USER MOD reduce.3.24.130724 H: found=0, std=0, add=911, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 766 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 74 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 75 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 87 TYR OH : rot 18:sc= -0.96 USER MOD Set 3.1: A 55 GLN : amide:sc= -1.87 K(o=-0.82,f=-4.1!) USER MOD Set 3.2: A 66 THR OG1 : rot 73:sc= 1.05 USER MOD Single : A 1 GLY N :NH3+ -102:sc= 0.0444 (180deg=0) USER MOD Single : A 2 SER OG : rot 35:sc= 1.02 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot -35:sc= 0.901 USER MOD Single : A 13 GLN : amide:sc= -0.278 K(o=-0.28,f=-2!) USER MOD Single : A 22 GLN : amide:sc= -1.96 K(o=-2,f=-4.4!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= -0.0687 X(o=-0.069,f=-0.022) USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.0161 USER MOD Single : A 39 THR OG1 : rot -179:sc= -5.53! USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -1.31 X(o=-1.3,f=-0.81) USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.553 USER MOD Single : A 52 TYR OH : rot 120:sc= 0 USER MOD Single : A 53 THR OG1 : rot -157:sc= -1.14 USER MOD Single : A 56 LYS NZ :NH3+ -160:sc= 0.128 (180deg=0.0681) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 150:sc= -0.548 USER MOD Single : A 62 MET CE :methyl -158:sc= -1.87! (180deg=-3.4!) USER MOD Single : A 70 HIS :FLIP no HD1:sc= -3.37! C(o=-6.5!,f=-3.4!) USER MOD Single : A 71 TYR OH : rot 173:sc= 0.194 USER MOD Single : A 72 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0.0178 USER MOD Single : A 85 ASN : amide:sc= -1.05 X(o=-1,f=-1.2) USER MOD Single : A 88 TYR OH : rot 30:sc= -0.196 USER MOD Single : A 93 SER OG : rot 133:sc= 1.04 USER MOD Single : A 95 ASN : amide:sc= -1.29! C(o=-1.3!,f=-17!) USER MOD Single : A 96 MET CE :methyl 156:sc= -0.0216 (180deg=-1.01) USER MOD Single : A 97 CYS SG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 106:sc= 0.464 USER MOD Single : A 104 THR OG1 : rot 180:sc=-0.00449 USER MOD Single : A 105 MET CE :methyl -153:sc= -0.125 (180deg=-1.41) USER MOD Single : A 106 THR OG1 : rot 98:sc= 1.25 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 SER OG : rot 14:sc= 0.319 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -3.109 -6.727 8.221 1.00 0.00 N ATOM 2 CA GLY A 1 -3.573 -6.680 9.597 1.00 0.00 C ATOM 3 C GLY A 1 -4.403 -5.421 9.853 1.00 0.00 C ATOM 4 O GLY A 1 -4.173 -4.384 9.232 1.00 0.00 O ATOM 0 H1 GLY A 1 -3.700 -7.388 7.678 1.00 0.00 H new ATOM 0 H2 GLY A 1 -3.174 -5.778 7.800 1.00 0.00 H new ATOM 0 H3 GLY A 1 -2.120 -7.048 8.199 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -4.172 -7.565 9.813 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -2.719 -6.700 10.274 1.00 0.00 H new ATOM 8 N SER A 2 -5.351 -5.552 10.770 1.00 0.00 N ATOM 9 CA SER A 2 -6.216 -4.438 11.116 1.00 0.00 C ATOM 10 C SER A 2 -6.936 -4.724 12.435 1.00 0.00 C ATOM 11 O SER A 2 -6.742 -4.012 13.419 1.00 0.00 O ATOM 12 CB SER A 2 -7.232 -4.163 10.005 1.00 0.00 C ATOM 13 OG SER A 2 -6.703 -3.306 8.997 1.00 0.00 O ATOM 0 H SER A 2 -5.538 -6.413 11.284 1.00 0.00 H new ATOM 0 HA SER A 2 -5.597 -3.549 11.233 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.540 -5.106 9.554 1.00 0.00 H new ATOM 0 HB3 SER A 2 -8.125 -3.709 10.435 1.00 0.00 H new ATOM 0 HG SER A 2 -5.749 -3.494 8.875 1.00 0.00 H new ATOM 18 N SER A 3 -7.753 -5.766 12.412 1.00 0.00 N ATOM 19 CA SER A 3 -8.503 -6.156 13.595 1.00 0.00 C ATOM 20 C SER A 3 -9.234 -7.475 13.339 1.00 0.00 C ATOM 21 O SER A 3 -9.314 -7.936 12.201 1.00 0.00 O ATOM 22 CB SER A 3 -9.500 -5.067 13.998 1.00 0.00 C ATOM 23 OG SER A 3 -10.616 -5.011 13.114 1.00 0.00 O ATOM 0 H SER A 3 -7.913 -6.353 11.593 1.00 0.00 H new ATOM 0 HA SER A 3 -7.800 -6.291 14.417 1.00 0.00 H new ATOM 0 HB2 SER A 3 -9.851 -5.254 15.013 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.997 -4.100 14.008 1.00 0.00 H new ATOM 0 HG SER A 3 -11.230 -4.305 13.406 1.00 0.00 H new ATOM 28 N GLY A 4 -9.749 -8.048 14.418 1.00 0.00 N ATOM 29 CA GLY A 4 -10.470 -9.307 14.325 1.00 0.00 C ATOM 30 C GLY A 4 -11.203 -9.615 15.632 1.00 0.00 C ATOM 31 O GLY A 4 -12.317 -9.142 15.850 1.00 0.00 O ATOM 0 H GLY A 4 -9.681 -7.664 15.360 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -11.186 -9.261 13.504 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -9.773 -10.113 14.095 1.00 0.00 H new ATOM 35 N SER A 5 -10.547 -10.407 16.467 1.00 0.00 N ATOM 36 CA SER A 5 -11.122 -10.786 17.747 1.00 0.00 C ATOM 37 C SER A 5 -12.402 -11.596 17.527 1.00 0.00 C ATOM 38 O SER A 5 -13.126 -11.368 16.560 1.00 0.00 O ATOM 39 CB SER A 5 -11.416 -9.553 18.605 1.00 0.00 C ATOM 40 OG SER A 5 -10.222 -8.918 19.054 1.00 0.00 O ATOM 0 H SER A 5 -9.623 -10.797 16.282 1.00 0.00 H new ATOM 0 HA SER A 5 -10.397 -11.402 18.279 1.00 0.00 H new ATOM 0 HB2 SER A 5 -12.009 -8.843 18.028 1.00 0.00 H new ATOM 0 HB3 SER A 5 -12.017 -9.845 19.466 1.00 0.00 H new ATOM 0 HG SER A 5 -10.452 -8.135 19.597 1.00 0.00 H new ATOM 45 N SER A 6 -12.640 -12.526 18.441 1.00 0.00 N ATOM 46 CA SER A 6 -13.819 -13.370 18.359 1.00 0.00 C ATOM 47 C SER A 6 -14.774 -13.050 19.511 1.00 0.00 C ATOM 48 O SER A 6 -14.389 -12.392 20.476 1.00 0.00 O ATOM 49 CB SER A 6 -13.438 -14.852 18.382 1.00 0.00 C ATOM 50 OG SER A 6 -13.821 -15.520 17.182 1.00 0.00 O ATOM 0 H SER A 6 -12.036 -12.713 19.242 1.00 0.00 H new ATOM 0 HA SER A 6 -14.320 -13.166 17.413 1.00 0.00 H new ATOM 0 HB2 SER A 6 -12.361 -14.948 18.522 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.915 -15.336 19.234 1.00 0.00 H new ATOM 0 HG SER A 6 -13.559 -16.463 17.235 1.00 0.00 H new ATOM 55 N GLY A 7 -16.000 -13.532 19.372 1.00 0.00 N ATOM 56 CA GLY A 7 -17.013 -13.305 20.389 1.00 0.00 C ATOM 57 C GLY A 7 -18.121 -14.355 20.302 1.00 0.00 C ATOM 58 O GLY A 7 -18.337 -15.116 21.245 1.00 0.00 O ATOM 0 H GLY A 7 -16.315 -14.079 18.571 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -16.555 -13.336 21.377 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -17.440 -12.310 20.267 1.00 0.00 H new ATOM 62 N ALA A 8 -18.797 -14.365 19.161 1.00 0.00 N ATOM 63 CA ALA A 8 -19.878 -15.309 18.939 1.00 0.00 C ATOM 64 C ALA A 8 -19.375 -16.457 18.062 1.00 0.00 C ATOM 65 O ALA A 8 -18.261 -16.403 17.543 1.00 0.00 O ATOM 66 CB ALA A 8 -21.072 -14.581 18.319 1.00 0.00 C ATOM 0 H ALA A 8 -18.616 -13.733 18.381 1.00 0.00 H new ATOM 0 HA ALA A 8 -20.213 -15.738 19.883 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -21.883 -15.289 18.152 