -1.357 -5.569 1.00 0.00 C ATOM 456 O SER A 32 -3.330 -1.431 -6.297 1.00 0.00 O ATOM 457 CB SER A 32 -5.348 0.546 -6.826 1.00 0.00 C ATOM 458 OG SER A 32 -6.137 1.721 -6.741 1.00 0.00 O ATOM 0 H SER A 32 -3.399 0.989 -4.808 1.00 0.00 H new ATOM 0 HA SER A 32 -6.063 -0.271 -4.971 1.00 0.00 H new ATOM 0 HB2 SER A 32 -4.394 0.778 -7.299 1.00 0.00 H new ATOM 0 HB3 SER A 32 -5.848 -0.187 -7.460 1.00 0.00 H new ATOM 0 HG SER A 32 -6.278 2.086 -7.639 1.00 0.00 H new ATOM 464 N VAL A 33 -4.773 -2.385 -4.857 1.00 0.00 N ATOM 465 CA VAL A 33 -4.117 -3.686 -4.891 1.00 0.00 C ATOM 466 C VAL A 33 -4.807 -4.623 -5.877 1.00 0.00 C ATOM 467 O VAL A 33 -6.032 -4.617 -6.001 1.00 0.00 O ATOM 468 CB VAL A 33 -4.102 -4.344 -3.499 1.00 0.00 C ATOM 469 CG1 VAL A 33 -3.196 -5.566 -3.495 1.00 0.00 C ATOM 470 CG2 VAL A 33 -3.664 -3.342 -2.441 1.00 0.00 C ATOM 0 H VAL A 33 -5.591 -2.341 -4.250 1.00 0.00 H new ATOM 0 HA VAL A 33 -3.090 -3.515 -5.214 1.00 0.00 H new ATOM 0 HB VAL A 33 -5.114 -4.671 -3.260 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -3.198 -6.017 -2.503 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -3.559 -6.290 -4.224 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -2.181 -5.267 -3.755 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -3.659 -3.824 -1.463 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -2.662 -2.982 -2.673 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -4.357 -2.501 -2.427 1.00 0.00 H new ATOM 480 N ILE A 34 -4.013 -5.428 -6.574 1.00 0.00 N ATOM 481 CA ILE A 34 -4.547 -6.372 -7.548 1.00 0.00 C ATOM 482 C ILE A 34 -3.863 -7.730 -7.430 1.00 0.00 C ATOM 483 O ILE A 34 -2.648 -7.842 -7.600 1.00 0.00 O ATOM 484 CB ILE A 34 -4.384 -5.850 -8.987 1.00 0.00 C ATOM 485 CG1 ILE A 34 -5.233 -4.595 -9.197 1.00 0.00 C ATOM 486 CG2 ILE A 34 -4.767 -6.929 -9.989 1.00 0.00 C ATOM 487 CD1 ILE A 34 -4.502 -3.310 -8.875 1.00 0.00 C ATOM 0 H ILE A 34 -2.997 -5.446 -6.483 1.00 0.00 H new ATOM 0 HA ILE A 34 -5.609 -6.483 -7.330 1.00 0.00 H new ATOM 0 HB ILE A 34 -3.338 -5.589 -9.146 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -5.569 -4.563 -10.233 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -6.125 -4.662 -8.575 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -4.646 -6.544 -11.002 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.123 -7.798 -9.852 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.806 -7.219 -9.832 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -5.165 -2.462 -9.047 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -4.190 -3.321 -7.831 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -3.624 -3.220 -9.515 1.00 0.00 H new ATOM 499 N PHE A 35 -4.650 -8.760 -7.140 1.00 0.00 N ATOM 500 CA PHE A 35 -4.120 -10.112 -7.001 1.00 0.00 C ATOM 501 C PHE A 35 -5.207 -11.151 -7.259 1.00 0.00 C ATOM 502 O PHE A 35 -6.322 -11.042 -6.747 1.00 0.00 O ATOM 503 CB PHE A 35 -3.531 -10.310 -5.603 1.00 0.00 C ATOM 504 CG PHE A 35 -2.719 -11.566 -5.467 1.00 0.00 C ATOM 505 CD1 PHE A 35 -1.361 -11.562 -5.739 1.00 0.00 C ATOM 506 CD2 PHE A 35 -3.314 -12.751 -5.066 1.00 0.00 C ATOM 507 CE1 PHE A 35 -0.612 -12.717 -5.616 1.00 0.00 C ATOM 508 CE2 PHE A 35 -2.570 -13.909 -4.940 1.00 0.00 C ATOM 509 CZ PHE A 35 -1.217 -13.892 -5.214 1.00 0.00 C ATOM 0 H PHE A 35 -5.657 -8.685 -6.997 1.00 0.00 H new ATOM 0 HA PHE A 35 -3.332 -10.245 -7.742 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -2.904 -9.453 -5.357 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -4.342 -10.331 -4.875 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -0.882 -10.646 -6.051 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -4.372 -12.770 -4.849 1.00 0.00 H new ATOM 0 HE1 PHE A 35 0.446 -12.701 -5.834 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -3.047 -14.826 -4.627 1.00 0.00 H new ATOM 0 HZ PHE A 35 -0.633 -14.795 -5.114 1.00 0.00 H new ATOM 519 N LYS A 36 -4.875 -12.161 -8.057 1.00 0.00 N ATOM 520 CA LYS A 36 -5.820 -13.221 -8.384 1.00 0.00 C ATOM 521 C LYS A 36 -7.085 -12.648 -9.014 1.00 0.00 C ATOM 522 O LYS A 36 -8.199 -13.012 -8.636 1.00 0.00 O ATOM 523 CB LYS A 36 -6.180 -14.017 -7.127 1.00 0.00 C ATOM 524 CG LYS A 36 -5.009 -14.782 -6.535 1.00 0.00 C ATOM 525 CD LYS A 36 -4.884 -16.169 -7.144 1.00 0.00 C ATOM 526 CE LYS A 36 -3.463 -16.699 -7.036 1.00 0.00 C ATOM 527 NZ LYS A 36 -2.570 -16.105 -8.070 1.00 0.00 N ATOM 0 H LYS A 36 -3.957 -12.267 -8.489 1.00 0.00 H new ATOM 0 HA LYS A 36 -5.345 -13.886 -9.105 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -6.574 -13.334 -6.375 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -6.978 -14.720 -7.368 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -4.087 -14.225 -6.703 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -5.137 -14.868 -5.456 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -5.567 -16.852 -6.640 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -5.182 -16.136 -8.192 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -3.067 -16.479 -6.044 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -3.471 -17.784 -7.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -1.614 -16.504 -7.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -2.942 -16.322 -9.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -2.529 -15.074 -7.942 1.00 0.00 H new ATOM 541 N ASP A 37 -6.906 -11.751 -9.978 1.00 0.00 N ATOM 542 CA ASP A 37 -8.033 -11.129 -10.663 1.00 0.00 C ATOM 543 C ASP A 37 -8.969 -10.454 -9.666 1.00 0.00 C ATOM 544 O ASP A 37 -10.185 -10.431 -9.859 1.00 0.00 O ATOM 545 CB ASP A 37 -8.801 -12.172 -11.477 1.00 0.00 C ATOM 546 CG ASP A 37 -9.670 -11.544 -12.549 1.00 0.00 C ATOM 547 OD1 ASP A 37 -9.123 -10.820 -13.407 1.00 0.00 O ATOM 548 OD2 ASP A 37 -10.897 -11.776 -12.530 1.00 0.00 O ATOM 0 H ASP A 37 -5.991 -11.439 -10.303 1.00 0.00 H new ATOM 0 HA ASP A 37 -7.641 -10.369 -11.339 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -8.094 -12.858 -11.943 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -9.425 -12.764 -10.807 1.00 0.00 H new ATOM 553 N GLU A 38 -8.395 -9.906 -8.600 1.00 0.00 N ATOM 554 CA GLU A 38 -9.179 -9.231 -7.572 1.00 0.00 C ATOM 555 C GLU A 38 -8.663 -7.815 -7.335 1.00 0.00 C ATOM 556 O GLU A 38 -7.622 -7.618 -6.708 1.00 0.00 O ATOM 557 CB GLU A 38 -9.138 -10.026 -6.265 1.00 0.00 C ATOM 558 CG GLU A 38 -10.357 -9.811 -5.383 1.00 0.00 C ATOM 559 CD GLU A 38 -11.610 -10.446 -5.954 1.00 0.00 C ATOM 560 OE1 GLU A 38 -11.769 -11.677 -5.812 1.00 0.00 O ATOM 561 OE2 GLU A 38 -12.431 -9.712 -6.542 1.00 0.00 O ATOM 0 H GLU A 38 -7.390 -9.916 -8.425 1.00 0.00 H new ATOM 0 HA GLU A 38 -10.210 -9.169 -7.920 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -9.051 -11.087 -6.498 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -8.243 -9.747 -5.708 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -10.163 -10.226 -4.394 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -10.523 -8.742 -5.253 1.00 0.00 H new ATOM 568 N LYS A 39 -9.399 -6.831 -7.842 1.00 0.00 N ATOM 569 CA LYS A 39 -9.018 -5.432 -7.686 1.00 0.00 C ATOM 570 C LYS A 39 -9.623 -4.842 -6.417 1.00 0.00 C ATOM 571 O LYS A 39 -10.829 -4.602 -6.345 1.00 0.00 O ATOM 572 CB LYS A 39 -9.468 -4.622 -8.904 1.00 0.00 C ATOM 573 CG LYS A 39 -8.806 -3.258 -9.005 1.00 0.00 C ATOM 574 CD LYS A 39 -9.024 -2.633 -10.373 1.00 0.00 C ATOM 575 CE LYS A 39 -7.986 -3.112 -11.376 1.00 0.00 C ATOM 576 NZ LYS A 39 -6.756 -2.273 -11.345 1.00 0.00 N ATOM 0 H LYS A 39 -10.263 -6.977 -8.364 1.00 0.00 H new ATOM 0 HA LYS A 39 -7.932 -5.383 -7.606 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -9.250 -5.190 -9.808 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -10.549 -4.490 -8.863 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -9.208 -2.600 -8.235 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -7.737 -3.356 -8.815 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -10.022 -2.882 -10.733 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -8.977 -1.547 -10.290 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -7.724 -4.148 -11.161 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -8.414 -3.093 -12.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -5.922 -2.873 -11.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -6.811 -1.548 -12.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -6.674 -1.811 -10.417 1.00 0.00 H new ATOM 590 N LYS A 40 -8.779 -4.608 -5.418 1.00 0.00 N ATOM 591 CA LYS A 40 -9.229 -4.042 -4.152 1.00 0.00 C ATOM 592 C LYS A 40 -8.452 -2.774 -3.815 1.00 0.00 C ATOM 593 O LYS A 40 -7.222 -2.784 -3.757 1.00 0.00 O ATOM 594 CB LYS A 40 -9.067 -5.066 -3.026 1.00 0.00 C ATOM 595 CG LYS A 40 -10.064 -6.210 -3.096 1.00 0.00 C ATOM 596 CD LYS A 40 -10.283 -6.843 -1.732 1.00 0.00 C ATOM 597 CE LYS A 40 -10.939 -8.210 -1.850 1.00 0.00 C ATOM 598 NZ LYS A 40 -11.684 -8.577 -0.614 1.00 0.00 N ATOM 0 H LYS A 40 -7.779 -4.802 -5.461 1.00 0.00 H new ATOM 0 HA LYS A 40 -10.283 -3.785 -4.253 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -8.056 -5.473 -3.059 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.175 -4.559 -2.067 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -11.014 -5.843 -3.484 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -9.704 -6.965 -3.795 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -9.327 -6.940 -1.217 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -10.908 -6.190 -1.123 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -11.622 -8.213 -2.700 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -10.176 -8.962 -2.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -12.515 -9.149 -0.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -11.064 -9.126 0.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -11.994 -7.713 -0.126 1.00 0.00 H new ATOM 612 N LYS A 41 -9.177 -1.683 -3.594 1.00 0.00 N ATOM 613 CA LYS A 41 -8.556 -0.406 -3.260 1.00 0.00 C ATOM 614 C LYS A 41 -8.994 0.067 -1.878 1.00 0.00 C ATOM 615 O LYS A 41 -10.034 -0.352 -1.366 1.00 0.00 O ATOM 616 CB LYS A 41 -8.915 0.649 -4.309 1.00 0.00 C ATOM 617 CG LYS A 41 -10.365 0.590 -4.759 1.00 0.00 C ATOM 618 CD LYS A 41 -10.869 1.955 -5.196 1.00 0.00 C ATOM 619 CE LYS A 41 -12.315 1.892 -5.664 1.00 0.00 C ATOM 620 NZ LYS A 41 -12.467 1.053 -6.885 1.00 0.00 N ATOM 0 H LYS A 41 -10.196 -1.657 -3.640 1.00 0.00 H new ATOM 0 HA LYS A 41 -7.475 -0.548 -3.251 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -8.710 1.639 -3.902 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -8.268 0.521 -5.177 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -10.463 -0.116 -5.584 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -10.985 0.216 -3.944 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -10.784 2.658 -4.367 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -10.241 2.335 -6.002 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -12.938 1.488 -4.866 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -12.675 2.900 -5.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -13.409 1.209 -7.