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -21.410 -13.795 18.994 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -20.775 -14.139 17.368 1.00 0.00 H new ATOM 72 N SER A 9 -20.220 -17.467 17.923 1.00 0.00 N ATOM 73 CA SER A 9 -19.874 -18.626 17.117 1.00 0.00 C ATOM 74 C SER A 9 -20.509 -18.507 15.730 1.00 0.00 C ATOM 75 O SER A 9 -20.506 -19.464 14.958 1.00 0.00 O ATOM 76 CB SER A 9 -20.321 -19.922 17.797 1.00 0.00 C ATOM 77 OG SER A 9 -19.962 -21.074 17.037 1.00 0.00 O ATOM 0 H SER A 9 -21.143 -17.507 18.355 1.00 0.00 H new ATOM 0 HA SER A 9 -18.790 -18.658 17.011 1.00 0.00 H new ATOM 0 HB2 SER A 9 -19.871 -19.986 18.787 1.00 0.00 H new ATOM 0 HB3 SER A 9 -21.402 -19.903 17.939 1.00 0.00 H new ATOM 0 HG SER A 9 -20.025 -20.868 16.081 1.00 0.00 H new ATOM 82 N ILE A 10 -21.040 -17.324 15.457 1.00 0.00 N ATOM 83 CA ILE A 10 -21.678 -17.068 14.177 1.00 0.00 C ATOM 84 C ILE A 10 -20.603 -16.890 13.103 1.00 0.00 C ATOM 85 O ILE A 10 -19.860 -15.910 13.120 1.00 0.00 O ATOM 86 CB ILE A 10 -22.641 -15.885 14.286 1.00 0.00 C ATOM 87 CG1 ILE A 10 -23.833 -16.227 15.180 1.00 0.00 C ATOM 88 CG2 ILE A 10 -23.082 -15.407 12.900 1.00 0.00 C ATOM 89 CD1 ILE A 10 -24.294 -15.004 15.974 1.00 0.00 C ATOM 0 H ILE A 10 -21.041 -16.532 16.100 1.00 0.00 H new ATOM 0 HA ILE A 10 -22.289 -17.920 13.878 1.00 0.00 H new ATOM 0 HB ILE A 10 -22.112 -15.058 14.759 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -24.655 -16.599 14.569 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -23.559 -17.028 15.866 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -23.766 -14.565 13.006 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -22.208 -15.095 12.328 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -23.586 -16.220 12.378 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -25.143 -15.276 16.601 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -23.477 -14.649 16.603 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -24.591 -14.213 15.285 1.00 0.00 H new ATOM 100 N ASP A 11 -20.555 -17.853 12.194 1.00 0.00 N ATOM 101 CA ASP A 11 -19.583 -17.814 11.114 1.00 0.00 C ATOM 102 C ASP A 11 -20.181 -17.065 9.922 1.00 0.00 C ATOM 103 O ASP A 11 -20.947 -17.637 9.146 1.00 0.00 O ATOM 104 CB ASP A 11 -19.218 -19.226 10.651 1.00 0.00 C ATOM 105 CG ASP A 11 -17.815 -19.692 11.042 1.00 0.00 C ATOM 106 OD1 ASP A 11 -17.650 -20.071 12.221 1.00 0.00 O ATOM 107 OD2 ASP A 11 -16.937 -19.660 10.152 1.00 0.00 O ATOM 0 H ASP A 11 -21.173 -18.664 12.183 1.00 0.00 H new ATOM 0 HA ASP A 11 -18.688 -17.313 11.483 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -19.945 -19.926 11.062 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -19.310 -19.272 9.566 1.00 0.00 H new ATOM 111 N ILE A 12 -19.810 -15.798 9.813 1.00 0.00 N ATOM 112 CA ILE A 12 -20.301 -14.966 8.727 1.00 0.00 C ATOM 113 C ILE A 12 -19.674 -15.429 7.411 1.00 0.00 C ATOM 114 O ILE A 12 -18.681 -14.863 6.959 1.00 0.00 O ATOM 115 CB ILE A 12 -20.059 -13.486 9.035 1.00 0.00 C ATOM 116 CG1 ILE A 12 -20.856 -13.045 10.265 1.00 0.00 C ATOM 117 CG2 ILE A 12 -20.359 -12.615 7.814 1.00 0.00 C ATOM 118 CD1 ILE A 12 -20.486 -11.619 10.675 1.00 0.00 C ATOM 0 H ILE A 12 -19.176 -15.327 10.458 1.00 0.00 H new ATOM 0 HA ILE A 12 -21.380 -15.075 8.622 1.00 0.00 H new ATOM 0 HB ILE A 12 -19.003 -13.354 9.271 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -21.923 -13.100 10.050 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -20.662 -13.727 11.093 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -20.179 -11.569 8.060 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -19.711 -12.910 6.989 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -21.401 -12.745 7.522 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -21.066 -11.330 11.551 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -19.423 -11.573 10.912 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -20.704 -10.936 9.854 1.00 0.00 H new ATOM 129 N GLN A 13 -20.281 -16.456 6.833 1.00 0.00 N ATOM 130 CA GLN A 13 -19.795 -17.003 5.578 1.00 0.00 C ATOM 131 C GLN A 13 -20.446 -16.278 4.397 1.00 0.00 C ATOM 132 O GLN A 13 -21.585 -15.826 4.493 1.00 0.00 O ATOM 133 CB GLN A 13 -20.047 -18.510 5.503 1.00 0.00 C ATOM 134 CG GLN A 13 -21.375 -18.810 4.807 1.00 0.00 C ATOM 135 CD GLN A 13 -22.030 -20.063 5.393 1.00 0.00 C ATOM 136 OE1 GLN A 13 -21.805 -20.438 6.532 1.00 0.00 O ATOM 137 NE2 GLN A 13 -22.852 -20.687 4.554 1.00 0.00 N ATOM 0 H GLN A 13 -21.105 -16.923 7.211 1.00 0.00 H new ATOM 0 HA GLN A 13 -18.718 -16.846 5.527 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -19.232 -18.992 4.963 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -20.056 -18.931 6.508 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -22.047 -17.959 4.916 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -21.207 -18.949 3.739 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -22.996 -20.320 3.613 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -23.339 -21.533 4.851 1.00 0.00 H new ATOM 144 N ILE A 14 -19.693 -16.191 3.311 1.00 0.00 N ATOM 145 CA ILE A 14 -20.181 -15.530 2.112 1.00 0.00 C ATOM 146 C ILE A 14 -20.035 -16.476 0.918 1.00 0.00 C ATOM 147 O ILE A 14 -18.944 -16.627 0.370 1.00 0.00 O ATOM 148 CB ILE A 14 -19.480 -14.185 1.919 1.00 0.00 C ATOM 149 CG1 ILE A 14 -19.104 -13.564 3.267 1.00 0.00 C ATOM 150 CG2 ILE A 14 -20.333 -13.238 1.071 1.00 0.00 C ATOM 151 CD1 ILE A 14 -18.358 -12.242 3.073 1.00 0.00 C ATOM 0 H ILE A 14 -18.748 -16.567 3.236 1.00 0.00 H new ATOM 0 HA ILE A 14 -21.242 -15.300 2.209 1.00 0.00 H new ATOM 0 HB ILE A 14 -18.552 -14.359 1.374 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -20.005 -13.394 3.857 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -18.480 -14.258 3.830 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -19.811 -12.289 0.949 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -20.508 -13.684 0.092 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -21.288 -13.066 1.567 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -18.103 -11.822 4.046 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -17.446 -12.419 2.504 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -18.994 -11.542 2.531 1.00 0.00 H new ATOM 162 N ILE A 15 -21.151 -17.088 0.550 1.00 0.00 N ATOM 163 CA ILE A 15 -21.162 -18.015 -0.570 1.00 0.00 C ATOM 164 C ILE A 15 -20.609 -17.313 -1.812 1.00 0.00 C ATOM 165 O ILE A 15 -20.654 -16.088 -1.909 1.00 0.00 O ATOM 166 CB ILE A 15 -22.562 -18.601 -0.767 1.00 0.00 C ATOM 167 CG1 ILE A 15 -23.052 -19.291 0.508 1.00 0.00 C ATOM 168 CG2 ILE A 15 -22.600 -19.537 -1.976 1.00 0.00 C ATOM 169 CD1 ILE A 15 -24.581 -19.322 0.560 1.00 0.00 C ATOM 0 H ILE A 15 -22.054 -16.960 1.007 1.00 0.00 H new ATOM 0 HA ILE A 15 -20.511 -18.866 -0.367 1.00 0.00 H new ATOM 0 HB ILE A 15 -23.249 -17.781 -0.974 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -22.662 -20.308 0.548 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -22.665 -18.766 1.382 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -23.606 -19.939 -2.093 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -22.324 -18.983 -2.873 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -21.897 -20.356 -1.824 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -24.904 -19.817 1.476 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -24.966 -18.303 0.544 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -24.963 -19.868 -0.302 1.00 0.00 H new ATOM 180 N ASP A 16 -20.099 -18.122 -2.730 1.00 0.00 N ATOM 181 CA ASP A 16 -19.537 -17.594 -3.962 1.00 0.00 C ATOM 182 C ASP A 16 -18.143 -17.029 -3.681 1.00 0.00 C ATOM 183 O ASP A 16 -17.694 -17.017 -2.536 1.00 0.00 O ATOM 184 CB ASP A 16 -20.401 -16.463 -4.522 1.00 0.00 C ATOM 185 CG ASP A 16 -20.617 -16.503 -6.036 1.00 0.00 C ATOM 186 OD1 ASP A 16 -19.630 -16.801 -6.742 1.00 0.00 O ATOM 187 OD2 ASP A 16 -21.765 -16.234 -6.453 1.00 0.00 O ATOM 0 H ASP A 16 -20.063 -19.138 -2.645 1.00 0.00 H new ATOM 0 HA ASP A 16 -19.493 -18.407 -4.687 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -21.374 -16.492 -4.031 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -19.940 -15.510 -4.261 1.00 0.00 H new ATOM 191 N ARG A 17 -17.498 -16.574 -4.745 1.00 0.00 N ATOM 192 CA ARG A 17 -16.164 -16.009 -4.626 1.00 0.00 C ATOM 193 C ARG A 17 -16.056 -15.168 -3.352 1.00 0.00 C ATOM 194 O ARG A 17 -17.058 -14.667 -2.847 1.00 0.00 O ATOM 195 CB ARG A 17 -15.828 -15.135 -5.836 1.00 0.00 C ATOM 196 CG ARG A 17 -15.656 -15.985 -7.097 1.00 0.00 C ATOM 197 CD ARG A 17 -16.414 -15.376 -8.277 1.00 0.00 C ATOM 198 NE ARG A 17 -17.124 -16.436 -9.025 1.00 0.00 N ATOM 199 CZ ARG A 17 -18.084 -16.203 -9.930 1.00 0.00 C ATOM 200 NH1 ARG A 17 -18.456 -14.946 -10.204 1.00 0.00 N ATOM 201 NH2 ARG A 17 -18.674 -17.229 -10.561 1.00 0.00 N ATOM 0 H ARG A 17 -17.874 -16.585 -5.693 1.00 0.00 H new ATOM 0 HA ARG A 17 -15.455 -16.836 -4.581 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -16.621 -14.403 -5.992 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -14.912 -14.576 -5.642 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -14.597 -16.066 -7.343 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -16.018 -16.996 -6.910 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -17.127 -14.634 -7.918 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -15.719 -14.857 -8.937 1.00 0.00 H new ATOM 0 HE ARG A 17 -16.867 -17.406 -8.840 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -18.008 -14.165 -9.724 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -19.187 -14.769 -10.893 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -18.392 -18.187 -10.352 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -19.405 -17.052 -11.250 1.00 0.00 H new ATOM 212 N PRO A 18 -14.795 -15.037 -2.857 1.00 0.00 N ATOM 213 CA PRO A 18 -14.542 -14.266 -1.651 1.00 0.00 C ATOM 214 C PRO A 18 -14.625 -12.765 -1.933 1.00 0.00 C ATOM 215 O PRO A 18 -14.754 -11.962 -1.010 1.00 0.00 O ATOM 216 CB PRO A 18 -13.165 -14.709 -1.184 1.00 0.00 C ATOM 217 CG PRO A 18 -12.505 -15.360 -2.389 1.00 0.00 C ATOM 218 CD PRO A 18 -13.584 -15.618 -3.428 1.00 0.00 C ATOM 0 HA PRO A 18 -15.286 -14.441 -0.874 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -12.581 -13.860 -0.830 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -13.241 -15.411 -0.354 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -11.730 -14.711 -2.797 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -12.021 -16.293 -2.101 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -13.334 -15.154 -4.382 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -13.707 -16.685 -3.615 1.00 0.00 H new ATOM 223 N GLY A 19 -14.546 -12.431 -3.213 1.00 0.00 N ATOM 224 CA GLY A 19 -14.610 -11.040 -3.628 1.00 0.00 C ATOM 225 C GLY A 19 -13.230 -10.382 -3.557 1.00 0.00 C ATOM 226 O GLY A 19 -12.213 -11.070 -3.499 1.00 0.00 O ATOM 0 H GLY A 19 -14.438 -13.099 -3.976 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -14.994 -10.978 -4.646 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -15.308 -10.498 -2.990 1.00 0.00 H new ATOM 230 N PRO A 20 -13.241 -9.022 -3.564 1.00 0.00 N ATOM 231 CA PRO A 20 -12.004 -8.264 -3.501 1.00 0.00 C ATOM 232 C PRO A 20 -11.418 -8.286 -2.088 1.00 0.00 C ATOM 233 O PRO A 20 -12.045 -8.794 -1.160 1.00 0.00 O ATOM 234 CB PRO A 20 -12.375 -6.865 -3.968 1.00 0.00 C ATOM 235 CG PRO A 20 -13.885 -6.767 -3.831 1.00 0.00 C ATOM 236 CD PRO A 20 -14.428 -8.174 -3.632 1.00 0.00 C ATOM 0 HA PRO A 20 -11.221 -8.686 -4.131 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -11.878 -6.107 -3.363 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -12.065 -6.703 -5.000 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -14.151 -6.132 -2.986 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -14.320 -6.312 -4.721 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -15.019 -8.245 -2.719 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -15.078 -8.468 -4.456 1.00 0.00 H new ATOM 241 N PRO A 21 -10.189 -7.715 -1.965 1.00 0.00 N ATOM 242 CA PRO A 21 -9.511 -7.665 -0.681 1.00 0.00 C ATOM 243 C PRO A 21 -10.134 -6.603 0.227 1.00 0.00 C ATOM 244 O PRO A 21 -10.909 -5.764 -0.234 1.00 0.00 O ATOM 245 CB PRO A 21 -8.056 -7.383 -1.015 1.00 0.00 C ATOM 246 CG PRO A 21 -8.053 -6.826 -2.429 1.00 0.00 C ATOM 247 CD PRO A 21 -9.416 -7.104 -3.043 1.00 0.00 C ATOM 0 HA PRO A 21 -9.603 -8.595 -0.120 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -7.626 -6.669 -0.313 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -7.458 -8.292 -0.952 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -7.851 -5.755 -2.417 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -7.265 -7.292 -3.021 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -9.886 -6.186 -3.397 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -9.335 -7.772 -3.901 1.00 0.00 H new ATOM 252 N GLN A 22 -9.773 -6.671 1.499 1.00 0.00 N ATOM 253 CA GLN A 22 -10.286 -5.725 2.474 1.00 0.00 C ATOM 