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -11.737 1.314 -7.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -12.362 0.050 -6.632 1.00 0.00 H new ATOM 634 N THR A 42 -8.196 0.944 -1.277 1.00 0.00 N ATOM 635 CA THR A 42 -8.502 1.475 0.046 1.00 0.00 C ATOM 636 C THR A 42 -9.346 2.740 -0.051 1.00 0.00 C ATOM 637 O THR A 42 -9.390 3.392 -1.094 1.00 0.00 O ATOM 638 CB THR A 42 -7.217 1.788 0.836 1.00 0.00 C ATOM 639 OG1 THR A 42 -6.484 2.832 0.186 1.00 0.00 O ATOM 640 CG2 THR A 42 -6.343 0.549 0.960 1.00 0.00 C ATOM 0 H THR A 42 -7.333 1.302 -1.686 1.00 0.00 H new ATOM 0 HA THR A 42 -9.066 0.705 0.573 1.00 0.00 H new ATOM 0 HB THR A 42 -7.502 2.114 1.836 1.00 0.00 H new ATOM 0 HG1 THR A 42 -6.174 3.479 0.854 1.00 0.00 H new ATOM 0 HG21 THR A 42 -5.442 0.794 1.522 1.00 0.00 H new ATOM 0 HG22 THR A 42 -6.894 -0.234 1.482 1.00 0.00 H new ATOM 0 HG23 THR A 42 -6.067 0.198 -0.034 1.00 0.00 H new ATOM 648 N LYS A 43 -10.016 3.084 1.044 1.00 0.00 N ATOM 649 CA LYS A 43 -10.859 4.273 1.084 1.00 0.00 C ATOM 650 C LYS A 43 -10.077 5.508 0.649 1.00 0.00 C ATOM 651 O LYS A 43 -9.116 5.910 1.305 1.00 0.00 O ATOM 652 CB LYS A 43 -11.417 4.480 2.494 1.00 0.00 C ATOM 653 CG LYS A 43 -10.346 4.724 3.543 1.00 0.00 C ATOM 654 CD LYS A 43 -10.923 4.685 4.948 1.00 0.00 C ATOM 655 CE LYS A 43 -9.832 4.517 5.994 1.00 0.00 C ATOM 656 NZ LYS A 43 -10.387 4.486 7.376 1.00 0.00 N ATOM 0 H LYS A 43 -9.991 2.556 1.916 1.00 0.00 H new ATOM 0 HA LYS A 43 -11.687 4.125 0.390 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -12.103 5.327 2.483 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -11.998 3.603 2.778 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.564 3.970 3.449 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -9.878 5.692 3.368 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -11.475 5.605 5.141 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -11.635 3.863 5.028 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -9.284 3.594 5.802 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -9.118 5.336 5.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -9.611 4.370 8.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -10.888 5.377 7.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -11.049 3.689 7.466 1.00 0.00 H new ATOM 670 N LYS A 44 -10.497 6.109 -0.459 1.00 0.00 N ATOM 671 CA LYS A 44 -9.839 7.300 -0.981 1.00 0.00 C ATOM 672 C LYS A 44 -9.681 8.356 0.109 1.00 0.00 C ATOM 673 O LYS A 44 -10.604 8.605 0.885 1.00 0.00 O ATOM 674 CB LYS A 44 -10.637 7.877 -2.152 1.00 0.00 C ATOM 675 CG LYS A 44 -11.801 8.754 -1.722 1.00 0.00 C ATOM 676 CD LYS A 44 -12.476 9.409 -2.915 1.00 0.00 C ATOM 677 CE LYS A 44 -13.538 10.406 -2.477 1.00 0.00 C ATOM 678 NZ LYS A 44 -14.463 10.756 -3.589 1.00 0.00 N ATOM 0 H LYS A 44 -11.291 5.790 -1.013 1.00 0.00 H new ATOM 0 HA LYS A 44 -8.848 7.013 -1.331 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -9.968 8.460 -2.784 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -11.017 7.057 -2.761 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -12.528 8.153 -1.176 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -11.445 9.523 -1.037 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -11.728 9.917 -3.524 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -12.931 8.643 -3.543 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -14.109 9.988 -1.648 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -13.056 11.311 -2.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -14.479 11.788 -3.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -14.137 10.304 -4.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -15.421 10.420 -3.362 1.00 0.00 H new ATOM 692 N VAL A 45 -8.505 8.974 0.162 1.00 0.00 N ATOM 693 CA VAL A 45 -8.227 10.004 1.155 1.00 0.00 C ATOM 694 C VAL A 45 -8.328 11.398 0.544 1.00 0.00 C ATOM 695 O VAL A 45 -7.796 11.653 -0.536 1.00 0.00 O ATOM 696 CB VAL A 45 -6.827 9.826 1.771 1.00 0.00 C ATOM 697 CG1 VAL A 45 -6.528 10.951 2.752 1.00 0.00 C ATOM 698 CG2 VAL A 45 -6.713 8.471 2.452 1.00 0.00 C ATOM 0 H VAL A 45 -7.730 8.779 -0.471 1.00 0.00 H new ATOM 0 HA VAL A 45 -8.977 9.899 1.939 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.089 9.868 0.970 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -5.535 10.808 3.177 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -6.566 11.908 2.231 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -7.269 10.944 3.551 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -5.717 8.362 2.882 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.459 8.397 3.243 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.881 7.681 1.720 1.00 0.00 H new ATOM 708 N ASP A 46 -9.013 12.296 1.244 1.00 0.00 N ATOM 709 CA ASP A 46 -9.183 13.665 0.772 1.00 0.00 C ATOM 710 C ASP A 46 -7.837 14.375 0.669 1.00 0.00 C ATOM 711 O ASP A 46 -6.796 13.803 0.989 1.00 0.00 O ATOM 712 CB ASP A 46 -10.112 14.439 1.709 1.00 0.00 C ATOM 713 CG ASP A 46 -11.568 14.328 1.302 1.00 0.00 C ATOM 714 OD1 ASP A 46 -11.999 15.103 0.422 1.00 0.00 O ATOM 715 OD2 ASP A 46 -12.276 13.466 1.862 1.00 0.00 O ATOM 0 H ASP A 46 -9.459 12.100 2.140 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.631 13.628 -0.221 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -9.992 14.064 2.726 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -9.820 15.489 1.720 1.00 0.00 H new ATOM 720 N ASN A 47 -7.866 15.626 0.219 1.00 0.00 N ATOM 721 CA ASN A 47 -6.648 16.414 0.072 1.00 0.00 C ATOM 722 C ASN A 47 -5.683 16.143 1.223 1.00 0.00 C ATOM 723 O ASN A 47 -5.765 16.775 2.275 1.00 0.00 O ATOM 724 CB ASN A 47 -6.985 17.905 0.014 1.00 0.00 C ATOM 725 CG ASN A 47 -8.145 18.200 -0.916 1.00 0.00 C ATOM 726 OD1 ASN A 47 -9.197 17.565 -0.836 1.00 0.00 O ATOM 727 ND2 ASN A 47 -7.959 19.168 -1.806 1.00 0.00 N ATOM 0 H ASN A 47 -8.720 16.115 -0.050 1.00 0.00 H new ATOM 0 HA ASN A 47 -6.165 16.121 -0.860 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -7.227 18.259 1.016 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -6.107 18.460 -0.317 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -8.704 19.411 -2.458 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -7.071 19.668 -1.837 1.00 0.00 H new ATOM 734 N GLU A 48 -4.770 15.200 1.013 1.00 0.00 N ATOM 735 CA GLU A 48 -3.790 14.846 2.033 1.00 0.00 C ATOM 736 C GLU A 48 -2.574 14.168 1.407 1.00 0.00 C ATOM 737 O GLU A 48 -2.706 13.192 0.667 1.00 0.00 O ATOM 738 CB GLU A 48 -4.420 13.924 3.079 1.00 0.00 C ATOM 739 CG GLU A 48 -3.419 13.012 3.767 1.00 0.00 C ATOM 740 CD GLU A 48 -3.825 12.666 5.187 1.00 0.00 C ATOM 741 OE1 GLU A 48 -4.879 12.020 5.363 1.00 0.00 O ATOM 742 OE2 GLU A 48 -3.087 13.042 6.122 1.00 0.00 O ATOM 0 H GLU A 48 -4.689 14.668 0.147 1.00 0.00 H new ATOM 0 HA GLU A 48 -3.462 15.764 2.520 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -4.922 14.532 3.832 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -5.185 13.314 2.599 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -3.313 12.094 3.189 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -2.442 13.495 3.780 1.00 0.00 H new ATOM 749 N LEU A 49 -1.392 14.692 1.708 1.00 0.00 N ATOM 750 CA LEU A 49 -0.151 14.139 1.176 1.00 0.00 C ATOM 751 C LEU A 49 0.127 12.760 1.765 1.00 0.00 C ATOM 752 O LEU A 49 0.430 11.814 1.039 1.00 0.00 O ATOM 753 CB LEU A 49 1.019 15.078 1.474 1.00 0.00 C ATOM 754 CG LEU A 49 1.327 16.127 0.404 1.00 0.00 C ATOM 755 CD1 LEU A 49 0.054 16.542 -0.318 1.00 0.00 C ATOM 756 CD2 LEU A 49 2.009 17.337 1.024 1.00 0.00 C ATOM 0 H LEU A 49 -1.266 15.500 2.318 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.261 14.038 0.096 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.815 15.594 2.412 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.913 14.474 1.630 1.00 0.00 H new ATOM 0 HG LEU A 49 2.007 15.686 -0.325 1.00 0.00 H new ATOM 0 HD11 LEU A 49 0.292 17.289 -1.076 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -0.394 15.671 -0.796 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.650 16.965 0.399 1.00 0.00 H new ATOM 0 HD21 LEU A 49 2.221 18.073 0.248 1.00 0.00 H new ATOM 0 HD22 LEU A 49 1.354 17.779 1.774 1.00 0.00 H new ATOM 0 HD23 LEU A 49 2.942 17.027 1.494 1.00 0.00 H new ATOM 768 N ASN A 50 0.019 12.653 3.085 1.00 0.00 N ATOM 769 CA ASN A 50 0.257 11.388 3.772 1.00 0.00 C ATOM 770 C ASN A 50 -1.054 10.782 4.265 1.00 0.00 C ATOM 771 O ASN A 50 -1.436 10.929 5.426 1.00 0.00 O ATOM 772 CB ASN A 50 1.211 11.595 4.949 1.00 0.00 C ATOM 773 CG ASN A 50 2.409 12.449 4.580 1.00 0.00 C ATOM 774 OD1 ASN A 50 2.751 12.583 3.404 1.00 0.00 O ATOM 775 ND2 ASN A 50 3.053 13.032 5.584 1.00 0.00 N ATOM 0 H ASN A 50 -0.232 13.427 3.701 1.00 0.00 H new ATOM 0 HA ASN A 50 0.712 10.697 3.062 1.00 0.00 H new ATOM 0 HB2 ASN A 50 0.672 12.066 5.771 1.00 0.00 H new ATOM 0 HB3 ASN A 50 1.556 10.625 5.308 1.00 0.00 H new ATOM 0 HD21 ASN A 50 3.866 13.619 5.396 1.00 0.00 H new ATOM 0 HD22 ASN A 50 2.735 12.893 6.543 1.00 0.00 H new ATOM 782 N PRO A 51 -1.759 10.084 3.363 1.00 0.00 N ATOM 783 CA PRO A 51 -3.037 9.440 3.683 1.00 0.00 C ATOM 784 C PRO A 51 -2.866 8.248 4.618 1.00 0.00 C ATOM 785 O PRO A 51 -1.924 7.467 4.481 1.00 0.00 O ATOM 786 CB PRO A 51 -3.554 8.980 2.318 1.00 0.00 C ATOM 787 CG PRO A 51 -2.330 8.820 1.483 1.00 0.00 C ATOM 788 CD PRO A 51 -1.364 9.868 1.961 1.00 0.00 C ATOM 0 HA PRO A 51 -3.715 10.115 4.205 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -4.104 8.042 2.398 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -4.235 9.713 1.885 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -1.909 7.821 1.595 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -2.559 8.953 0.426 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -0.331 9.528 1.883 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -1.443 10.784 1.376 1.00 0.00 H new ATOM 796 N VAL A 52 -3.785 8.112 5.570 1.00 0.00 N ATOM 797 CA VAL A 52 -3.737 7.013 6.527 1.00 0.00 C ATOM 798 C VAL A 52 -4.951 6.103 6.380 1.00 0.00 C ATOM 799 O VAL A 52 -6.040 6.421 6.857 1.00 0.00 O ATOM 800 CB VAL A 52 -3.672 7.533 7.976 1.00 0.00 C ATOM 801 CG1 VAL A 52 -3.802 6.383 8.962 1.00 0.00 C ATOM 802 CG2 VAL A 52 -2.380 8.302 8.208 1.00 0.00 C ATOM 0 H VAL A 52 -4.571 8.749 5.698 1.00 0.00 H new ATOM 0 HA VAL A 52 -2.832 6.445 6.311 1.00 0.00 H new ATOM 0 HB VAL A 52 -4.507 8.214 8.137 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -3.754 6.769 9.980 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -4.757 5.879 8.810 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -2.989 5.675 8.804 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.351 8.662 9.236 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.529 7.645 8.029 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -2.334 9.150 7.525 1.00 0.00 H new ATOM 812 N TRP A 53 -4.755 4.969 5.717 1.00 0.00 N ATOM 813 CA TRP A 53 -5.835 4.011 5.507 1.00 0.00 C ATOM 814 C TRP A 53 -5.916 3.020 6.663 1.00 0.00 C ATOM 815 O TRP A 53 -7.004 2.688 7.131 1.00 0.00 O ATOM 816 CB TRP A 53 -5.630 3.261 4.189 1.00 0.00 C ATOM 817 CG TRP A 53 -5.582 4.163 2.993 1.00 0.00 C ATOM 818 CD1 TRP A 53 -6.647 4.714 2.340 1.00 0.00 C ATOM 819 CD2 TRP A 53 -4.410 4.616 2.308 1.00 0.00 C ATOM 820 NE1 TRP A 53 -6.208 5.482 1.289 1.00 0.00 N ATOM 821 CE2 TRP A 53 -4.839 5.440 1.249 1.00 0.00 C ATOM 822 CE3 TRP A 53 -3.040 4.409 2.487 1.00 0.00 C ATOM 823 CZ2 TRP A 53 -3.946 6.053 0.374 1.00 0.00 C ATOM 824 CZ3 TRP A 53 -2.155 5.018 1.618 1.00 0.00 C ATOM 825 CH2 TRP A 53 -2.610 5.832 0.572 1.00 0.00 C ATOM 0 H TRP A 53 -3.860 4.690 5.316 1.00 0.00 H new ATOM 0 HA TRP A 53 -6.773 4.563 5.460 1.00 0.00 H new ATOM 0 HB2 TRP A 53 -4.702 2.692 4.244 1.00 0.00 H new ATOM 0 HB3 TRP A 53 -6.438 2.541 4.060 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -7.682 4.568 2.610 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -6.804 5.999 0.643 1.00 0.00 H new ATOM 0 HE3 TRP A 53 -2.679 3.784 3.290 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 -4.295 6.681 -0.432 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 -1.094 4.864 1.747 1.00 0.00 H new ATOM 0 HH2 TRP A 53 -1.893 6.294 -0.090 1.00 0.00 H new ATOM 836 N ASN A 54 -4.759 2.553 7.118 1.00 0.00 N ATOM 837 CA ASN A 54 -4.700 1.599 8.220 1.00 0.00 C ATOM 838 C ASN A 54 -5.811 0.560 8.100 1.00 0.00 C ATOM 839 O ASN A 54 -6.501 0.261 9.074 1.00 0.00 O ATOM 840 CB ASN A 54 -4.811 2.329 9.560 1.00 0.00 C ATOM 841 CG ASN A 54 -6.201 2.886 9.801 1.00 0.00 C ATOM 842 OD1 ASN A 54 -7.065 2.210 10.360 1.00 0.00 O ATOM 843 ND2 ASN A 54 -6.422 4.126 9.380 1.00 0.00 N ATOM 0 H ASN A 54 -3.849 2.819 6.741 1.00 0.00 H new ATOM 0 HA ASN A 54 -3.740 1.085 8.172 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -4.552 1.643 10.367 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -4.086 3.143 9.589 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -7.337 4.555 9.515 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -5.676 4.649 8.921 1.00 0.00 H new ATOM 850 N GLU A 55 -5.976 0.014 6.900 1.00 0.00 N ATOM 851 CA GLU A 55 -7.003 -0.991 6.653 1.00 0.00 C ATOM 852 C GLU A 55 -6.376 -2.357 6.388 1.00 0.00 C ATOM 853 O GLU A 55 -5.156 -2.479 6.269 1.00 0.00 O ATOM 854 CB GLU A 55 -7.877 -0.580 5.467 1.00 0.00 C ATOM 855 CG GLU A 55 -7.323 -1.020 4.122 1.00 0.00 C ATOM 856 CD GLU A 55 -8.299 -0.788 2.985 1.00 0.00 C ATOM 857 OE1 GLU A 55 -9.193 0.071 3.137 1.00 0.00 O ATOM 858 OE2 GLU A 55 -8.170 -1.466 1.944 1.00 0.00 O ATOM 0 H GLU A 55 -5.412 0.250 6.084 1.00 0.00 H new ATOM 0 HA GLU A 55 -7.625 -1.063 7.545 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -8.873 -1.003 5.596 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -7.989 0.504 5.467 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -6.399 -0.478 3.919 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -7.068 -2.079 4.167 1.00 0.00 H new ATOM 865 N ILE A 56 -7.218 -3.381 6.297 1.00 0.00 N ATOM 866 CA ILE A 56 -6.746 -4.737 6.045 1.00 0.00 C ATOM 867 C ILE A 56 -7.480 -5.363 4.864 1.00 0.00 C ATOM 868 O ILE A 56 -8.708 -5.318 4.787 1.00 0.00 O ATOM 869 CB ILE A 56 -6.928 -5.635 7.283 1.00 0.00 C ATOM 870 CG1 ILE A 56 -6.290 -4.983 8.511 1.00 0.00 C ATOM 871 CG2 ILE A 56 -6.326 -7.009 7.033 1.00 0.00 C ATOM 872 CD1 ILE A 56 -6.342 -5.849 9.750 1.00 0.00 C ATOM 0 H ILE A 56 -8.230 -3.297 6.394 1.00 0.00 H new ATOM 0 HA ILE A 56 -5.684 -4.664 5.812 1.00 0.00 H new ATOM 0 HB ILE A 56 -7.995 -5.756 7.473 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.250 -4.745 8.287 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -6.796 -4.039 8.715 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.462 -7.632 7.917 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -6.822 -7.474 6.181 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -5.262 -6.907 6.822 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -5.872 -5.324 10.581 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -7.381 -6.066 9.999 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -5.811 -6.783 9.564 1.00 0.00 H new ATOM 884 N LEU A 57 -6.719 -5.949 3.946 1.00 0.00 N ATOM 885 CA LEU A 57 -7.296 -6.588 2.768 1.00 0.00 C ATOM 886 C LEU A 57 -7.047 -8.092 2.787 1.00 0.00 C ATOM 887 O LEU A 57 -6.060 -8.560 3.353 1.00 0.00 O ATOM 888 CB LEU A 57 -6.710 -5.978 1.494 1.00 0.00 C ATOM 889 CG LEU A 57 -6.717 -4.451 1.416 1.00 0.00 C ATOM 890 CD1 LEU A 57 -5.558 -3.955 0.565 1.00 0.00 C ATOM 891 CD2 LEU A 57 -8.042 -3.951 0.859 1.00 0.00 C ATOM 0 H LEU A 57 -5.701 -5.995 3.995 1.00 0.00 H new ATOM 0 HA LEU A 57 -8.372 -6.417 2.783 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -5.681 -6.322 1.390 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -7.264 -6.368 0.640 1.00 0.00 H new ATOM 0 HG LEU A 57 -6.597 -4.054 2.424 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -5.579 -2.866 0.521 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.617 -4.282 1.006 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -5.647 -4.361 -0.443 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -8.029 -2.862 0.811 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -8.192 -4.357 -0.141 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -8.855 -4.275 1.508 1.00 0.00 H new ATOM 903 N GLU A 58 -7.948 -8.845 2.162 1.00 0.00 N ATOM 904 CA GLU A 58 -7.823 -10.296 2.107 1.00 0.00 C ATOM 905 C GLU A 58 -8.124 -10.815 0.704 1.00 0.00 C ATOM 906 O GLU A 58 -8.963 -10.262 -0.008 1.00 0.00 O ATOM 907 CB GLU A 58 -8.768 -10.950 3.117 1.00 0.00 C ATOM 908 CG GLU A 58 -8.819 -10.233 4.456 1.00 0.00 C ATOM 909 CD GLU A 58 -9.969 -10.702 5.326 1.00 0.00 C ATOM 910 OE1 GLU A 58 -9.811 -11.730 6.016 1.00 0.00 O ATOM 911 OE2 GLU A 58 -11.028 -10.040 5.315 1.00 0.00 O ATOM 0 H GLU A 58 -8.771 -8.474 1.688 1.00 0.00 H new ATOM 0 HA GLU A 58 -6.795 -10.556 2.360 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -9.772 -10.983 2.694 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -8.456 -11.982 3.279 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -7.880 -10.393 4.985 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -8.911 -9.160 4.286 1.00 0.00 H new ATOM 918 N PHE A 59 -7.432 -11.880 0.312 1.00 0.00 N ATOM 919 CA PHE A 59 -7.623 -12.473 -1.006 1.00 0.00 C ATOM 920 C PHE A 59 -7.651 -13.996 -0.919 1.00 0.00 C ATOM 921 O PHE A 59 -6.751 -14.613 -0.348 1.00 0.00 O ATOM 922 CB PHE A 59 -6.509 -12.027 -1.956 1.00 0.00 C ATOM 923 CG PHE A 59 -6.512 -10.550 -2.231 1.00 0.00 C ATOM 924 CD1 PHE A 59 -7.287 -10.024 -3.252 1.00 0.00 C ATOM 925 CD2 PHE A 59 -5.740 -9.688 -1.469 1.00 0.00 C ATOM 926 CE1 PHE A 59 -7.291 -8.666 -3.508 1.00 0.00 C ATOM 927 CE2 PHE A 59 -5.740 -8.329 -1.720 1.00 0.00 C ATOM 928 CZ PHE A 59 -6.518 -7.817 -2.740 1.00 0.00 C ATOM 0 H PHE A 59 -6.734 -12.350 0.889 1.00 0.00 H new ATOM 0 HA PHE A 59 -8.582 -12.131 -1.394 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -5.545 -12.307 -1.530 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -6.610 -12.564 -2.899 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -7.895 -10.683 -3.855 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -5.131 -10.083 -0.669 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -7.898 -8.269 -4.308 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -5.133 -7.668 -1.119 1.00 0.00 H new ATOM 0 HZ PHE A 59 -6.522 -6.755 -2.937 1.00 0.00 H new ATOM 938 N ASP A 60 -8.692 -14.596 -1.487 1.00 0.00 N ATOM 939 CA ASP A 60 -8.839 -16.047 -1.474 1.00 0.00 C ATOM 940 C ASP A 60 -8.085 -16.680 -2.639 1.00 0.00 C ATOM 941 O ASP A 60 -8.256 -16.283 -3.792 1.00 0.00 O ATOM 942 CB ASP A 60 -10.318 -16.431 -1.538 1.00 0.00 C ATOM 943 CG ASP A 60 -10.600 -17.762 -0.869 1.00 0.00 C ATOM 944 OD1 ASP A 60 -9.738 -18.662 -0.953 1.00 0.00 O ATOM 945 OD2 ASP A 60 -11.682 -17.905 -0.263 1.00 0.00 O ATOM 0 H ASP A 60 -9.446 -14.100 -1.962 1.00 0.00 H new ATOM 0 HA ASP A 60 -8.414 -16.423 -0.543 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -10.913 -15.654 -1.059 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -10.634 -16.477 -2.580 1.00 0.00 H new ATOM 950 N LEU A 61 -7.248 -17.665 -2.330 1.00 0.00 N ATOM 951 CA LEU A 61 -6.466 -18.353 -3.351 1.00 0.00 C ATOM 952 C LEU A 61 -7.149 -19.648 -3.780 1.00 0.00 C ATOM 953 O LEU A 61 -6.882 -20.174 -4.860 1.00 0.00 O ATOM 954 CB LEU A 61 -5.060 -18.653 -2.829 1.00 0.00 C ATOM 955 CG LEU A 61 -4.382 -17.530 -2.044 1.00 0.00 C ATOM 956 CD1 LEU A 61 -3.167 -18.058 -1.298 1.00 0.00 C ATOM 957 CD2 LEU A 61 -3.986 -16.393 -2.975 1.00 0.00 C ATOM 0 H LEU A 61 -7.094 -18.005 -1.381 1.00 0.00 H new ATOM 0 HA LEU A 61 -6.392 -17.698 -4.219 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.112 -19.535 -2.191 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -4.426 -18.910 -3.678 1.00 0.00 H new ATOM 0 HG LEU A 61 -5.092 -17.144 -1.312 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.698 -17.244 -0.745 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.478 -18.838 -0.602 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -2.454 -18.471 -2.011 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.505 -15.602 -2.399 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -3.293 -16.765 -3.730 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.876 -15.996 -3.463 1.00 0.00 H new ATOM 969 N ARG A 62 -8.033 -20.155 -2.926 1.00 0.00 N ATOM 970 CA ARG A 62 -8.755 -21.388 -3.217 1.00 0.00 C ATOM 971 C ARG A 62 -7.797 -22.573 -3.295 1.00 0.00 C ATOM 972 O ARG A 62 -7.818 -23.339 -4.258 1.00 0.00 O ATOM 973 CB ARG A 62 -9.526 -21.254 -4.531 1.00 0.00 C ATOM 974 CG ARG A 62 -10.258 -19.930 -4.676 1.00 0.00 C ATOM 975 CD ARG A 62 -10.422 -19.541 -6.137 1.00 0.00 C ATOM 976 NE ARG A 62 -11.574 -18.668 -6.345 1.00 0.00 N ATOM 977 CZ ARG A 62 -12.014 -18.305 -7.545 1.00 0.00 C ATOM 978 NH1 ARG A 62 -11.402 -18.738 -8.638 1.00 0.00 N ATOM 979 NH2 ARG A 62 -13.069 -17.508 -7.652 1.00 0.00 N ATOM 0 H ARG A 62 -8.266 -19.731 -2.028 1.00 0.00 H new ATOM 0 HA ARG A 62 -9.461 -21.567 -2.406 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.831 -21.368 -5.363 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -10.247 -22.068 -4.604 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -11.238 -20.002 -4.205 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -9.708 -19.150 -4.150 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -9.519 -19.038 -6.482 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -10.535 -20.441 -6.741 1.00 0.00 H new ATOM 0 HE ARG A 62 -12.068 -18.318 -5.524 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -10.591 -19.352 -8.559 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -11.742 -18.458 -9.558 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -13.543 -17.174 -6.813 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -13.406 -17.230 -8.573 1.00 0.00 H new ATOM 993 N GLY A 63 -6.958 -22.718 -2.273 1.00 0.00 N ATOM 994 CA GLY A 63 -6.005 -23.812 -2.246 1.00 0.00 C ATOM 995 C GLY A 63 -4.831 -23.581 -3.178 1.00 0.00 C ATOM 996 O GLY A 63 -3.977 -24.453 -3.337 1.00 0.00 O ATOM 0 H GLY A 63 -6.922 -22.098 -1.464 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -5.637 -23.944 -1.229 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.510 -24.737 -2.525 1.00 0.00 H new ATOM 1000 N ILE A 64 -4.790 -22.406 -3.795 1.00 0.00 N ATOM 1001 CA ILE A 64 -3.714 -22.065 -4.716 1.00 0.00 C ATOM 1002 C ILE A 64 -2.568 -21.368 -3.989 1.00 0.00 C ATOM 1003 O ILE A 64 -2.681 -20.221 -3.558 1.00 0.00 O ATOM 1004 CB ILE A 64 -4.213 -21.155 -5.854 1.00 0.00 C ATOM 1005 CG1 ILE A 64 -5.282 -21.874 -6.680 1.00 0.00 C ATOM 1006 CG2 ILE A 64 -3.052 -20.727 -6.739 1.00 0.00 C ATOM 1007 CD1 ILE A 64 -4.763 -23.093 -7.410 1.00 0.00 C ATOM 0 H ILE A 64 -5.490 -21.674 -3.674 1.00 0.00 H new ATOM 0 HA ILE A 64 -3.355 -23.002 -5.142 1.00 0.00 H new ATOM 0 HB ILE A 64 -4.658 -20.262 -5.416 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -6.097 -22.174 -6.022 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -5.699 -21.176 -7.406 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -3.421 -20.084 -7.538 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.322 -20.180 -6.142 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -2.580 -21.609 -7.172 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -5.575 -23.552 -7.974 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -3.968 -22.796 -8.094 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -4.372 -23.810 -6.688 1.00 0.00 H new ATOM 1019 N PRO A 65 -1.437 -22.076 -3.851 1.00 0.00 N ATOM 1020 CA PRO A 65 -0.248 -21.545 -3.179 1.00 0.00 C ATOM 1021 C PRO A 65 0.427 -20.439 -3.983 1.00 0.00 C ATOM 1022 O PRO A 65 -0.073 -20.024 -5.029 1.00 0.00 O ATOM 1023 CB PRO A 65 0.671 -22.764 -3.070 1.00 0.00 C ATOM 1024 CG PRO A 65 0.248 -23.659 -4.182 1.00 0.00 C ATOM 1025 CD PRO A 65 -1.233 -23.450 -4.342 1.00 0.00 C ATOM 0 HA PRO A 65 -0.491 -21.090 -2.219 1.00 0.00 H new ATOM 0 HB2 PRO A 65 1.719 -22.480 -3.168 1.00 0.00 H new ATOM 0 HB3 PRO A 65 0.563 -23.256 -2.103 1.00 0.00 H new ATOM 0 HG2 PRO A 65 0.778 -23.415 -5.103 1.00 0.00 H new ATOM 0 HG3 PRO A 65 0.472 -24.700 -3.952 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -1.544 -23.556 -5.381 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -1.806 -24.174 -3.762 1.00 0.00 H new ATOM 1033 N LEU A 66 1.565 -19.966 -3.489 1.00 0.00 N ATOM 1034 CA LEU A 66 2.310 -18.907 -4.162 1.00 0.00 C ATOM 1035 C LEU A 66 3.503 -19.479 -4.921 1.00 0.00 C ATOM 1036 O LEU A 66 3.879 -20.635 -4.727 1.00 0.00 O ATOM 1037 CB LEU A 66 2.788 -17.867 -3.146 1.00 0.00 C ATOM 1038 CG LEU A 66 1.703 -16.983 -2.530 1.00 0.00 C ATOM 1039 CD1 LEU A 66 2.307 -16.028 -1.513 1.00 0.00 C ATOM 1040 CD2 LEU A 66 0.962 -16.214 -3.614 1.00 0.00 C ATOM 0 H LEU A 66 1.993 -20.299 -2.625 1.00 0.00 H new ATOM 0 HA LEU A 66 1.644 -18.426 -4.878 1.00 0.00 H new ATOM 0 HB2 LEU A 66 3.306 -18.387 -2.340 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.521 -17.223 -3.632 1.00 0.00 H new ATOM 0 HG LEU A 66 0.988 -17.624 -2.015 1.00 0.00 H new ATOM 0 HD11 LEU A 66 1.520 -15.407 -1.085 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.790 -16.599 -0.720 1.00 0.00 H new ATOM 0 HD13 LEU A 66 3.044 -15.393 -2.004 1.00 0.00 H new ATOM 0 HD21 LEU A 66 0.194 -15.590 -3.157 1.00 0.00 H new ATOM 0 HD22 LEU A 66 1.665 -15.583 -4.158 1.00 0.00 H new ATOM 0 HD23 LEU A 66 0.496 -16.917 -4.304 1.00 0.00 H new ATOM 1052 N ASP A 67 4.096 -18.661 -5.784 1.00 0.00 N ATOM 1053 CA ASP A 67 5.249 -19.083 -6.570 1.00 0.00 C ATOM 1054 C ASP A 67 6.145 -17.895 -6.903 1.00 0.00 C ATOM 1055 O ASP A 67 5.777 -16.743 -6.673 1.00 0.00 O ATOM 1056 CB ASP A 67 4.791 -19.770 -7.858 1.00 0.00 C ATOM 1057 CG ASP A 67 3.530 -19.150 -8.427 1.00 0.00 C ATOM 1058 OD1 ASP A 67 2.494 -19.168 -7.731 1.00 0.00 O ATOM 1059 OD2 ASP A 67 3.580 -18.648 -9.570 1.00 0.00 O ATOM 0 H ASP A 67 3.797 -17.701 -5.957 1.00 0.00 H new ATOM 0 HA ASP A 67 5.824 -19.792 -5.974 1.00 0.00 H new ATOM 0 HB2 ASP A 67 5.587 -19.713 -8.600 1.00 0.00 H new ATOM 0 HB3 ASP A 67 4.615 -20.827 -7.660 1.00 0.00 H new ATOM 1064 N PHE A 68 7.323 -18.182 -7.446 1.00 0.00 N ATOM 1065 CA PHE A 68 8.273 -17.137 -7.809 1.00 0.00 C ATOM 1066 C PHE A 68 7.684 -16.211 -8.869 1.00 0.00 C ATOM 1067 O PHE A 68 8.253 -15.165 -9.181 1.00 0.00 O ATOM 1068 CB PHE A 68 9.574 -17.757 -8.323 1.00 0.00 C ATOM 1069 CG PHE A 68 10.076 -18.888 -7.473 1.00 0.00 C ATOM 1070 CD1 PHE A 68 10.719 -18.637 -6.271 1.00 0.00 C ATOM 1071 CD2 PHE A 68 9.906 -20.203 -7.875 1.00 0.00 C ATOM 1072 CE1 PHE A 68 11.182 -19.676 -5.486 1.00 0.00 C ATOM 1073 CE2 PHE A 68 10.367 -21.246 -7.094 1.00 0.00 C ATOM 1074 CZ PHE A 68 11.006 -20.982 -5.898 1.00 0.00 C ATOM 0 H PHE A 68 7.643 -19.130 -7.645 1.00 0.00 H new ATOM 0 HA PHE A 68 8.487 -16.549 -6.916 1.00 0.00 H new ATOM 0 HB2 PHE A 68 9.418 -18.119 -9.339 1.00 0.00 H new ATOM 0 HB3 PHE A 68 10.340 -16.984 -8.374 1.00 0.00 H new ATOM 0 HD1 PHE A 68 10.860 -17.617 -5.944 1.00 0.00 H new ATOM 0 HD2 PHE A 68 9.408 -20.415 -8.809 1.00 0.00 H new ATOM 0 HE1 PHE A 68 11.681 -19.467 -4.551 1.00 0.00 H new ATOM 0 HE2 PHE A 68 10.228 -22.267 -7.419 1.00 0.00 H new ATOM 0 HZ PHE A 68 11.367 -21.796 -5.286 1.00 0.00 H new ATOM 1084 N SER A 69 6.540 -16.604 -9.419 1.00 0.00 N ATOM 1085 CA SER A 69 5.875 -15.812 -10.448 1.00 0.00 C ATOM 1086 C SER A 69 4.784 -14.936 -9.838 1.00 0.00 C ATOM 1087 O SER A 69 4.362 -13.946 -10.435 1.00 0.00 O ATOM 1088 CB SER A 69 5.272 -16.727 -11.515 1.00 0.00 C ATOM 1089 OG SER A 69 4.950 -16.000 -12.688 1.00 0.00 O ATOM 0 H SER A 69 6.054 -17.466 -9.170 1.00 0.00 H new ATOM 0 HA SER A 69 6.620 -15.165 -10.912 1.00 0.00 H new ATOM 0 HB2 SER A 69 5.978 -17.521 -11.758 1.00 0.00 H new ATOM 0 HB3 SER A 69 4.375 -17.206 -11.123 1.00 0.00 H new ATOM 0 HG SER A 69 4.568 -16.608 -13.355 1.00 0.00 H new ATOM 1095 N SER A 70 4.332 -15.309 -8.645 1.00 0.00 N ATOM 1096 CA SER A 70 3.288 -14.561 -7.955 1.00 0.00 C ATOM 1097 C SER A 70 3.842 -13.262 -7.378 1.00 0.00 C ATOM 1098 O SER A 70 4.956 -13.227 -6.855 1.00 0.00 O ATOM 1099 CB SER A 70 2.677 -15.409 -6.838 1.00 0.00 C ATOM 1100 OG SER A 70 2.075 -16.581 -7.359 1.00 0.00 O ATOM 0 H SER A 70 4.673 -16.125 -8.136 1.00 0.00 H new ATOM 0 HA SER A 70 2.512 -14.315 -8.680 1.00 0.00 H new ATOM 0 HB2 SER A 70 3.450 -15.682 -6.120 1.00 0.00 H new ATOM 0 HB3 SER A 70 1.933 -14.823 -6.298 1.00 0.00 H new ATOM 0 HG SER A 70 1.693 -17.107 -6.625 1.00 0.00 H new ATOM 1106 N SER A 71 3.056 -12.195 -7.477 1.00 0.00 N ATOM 1107 CA SER A 71 3.468 -10.891 -6.969 1.00 0.00 C ATOM 1108 C SER A 71 2.259 -9.988 -6.747 1.00 0.00 C ATOM 1109 O SER A 71 1.174 -10.242 -7.272 1.00 0.00 O ATOM 1110 CB SER A 71 4.444 -10.226 -7.942 1.00 0.00 C ATOM 1111 OG SER A 71 3.909 -10.188 -9.254 1.00 0.00 O ATOM 0 H SER A 71 2.130 -12.207 -7.904 1.00 0.00 H new ATOM 0 HA SER A 71 3.967 -11.043 -6.012 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.664 -9.213 -7.606 1.00 0.00 H new ATOM 0 HB3 SER A 71 5.387 -10.772 -7.946 1.00 0.00 H new ATOM 0 HG SER A 71 4.551 -9.757 -9.857 1.00 0.00 H new ATOM 1117 N LEU A 72 2.453 -8.932 -5.965 1.00 0.00 N ATOM 1118 CA LEU A 72 1.379 -7.989 -5.671 1.00 0.00 C ATOM 1119 C LEU A 72 1.587 -6.677 -6.422 1.00 0.00 C ATOM 1120 O LEU A 72 2.707 -6.178 -6.522 1.00 0.00 O ATOM 1121 CB LEU A 72 1.304 -7.723 -4.167 1.00 0.00 C ATOM 1122 CG LEU A 72 -0.055 -7.270 -3.632 1.00 0.00 C ATOM 1123 CD1 LEU A 72 -1.063 -8.407 -3.705 1.00 0.00 C ATOM 1124 CD2 LEU A 72 0.076 -6.762 -2.204 1.00 0.00 C ATOM 0 H LEU A 72 3.344 -8.707 -5.523 1.00 0.00 H new ATOM 0 HA LEU A 72 0.439 -8.431 -6.002 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.593 -8.634 -3.642 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.043 -6.962 -3.916 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.415 -6.452 -4.256 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.024 -8.066 -3.320 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.179 -8.724 -4.741 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.709 -9.246 -3.106 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -0.901 -6.444 -1.840 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.458 -7.560 -1.568 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.765 -5.917 -2.180 1.00 0.00 H new ATOM 1136 N GLY A 73 0.498 -6.122 -6.946 1.00 0.00 N ATOM 1137 CA GLY A 73 0.581 -4.872 -7.678 1.00 0.00 C ATOM 1138 C GLY A 73 0.031 -3.701 -6.890 1.00 0.00 C ATOM 1139 O GLY A 73 -1.154 -3.670 -6.557 1.00 0.00 O ATOM 0 H GLY A 73 -0.440 -6.516 -6.876 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.621 -4.675 -7.937 1.00 0.00 H new ATOM 0 HA3 GLY A 73 0.031 -4.966 -8.615 1.00 0.00 H new ATOM 1143 N ILE A 74 0.892 -2.735 -6.590 1.00 0.00 N ATOM 1144 CA ILE A 74 0.485 -1.556 -5.835 1.00 0.00 C ATOM 1145 C ILE A 74 0.550 -0.301 -6.699 1.00 0.00 C ATOM 1146 O ILE A 74 1.632 0.139 -7.091 1.00 0.00 O ATOM 1147 CB ILE A 74 1.365 -1.354 -4.588 1.00 0.00 C ATOM 1148 CG1 ILE A 74 1.174 -2.514 -3.609 1.00 0.00 C ATOM 1149 CG2 ILE A 74 1.037 -0.028 -3.917 1.00 0.00 C ATOM 1150 CD1 ILE A 74 -0.277 -2.826 -3.317 1.00 0.00 C ATOM 0 H ILE A 74 1.876 -2.745 -6.858 1.00 0.00 H new ATOM 0 HA ILE A 74 -0.545 -1.724 -5.519 1.00 0.00 H new ATOM 0 HB ILE A 74 2.410 -1.333 -4.898 1.00 0.00 H new ATOM 0 HG12 ILE A 74 1.654 -3.404 -4.015 1.00 0.00 H new ATOM 0 HG13 ILE A 74 1.681 -2.277 -2.674 1.00 0.00 H new ATOM 0 HG21 ILE A 74 1.667 0.100 -3.037 1.00 0.00 H new ATOM 0 HG22 ILE A 74 1.219 0.788 -4.616 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -0.011 -0.022 -3.617 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -0.336 -3.659 -2.616 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.757 -1.950 -2.881 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -0.785 -3.095 -4.243 1.00 0.00 H new ATOM 1162 N ILE A 75 -0.613 0.273 -6.989 1.00 0.00 N ATOM 1163 CA ILE A 75 -0.687 1.479 -7.803 1.00 0.00 C ATOM 1164 C ILE A 75 -1.411 2.599 -7.062 1.00 0.00 C ATOM 1165 O ILE A 75 -2.545 2.429 -6.615 1.00 0.00 O ATOM 1166 CB ILE A 75 -1.406 1.214 -9.139 1.00 0.00 C ATOM 1167 CG1 ILE A 75 -0.930 -0.108 -9.745 1.00 0.00 C ATOM 1168 CG2 ILE A 75 -1.167 2.363 -10.107 1.00 0.00 C ATOM 1169 CD1 ILE A 75 -1.910 -0.709 -10.728 1.00 0.00 C ATOM 0 H ILE A 75 -1.517 -0.078 -6.672 1.00 0.00 H new ATOM 0 HA ILE A 75 0.339 1.785 -8.007 1.00 0.00 H new ATOM 0 HB ILE A 75 -2.477 1.141 -8.950 1.00 0.00 H new ATOM 0 HG12 ILE A 75 0.023 0.054 -10.248 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -0.749 -0.822 -8.942 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -1.682 2.160 -11.046 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -1.550 3.288 -9.676 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -0.098 2.465 -10.294 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.507 -1.644 -11.118 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.857 -0.904 -10.225 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -2.073 -0.013 -11.551 1.00 0.00 H new ATOM 1181 N VAL A 76 -0.748 3.744 -6.937 1.00 0.00 N ATOM 1182 CA VAL A 76 -1.329 4.893 -6.254 1.00 0.00 C ATOM 1183 C VAL A 76 -1.544 6.055 -7.217 1.00 0.00 C ATOM 1184 O VAL A 76 -0.609 6.512 -7.875 1.00 0.00 