254 C GLN A 22 -9.845 -4.303 2.120 1.00 0.00 C ATOM 255 O GLN A 22 -10.669 -3.392 2.055 1.00 0.00 O ATOM 256 CB GLN A 22 -9.840 -6.100 3.889 1.00 0.00 C ATOM 257 CG GLN A 22 -10.868 -7.009 4.566 1.00 0.00 C ATOM 258 CD GLN A 22 -10.868 -6.804 6.082 1.00 0.00 C ATOM 259 OE1 GLN A 22 -11.796 -6.261 6.661 1.00 0.00 O ATOM 260 NE2 GLN A 22 -9.779 -7.265 6.691 1.00 0.00 N ATOM 0 H GLN A 22 -9.131 -7.367 1.877 1.00 0.00 H new ATOM 0 HA GLN A 22 -11.375 -5.763 2.448 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -8.875 -6.604 3.848 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -9.702 -5.196 4.482 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -11.861 -6.801 4.167 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -10.644 -8.051 4.336 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -9.040 -7.709 6.147 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -9.683 -7.174 7.702 1.00 0.00 H new ATOM 267 N ILE A 23 -8.546 -4.159 1.899 1.00 0.00 N ATOM 268 CA ILE A 23 -7.986 -2.864 1.551 1.00 0.00 C ATOM 269 C ILE A 23 -6.649 -3.067 0.838 1.00 0.00 C ATOM 270 O ILE A 23 -6.029 -4.123 0.961 1.00 0.00 O ATOM 271 CB ILE A 23 -7.893 -1.971 2.791 1.00 0.00 C ATOM 272 CG1 ILE A 23 -7.913 -0.491 2.402 1.00 0.00 C ATOM 273 CG2 ILE A 23 -6.666 -2.327 3.632 1.00 0.00 C ATOM 274 CD1 ILE A 23 -6.512 -0.005 2.022 1.00 0.00 C ATOM 0 H ILE A 23 -7.866 -4.917 1.954 1.00 0.00 H new ATOM 0 HA ILE A 23 -8.641 -2.339 0.856 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.771 -2.153 3.411 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.594 -0.341 1.564 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -8.295 0.102 3.233 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -6.624 -1.678 4.507 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -6.735 -3.366 3.954 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -5.764 -2.191 3.035 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -6.554 1.050 1.750 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -5.840 -0.134 2.870 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -6.143 -0.584 1.175 1.00 0.00 H new ATOM 285 N VAL A 24 -6.242 -2.040 0.107 1.00 0.00 N ATOM 286 CA VAL A 24 -4.989 -2.092 -0.627 1.00 0.00 C ATOM 287 C VAL A 24 -4.232 -0.776 -0.431 1.00 0.00 C ATOM 288 O VAL A 24 -4.681 0.276 -0.883 1.00 0.00 O ATOM 289 CB VAL A 24 -5.257 -2.414 -2.098 1.00 0.00 C ATOM 290 CG1 VAL A 24 -3.952 -2.457 -2.897 1.00 0.00 C ATOM 291 CG2 VAL A 24 -6.030 -3.726 -2.240 1.00 0.00 C ATOM 0 H VAL A 24 -6.758 -1.166 0.007 1.00 0.00 H new ATOM 0 HA VAL A 24 -4.355 -2.892 -0.243 1.00 0.00 H new ATOM 0 HB VAL A 24 -5.875 -1.615 -2.508 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -4.171 -2.688 -3.939 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -3.456 -1.488 -2.836 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -3.298 -3.226 -2.485 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -6.207 -3.931 -3.296 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -5.449 -4.539 -1.805 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -6.985 -3.644 -1.721 1.00 0.00 H new ATOM 301 N LYS A 25 -3.098 -0.878 0.245 1.00 0.00 N ATOM 302 CA LYS A 25 -2.275 0.290 0.507 1.00 0.00 C ATOM 303 C LYS A 25 -0.889 0.080 -0.106 1.00 0.00 C ATOM 304 O LYS A 25 -0.575 -1.009 -0.584 1.00 0.00 O ATOM 305 CB LYS A 25 -2.244 0.599 2.005 1.00 0.00 C ATOM 306 CG LYS A 25 -3.350 1.586 2.384 1.00 0.00 C ATOM 307 CD LYS A 25 -2.850 2.600 3.416 1.00 0.00 C ATOM 308 CE LYS A 25 -3.377 2.265 4.813 1.00 0.00 C ATOM 309 NZ LYS A 25 -2.253 2.001 5.740 1.00 0.00 N ATOM 0 H LYS A 25 -2.729 -1.752 0.620 1.00 0.00 H new ATOM 0 HA LYS A 25 -2.704 1.172 0.032 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -2.365 -0.324 2.573 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -1.273 1.014 2.274 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -3.696 2.109 1.493 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -4.205 1.043 2.787 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -1.760 2.607 3.426 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -3.172 3.602 3.132 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -3.980 3.092 5.189 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -4.028 1.392 4.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -2.627 1.775 6.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -1.694 1.198 5.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -1.647 2.844 5.800 1.00 0.00 H new ATOM 319 N ILE A 26 -0.095 1.141 -0.072 1.00 0.00 N ATOM 320 CA ILE A 26 1.250 1.087 -0.619 1.00 0.00 C ATOM 321 C ILE A 26 2.257 1.426 0.482 1.00 0.00 C ATOM 322 O ILE A 26 2.482 2.597 0.784 1.00 0.00 O ATOM 323 CB ILE A 26 1.363 1.984 -1.853 1.00 0.00 C ATOM 324 CG1 ILE A 26 0.458 1.482 -2.980 1.00 0.00 C ATOM 325 CG2 ILE A 26 2.820 2.115 -2.303 1.00 0.00 C ATOM 326 CD1 ILE A 26 -0.386 2.622 -3.554 1.00 0.00 C ATOM 0 H ILE A 26 -0.358 2.043 0.326 1.00 0.00 H new ATOM 0 HA ILE A 26 1.481 0.079 -0.964 1.00 0.00 H new ATOM 0 HB ILE A 26 1.018 2.982 -1.583 1.00 0.00 H new ATOM 0 HG12 ILE A 26 1.066 1.041 -3.770 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -0.195 0.695 -2.603 1.00 0.00 H new ATOM 0 HG21 ILE A 26 2.873 2.758 -3.182 1.00 0.00 H new ATOM 0 HG22 ILE A 26 3.412 2.551 -1.498 1.00 0.00 H new ATOM 0 HG23 ILE A 26 3.215 1.129 -2.550 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -1.020 2.238 -4.353 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -1.010 3.045 -2.767 1.00 0.00 H new ATOM 0 HD13 ILE A 26 0.270 3.396 -3.952 1.00 0.00 H new ATOM 337 N GLU A 27 2.837 0.380 1.052 1.00 0.00 N ATOM 338 CA GLU A 27 3.815 0.552 2.112 1.00 0.00 C ATOM 339 C GLU A 27 4.713 1.755 1.816 1.00 0.00 C ATOM 340 O GLU A 27 4.942 2.593 2.688 1.00 0.00 O ATOM 341 CB GLU A 27 4.646 -0.719 2.304 1.00 0.00 C ATOM 342 CG GLU A 27 4.551 -1.223 3.745 1.00 0.00 C ATOM 343 CD GLU A 27 5.865 -1.874 4.185 1.00 0.00 C ATOM 344 OE1 GLU A 27 6.374 -2.707 3.404 1.00 0.00 O ATOM 345 OE2 GLU A 27 6.329 -1.524 5.291 1.00 0.00 O ATOM 0 H GLU A 27 2.648 -0.590 0.799 1.00 0.00 H new ATOM 0 HA GLU A 27 3.282 0.742 3.044 1.00 0.00 H new ATOM 0 HB2 GLU A 27 4.297 -1.493 1.620 1.00 0.00 H new ATOM 0 HB3 GLU A 27 5.688 -0.518 2.053 1.00 0.00 H new ATOM 0 HG2 GLU A 27 4.312 -0.393 4.410 1.00 0.00 H new ATOM 0 HG3 GLU A 27 3.738 -1.944 3.829 1.00 0.00 H new ATOM 350 N ASP A 28 5.198 1.802 0.584 1.00 0.00 N ATOM 351 CA ASP A 28 6.066 2.888 0.163 1.00 0.00 C ATOM 352 C ASP A 28 6.585 2.602 -1.248 1.00 0.00 C ATOM 353 O ASP A 28 6.260 1.571 -1.836 1.00 0.00 O ATOM 354 CB ASP A 28 7.273 3.021 1.093 1.00 0.00 C ATOM 355 CG ASP A 28 7.625 4.455 1.494 1.00 0.00 C ATOM 356 OD1 ASP A 28 7.184 5.372 0.768 1.00 0.00 O ATOM 357 OD2 ASP A 28 8.327 4.602 2.517 1.00 0.00 O ATOM 0 H ASP A 28 5.006 1.105 -0.136 1.00 0.00 H new ATOM 0 HA ASP A 28 5.488 3.812 0.189 1.00 0.00 H new ATOM 0 HB2 ASP A 28 7.081 2.443 1.997 1.00 0.00 H new ATOM 0 HB3 ASP A 28 8.139 2.573 0.606 1.00 0.00 H new ATOM 361 N VAL A 29 7.383 3.532 -1.750 1.00 0.00 N ATOM 362 CA VAL A 29 7.951 3.393 -3.080 1.00 0.00 C ATOM 363 C VAL A 29 9.335 4.046 -3.111 1.00 0.00 C ATOM 364 O VAL A 29 9.474 5.227 -2.799 1.00 0.00 O ATOM 365 CB VAL A 29 6.993 3.974 -4.122 1.00 0.00 C ATOM 366 CG1 VAL A 29 6.491 5.355 -3.694 1.00 0.00 C ATOM 367 CG2 VAL A 29 7.651 4.033 -5.502 1.00 0.00 C ATOM 0 H VAL A 29 7.650 4.385 -1.259 1.00 0.00 H new ATOM 0 HA VAL A 29 8.083 2.340 -3.330 1.00 0.00 H new ATOM 0 HB VAL A 29 6.131 3.310 -4.191 1.00 0.00 H new ATOM 0 HG11 VAL A 29 5.812 5.746 -4.452 1.00 0.00 H new ATOM 0 HG12 VAL A 29 5.965 5.272 -2.743 1.00 0.00 H new ATOM 0 HG13 VAL A 29 7.338 6.032 -3.582 1.00 0.00 H new ATOM 0 HG21 VAL A 29 6.948 4.450 -6.223 1.00 0.00 H new ATOM 0 HG22 VAL A 29 8.539 4.663 -5.455 1.00 0.00 H new ATOM 0 HG23 VAL A 29 7.936 3.028 -5.813 1.00 0.00 H new ATOM 377 N TRP A 30 10.322 3.248 -3.490 1.00 0.00 N ATOM 378 CA TRP A 30 11.690 3.733 -3.566 1.00 0.00 C ATOM 379 C TRP A 30 12.256 3.340 -4.931 1.00 0.00 C ATOM 380 O TRP A 30 11.889 2.305 -5.484 1.00 0.00 O ATOM 381 CB TRP A 30 12.524 3.205 -2.397 1.00 0.00 C ATOM 382 CG TRP A 30 12.584 1.678 -2.315 1.00 0.00 C ATOM 383 CD1 TRP A 30 13.582 0.869 -2.695 1.00 0.00 C ATOM 384 CD2 TRP A 30 11.554 0.804 -1.805 1.00 0.00 C ATOM 385 NE1 TRP A 30 13.273 -0.457 -2.467 1.00 0.00 N ATOM 386 CE2 TRP A 30 12.002 -0.497 -1.907 1.00 0.00 C ATOM 387 CE3 TRP A 30 10.288 1.103 -1.272 1.00 0.00 C ATOM 388 CZ2 TRP A 30 11.246 -1.602 -1.499 1.00 0.00 C ATOM 389 CZ3 TRP A 30 9.544 -0.012 -0.868 1.00 0.00 C ATOM 390 CH2 TRP A 30 9.981 -1.328 -0.966 1.00 0.00 C ATOM 0 H TRP A 30 10.202 2.268 -3.748 1.00 0.00 H new ATOM 0 HA TRP A 30 11.720 4.819 -3.477 1.00 0.00 H new ATOM 0 HB2 TRP A 30 13.539 3.594 -2.483 1.00 0.00 H new ATOM 0 HB3 TRP A 30 12.112 3.593 -1.465 1.00 0.00 H new ATOM 0 HD1 TRP A 30 14.511 1.211 -3.126 1.00 0.00 H new ATOM 0 HE1 TRP A 30 13.868 -1.260 -2.672 1.00 0.00 H new ATOM 0 HE3 TRP A 30 9.918 2.114 -1.181 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 11.619 -2.612 -1.590 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 8.563 0.162 -0.451 1.00 0.00 H new ATOM 0 HH2 TRP A 30 9.347 -2.136 -0.632 1.00 0.00 H new ATOM 400 N GLY A 31 13.141 4.187 -5.435 1.00 0.00 N ATOM 401 CA GLY A 31 13.762 3.942 -6.726 1.00 0.00 C ATOM 402 C GLY A 31 12.764 3.321 -7.705 1.00 0.00 C ATOM 403 O GLY A 31 11.731 3.917 -8.005 1.00 0.00 O ATOM 0 H GLY A 31 13.443 5.044 -4.973 1.00 0.00 H new ATOM 0 HA2 GLY A 31 14.143 4.878 -7.134 1.00 0.00 H new ATOM 0 HA3 GLY A 31 14.617 3.277 -6.602 1.00 0.00 H new ATOM 407 N GLU A 32 13.107 2.130 -8.175 1.00 0.00 N ATOM 408 CA GLU A 32 12.254 1.422 -9.115 1.00 0.00 C ATOM 409 C GLU A 32 11.590 0.226 -8.429 1.00 0.00 C ATOM 410 O GLU A 32 11.394 -0.818 -9.049 1.00 0.00 O ATOM 411 CB GLU A 32 13.045 0.979 -10.346 1.00 0.00 C ATOM 412 CG GLU A 32 13.786 2.159 -10.977 1.00 0.00 C ATOM 413 CD GLU A 32 14.878 1.674 -11.934 1.00 0.00 C ATOM 414 OE1 GLU A 32 14.534 1.432 -13.111 1.00 0.00 O ATOM 415 OE2 GLU A 32 16.031 1.557 -11.466 1.00 0.00 O ATOM 0 H GLU A 32 13.964 1.638 -7.922 1.00 0.00 H new ATOM 0 HA GLU A 32 11.473 2.103 -9.453 1.00 0.00 H new ATOM 0 HB2 GLU A 32 13.759 0.205 -10.064 1.00 0.00 H new ATOM 0 HB3 GLU A 32 12.368 0.537 -11.077 1.00 0.00 H new ATOM 0 HG2 GLU A 32 13.079 2.790 -11.516 1.00 0.00 H new ATOM 0 HG3 GLU A 32 14.230 2.774 -10.195 1.00 0.00 H new ATOM 420 N ASN A 33 11.260 0.420 -7.161 1.00 0.00 N ATOM 421 CA ASN A 33 10.621 -0.629 -6.385 1.00 0.00 C ATOM 422 C ASN A 33 9.460 -0.033 -5.588 1.00 0.00 C ATOM 423 O ASN A 33 9.630 0.963 -4.888 1.00 0.00 O ATOM 424 CB ASN A 33 11.604 -1.257 -5.393 1.00 0.00 C ATOM 425 CG ASN A 33 12.866 -1.744 -6.106 1.00 0.00 C ATOM 426 OD1 ASN A 33 12.969 -2.880 -6.538 1.00 0.00 O ATOM 427 ND2 ASN A 33 13.821 -0.823 -6.204 1.00 0.00 N ATOM 0 H ASN A 33 11.423 1.288 -6.651 1.00 0.00 H new ATOM 0 HA ASN A 33 10.269 -1.394 -7.077 1.00 0.00 H new ATOM 0 HB2 ASN A 33 11.872 -0.527 -4.630 1.00 0.00 H new ATOM 0 HB3 ASN A 33 11.126 -2.092 -4.881 1.00 0.00 H new ATOM 0 HD21 ASN A 33 14.703 -1.050 -6.662 1.00 0.00 H new ATOM 0 HD22 ASN A 33 13.671 0.110 -5.821 1.00 0.00 H new ATOM 433 N VAL A 34 8.305 -0.669 -5.720 1.00 0.00 N ATOM 434 CA VAL A 34 7.116 -0.214 -5.021 1.00 0.00 C ATOM 435 C VAL A 34 6.721 -1.250 -3.967 1.00 0.00 C ATOM 436 O VAL A 34 6.939 -2.446 -4.155 1.00 0.00 O ATOM 437 CB VAL A 34 5.996 0.074 -6.024 1.00 0.00 C ATOM 438 CG1 VAL A 34 4.623 -0.184 -5.401 1.00 0.00 C ATOM 439 CG2 VAL A 34 6.096 1.504 -6.560 1.00 0.00 C ATOM 0 H VAL A 34 8.168 -1.496 -6.301 1.00 0.00 H new ATOM 0 HA VAL A 34 7.316 0.722 -4.499 1.00 0.00 H new ATOM 0 HB VAL A 34 6.115 -0.608 -6.866 1.00 0.00 H new ATOM 0 HG11 VAL A 34 3.845 0.028 -6.134 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.554 -1.227 -5.091 1.00 0.00 H new ATOM 0 HG13 VAL A 34 4.490 0.462 -4.533 1.00 0.00 H new ATOM 0 HG21 VAL A 34 5.289 1.683 -7.271 1.00 0.00 H new ATOM 0 HG22 VAL A 34 6.015 2.209 -5.733 1.00 0.00 H new ATOM 0 HG23 VAL A 34 7.056 1.639 -7.059 1.00 0.00 H new ATOM 449 N ALA A 35 6.147 -0.755 -2.881 1.00 0.00 N ATOM 450 CA ALA A 35 5.719 -1.621 -1.797 1.00 0.00 C ATOM 451 C ALA A 35 4.195 -1.577 -1.683 1.00 0.00 C ATOM 452 O ALA A 35 3.619 -0.520 -1.430 1.00 0.00 O ATOM 453 CB ALA A 35 6.413 -1.199 -0.500 1.00 0.00 C ATOM 0 H ALA A 35 5.968 0.238 -2.729 1.00 0.00 H new ATOM 0 HA ALA A 35 6.004 -2.654 -1.998 1.00 0.00 H new ATOM 0 HB1 ALA A 35 6.091 -1.850 0.313 1.00 0.00 H new ATOM 0 HB2 ALA A 35 7.493 -1.279 -0.623 1.00 0.00 H new ATOM 0 HB3 ALA A 35 6.150 -0.168 -0.265 1.00 0.00 H new ATOM 459 N LEU A 36 3.584 -2.737 -1.877 1.00 0.00 N ATOM 460 CA LEU A 36 2.137 -2.843 -1.799 1.00 0.00 C ATOM 461 C LEU A 36 1.751 -3.561 -0.505 1.00 0.00 C ATOM 462 O LEU A 36 2.504 -4.398 -0.006 1.00 0.00 O ATOM 463 CB LEU A 36 1.580 -3.507 -3.061 1.00 0.00 C ATOM 464 CG LEU A 36 1.492 -2.618 -4.303 1.00 0.00 C ATOM 465 CD1 LEU A 36 1.598 -3.450 -5.581 1.00 0.00 