O ATOM 1185 CB VAL A 76 -0.437 5.364 -5.090 1.00 0.00 C ATOM 1186 CG1 VAL A 76 -1.040 6.586 -4.415 1.00 0.00 C ATOM 1187 CG2 VAL A 76 -0.230 4.238 -4.088 1.00 0.00 C ATOM 0 H VAL A 76 0.192 3.900 -7.300 1.00 0.00 H new ATOM 0 HA VAL A 76 -2.292 4.571 -5.857 1.00 0.00 H new ATOM 0 HB VAL A 76 0.536 5.645 -5.492 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -0.396 6.904 -3.595 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.130 7.395 -5.140 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.027 6.336 -4.025 1.00 0.00 H new ATOM 0 HG21 VAL A 76 0.403 4.588 -3.272 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -1.195 3.923 -3.690 1.00 0.00 H new ATOM 0 HG23 VAL A 76 0.251 3.394 -4.583 1.00 0.00 H new ATOM 1197 N LYS A 77 -2.782 6.530 -7.296 1.00 0.00 N ATOM 1198 CA LYS A 77 -3.122 7.640 -8.178 1.00 0.00 C ATOM 1199 C LYS A 77 -4.082 8.606 -7.491 1.00 0.00 C ATOM 1200 O LYS A 77 -4.483 8.389 -6.347 1.00 0.00 O ATOM 1201 CB LYS A 77 -3.747 7.117 -9.473 1.00 0.00 C ATOM 1202 CG LYS A 77 -2.900 6.073 -10.179 1.00 0.00 C ATOM 1203 CD LYS A 77 -3.686 5.359 -11.265 1.00 0.00 C ATOM 1204 CE LYS A 77 -4.654 4.344 -10.677 1.00 0.00 C ATOM 1205 NZ LYS A 77 -5.293 3.509 -11.732 1.00 0.00 N ATOM 0 H LYS A 77 -3.568 6.163 -6.759 1.00 0.00 H new ATOM 0 HA LYS A 77 -2.204 8.176 -8.417 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -4.724 6.689 -9.248 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -3.915 7.955 -10.150 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -2.023 6.550 -10.617 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.538 5.345 -9.453 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -4.238 6.090 -11.856 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -2.997 4.856 -11.943 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -4.123 3.700 -9.976 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -5.425 4.865 -10.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -5.945 2.830 -11.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -5.821 4.121 -12.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -4.559 2.992 -12.257 1.00 0.00 H new ATOM 1219 N ASP A 78 -4.447 9.671 -8.196 1.00 0.00 N ATOM 1220 CA ASP A 78 -5.363 10.669 -7.655 1.00 0.00 C ATOM 1221 C ASP A 78 -6.800 10.367 -8.065 1.00 0.00 C ATOM 1222 O ASP A 78 -7.142 10.411 -9.247 1.00 0.00 O ATOM 1223 CB ASP A 78 -4.966 12.068 -8.132 1.00 0.00 C ATOM 1224 CG ASP A 78 -6.119 13.050 -8.065 1.00 0.00 C ATOM 1225 OD1 ASP A 78 -6.874 13.013 -7.070 1.00 0.00 O ATOM 1226 OD2 ASP A 78 -6.266 13.857 -9.006 1.00 0.00 O ATOM 0 H ASP A 78 -4.123 9.866 -9.143 1.00 0.00 H new ATOM 0 HA ASP A 78 -5.300 10.633 -6.567 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -4.142 12.437 -7.521 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -4.601 12.009 -9.157 1.00 0.00 H new ATOM 1231 N PHE A 79 -7.639 10.059 -7.081 1.00 0.00 N ATOM 1232 CA PHE A 79 -9.040 9.747 -7.339 1.00 0.00 C ATOM 1233 C PHE A 79 -9.670 10.794 -8.253 1.00 0.00 C ATOM 1234 O PHE A 79 -10.213 10.466 -9.307 1.00 0.00 O ATOM 1235 CB PHE A 79 -9.817 9.666 -6.024 1.00 0.00 C ATOM 1236 CG PHE A 79 -11.180 9.052 -6.170 1.00 0.00 C ATOM 1237 CD1 PHE A 79 -11.325 7.681 -6.315 1.00 0.00 C ATOM 1238 CD2 PHE A 79 -12.316 9.845 -6.163 1.00 0.00 C ATOM 1239 CE1 PHE A 79 -12.578 7.114 -6.450 1.00 0.00 C ATOM 1240 CE2 PHE A 79 -13.572 9.283 -6.298 1.00 0.00 C ATOM 1241 CZ PHE A 79 -13.703 7.916 -6.441 1.00 0.00 C ATOM 0 H PHE A 79 -7.373 10.019 -6.097 1.00 0.00 H new ATOM 0 HA PHE A 79 -9.086 8.779 -7.839 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -9.240 9.084 -5.306 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -9.922 10.669 -5.611 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -10.449 7.049 -6.323 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -12.219 10.915 -6.051 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -12.678 6.045 -6.562 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -14.450 9.913 -6.292 1.00 0.00 H new ATOM 0 HZ PHE A 79 -14.683 7.474 -6.546 1.00 0.00 H new ATOM 1378 N ILE A 88 0.446 8.965 -9.771 1.00 0.00 N ATOM 1379 CA ILE A 88 1.309 9.400 -8.679 1.00 0.00 C ATOM 1380 C ILE A 88 2.525 8.489 -8.544 1.00 0.00 C ATOM 1381 O ILE A 88 3.657 8.959 -8.436 1.00 0.00 O ATOM 1382 CB ILE A 88 0.551 9.428 -7.339 1.00 0.00 C ATOM 1383 CG1 ILE A 88 -0.638 10.387 -7.421 1.00 0.00 C ATOM 1384 CG2 ILE A 88 1.487 9.832 -6.210 1.00 0.00 C ATOM 1385 CD1 ILE A 88 -1.504 10.383 -6.181 1.00 0.00 C ATOM 0 HA ILE A 88 1.639 10.410 -8.921 1.00 0.00 H new ATOM 0 HB ILE A 88 0.173 8.427 -7.131 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -0.268 11.398 -7.593 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -1.250 10.121 -8.283 1.00 0.00 H new ATOM 0 HG21 ILE A 88 0.937 9.847 -5.269 1.00 0.00 H new ATOM 0 HG22 ILE A 88 2.304 9.114 -6.141 1.00 0.00 H new ATOM 0 HG23 ILE A 88 1.891 10.824 -6.410 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -2.327 11.086 -6.310 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -1.904 9.382 -6.020 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -0.906 10.678 -5.319 1.00 0.00 H new ATOM 1397 N GLY A 89 2.283 7.182 -8.552 1.00 0.00 N ATOM 1398 CA GLY A 89 3.367 6.225 -8.431 1.00 0.00 C ATOM 1399 C GLY A 89 2.871 4.799 -8.305 1.00 0.00 C ATOM 1400 O GLY A 89 1.685 4.563 -8.072 1.00 0.00 O ATOM 0 H GLY A 89 1.355 6.769 -8.640 1.00 0.00 H new ATOM 0 HA2 GLY A 89 4.017 6.305 -9.303 1.00 0.00 H new ATOM 0 HA3 GLY A 89 3.972 6.474 -7.559 1.00 0.00 H new ATOM 1404 N THR A 90 3.780 3.841 -8.461 1.00 0.00 N ATOM 1405 CA THR A 90 3.428 2.430 -8.367 1.00 0.00 C ATOM 1406 C THR A 90 4.545 1.628 -7.709 1.00 0.00 C ATOM 1407 O THR A 90 5.605 2.166 -7.391 1.00 0.00 O ATOM 1408 CB THR A 90 3.130 1.832 -9.754 1.00 0.00 C ATOM 1409 OG1 THR A 90 4.338 1.737 -10.517 1.00 0.00 O ATOM 1410 CG2 THR A 90 2.116 2.683 -10.504 1.00 0.00 C ATOM 0 H THR A 90 4.766 4.017 -8.653 1.00 0.00 H new ATOM 0 HA THR A 90 2.530 2.368 -7.753 1.00 0.00 H new ATOM 0 HB THR A 90 2.711 0.836 -9.613 1.00 0.00 H new ATOM 0 HG1 THR A 90 4.781 2.611 -10.538 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.921 2.241 -11.481 1.00 0.00 H new ATOM 0 HG22 THR A 90 1.187 2.729 -9.935 1.00 0.00 H new ATOM 0 HG23 THR A 90 2.512 3.690 -10.634 1.00 0.00 H new ATOM 1418 N ALA A 91 4.301 0.337 -7.509 1.00 0.00 N ATOM 1419 CA ALA A 91 5.288 -0.540 -6.892 1.00 0.00 C ATOM 1420 C ALA A 91 4.816 -1.990 -6.901 1.00 0.00 C ATOM 1421 O ALA A 91 3.657 -2.279 -6.600 1.00 0.00 O ATOM 1422 CB ALA A 91 5.581 -0.088 -5.469 1.00 0.00 C ATOM 0 H ALA A 91 3.428 -0.124 -7.765 1.00 0.00 H new ATOM 0 HA ALA A 91 6.206 -0.480 -7.477 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.320 -0.752 -5.021 1.00 0.00 H new ATOM 0 HB2 ALA A 91 5.970 0.930 -5.483 1.00 0.00 H new ATOM 0 HB3 ALA A 91 4.663 -0.117 -4.882 1.00 0.00 H new ATOM 1428 N THR A 92 5.720 -2.900 -7.249 1.00 0.00 N ATOM 1429 CA THR A 92 5.396 -4.320 -7.299 1.00 0.00 C ATOM 1430 C THR A 92 6.121 -5.090 -6.201 1.00 0.00 C ATOM 1431 O THR A 92 7.345 -5.023 -6.088 1.00 0.00 O ATOM 1432 CB THR A 92 5.760 -4.932 -8.665 1.00 0.00 C ATOM 1433 OG1 THR A 92 5.060 -4.248 -9.711 1.00 0.00 O ATOM 1434 CG2 THR A 92 5.417 -6.413 -8.704 1.00 0.00 C ATOM 0 H THR A 92 6.683 -2.678 -7.501 1.00 0.00 H new ATOM 0 HA THR A 92 4.320 -4.403 -7.147 1.00 0.00 H new ATOM 0 HB THR A 92 6.834 -4.820 -8.813 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.298 -4.642 -10.576 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.683 -6.823 -9.678 1.00 0.00 H new ATOM 0 HG22 THR A 92 5.974 -6.936 -7.926 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.348 -6.543 -8.535 1.00 0.00 H new ATOM 1442 N VAL A 93 5.359 -5.821 -5.395 1.00 0.00 N ATOM 1443 CA VAL A 93 5.930 -6.605 -4.306 1.00 0.00 C ATOM 1444 C VAL A 93 6.033 -8.078 -4.685 1.00 0.00 C ATOM 1445 O VAL A 93 5.026 -8.780 -4.768 1.00 0.00 O ATOM 1446 CB VAL A 93 5.092 -6.474 -3.021 1.00 0.00 C ATOM 1447 CG1 VAL A 93 5.811 -7.120 -1.846 1.00 0.00 C ATOM 1448 CG2 VAL A 93 4.785 -5.013 -2.731 1.00 0.00 C ATOM 0 H VAL A 93 4.344 -5.887 -5.475 1.00 0.00 H new ATOM 0 HA VAL A 93 6.929 -6.210 -4.121 1.00 0.00 H new ATOM 0 HB VAL A 93 4.147 -6.997 -3.170 1.00 0.00 H new ATOM 0 HG11 VAL A 93 5.204 -7.017 -0.947 1.00 0.00 H new ATOM 0 HG12 VAL A 93 5.973 -8.177 -2.056 1.00 0.00 H new ATOM 0 HG13 VAL A 93 6.772 -6.629 -1.693 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.192 -4.940 -1.819 1.00 0.00 H new ATOM 0 HG22 VAL A 93 5.718 -4.464 -2.602 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.225 -4.587 -3.563 1.00 0.00 H new ATOM 1458 N ALA A 94 7.258 -8.540 -4.914 1.00 0.00 N ATOM 1459 CA ALA A 94 7.494 -9.931 -5.282 1.00 0.00 C ATOM 1460 C ALA A 94 7.261 -10.859 -4.095 1.00 0.00 C ATOM 1461 O ALA A 94 8.047 -10.880 -3.146 1.00 0.00 O ATOM 1462 CB ALA A 94 8.906 -10.102 -5.820 1.00 0.00 C ATOM 0 H ALA A 94 8.102 -7.971 -4.851 1.00 0.00 H new ATOM 0 HA ALA A 94 6.785 -10.200 -6.065 1.00 0.00 H new ATOM 0 HB1 ALA A 94 9.068 -11.145 -6.091 1.00 0.00 H new ATOM 0 HB2 ALA A 94 9.038 -9.474 -6.701 1.00 0.00 H new ATOM 0 HB3 ALA A 94 9.625 -9.810 -5.055 1.00 0.00 H new ATOM 1468 N LEU A 95 6.178 -11.626 -4.153 1.00 0.00 N ATOM 1469 CA LEU A 95 5.842 -12.558 -3.081 1.00 0.00 C ATOM 1470 C LEU A 95 6.742 -13.789 -3.128 1.00 0.00 C ATOM 1471 O LEU A 95 6.630 -14.684 -2.290 1.00 0.00 O ATOM 1472 CB LEU A 95 4.375 -12.979 -3.187 1.00 0.00 C ATOM 1473 CG LEU A 95 3.353 -11.844 -3.237 1.00 0.00 C ATOM 1474 CD1 LEU A 95 1.962 -12.390 -3.520 1.00 0.00 C ATOM 1475 CD2 LEU A 95 3.364 -11.058 -1.934 1.00 0.00 C ATOM 0 H LEU A 95 5.517 -11.621 -4.930 1.00 0.00 H new ATOM 0 HA LEU A 95 6.000 -12.052 -2.129 1.00 0.00 H new ATOM 0 HB2 LEU A 95 4.256 -13.588 -4.084 1.00 0.00 H new ATOM 0 HB3 LEU A 95 4.138 -13.617 -2.335 1.00 0.00 H new ATOM 0 HG LEU A 95 3.628 -11.169 -4.048 1.00 0.00 H new ATOM 0 HD11 LEU A 95 1.248 -11.567 -3.552 1.00 0.00 H new ATOM 0 HD12 LEU A 95 1.962 -12.908 -4.479 1.00 0.00 H new ATOM 0 HD13 LEU A 95 1.677 -13.087 -2.732 1.00 0.00 H new ATOM 0 HD21 LEU A 95 2.630 -10.254 -1.988 1.00 0.00 H new ATOM 0 HD22 LEU A 95 3.115 -11.722 -1.106 1.00 0.00 H new ATOM 0 HD23 LEU A 95 4.355 -10.634 -1.773 1.00 0.00 H new ATOM 1487 N LYS A 96 7.635 -13.826 -4.111 1.00 0.00 N ATOM 1488 CA LYS A 96 8.557 -14.945 -4.266 1.00 0.00 C ATOM 1489 C LYS A 96 9.310 -15.213 -2.966 1.00 0.00 C ATOM 1490 O LYS A 96 9.805 -16.317 -2.741 1.00 0.00 O ATOM 1491 CB LYS A 96 9.551 -14.661 -5.394 1.00 0.00 C ATOM 1492 CG LYS A 96 10.531 -13.546 -5.075 1.00 0.00 C ATOM 1493 CD LYS A 96 11.802 -13.668 -5.900 1.00 0.00 C ATOM 1494 CE LYS A 96 12.953 -12.902 -5.266 1.00 0.00 C ATOM 1495 NZ LYS A 96 13.508 -13.614 -4.082 1.00 0.00 N ATOM 0 H LYS A 96 7.740 -13.093 -4.813 1.00 0.00 H new ATOM 0 HA LYS A 96 7.975 -15.831 -4.518 1.00 0.00 H new ATOM 0 HB2 LYS A 96 10.109 -15.572 -5.613 1.00 0.00 H new ATOM 0 HB3 LYS A 96 8.998 -14.400 -6.297 1.00 0.00 H new ATOM 0 HG2 LYS A 96 10.062 -12.581 -5.268 1.00 0.00 H new ATOM 0 HG3 LYS A 96 10.781 -13.572 -4.014 1.00 0.00 H new ATOM 0 HD2 LYS A 96 12.074 -14.719 -5.999 1.00 0.00 H new ATOM 0 HD3 LYS A 96 11.622 -13.289 -6.906 1.00 0.00 H new ATOM 0 HE2 LYS A 96 13.742 -12.755 -6.004 1.00 0.00 H new ATOM 0 HE3 LYS A 96 12.609 -11.912 -4.