C ATOM 466 CD2 LEU A 36 0.220 -1.766 -4.278 1.00 0.00 C ATOM 0 H LEU A 36 4.065 -3.611 -2.088 1.00 0.00 H new ATOM 0 HA LEU A 36 1.684 -1.852 -1.761 1.00 0.00 H new ATOM 0 HB2 LEU A 36 2.203 -4.369 -3.299 1.00 0.00 H new ATOM 0 HB3 LEU A 36 0.583 -3.886 -2.838 1.00 0.00 H new ATOM 0 HG LEU A 36 2.340 -1.933 -4.293 1.00 0.00 H new ATOM 0 HD11 LEU A 36 1.533 -2.794 -6.449 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.553 -3.976 -5.595 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.784 -4.175 -5.612 1.00 0.00 H new ATOM 0 HD21 LEU A 36 0.182 -1.143 -5.172 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.654 -2.417 -4.252 1.00 0.00 H new ATOM 0 HD23 LEU A 36 0.225 -1.130 -3.393 1.00 0.00 H new ATOM 477 N THR A 37 0.579 -3.211 0.002 1.00 0.00 N ATOM 478 CA THR A 37 0.084 -3.812 1.229 1.00 0.00 C ATOM 479 C THR A 37 -1.443 -3.907 1.198 1.00 0.00 C ATOM 480 O THR A 37 -2.134 -2.899 1.331 1.00 0.00 O ATOM 481 CB THR A 37 0.618 -2.992 2.406 1.00 0.00 C ATOM 482 OG1 THR A 37 0.620 -1.652 1.923 1.00 0.00 O ATOM 483 CG2 THR A 37 2.090 -3.284 2.703 1.00 0.00 C ATOM 0 H THR A 37 -0.043 -2.518 -0.415 1.00 0.00 H new ATOM 0 HA THR A 37 0.440 -4.836 1.339 1.00 0.00 H new ATOM 0 HB THR A 37 0.021 -3.200 3.294 1.00 0.00 H new ATOM 0 HG1 THR A 37 0.951 -1.052 2.624 1.00 0.00 H new ATOM 0 HG21 THR A 37 2.419 -2.676 3.546 1.00 0.00 H new ATOM 0 HG22 THR A 37 2.209 -4.339 2.948 1.00 0.00 H new ATOM 0 HG23 THR A 37 2.692 -3.045 1.827 1.00 0.00 H new ATOM 491 N TRP A 38 -1.924 -5.129 1.022 1.00 0.00 N ATOM 492 CA TRP A 38 -3.356 -5.370 0.972 1.00 0.00 C ATOM 493 C TRP A 38 -3.726 -6.270 2.153 1.00 0.00 C ATOM 494 O TRP A 38 -2.902 -7.052 2.623 1.00 0.00 O ATOM 495 CB TRP A 38 -3.766 -5.957 -0.379 1.00 0.00 C ATOM 496 CG TRP A 38 -3.082 -7.284 -0.715 1.00 0.00 C ATOM 497 CD1 TRP A 38 -3.547 -8.525 -0.519 1.00 0.00 C ATOM 498 CD2 TRP A 38 -1.780 -7.452 -1.318 1.00 0.00 C ATOM 499 NE1 TRP A 38 -2.645 -9.477 -0.950 1.00 0.00 N ATOM 500 CE2 TRP A 38 -1.537 -8.803 -1.450 1.00 0.00 C ATOM 501 CE3 TRP A 38 -0.842 -6.493 -1.736 1.00 0.00 C ATOM 502 CZ2 TRP A 38 -0.358 -9.319 -2.002 1.00 0.00 C ATOM 503 CZ3 TRP A 38 0.332 -7.024 -2.286 1.00 0.00 C ATOM 504 CH2 TRP A 38 0.592 -8.382 -2.426 1.00 0.00 C ATOM 0 H TRP A 38 -1.347 -5.963 0.912 1.00 0.00 H new ATOM 0 HA TRP A 38 -3.908 -4.434 1.062 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -4.846 -6.105 -0.387 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -3.538 -5.234 -1.162 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -4.507 -8.752 -0.079 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -2.769 -10.489 -0.909 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -1.013 -5.431 -1.641 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -0.191 -10.382 -2.096 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 1.087 -6.330 -2.625 1.00 0.00 H new ATOM 0 HH2 TRP A 38 1.524 -8.713 -2.860 1.00 0.00 H new ATOM 514 N THR A 39 -4.966 -6.128 2.597 1.00 0.00 N ATOM 515 CA THR A 39 -5.455 -6.919 3.714 1.00 0.00 C ATOM 516 C THR A 39 -6.137 -8.192 3.208 1.00 0.00 C ATOM 517 O THR A 39 -6.576 -8.251 2.060 1.00 0.00 O ATOM 518 CB THR A 39 -6.374 -6.031 4.555 1.00 0.00 C ATOM 519 OG1 THR A 39 -7.137 -5.309 3.591 1.00 0.00 O ATOM 520 CG2 THR A 39 -5.607 -4.945 5.312 1.00 0.00 C ATOM 0 H THR A 39 -5.646 -5.478 2.204 1.00 0.00 H new ATOM 0 HA THR A 39 -4.635 -7.257 4.348 1.00 0.00 H new ATOM 0 HB THR A 39 -6.924 -6.648 5.265 1.00 0.00 H new ATOM 0 HG1 THR A 39 -7.750 -4.697 4.050 1.00 0.00 H new ATOM 0 HG21 THR A 39 -6.306 -4.343 5.893 1.00 0.00 H new ATOM 0 HG22 THR A 39 -4.885 -5.410 5.983 1.00 0.00 H new ATOM 0 HG23 THR A 39 -5.083 -4.307 4.601 1.00 0.00 H new ATOM 528 N PRO A 40 -6.205 -9.205 4.113 1.00 0.00 N ATOM 529 CA PRO A 40 -6.825 -10.474 3.769 1.00 0.00 C ATOM 530 C PRO A 40 -8.350 -10.349 3.742 1.00 0.00 C ATOM 531 O PRO A 40 -8.908 -9.395 4.282 1.00 0.00 O ATOM 532 CB PRO A 40 -6.328 -11.452 4.822 1.00 0.00 C ATOM 533 CG PRO A 40 -5.824 -10.601 5.977 1.00 0.00 C ATOM 534 CD PRO A 40 -5.695 -9.171 5.480 1.00 0.00 C ATOM 0 HA PRO A 40 -6.558 -10.816 2.769 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -7.129 -12.116 5.147 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -5.532 -12.082 4.425 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -6.515 -10.652 6.819 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -4.862 -10.970 6.332 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -6.270 -8.483 6.100 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -4.659 -8.834 5.507 1.00 0.00 H new ATOM 539 N PRO A 41 -8.998 -11.352 3.092 1.00 0.00 N ATOM 540 CA PRO A 41 -10.447 -11.364 2.987 1.00 0.00 C ATOM 541 C PRO A 41 -11.089 -11.765 4.317 1.00 0.00 C ATOM 542 O PRO A 41 -10.501 -12.517 5.092 1.00 0.00 O ATOM 543 CB PRO A 41 -10.752 -12.338 1.862 1.00 0.00 C ATOM 544 CG PRO A 41 -9.500 -13.183 1.690 1.00 0.00 C ATOM 545 CD PRO A 41 -8.369 -12.498 2.439 1.00 0.00 C ATOM 0 HA PRO A 41 -10.861 -10.380 2.766 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -11.612 -12.961 2.107 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -10.994 -11.807 0.941 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -9.662 -14.188 2.079 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -9.251 -13.286 0.634 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -7.913 -13.168 3.168 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -7.578 -12.182 1.759 1.00 0.00 H new ATOM 550 N LYS A 42 -12.288 -11.246 4.538 1.00 0.00 N ATOM 551 CA LYS A 42 -13.016 -11.541 5.760 1.00 0.00 C ATOM 552 C LYS A 42 -13.757 -12.869 5.599 1.00 0.00 C ATOM 553 O LYS A 42 -14.342 -13.377 6.554 1.00 0.00 O ATOM 554 CB LYS A 42 -13.927 -10.370 6.137 1.00 0.00 C ATOM 555 CG LYS A 42 -13.264 -9.474 7.185 1.00 0.00 C ATOM 556 CD LYS A 42 -14.301 -8.598 7.890 1.00 0.00 C ATOM 557 CE LYS A 42 -14.361 -7.204 7.260 1.00 0.00 C ATOM 558 NZ LYS A 42 -15.765 -6.809 7.010 1.00 0.00 N ATOM 0 H LYS A 42 -12.773 -10.623 3.892 1.00 0.00 H new ATOM 0 HA LYS A 42 -12.326 -11.660 6.595 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -14.159 -9.784 5.247 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -14.872 -10.750 6.524 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -12.743 -10.090 7.918 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -12.514 -8.844 6.708 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -15.282 -9.070 7.831 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -14.052 -8.513 8.948 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -13.885 -6.479 7.920 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -13.803 -7.197 6.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -15.788 -5.861 6.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -16.208 -7.492 6.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -16.287 -6.796 7.909 1.00 0.00 H new ATOM 568 N ASP A 43 -13.708 -13.394 4.384 1.00 0.00 N ATOM 569 CA ASP A 43 -14.366 -14.654 4.085 1.00 0.00 C ATOM 570 C ASP A 43 -13.310 -15.736 3.856 1.00 0.00 C ATOM 571 O ASP A 43 -12.182 -15.435 3.469 1.00 0.00 O ATOM 572 CB ASP A 43 -15.215 -14.546 2.816 1.00 0.00 C ATOM 573 CG ASP A 43 -16.295 -15.619 2.667 1.00 0.00 C ATOM 574 OD1 ASP A 43 -16.854 -16.011 3.713 1.00 0.00 O ATOM 575 OD2 ASP A 43 -16.537 -16.022 1.508 1.00 0.00 O ATOM 0 H ASP A 43 -13.222 -12.969 3.594 1.00 0.00 H new ATOM 0 HA ASP A 43 -15.009 -14.905 4.929 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -15.693 -13.566 2.799 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -14.555 -14.594 1.950 1.00 0.00 H new ATOM 579 N ASP A 44 -13.712 -16.974 4.105 1.00 0.00 N ATOM 580 CA ASP A 44 -12.813 -18.102 3.931 1.00 0.00 C ATOM 581 C ASP A 44 -13.533 -19.389 4.337 1.00 0.00 C ATOM 582 O ASP A 44 -13.492 -19.787 5.501 1.00 0.00 O ATOM 583 CB ASP A 44 -11.570 -17.957 4.812 1.00 0.00 C ATOM 584 CG ASP A 44 -11.847 -17.879 6.314 1.00 0.00 C ATOM 585 OD1 ASP A 44 -12.579 -16.944 6.708 1.00 0.00 O ATOM 586 OD2 ASP A 44 -11.322 -18.754 7.035 1.00 0.00 O ATOM 0 H ASP A 44 -14.648 -17.220 4.426 1.00 0.00 H new ATOM 0 HA ASP A 44 -12.511 -18.134 2.884 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -10.909 -18.803 4.623 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -11.032 -17.058 4.510 1.00 0.00 H new ATOM 590 N GLY A 45 -14.176 -20.005 3.356 1.00 0.00 N ATOM 591 CA GLY A 45 -14.904 -21.240 3.597 1.00 0.00 C ATOM 592 C GLY A 45 -15.363 -21.870 2.281 1.00 0.00 C ATOM 593 O GLY A 45 -14.705 -22.766 1.755 1.00 0.00 O ATOM 0 H GLY A 45 -14.208 -19.672 2.392 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -14.269 -21.941 4.138 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -15.769 -21.039 4.230 1.00 0.00 H new ATOM 597 N ASN A 46 -16.490 -21.378 1.787 1.00 0.00 N ATOM 598 CA ASN A 46 -17.044 -21.883 0.543 1.00 0.00 C ATOM 599 C ASN A 46 -15.916 -22.079 -0.472 1.00 0.00 C ATOM 600 O ASN A 46 -15.747 -23.171 -1.014 1.00 0.00 O ATOM 601 CB ASN A 46 -18.049 -20.895 -0.054 1.00 0.00 C ATOM 602 CG ASN A 46 -19.354 -20.891 0.745 1.00 0.00 C ATOM 603 OD1 ASN A 46 -20.230 -21.718 0.556 1.00 0.00 O ATOM 604 ND2 ASN A 46 -19.434 -19.915 1.645 1.00 0.00 N ATOM 0 H ASN A 46 -17.034 -20.635 2.226 1.00 0.00 H new ATOM 0 HA ASN A 46 -17.547 -22.826 0.758 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -17.619 -19.893 -0.061 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -18.254 -21.161 -1.091 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -20.266 -19.826 2.228 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -18.663 -19.255 1.752 1.00 0.00 H new ATOM 610 N ALA A 47 -15.173 -21.006 -0.698 1.00 0.00 N ATOM 611 CA ALA A 47 -14.066 -21.046 -1.637 1.00 0.00 C ATOM 612 C ALA A 47 -12.791 -20.571 -0.937 1.00 0.00 C ATOM 613 O ALA A 47 -12.391 -19.417 -1.083 1.00 0.00 O ATOM 614 CB ALA A 47 -14.406 -20.200 -2.865 1.00 0.00 C ATOM 0 H ALA A 47 -15.316 -20.103 -0.246 1.00 0.00 H new ATOM 0 HA ALA A 47 -13.893 -22.065 -1.982 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -13.575 -20.230 -3.569 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -15.302 -20.596 -3.343 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -14.584 -19.169 -2.559 1.00 0.00 H new ATOM 620 N ALA A 48 -12.188 -21.485 -0.192 1.00 0.00 N ATOM 621 CA ALA A 48 -10.966 -21.174 0.532 1.00 0.00 C ATOM 622 C ALA A 48 -9.961 -20.531 -0.426 1.00 0.00 C ATOM 623 O ALA A 48 -9.589 -21.130 -1.435 1.00 0.00 O ATOM 624 CB ALA A 48 -10.420 -22.446 1.183 1.00 0.00 C ATOM 0 H ALA A 48 -12.522 -22.441 -0.074 1.00 0.00 H new ATOM 0 HA ALA A 48 -11.164 -20.459 1.331 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -9.504 -22.213 1.726 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -11.160 -22.847 1.876 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -10.206 -23.186 0.412 1.00 0.00 H new ATOM 630 N ILE A 49 -9.549 -19.321 -0.078 1.00 0.00 N ATOM 631 CA ILE A 49 -8.594 -18.593 -0.894 1.00 0.00 C ATOM 632 C ILE A 49 -7.305 -19.408 -1.016 1.00 0.00 C ATOM 633 O ILE A 49 -6.970 -20.183 -0.122 1.00 0.00 O ATOM 634 CB ILE A 49 -8.379 -17.183 -0.337 1.00 0.00 C ATOM 635 CG1 ILE A 49 -9.670 -16.364 -0.404 1.00 0.00 C ATOM 636 CG2 ILE A 49 -7.219 -16.484 -1.047 1.00 0.00 C ATOM 637 CD1 ILE A 49 -10.355 -16.306 0.962 1.00 0.00 C ATOM 0 H ILE A 49 -9.860 -18.827 0.758 1.00 0.00 H new ATOM 0 HA ILE A 49 -8.982 -18.458 -1.904 1.00 0.00 H new ATOM 0 HB ILE A 49 -8.107 -17.269 0.715 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -9.446 -15.353 -0.746 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -10.347 -16.805 -1.136 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -7.088 -15.485 -0.632 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -6.305 -17.059 -0.903 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -7.437 -16.409 -2.112 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -11.270 -15.718 0.886 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -10.599 -17.316 1.290 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -9.685 -15.842 1.686 1.00 0.00 H new ATOM 648 N THR A 50 -6.618 -19.206 -2.130 1.00 0.00 N ATOM 649 CA THR A 50 -5.374 -19.913 -2.381 1.00 0.00 C ATOM 650 C THR A 50 -4.209 -18.926 -2.480 1.00 0.00 C ATOM 651 O THR A 50 -3.157 -19.139 -1.881 1.00 0.00 O ATOM 652 CB THR A 50 -5.558 -20.763 -3.640 1.00 0.00 C ATOM 653 OG1 THR A 50 -5.646 -19.808 -4.694 1.00 0.00 O ATOM 654 CG2 THR A 50 -6.911 -21.477 -3.671 1.00 0.00 C ATOM 0 H THR A 50 -6.899 -18.562 -2.870 1.00 0.00 H new ATOM 0 HA THR A 50 -5.125 -20.579 -1.555 1.00 0.00 H new ATOM 0 HB THR A 50 -4.757 -21.500 -3.701 1.00 0.00 H new ATOM 0 HG1 THR A 50 -5.765 -20.274 -5.548 1.00 0.00 H new ATOM 0 HG21 THR A 50 -6.991 -22.066 -4.585 1.00 0.00 H new ATOM 0 HG22 THR A 50 -6.995 -22.135 -2.806 1.00 0.00 H new ATOM 0 HG23 THR A 50 -7.713 -20.739 -3.644 1.00 0.00 H new ATOM 662 N GLY A 51 -4.438 -17.866 -3.241 1.00 0.00 N ATOM 663 CA GLY A 51 -3.421 -16.844 -3.426 1.00 0.00 C ATOM 664 C GLY A 51 -4.050 -15.513 -3.841 