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 14.507 -13.352 -3.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.970 -13.347 -3.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 13.435 -14.641 -4.229 1.00 0.00 H new ATOM 1509 N ASP A 97 9.391 -14.196 -2.115 1.00 0.00 N ATOM 1510 CA ASP A 97 10.082 -14.323 -0.837 1.00 0.00 C ATOM 1511 C ASP A 97 9.158 -14.912 0.224 1.00 0.00 C ATOM 1512 O ASP A 97 9.600 -15.641 1.113 1.00 0.00 O ATOM 1513 CB ASP A 97 10.604 -12.961 -0.377 1.00 0.00 C ATOM 1514 CG ASP A 97 11.891 -12.569 -1.075 1.00 0.00 C ATOM 1515 OD1 ASP A 97 12.659 -13.476 -1.457 1.00 0.00 O ATOM 1516 OD2 ASP A 97 12.132 -11.354 -1.238 1.00 0.00 O ATOM 0 H ASP A 97 8.987 -13.275 -2.287 1.00 0.00 H new ATOM 0 HA ASP A 97 10.926 -14.999 -0.974 1.00 0.00 H new ATOM 0 HB2 ASP A 97 9.845 -12.202 -0.566 1.00 0.00 H new ATOM 0 HB3 ASP A 97 10.770 -12.984 0.700 1.00 0.00 H new ATOM 1521 N LEU A 98 7.872 -14.591 0.126 1.00 0.00 N ATOM 1522 CA LEU A 98 6.885 -15.087 1.078 1.00 0.00 C ATOM 1523 C LEU A 98 6.532 -16.542 0.787 1.00 0.00 C ATOM 1524 O LEU A 98 6.032 -17.257 1.657 1.00 0.00 O ATOM 1525 CB LEU A 98 5.622 -14.225 1.029 1.00 0.00 C ATOM 1526 CG LEU A 98 5.810 -12.741 1.348 1.00 0.00 C ATOM 1527 CD1 LEU A 98 4.670 -11.921 0.764 1.00 0.00 C ATOM 1528 CD2 LEU A 98 5.909 -12.527 2.851 1.00 0.00 C ATOM 0 H LEU A 98 7.489 -13.989 -0.603 1.00 0.00 H new ATOM 0 HA LEU A 98 7.318 -15.030 2.076 1.00 0.00 H new ATOM 0 HB2 LEU A 98 5.187 -14.310 0.033 1.00 0.00 H new ATOM 0 HB3 LEU A 98 4.897 -14.638 1.730 1.00 0.00 H new ATOM 0 HG LEU A 98 6.742 -12.406 0.892 1.00 0.00 H new ATOM 0 HD11 LEU A 98 4.821 -10.868 1.001 1.00 0.00 H new ATOM 0 HD12 LEU A 98 4.646 -12.050 -0.318 1.00 0.00 H new ATOM 0 HD13 LEU A 98 3.725 -12.257 1.190 1.00 0.00 H new ATOM 0 HD21 LEU A 98 6.043 -11.465 3.059 1.00 0.00 H new ATOM 0 HD22 LEU A 98 4.995 -12.879 3.330 1.00 0.00 H new ATOM 0 HD23 LEU A 98 6.761 -13.083 3.242 1.00 0.00 H new ATOM 1540 N THR A 99 6.797 -16.976 -0.441 1.00 0.00 N ATOM 1541 CA THR A 99 6.508 -18.346 -0.846 1.00 0.00 C ATOM 1542 C THR A 99 7.056 -19.346 0.166 1.00 0.00 C ATOM 1543 O THR A 99 7.954 -19.028 0.944 1.00 0.00 O ATOM 1544 CB THR A 99 7.103 -18.659 -2.232 1.00 0.00 C ATOM 1545 OG1 THR A 99 8.503 -18.362 -2.243 1.00 0.00 O ATOM 1546 CG2 THR A 99 6.400 -17.855 -3.316 1.00 0.00 C ATOM 0 H THR A 99 7.211 -16.398 -1.173 1.00 0.00 H new ATOM 0 HA THR A 99 5.423 -18.439 -0.894 1.00 0.00 H new ATOM 0 HB THR A 99 6.956 -19.720 -2.435 1.00 0.00 H new ATOM 0 HG1 THR A 99 8.663 -17.561 -2.785 1.00 0.00 H new ATOM 0 HG21 THR A 99 6.837 -18.092 -4.286 1.00 0.00 H new ATOM 0 HG22 THR A 99 5.339 -18.106 -3.325 1.00 0.00 H new ATOM 0 HG23 THR A 99 6.520 -16.790 -3.115 1.00 0.00 H new ATOM 1554 N GLY A 100 6.508 -20.558 0.150 1.00 0.00 N ATOM 1555 CA GLY A 100 6.955 -21.586 1.072 1.00 0.00 C ATOM 1556 C GLY A 100 5.825 -22.490 1.524 1.00 0.00 C ATOM 1557 O GLY A 100 4.735 -22.465 0.954 1.00 0.00 O ATOM 0 H GLY A 100 5.763 -20.846 -0.485 1.00 0.00 H new ATOM 0 HA2 GLY A 100 7.728 -22.187 0.594 1.00 0.00 H new ATOM 0 HA3 GLY A 100 7.410 -21.115 1.943 1.00 0.00 H new ATOM 1561 N ASP A 101 6.087 -23.292 2.551 1.00 0.00 N ATOM 1562 CA ASP A 101 5.083 -24.209 3.079 1.00 0.00 C ATOM 1563 C ASP A 101 4.669 -23.806 4.491 1.00 0.00 C ATOM 1564 O ASP A 101 4.009 -24.569 5.195 1.00 0.00 O ATOM 1565 CB ASP A 101 5.621 -25.641 3.080 1.00 0.00 C ATOM 1566 CG ASP A 101 5.594 -26.271 1.702 1.00 0.00 C ATOM 1567 OD1 ASP A 101 4.496 -26.652 1.245 1.00 0.00 O ATOM 1568 OD2 ASP A 101 6.671 -26.383 1.079 1.00 0.00 O ATOM 0 H ASP A 101 6.985 -23.326 3.034 1.00 0.00 H new ATOM 0 HA ASP A 101 4.205 -24.160 2.435 1.00 0.00 H new ATOM 0 HB2 ASP A 101 6.644 -25.641 3.456 1.00 0.00 H new ATOM 0 HB3 ASP A 101 5.029 -26.248 3.765 1.00 0.00 H new ATOM 1573 N GLN A 102 5.063 -22.604 4.898 1.00 0.00 N ATOM 1574 CA GLN A 102 4.734 -22.101 6.226 1.00 0.00 C ATOM 1575 C GLN A 102 4.442 -20.605 6.186 1.00 0.00 C ATOM 1576 O GLN A 102 5.259 -19.816 5.713 1.00 0.00 O ATOM 1577 CB GLN A 102 5.881 -22.383 7.199 1.00 0.00 C ATOM 1578 CG GLN A 102 6.060 -23.858 7.518 1.00 0.00 C ATOM 1579 CD GLN A 102 7.495 -24.212 7.855 1.00 0.00 C ATOM 1580 OE1 GLN A 102 8.430 -23.529 7.435 1.00 0.00 O ATOM 1581 NE2 GLN A 102 7.678 -25.284 8.617 1.00 0.00 N ATOM 0 H GLN A 102 5.611 -21.960 4.327 1.00 0.00 H new ATOM 0 HA GLN A 102 3.838 -22.617 6.571 1.00 0.00 H new ATOM 0 HB2 GLN A 102 6.808 -21.996 6.776 1.00 0.00 H new ATOM 0 HB3 GLN A 102 5.702 -21.839 8.126 1.00 0.00 H new ATOM 0 HG2 GLN A 102 5.417 -24.125 8.357 1.00 0.00 H new ATOM 0 HG3 GLN A 102 5.734 -24.453 6.665 1.00 0.00 H new ATOM 0 HE21 GLN A 102 6.875 -25.821 8.943 1.00 0.00 H new ATOM 0 HE22 GLN A 102 8.622 -25.570 8.876 1.00 0.00 H new ATOM 1590 N SER A 103 3.270 -20.223 6.684 1.00 0.00 N ATOM 1591 CA SER A 103 2.868 -18.821 6.701 1.00 0.00 C ATOM 1592 C SER A 103 4.072 -17.913 6.926 1.00 0.00 C ATOM 1593 O SER A 103 4.943 -18.209 7.744 1.00 0.00 O ATOM 1594 CB SER A 103 1.823 -18.582 7.793 1.00 0.00 C ATOM 1595 OG SER A 103 1.518 -17.203 7.913 1.00 0.00 O ATOM 0 H SER A 103 2.583 -20.864 7.081 1.00 0.00 H new ATOM 0 HA SER A 103 2.432 -18.582 5.731 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.916 -19.140 7.561 1.00 0.00 H new ATOM 0 HB3 SER A 103 2.195 -18.960 8.745 1.00 0.00 H new ATOM 0 HG SER A 103 1.338 -16.829 7.025 1.00 0.00 H new ATOM 1601 N ARG A 104 4.115 -16.804 6.193 1.00 0.00 N ATOM 1602 CA ARG A 104 5.213 -15.852 6.311 1.00 0.00 C ATOM 1603 C ARG A 104 4.740 -14.436 5.998 1.00 0.00 C ATOM 1604 O ARG A 104 4.306 -14.147 4.883 1.00 0.00 O ATOM 1605 CB ARG A 104 6.355 -16.239 5.370 1.00 0.00 C ATOM 1606 CG ARG A 104 7.711 -15.710 5.808 1.00 0.00 C ATOM 1607 CD ARG A 104 8.704 -15.702 4.656 1.00 0.00 C ATOM 1608 NE ARG A 104 9.960 -15.052 5.021 1.00 0.00 N ATOM 1609 CZ ARG A 104 10.917 -15.645 5.726 1.00 0.00 C ATOM 1610 NH1 ARG A 104 10.762 -16.896 6.139 1.00 0.00 N ATOM 1611 NH2 ARG A 104 12.032 -14.988 6.018 1.00 0.00 N ATOM 0 H ARG A 104 3.402 -16.543 5.512 1.00 0.00 H new ATOM 0 HA ARG A 104 5.574 -15.877 7.339 1.00 0.00 H new ATOM 0 HB2 ARG A 104 6.404 -17.326 5.299 1.00 0.00 H new ATOM 0 HB3 ARG A 104 6.134 -15.864 4.371 1.00 0.00 H new ATOM 0 HG2 ARG A 104 7.599 -14.699 6.200 1.00 0.00 H new ATOM 0 HG3 ARG A 104 8.098 -16.326 6.620 1.00 0.00 H new ATOM 0 HD2 ARG A 104 8.904 -16.727 4.342 1.00 0.00 H new ATOM 0 HD3 ARG A 104 8.264 -15.187 3.802 1.00 0.00 H new ATOM 0 HE ARG A 104 10.111 -14.090 4.718 1.00 0.00 H new ATOM 0 HH11 ARG A 104 9.907 -17.405 5.915 1.00 0.00 H new ATOM 0 HH12 ARG A 104 11.498 -17.349 6.680 1.00 0.00 H new ATOM 0 HH21 ARG A 104 12.155 -14.026 5.701 1.00 0.00 H new ATOM 0 HH22 ARG A 104 12.766 -15.445 6.559 1.00 0.00 H new ATOM 1625 N SER A 105 4.826 -13.556 6.991 1.00 0.00 N ATOM 1626 CA SER A 105 4.403 -12.170 6.823 1.00 0.00 C ATOM 1627 C SER A 105 5.581 -11.217 7.000 1.00 0.00 C ATOM 1628 O SER A 105 6.051 -10.992 8.116 1.00 0.00 O ATOM 1629 CB SER A 105 3.300 -11.827 7.826 1.00 0.00 C ATOM 1630 OG SER A 105 3.691 -12.157 9.147 1.00 0.00 O ATOM 0 H SER A 105 5.185 -13.778 7.920 1.00 0.00 H new ATOM 0 HA SER A 105 4.014 -12.055 5.811 1.00 0.00 H new ATOM 0 HB2 SER A 105 3.068 -10.764 7.767 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.389 -12.366 7.568 1.00 0.00 H new ATOM 0 HG SER A 105 4.628 -11.905 9.283 1.00 0.00 H new ATOM 1636 N LEU A 106 6.054 -10.660 5.891 1.00 0.00 N ATOM 1637 CA LEU A 106 7.178 -9.730 5.921 1.00 0.00 C ATOM 1638 C LEU A 106 6.703 -8.294 5.725 1.00 0.00 C ATOM 1639 O LEU A 106 6.045 -7.962 4.738 1.00 0.00 O ATOM 1640 CB LEU A 106 8.197 -10.095 4.840 1.00 0.00 C ATOM 1641 CG LEU A 106 8.998 -11.375 5.077 1.00 0.00 C ATOM 1642 CD1 LEU A 106 9.544 -11.915 3.764 1.00 0.00 C ATOM 1643 CD2 LEU A 106 10.130 -11.121 6.062 1.00 0.00 C ATOM 0 H LEU A 106 5.677 -10.836 4.960 1.00 0.00 H new ATOM 0 HA LEU A 106 7.653 -9.805 6.899 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.671 -10.190 3.890 1.00 0.00 H new ATOM 0 HB3 LEU A 106 8.897 -9.266 4.735 1.00 0.00 H new ATOM 0 HG LEU A 106 8.331 -12.123 5.505 1.00 0.00 H new ATOM 0 HD11 LEU A 106 10.111 -12.826 3.953 1.00 0.00 H new ATOM 0 HD12 LEU A 106 8.717 -12.136 3.089 1.00 0.00 H new ATOM 0 HD13 LEU A 106 10.196 -11.170 3.307 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.690 -12.043 6.219 1.00 0.00 H new ATOM 0 HD22 LEU A 106 10.796 -10.356 5.662 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.717 -10.782 7.012 1.00 0.00 H new ATOM 1655 N PRO A 107 7.044 -7.421 6.684 1.00 0.00 N ATOM 1656 CA PRO A 107 6.665 -6.006 6.637 1.00 0.00 C ATOM 1657 C PRO A 107 7.404 -5.243 5.543 1.00 0.00 C ATOM 1658 O PRO A 107 8.607 -5.003 5.645 1.00 0.00 O ATOM 1659 CB PRO A 107 7.068 -5.485 8.019 1.00 0.00 C ATOM 1660 CG PRO A 107 8.156 -6.399 8.466 1.00 0.00 C ATOM 1661 CD PRO A 107 7.827 -7.748 7.887 1.00 0.00 C ATOM 0 HA PRO A 107 5.607 -5.875 6.409 1.00 0.00 H new ATOM 0 HB2 PRO A 107 7.414 -4.453 7.967 1.00 0.00 H new ATOM 0 HB3 PRO A 107 6.226 -5.504 8.710 1.00 0.00 H new ATOM 0 HG2 PRO A 107 9.127 -6.050 8.116 1.00 0.00 H new ATOM 0 HG3 PRO A 107 8.207 -6.443 9.554 1.00 0.00 H new ATOM 0 HD2 PRO A 107 8.728 -8.310 7.640 1.00 0.00 H new ATOM 0 HD3 PRO A 107 7.254 -8.357 8.586 1.00 0.00 H new ATOM 1669 N TYR A 108 6.677 -4.864 4.498 1.00 0.00 N ATOM 1670 CA TYR A 108 7.265 -4.130 3.384 1.00 0.00 C ATOM 1671 C TYR A 108 7.060 -2.627 3.553 1.00 0.00 C ATOM 1672 O TYR A 108 5.982 -2.100 3.278 1.00 0.00 O ATOM 1673 CB TYR A 108 6.653 -4.593 2.061 1.00 0.00 C ATOM 1674 CG TYR A 108 7.086 -5.982 1.647 1.00 0.00 C ATOM 1675 CD1 TYR A 108 8.286 -6.185 0.977 1.00 0.00 C ATOM 1676 CD2 TYR A 108 6.295 -7.089 1.926 1.00 0.00 C ATOM 1677 CE1 TYR A 108 8.685 -7.452 0.596 1.00 0.00 C ATOM 1678 CE2 TYR A 108 6.687 -8.360 1.551 1.00 0.00 C ATOM 1679 CZ TYR A 108 7.883 -8.536 0.886 1.00 0.00 C ATOM 1680 OH TYR A 108 8.276 -9.800 0.509 1.00 0.00 O ATOM 0 H TYR A 108 5.680 -5.053 4.399 1.00 0.00 H new ATOM 0 HA TYR A 108 8.336 -4.334 3.373 1.00 0.00 H new ATOM 0 HB2 TYR A 108 5.566 -4.570 2.145 1.00 0.00 H new ATOM 0 HB3 TYR A 108 6.927 -3.887 1.277 1.00 0.00 H new ATOM 0 HD1 TYR A 108 8.917 -5.339 0.750 1.00 0.00 H new ATOM 0 HD2 TYR A 108 5.357 -6.954 2.445 1.00 0.00 H new ATOM 0 HE1 TYR A 108 9.620 -7.593 0.074 1.00 0.00 H new ATOM 0 HE2 TYR A 108 6.061 -9.210 1.777 1.00 0.00 H new ATOM 0 HH TYR A 108 7.737 -10.466 0.985 1.00 0.00 H new ATOM 1690 N LYS A 109 8.104 -1.942 4.008 1.00 0.00 N ATOM 1691 CA LYS A 109 8.043 -0.500 4.213 1.00 0.00 C ATOM 1692 C LYS A 109 9.163 0.205 3.455 1.00 0.00 C ATOM 1693 O LYS A 109 10.101 -0.433 2.977 1.00 0.00 O ATOM 1694 CB LYS A 109 8.138 -0.172 5.705 1.00 0.00 C ATOM 1695 CG LYS A 109 7.393 -1.154 6.592 1.00 0.00 C ATOM 1696 CD LYS A 109 6.906 -0.493 7.871 1.00 0.00 C ATOM 1697 CE LYS A 109 6.393 -1.519 8.869 1.00 0.00 C ATOM 1698 NZ LYS A 109 6.525 -1.042 10.273 1.00 0.00 N ATOM 0 H LYS A 109 9.003 -2.363 4.242 1.00 0.00 H new ATOM 0 HA LYS A 109 7.087 -0.144 3.829 1.00 0.00 H new ATOM 0 HB2 LYS A 109 9.188 -0.154 5.998 1.00 0.00 H new ATOM 0 HB3 LYS A 109 7.743 0.830 5.874 1.00 0.00 H new ATOM 0 HG2 LYS A 109 6.543 -1.565 6.047 1.00 0.00 H new ATOM 0 HG3 LYS A 109 8.047 -1.990 6.840 1.00 0.00 H new ATOM 0 HD2 LYS A 109 7.720 0.077 8.320 1.00 0.00 H new ATOM 0 HD3 LYS A 109 6.112 0.216 7.636 1.00 0.00 H new ATOM 0 HE2 LYS A 109 5.347 -1.740 8.657 1.00 0.00 H new ATOM 0 HE3 LYS A 109 6.946 -2.451 8.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 6.164 -1.770 10.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 7.526 -0.856 10.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 5.977 -0.167 10.395 1.00 0.00 H new ATOM 1712 N LEU A 110 9.058 1.525 3.348 1.00 0.00 N ATOM 1713 CA LEU A 110 10.063 2.318 2.649 1.00 0.00 C ATOM 1714 C LEU A 110 10.092 1.973 1.163 1.00 0.00 C ATOM 1715 O LEU A 110 11.139 2.046 0.520 1.00 0.00 O ATOM 1716 CB LEU A 110 11.444 2.086 3.265 1.00 0.00 C ATOM 1717 CG LEU A 110 11.557 2.328 4.770 1.00 0.00 C ATOM 1718 CD1 LEU A 110 12.717 1.536 5.353 1.00 0.00 C ATOM 1719 CD2 LEU A 110 11.723 3.813 5.061 1.00 0.00 C ATOM 0 H LEU A 110 8.287 2.069 3.736 1.00 0.00 H new ATOM 0 HA LEU A 110 9.797 3.370 2.754 1.00 0.00 H new ATOM 0 HB2 LEU A 110 11.744 1.058 3.059 1.00 0.00 H new ATOM 0 HB3 LEU A 110 12.159 2.734 2.758 1.00 0.00 H new ATOM 0 HG LEU A 110 10.636 1.986 5.243 1.00 0.00 H new ATOM 0 HD11 LEU A 110 12.782 1.721 6.425 1.00 0.00 H new ATOM 0 HD12 LEU A 110 12.556 0.472 5.177 1.00 0.00 H new ATOM 0 HD13 LEU A 110 13.646 1.846 4.875 1.00 0.00 H new ATOM 0 HD21 LEU A 110 11.802 3.966 6.137 1.00 0.00 H new ATOM 0 HD22 LEU A 110 12.627 4.180 4.575 1.00 0.00 H new ATOM 0 HD23 LEU A 110 10.859 4.357 4.679 1.00 0.00 H new ATOM 1731 N ILE A 111 8.936 1.601 0.625 1.00 0.00 N ATOM 1732 CA ILE A 111 8.828 1.248 -0.785 1.00 0.00 C ATOM 1733 C ILE A 111 8.827 2.494 -1.664 1.00 0.00 C ATOM 1734 O ILE A 111 7.998 3.388 -1.491 1.00 0.00 O ATOM 1735 CB ILE A 111 7.552 0.434 -1.066 1.00 0.00 C ATOM 1736 CG1 ILE A 111 7.540 -0.844 -0.224 1.00 0.00 C ATOM 1737 CG2 ILE A 111 7.452 0.100 -2.547 1.00 0.00 C ATOM 1738 CD1 ILE A 111 6.229 -1.596 -0.285 1.00 0.00 C ATOM 0 H ILE A 111 8.060 1.536 1.144 1.00 0.00 H new ATOM 0 HA ILE A 111 9.698 0.637 -1.025 1.00 0.00 H new ATOM 0 HB ILE A 111 6.687 1.036 -0.790 1.00 0.00 H new ATOM 0 HG12 ILE A 111 8.342 -1.500 -0.563 1.00 0.00 H new ATOM 0 HG13 ILE A 111 7.755 -0.588 0.814 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.545 -0.476 -2.730 1.00 0.00 H new ATOM 0 HG22 ILE A 111 7.419 1.023 -3.127 1.00 0.00 H new ATOM 0 HG23 ILE A 111 8.320 -0.486 -2.847 1.00 0.00 H new ATOM 0 HD11 ILE A 111 6.293 -2.490 0.335 1.00 0.00 H new ATOM 0 HD12 ILE A 111 5.426 -0.957 0.082 1.00 0.00 H new ATOM 0 HD13 ILE A 111 6.022 -1.883 -1.316 1.00 0.00 H new ATOM 1750 N SER A 112 9.759 2.545 -2.610 1.00 0.00 N ATOM 1751 CA SER A 112 9.867 3.682 -3.517 1.00 0.00 C ATOM 1752 C SER A 112 8.865 3.562 -4.661 1.00 0.00 C ATOM 1753 O SER A 112 8.894 2.600 -5.429 1.00 0.00 O ATOM 1754 CB SER A 112 11.287 3.783 -4.076 1.00 0.00 C ATOM 1755 OG SER A 112 12.112 4.571 -3.235 1.00 0.00 O ATOM 0 H SER A 112 10.450 1.812 -2.769 1.00 0.00 H new ATOM 0 HA SER A 112 9.641 4.587 -2.953 1.00 0.00 H new ATOM 0 HB2 SER A 112 11.713 2.785 -4.177 1.00 0.00 H new ATOM 0 HB3 SER A 112 11.258 4.219 -5.074 1.00 0.00 H new ATOM 0 HG SER A 112 13.015 4.618 -3.614 1.00 0.00 H new ATOM 1761 N LEU A 113 7.978 4.546 -4.768 1.00 0.00 N ATOM 1762 CA LEU A 113 6.966 4.552 -5.818 1.00 0.00 C ATOM 1763 C LEU A 113 7.508 5.188 -7.094 1.00 0.00 C ATOM 1764 O LEU A 113 8.158 6.234 -7.051 1.00 0.00 O ATOM 1765 CB LEU A 113 5.720 5.306 -5.348 1.00 0.00 C ATOM 1766 CG LEU A 113 4.962 4.684 -4.175 1.00 0.00 C ATOM 1767 CD1 LEU A 113 3.936 5.662 -3.625 1.00 0.00 C ATOM 1768 CD2 LEU A 113 4.290 3.387 -4.602 1.00 0.00 C ATOM 0 H LEU A 113 7.940 5.349 -4.141 1.00 0.00 H new ATOM 0 HA LEU A 113 6.698 3.518 -6.036 1.00 0.00 H new ATOM 0 HB2 LEU A 113 6.016 6.317 -5.068 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.035 5.396 -6.191 1.00 0.00 H new ATOM 0 HG LEU A 113 5.677 4.456 -3.385 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.406 5.202 -2.791 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.441 6.564 -3.281 1.00 0.00 H new ATOM 0 HD13 LEU A 113 3.224 5.921 -4.409 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.755 2.958 -3.755 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.587 3.590 -5.410 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.046 2.682 -4.948 1.00 0.00 H new ATOM 1780 N LEU A 114 7.235 4.553 -8.228 1.00 0.00 N ATOM 1781 CA LEU A 114 7.694 5.058 -9.518 1.00 0.00 C ATOM 1782 C LEU A 114 6.513 5.425 -10.410 1.00 0.00 C ATOM 1783 O LEU A 114 5.497 4.732 -10.429 1.00 0.00 O ATOM 1784 CB LEU A 114 8.568 4.014 -10.214 1.00 0.00 C ATOM 1785 CG LEU A 114 9.362 3.082 -9.297 1.00 0.00 C ATOM 1786 CD1 LEU A 114 9.931 1.914 -10.086 1.00 0.00 C ATOM 1787 CD2 LEU A 114 10.475 3.846 -8.595 1.00 0.00 C ATOM 0 H LEU A 114 6.698 3.687 -8.281 1.00 0.00 H new ATOM 0 HA LEU A 114 8.284 5.957 -9.340 1.00 0.00 H new ATOM 0 HB2 LEU A 114 7.930 3.404 -10.854 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.270 4.534 -10.866 1.00 0.00 H new ATOM 0 HG LEU A 114 8.686 2.687 -8.539 1.00 0.00 H new ATOM 0 HD11 LEU A 114 10.493 1.262 -9.417 1.00 0.00 H new ATOM 0 HD12 LEU A 114 9.116 1.351 -10.542 1.00 0.00 H new ATOM 0 HD13 LEU A 114 10.593 2.290 -10.866 1.00 0.00 H new ATOM 0 HD21 LEU A 114 11.029 3.167 -7.947 1.00 0.00 H new ATOM 0 HD22 LEU A 114 11.150 4.270 -9.338 1.00 0.00 H new ATOM 0 HD23 LEU A 114 10.044 4.648 -7.996 1.00 0.00 H new ATOM 1799 N ASN A 115 6.655 6.521 -11.149 1.00 0.00 N ATOM 1800 CA ASN A 115 5.600 6.980 -12.045 1.00 0.00 C ATOM 1801 C ASN A 115 5.472 6.056 -13.253 1.00 0.00 C ATOM 1802 O ASN A 115 6.158 5.039 -13.344 1.00 0.00 O ATOM 1803 CB ASN A 115 5.883 8.410 -12.510 1.00 0.00 C ATOM 1804 CG ASN A 115 7.368 8.698 -12.620 1.00 0.00 C ATOM 1805 OD1 ASN A 115 8.085 8.041 -13.375 1.00 0.00 O ATOM 1806 ND2 ASN A 115 7.837 9.684 -11.865 1.00 0.00 N ATOM 0 H ASN A 115 7.490 7.107 -11.145 1.00 0.00 H new ATOM 0 HA ASN A 115 4.659 6.964 -11.496 1.00 0.00 H new ATOM 0 HB2 ASN A 115 5.411 8.575 -13.479 1.00 0.00 H new ATOM 0 HB3 ASN A 115 5.430 9.113 -11.811 1.00 0.00 H new ATOM 0 HD21 ASN A 115 8.828 9.923 -11.896 1.00 0.00 H new ATOM 0 HD22 ASN A 115 7.206 10.202 -11.253 1.00 0.00 H new ATOM 1813 N GLU A 116 4.588 6.419 -14.178 1.00 0.00 N ATOM 1814 CA GLU A 116 4.371 5.623 -15.380 1.00 0.00 C ATOM 1815 C GLU A 116 5.644 5.544 -16.218 1.00 0.00 C ATOM 1816 O GLU A 116 5.732 4.758 -17.162 1.00 0.00 O ATOM 1817 CB GLU A 116 3.234 6.218 -16.214 1.00 0.00 C ATOM 1818 CG GLU A 116 3.585 7.547 -16.861 1.00 0.00 C ATOM 1819 CD GLU A 116 2.424 8.146 -17.630 1.00 0.00 C ATOM 1820 OE1 GLU A 116 1.724 7.387 -18.333 1.00 0.00 O ATOM 1821 OE2 GLU A 116 2.215 9.373 -17.529 1.00 0.00 O ATOM 0 H GLU A 116 4.011 7.258 -14.118 1.00 0.00 H new ATOM 0 HA GLU A 116 4.097 4.614 -15.072 1.00 0.00 H new ATOM 0 HB2 GLU A 116 2.955 5.507 -16.992 1.00 0.00 H new ATOM 0 HB3 GLU A 116 2.360 6.353 -15.577 1.00 0.00 H new ATOM 0 HG2 GLU A 116 3.906 8.248 -16.091 1.00 0.00 H new ATOM 0 HG3 GLU A 116 4.429 7.406 -17.536 1.00 0.00 H new ATOM 1828 N LYS A 117 6.628 6.364 -15.867 1.00 0.00 N ATOM 1829 CA LYS A 117 7.897 6.388 -16.584 1.00 0.00 C ATOM 1830 C LYS A 117 8.930 5.504 -15.893 1.00 0.00 C ATOM 1831 O LYS A 117 9.898 5.064 -16.512 1.00 0.00 O ATOM 1832 CB LYS A 117 8.423 7.822 -16.684 1.00 0.00 C ATOM 1833 CG LYS A 117 7.596 8.712 -17.595 1.00 0.00 C ATOM 1834 CD LYS A 117 7.831 8.382 -19.060 1.00 0.00 C ATOM 1835 CE LYS A 117 6.670 8.841 -19.928 1.00 0.00 C ATOM 1836 NZ LYS A 117 6.531 8.007 -21.154 1.00 0.00 N ATOM 0 H LYS A 117 6.571 7.022 -15.089 1.00 0.00 H new ATOM 0 HA LYS A 117 7.725 5.999 -17.588 1.00 0.00 H new ATOM 0 HB2 LYS A 117 8.448 8.261 -15.687 1.00 0.00 H new ATOM 0 HB3 LYS A 117 9.450 7.799 -17.048 1.00 0.00 H new ATOM 0 HG2 LYS A 117 6.538 8.593 -17.359 1.00 0.00 H new ATOM 0 HG3 LYS A 117 7.848 9.756 -17.411 1.00 0.00 H new ATOM 0 HD2 LYS A 117 8.751 8.859 -19.399 1.00 0.00 H new ATOM 0 HD3 LYS A 117 7.969 7.307 -19.174 1.00 0.00 H new ATOM 0 HE2 LYS A 117 5.746 8.797 -19.352 1.00 0.00 H new ATOM 0 HE3 LYS A 117 6.819 9.883 -20.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 5.729 8.352 -21.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 7.403 8.069 -21.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 6.364 7.017 -20.883 1.00 0.00 H new ATOM 1850 N GLY A 118 8.715 5.245 -14.607 1.00 0.00 N ATOM 1851 CA GLY A 118 9.635 4.412 -13.854 1.00 0.00 C ATOM 1852 C GLY A 118 10.670 5.225 -13.102 1.00 0.00 C ATOM 1853 O GLY A 118 11.747 4.724 -12.781 1.00 0.00 O ATOM 0 H GLY A 118 7.920 5.597 -14.073 1.00 0.00 H new ATOM 0 HA2 GLY A 118 9.073 3.802 -13.147 1.00 0.00 H new ATOM 0 HA3 GLY A 118 10.140 3.727 -14.535 1.00 0.00 H new ATOM 1857 N GLN A 119 10.344 6.483 -12.823 1.00 0.00 N ATOM 1858 CA GLN A 119 11.255 7.367 -12.107 1.00 0.00 C ATOM 1859 C GLN A 119 10.816 7.543 -10.657 1.00 0.00 C ATOM 1860 O GLN A 119 9.634 7.741 -10.376 1.00 0.00 O ATOM 1861 CB GLN A 119 11.328 8.730 -12.799 1.00 0.00 C ATOM 1862 CG GLN A 119 12.052 8.696 -14.135 1.00 0.00 C ATOM 1863 CD GLN A 119 13.532 8.402 -13.990 1.00 0.00 C ATOM 1864 OE1 GLN A 119 14.019 8.140 -12.890 1.00 0.00 O ATOM 1865 NE2 GLN A 119 14.256 8.443 -15.102 1.00 0.00 N ATOM 0 H GLN A 119 9.456 6.913 -13.082 1.00 0.00 H new ATOM 0 HA GLN A 119 12.245 6.910 -12.115 1.00 0.00 H new ATOM 0 HB2 GLN A 119 10.316 9.105 -12.953 1.00 0.00 H new ATOM 0 HB3 GLN A 119 11.832 9.436 -12.140 1.00 0.00 H new ATOM 0 HG2 GLN A 119 11.596 7.938 -14.772 1.00 0.00 H new ATOM 0 HG3 GLN A 119 11.924 9.654 -14.638 1.00 0.00 H new ATOM 0 HE21 GLN A 119 13.811 8.664 -15.993 1.00 0.00 H new ATOM 0 HE22 GLN A 119 15.257 8.253 -15.066 1.00 0.00 H new ATOM 1874 N ASP A 120 11.775 7.468 -9.741 1.00 0.00 N ATOM 1875 CA ASP A 120 11.487 7.620 -8.319 1.00 0.00 C ATOM 1876 C ASP A 120 10.642 8.864 -8.065 1.00 0.00 C ATOM 1877 O ASP A 120 11.132 9.990 -8.152 1.00 0.00 O ATOM 1878 CB ASP A 120 12.788 7.701 -7.519 1.00 0.00 C ATOM 1879 CG ASP A 120 13.788 8.659 -8.135 1.00 0.00 C ATOM 1880 OD1 ASP A 120 14.440 8.279 -9.131 1.00 0.00 O ATOM 1881 OD2 ASP A 120 13.918 9.790 -7.623 1.00 0.00 O ATOM 0 H ASP A 120 12.758 7.303 -9.957 1.00 0.00 H new ATOM 0 HA ASP A 120 10.922 6.746 -7.993 1.00 0.00 H new ATOM 0 HB2 ASP A 120 12.565 8.018 -6.500 1.00 0.00 H new ATOM 0 HB3 ASP A 120 13.233 6.708 -7.454 1.00 0.00 H new ATOM 1886 N THR A 121 9.367 8.653 -7.752 1.00 0.00 N ATOM 1887 CA THR A 121 8.452 9.757 -7.488 1.00 0.00 C ATOM 1888 C THR A 121 8.789 10.448 -6.172 1.00 0.00 C ATOM 1889 O THR A 121 8.418 11.600 -5.951 1.00 0.00 O ATOM 1890 CB THR A 121 6.990 9.276 -7.442 1.00 0.00 C ATOM 1891 OG1 THR A 121 6.807 8.367 -6.351 1.00 0.00 O ATOM 1892 CG2 THR A 121 6.603 8.595 -8.746 1.00 0.00 C ATOM 0 H THR A 121 8.945 7.728 -7.675 1.00 0.00 H new ATOM 0 HA THR A 121 8.568 10.466 -8.308 1.00 0.00 H new ATOM 0 HB THR A 121 6.349 10.146 -7.301 1.00 0.00 H new ATOM 0 HG1 THR A 121 7.453 7.634 -6.424 1.00 0.00 H new ATOM 0 HG21 THR A 121 5.566 8.264 -8.690 1.00 0.00 H new ATOM 0 HG22 THR A 121 6.715 9.298 -9.571 1.00 0.00 H new ATOM 0 HG23 THR A 121 7.250 7.734 -8.913 1.00 0.00 H new ATOM 1900 N GLY A 122 9.497 9.736 -5.299 1.00 0.00 N ATOM 1901 CA GLY A 122 9.873 10.298 -4.015 1.00 0.00 C ATOM 1902 C GLY A 122 8.848 10.013 -2.935 1.00 0.00 C ATOM 1903 O GLY A 122 8.918 10.571 -1.841 1.00 0.00 O ATOM 0 H GLY A 122 9.816 8.781 -5.459 1.00 0.00 H new ATOM 0 HA2 GLY A 122 10.838 9.891 -3.712 1.00 0.00 H new ATOM 0 HA3 GLY A 122 9.999 11.376 -4.117 1.00 0.00 H new ATOM 1907 N ALA A 123 7.891 9.144 -3.244 1.00 0.00 N ATOM 1908 CA ALA A 123 6.848 8.786 -2.291 1.00 0.00 C ATOM 1909 C ALA A 123 7.083 7.394 -1.716 1.00 0.00 C ATOM 1910 O ALA A 123 7.559 6.495 -2.411 1.00 0.00 O ATOM 1911 CB ALA A 123 5.480 8.861 -2.954 1.00 0.00 C ATOM 0 H ALA A 123 7.817 8.675 -4.147 1.00 0.00 H new ATOM 0 HA ALA A 123 6.881 9.500 -1.468 1.00 0.00 H new ATOM 0 HB1 ALA A 123 4.710 8.591 -2.231 1.00 0.00 H new ATOM 0 HB2 ALA A 123 5.304 9.876 -3.310 1.00 0.00 H new ATOM 0 HB3 ALA A 123 5.445 8.170 -3.796 1.00 0.00 H new ATOM 1917 N THR A 124 6.748 7.220 -0.441 1.00 0.00 N ATOM 1918 CA THR A 124 6.925 5.938 0.228 1.00 0.00 C ATOM 1919 C THR A 124 5.623 5.466 0.866 1.00 0.00 C ATOM 1920 O THR A 124 4.841 6.272 1.372 1.00 0.00 O ATOM 1921 CB THR A 124 8.015 6.016 1.313 1.00 0.00 C ATOM 1922 OG1 THR A 124 7.579 6.857 2.387 1.00 0.00 O ATOM 1923 CG2 THR A 124 9.315 6.557 0.736 1.00 0.00 C ATOM 0 H THR A 124 6.352 7.952 0.149 1.00 0.00 H new ATOM 0 HA THR A 124 7.233 5.224 -0.536 1.00 0.00 H new ATOM 0 HB THR A 124 8.193 5.009 1.690 1.00 0.00 H new ATOM 0 HG1 THR A 124 8.277 6.900 3.073 1.00 0.00 H new ATOM 0 HG21 THR A 124 10.070 6.603 1.521 1.00 0.00 H new ATOM 0 HG22 THR A 124 9.660 5.899 -0.062 1.00 0.00 H new ATOM 0 HG23 THR A 124 9.147 7.557 0.335 1.00 0.00 H new ATOM 1931 N ILE A 125 5.396 4.157 0.838 1.00 0.00 N ATOM 1932 CA ILE A 125 4.189 3.579 1.416 1.00 0.00 C ATOM 1933 C ILE A 125 4.502 2.289 2.166 1.00 0.00 C ATOM 1934 O ILE A 125 5.252 1.443 1.681 1.00 0.00 O ATOM 1935 CB ILE A 125 3.132 3.287 0.334 1.00 0.00 C ATOM 1936 CG1 ILE A 125 1.862 2.719 0.972 1.00 0.00 C ATOM 1937 CG2 ILE A 125 3.688 2.323 -0.703 1.00 0.00 C ATOM 1938 CD1 ILE A 125 0.644 2.815 0.081 1.00 0.00 C ATOM 0 H ILE A 125 6.032 3.477 0.421 1.00 0.00 H new ATOM 0 HA ILE A 125 3.790 4.314 2.114 1.00 0.00 H new ATOM 0 HB ILE A 125 2.878 4.221 -0.167 1.00 0.00 H new ATOM 0 HG12 ILE A 125 2.031 1.674 1.231 1.00 0.00 H new ATOM 0 HG13 ILE A 125 1.664 3.250 1.903 1.00 0.00 H new ATOM 0 HG21 ILE A 125 2.929 2.126 -1.461 1.00 0.00 H new ATOM 0 HG22 ILE A 125 4.567 2.763 -1.175 1.00 0.00 H new ATOM 0 HG23 ILE A 125 3.967 1.388 -0.218 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -0.219 2.394 0.597 1.00 0.00 H new ATOM 0 HD12 ILE A 125 0.449 3.861 -0.158 1.00 0.00 H new ATOM 0 HD13 ILE A 125 0.822 2.260 -0.840 1.00 0.00 H new ATOM 1950 N ASP A 126 3.921 2.146 3.352 1.00 0.00 N ATOM 1951 CA ASP A 126 4.135 0.958 4.170 1.00 0.00 C ATOM 1952 C ASP A 126 3.037 -0.073 3.929 1.00 0.00 C ATOM 1953 O ASP A 126 1.857 0.270 3.841 1.00 0.00 O ATOM 1954 CB ASP A 126 4.182 1.334 5.652 1.00 0.00 C ATOM 1955 CG ASP A 126 5.022 2.569 5.909 1.00 0.00 C ATOM 1956 OD1 ASP A 126 6.134 2.657 5.348 1.00 0.00 O ATOM 1957 OD2 ASP A 126 4.568 3.447 6.673 1.00 0.00 O ATOM 0 H ASP A 126 3.298 2.838 3.768 1.00 0.00 H new ATOM 0 HA ASP A 126 5.091 0.518 3.884 1.00 0.00 H new ATOM 0 HB2 ASP A 126 3.168 1.506 6.013 1.00 0.00 H new ATOM 0 HB3 ASP A 126 4.586 0.498 6.223 1.00 0.00 H new ATOM 1962 N LEU A 127 3.433 -1.337 3.821 1.00 0.00 N ATOM 1963 CA LEU A 127 2.482 -2.419 3.588 1.00 0.00 C ATOM 1964 C LEU A 127 2.969 -3.718 4.223 1.00 0.00 C ATOM 1965 O LEU A 127 4.163 -4.017 4.210 1.00 0.00 O ATOM 1966 CB LEU A 127 2.266 -2.621 2.088 1.00 0.00 C ATOM 1967 CG LEU A 127 1.691 -1.426 1.325 1.00 0.00 C ATOM 1968 CD1 LEU A 127 1.958 -1.566 -0.165 1.00 0.00 C ATOM 1969 CD2 LEU A 127 0.199 -1.292 1.592 1.00 0.00 C ATOM 0 H LEU A 127 4.405 -1.638 3.891 1.00 0.00 H new ATOM 0 HA LEU A 127 1.535 -2.143 4.051 1.00 0.00 H new ATOM 0 HB2 LEU A 127 3.221 -2.889 1.637 1.00 0.00 H new ATOM 0 HB3 LEU A 127 1.598 -3.471 1.949 1.00 0.00 H new ATOM 0 HG LEU A 127 2.186 -0.521 1.678 1.00 0.00 H new ATOM 0 HD11 LEU A 127 1.542 -0.707 -0.691 1.00 0.00 H new ATOM 0 HD12 LEU A 127 3.033 -1.613 -0.339 1.00 0.00 H new ATOM 0 HD13 LEU A 127 1.491 -2.479 -0.534 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -0.194 -0.437 1.042 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.312 -2.199 1.267 1.00 0.00 H new ATOM 0 HD23 LEU A 127 0.032 -1.144 2.659 1.00 0.00 H new ATOM 1981 N VAL A 128 2.036 -4.486 4.776 1.00 0.00 N ATOM 1982 CA VAL A 128 2.369 -5.755 5.413 1.00 0.00 C ATOM 1983 C VAL A 128 1.605 -6.908 4.773 1.00 0.00 C ATOM 1984 O VAL A 128 0.434 -7.135 5.078 1.00 0.00 O ATOM 1985 CB VAL A 128 2.062 -5.724 6.922 1.00 0.00 C ATOM 1986 CG1 VAL A 128 2.399 -7.061 7.563 1.00 0.00 C ATOM 1987 CG2 VAL A 128 2.822 -4.592 7.597 1.00 0.00 C ATOM 0 H VAL A 128 1.043 -4.252 4.796 1.00 0.00 H new ATOM 0 HA VAL A 128 3.439 -5.909 5.271 1.00 0.00 H new ATOM 0 HB VAL A 128 0.995 -5.544 7.055 1.00 0.00 H new ATOM 0 HG11 VAL A 128 2.176 -7.020 8.629 1.00 0.00 H new ATOM 0 HG12 VAL A 128 1.805 -7.848 7.098 1.00 0.00 H new ATOM 0 HG13 VAL A 128 3.458 -7.275 7.422 1.00 0.00 H new ATOM 0 HG21 VAL A 128 2.593 -4.585 8.663 1.00 0.00 H new ATOM 0 HG22 VAL A 128 3.893 -4.738 7.457 1.00 0.00 H new ATOM 0 HG23 VAL A 128 2.525 -3.641 7.156 1.00 0.00 H new ATOM 1997 N ILE A 129 2.276 -7.635 3.886 1.00 0.00 N ATOM 1998 CA ILE A 129 1.660 -8.767 3.204 1.00 0.00 C ATOM 1999 C ILE A 129 1.964 -10.075 3.926 1.00 0.00 C ATOM 2000 O ILE A 129 3.105 -10.337 4.303 1.00 0.00 O ATOM 2001 CB ILE A 129 2.141 -8.875 1.745 1.00 0.00 C ATOM 2002 CG1 ILE A 129 2.142 -7.496 1.082 1.00 0.00 C ATOM 2003 CG2 ILE A 129 1.260 -9.841 0.967 1.00 0.00 C ATOM 2004 CD1 ILE A 129 3.144 -7.367 -0.044 1.00 0.00 C ATOM 0 H ILE A 129 3.246 -7.461 3.623 1.00 0.00 H new ATOM 0 HA ILE A 129 0.584 -8.592 3.211 1.00 0.00 H new ATOM 0 HB ILE A 129 3.161 -9.260 1.742 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.144 -7.287 0.695 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.356 -6.739 1.837 1.00 0.00 H new ATOM 0 HG21 ILE A 129 1.613 -9.907 -0.062 1.00 0.00 H new ATOM 0 HG22 ILE A 129 1.305 -10.827 1.429 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.231 -9.482 0.976 1.00 0.00 H new ATOM 0 HD11 ILE A 129 3.089 -6.364 -0.467 1.00 0.00 H new ATOM 0 HD12 ILE A 129 4.148 -7.544 0.341 1.00 0.00 H new ATOM 0 HD13 ILE A 129 2.918 -8.100 -0.818 1.00 0.00 H new ATOM 2016 N GLY A 130 0.934 -10.895 4.113 1.00 0.00 N ATOM 2017 CA GLY A 130 1.112 -12.167 4.788 1.00 0.00 C ATOM 2018 C GLY A 130 0.590 -13.333 3.973 1.00 0.00 C ATOM 2019 O GLY A 130 -0.577 -13.353 3.581 1.00 0.00 O ATOM 0 H GLY A 130 -0.020 -10.701 3.809 1.00 0.00 H new ATOM 0 HA2 GLY A 130 2.171 -12.319 4.997 1.00 0.00 H new ATOM 0 HA3 GLY A 130 0.598 -12.140 5.749 1.00 0.00 H new ATOM 2023 N TYR A 131 1.455 -14.308 3.715 1.00 0.00 N ATOM 2024 CA TYR A 131 1.076 -15.481 2.937 1.00 0.00 C ATOM 2025 C TYR A 131 0.672 -16.634 3.852 1.00 0.00 C ATOM 2026 O TYR A 131 1.211 -16.790 4.947 1.00 0.00 O ATOM 2027 CB TYR A 131 2.230 -15.914 2.032 1.00 0.00 C ATOM 2028 CG TYR A 131 2.103 -17.332 1.524 1.00 0.00 C ATOM 2029 CD1 TYR A 131 1.006 -17.723 0.765 1.00 0.00 C ATOM 2030 CD2 TYR A 131 3.077 -18.282 1.804 1.00 0.00 C ATOM 2031 CE1 TYR A 131 0.885 -19.018 0.300 1.00 0.00 C ATOM 2032 CE2 TYR A 131 2.965 -19.579 1.342 1.00 0.00 C ATOM 2033 CZ TYR A 131 1.867 -19.942 0.590 1.00 0.00 C ATOM 2034 OH TYR A 131 1.751 -21.233 0.129 1.00 0.00 O ATOM 0 H TYR A 131 2.424 -14.309 4.034 1.00 0.00 H new ATOM 0 HA TYR A 131 0.219 -15.214 2.319 1.00 0.00 H new ATOM 0 HB2 TYR A 131 2.287 -15.236 1.181 1.00 0.00 H new ATOM 0 HB3 TYR A 131 3.167 -15.816 2.580 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.235 -17.002 0.535 1.00 0.00 H new ATOM 0 HD2 TYR A 131 3.937 -18.002 2.394 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.026 -19.306 -0.288 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.732 -20.304 1.568 1.00 0.00 H new ATOM 0 HH TYR A 131 2.575 -21.726 0.325 1.00 0.00 H new ATOM 2044 N ASP A 132 -0.280 -17.439 3.393 1.00 0.00 N ATOM 2045 CA ASP A 132 -0.756 -18.579 4.167 1.00 0.00 C ATOM 2046 C ASP A 132 -0.961 -19.796 3.271 1.00 0.00 C ATOM 2047 O ASP A 132 -1.798 -19.799 2.368 1.00 0.00 O ATOM 2048 CB ASP A 132 -2.063 -18.228 4.880 1.00 0.00 C ATOM 2049 CG ASP A 132 -2.234 -18.988 6.181 1.00 0.00 C ATOM 2050 OD1 ASP A 132 -1.775 -18.484 7.227 1.00 0.00 O ATOM 2051 OD2 ASP A 132 -2.827 -20.087 6.153 1.00 0.00 O ATOM 0 H ASP A 132 -0.737 -17.323 2.489 1.00 0.00 H new ATOM 0 HA ASP A 132 0.001 -18.823 4.912 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -2.087 -17.157 5.082 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -2.903 -18.447 4.221 1.00 0.00 H new ATOM 2056 N PRO A 133 -0.180 -20.857 3.525 1.00 0.00 N ATOM 2057 CA PRO A 133 -0.257 -22.100 2.752 1.00 0.00 C ATOM 2058 C PRO A 133 -1.549 -22.866 3.014 1.00 0.00 C ATOM 2059 O PRO A 133 -1.953 -23.077 4.158 1.00 0.00 O ATOM 2060 CB PRO A 133 0.950 -22.901 3.247 1.00 0.00 C ATOM 2061 CG PRO A 133 1.214 -22.380 4.617 1.00 0.00 C ATOM 2062 CD PRO A 133 0.839 -20.924 4.586 1.00 0.00 C ATOM 0 HA PRO A 133 -0.250 -21.913 1.678 1.00 0.00 H new ATOM 0 HB2 PRO A 133 0.736 -23.970 3.264 1.00 0.00 H new ATOM 0 HB3 PRO A 133 1.813 -22.759 2.596 1.00 0.00 H new ATOM 0 HG2 PRO A 133 0.625 -22.919 5.359 1.00 0.00 H new ATOM 0 HG3 PRO A 133 2.262 -22.507 4.888 1.00 0.00 H new ATOM 0 HD2 PRO A 133 0.443 -20.590 5.545 1.00 0.00 H new ATOM 0 HD3 PRO A 133 1.698 -20.293 4.359 1.00 0.00 H new ATOM 2070 N PRO A 134 -2.215 -23.294 1.931 1.00 0.00 N ATOM 2071 CA PRO A 134 -3.471 -24.045 2.019 1.00 0.00 C ATOM 2072 C PRO A 134 -3.268 -25.451 2.571 1.00 0.00 C ATOM 2073 O PRO A 134 -2.217 -26.061 2.371 1.00 0.00 O ATOM 2074 CB PRO A 134 -3.951 -24.104 0.567 1.00 0.00 C ATOM 2075 CG PRO A 134 -2.711 -23.973 -0.248 1.00 0.00 C ATOM 2076 CD PRO A 134 -1.792 -23.078 0.537 1.00 0.00 C ATOM 0 HA PRO A 134 -4.181 -23.574 2.698 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -4.465 -25.042 0.358 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -4.654 -23.300 0.350 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -2.253 -24.947 -0.421 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -2.930 -23.545 -1.226 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -0.746 -23.346 0.388 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -1.899 -22.034 0.242 1.00 0.00 H new