1.00 0.00 C ATOM 665 O GLY A 51 -5.265 -15.341 -3.749 1.00 0.00 O ATOM 0 H GLY A 51 -5.312 -17.692 -3.737 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -2.860 -16.712 -2.501 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -2.710 -17.167 -4.186 1.00 0.00 H new ATOM 669 N TYR A 52 -3.195 -14.604 -4.288 1.00 0.00 N ATOM 670 CA TYR A 52 -3.652 -13.293 -4.717 1.00 0.00 C ATOM 671 C TYR A 52 -2.820 -12.781 -5.894 1.00 0.00 C ATOM 672 O TYR A 52 -1.592 -12.766 -5.831 1.00 0.00 O ATOM 673 CB TYR A 52 -3.448 -12.363 -3.519 1.00 0.00 C ATOM 674 CG TYR A 52 -4.042 -12.891 -2.211 1.00 0.00 C ATOM 675 CD1 TYR A 52 -3.285 -13.693 -1.383 1.00 0.00 C ATOM 676 CD2 TYR A 52 -5.337 -12.564 -1.862 1.00 0.00 C ATOM 677 CE1 TYR A 52 -3.845 -14.188 -0.153 1.00 0.00 C ATOM 678 CE2 TYR A 52 -5.897 -13.061 -0.632 1.00 0.00 C ATOM 679 CZ TYR A 52 -5.124 -13.849 0.162 1.00 0.00 C ATOM 680 OH TYR A 52 -5.653 -14.318 1.323 1.00 0.00 O ATOM 0 H TYR A 52 -2.188 -14.750 -4.362 1.00 0.00 H new ATOM 0 HA TYR A 52 -4.692 -13.335 -5.041 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -2.380 -12.196 -3.380 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -3.895 -11.395 -3.744 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -2.272 -13.950 -1.657 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -5.930 -11.936 -2.511 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -3.262 -14.815 0.506 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -6.909 -12.813 -0.346 1.00 0.00 H new ATOM 0 HH TYR A 52 -5.909 -13.564 1.894 1.00 0.00 H new ATOM 689 N THR A 53 -3.523 -12.372 -6.940 1.00 0.00 N ATOM 690 CA THR A 53 -2.865 -11.860 -8.130 1.00 0.00 C ATOM 691 C THR A 53 -2.683 -10.344 -8.028 1.00 0.00 C ATOM 692 O THR A 53 -3.508 -9.656 -7.430 1.00 0.00 O ATOM 693 CB THR A 53 -3.683 -12.294 -9.347 1.00 0.00 C ATOM 694 OG1 THR A 53 -3.530 -13.711 -9.381 1.00 0.00 O ATOM 695 CG2 THR A 53 -3.067 -11.822 -10.666 1.00 0.00 C ATOM 0 H THR A 53 -4.542 -12.385 -6.988 1.00 0.00 H new ATOM 0 HA THR A 53 -1.860 -12.270 -8.234 1.00 0.00 H new ATOM 0 HB THR A 53 -4.697 -11.904 -9.260 1.00 0.00 H new ATOM 0 HG1 THR A 53 -3.697 -14.036 -10.290 1.00 0.00 H new ATOM 0 HG21 THR A 53 -3.687 -12.157 -11.498 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.009 -10.734 -10.672 1.00 0.00 H new ATOM 0 HG23 THR A 53 -2.065 -12.239 -10.769 1.00 0.00 H new ATOM 703 N ILE A 54 -1.599 -9.869 -8.622 1.00 0.00 N ATOM 704 CA ILE A 54 -1.299 -8.448 -8.607 1.00 0.00 C ATOM 705 C ILE A 54 -1.012 -7.975 -10.033 1.00 0.00 C ATOM 706 O ILE A 54 -0.516 -8.743 -10.857 1.00 0.00 O ATOM 707 CB ILE A 54 -0.168 -8.149 -7.621 1.00 0.00 C ATOM 708 CG1 ILE A 54 -0.601 -8.441 -6.183 1.00 0.00 C ATOM 709 CG2 ILE A 54 0.341 -6.716 -7.787 1.00 0.00 C ATOM 710 CD1 ILE A 54 0.201 -9.601 -5.592 1.00 0.00 C ATOM 0 H ILE A 54 -0.917 -10.444 -9.117 1.00 0.00 H new ATOM 0 HA ILE A 54 -2.160 -7.882 -8.251 1.00 0.00 H new ATOM 0 HB ILE A 54 0.665 -8.814 -7.847 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -0.463 -7.550 -5.570 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -1.664 -8.681 -6.162 1.00 0.00 H new ATOM 0 HG21 ILE A 54 1.144 -6.530 -7.074 1.00 0.00 H new ATOM 0 HG22 ILE A 54 0.717 -6.578 -8.801 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -0.475 -6.017 -7.604 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -0.128 -9.787 -4.569 1.00 0.00 H new ATOM 0 HD12 ILE A 54 0.042 -10.497 -6.193 1.00 0.00 H new ATOM 0 HD13 ILE A 54 1.261 -9.348 -5.592 1.00 0.00 H new ATOM 721 N GLN A 55 -1.336 -6.715 -10.282 1.00 0.00 N ATOM 722 CA GLN A 55 -1.120 -6.131 -11.595 1.00 0.00 C ATOM 723 C GLN A 55 -0.772 -4.647 -11.465 1.00 0.00 C ATOM 724 O GLN A 55 -1.117 -4.009 -10.471 1.00 0.00 O ATOM 725 CB GLN A 55 -2.342 -6.332 -12.493 1.00 0.00 C ATOM 726 CG GLN A 55 -2.573 -7.817 -12.780 1.00 0.00 C ATOM 727 CD GLN A 55 -3.177 -8.019 -14.171 1.00 0.00 C ATOM 728 OE1 GLN A 55 -3.035 -7.199 -15.063 1.00 0.00 O ATOM 729 NE2 GLN A 55 -3.857 -9.154 -14.307 1.00 0.00 N ATOM 0 H GLN A 55 -1.747 -6.082 -9.596 1.00 0.00 H new ATOM 0 HA GLN A 55 -0.279 -6.641 -12.064 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -3.224 -5.909 -12.013 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -2.201 -5.794 -13.431 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -1.628 -8.356 -12.708 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -3.238 -8.238 -12.026 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -3.938 -9.798 -13.520 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -4.298 -9.381 -15.198 1.00 0.00 H new ATOM 736 N LYS A 56 -0.094 -4.140 -12.484 1.00 0.00 N ATOM 737 CA LYS A 56 0.304 -2.742 -12.496 1.00 0.00 C ATOM 738 C LYS A 56 -0.223 -2.077 -13.770 1.00 0.00 C ATOM 739 O LYS A 56 -0.446 -2.748 -14.777 1.00 0.00 O ATOM 740 CB LYS A 56 1.819 -2.614 -12.317 1.00 0.00 C ATOM 741 CG LYS A 56 2.563 -3.154 -13.540 1.00 0.00 C ATOM 742 CD LYS A 56 4.063 -3.263 -13.264 1.00 0.00 C ATOM 743 CE LYS A 56 4.809 -3.791 -14.491 1.00 0.00 C ATOM 744 NZ LYS A 56 6.168 -4.243 -14.116 1.00 0.00 N ATOM 0 H LYS A 56 0.190 -4.672 -13.307 1.00 0.00 H new ATOM 0 HA LYS A 56 -0.139 -2.213 -11.652 1.00 0.00 H new ATOM 0 HB2 LYS A 56 2.083 -1.568 -12.159 1.00 0.00 H new ATOM 0 HB3 LYS A 56 2.131 -3.160 -11.427 1.00 0.00 H new ATOM 0 HG2 LYS A 56 2.167 -4.133 -13.808 1.00 0.00 H new ATOM 0 HG3 LYS A 56 2.393 -2.497 -14.393 1.00 0.00 H new ATOM 0 HD2 LYS A 56 4.457 -2.285 -12.987 1.00 0.00 H new ATOM 0 HD3 LYS A 56 4.233 -3.927 -12.417 1.00 0.00 H new ATOM 0 HE2 LYS A 56 4.254 -4.618 -14.934 1.00 0.00 H new ATOM 0 HE3 LYS A 56 4.875 -3.010 -15.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 6.769 -4.276 -14.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 6.577 -3.580 -13.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 6.114 -5.192 -13.693 1.00 0.00 H new ATOM 754 N ALA A 57 -0.405 -0.769 -13.683 1.00 0.00 N ATOM 755 CA ALA A 57 -0.902 -0.006 -14.817 1.00 0.00 C ATOM 756 C ALA A 57 -0.470 1.455 -14.671 1.00 0.00 C ATOM 757 O ALA A 57 -0.940 2.160 -13.780 1.00 0.00 O ATOM 758 CB ALA A 57 -2.422 -0.158 -14.908 1.00 0.00 C ATOM 0 H ALA A 57 -0.218 -0.217 -12.846 1.00 0.00 H new ATOM 0 HA ALA A 57 -0.480 -0.384 -15.748 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -2.795 0.414 -15.758 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -2.675 -1.210 -15.039 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -2.880 0.214 -13.992 1.00 0.00 H new ATOM 764 N ASP A 58 0.421 1.865 -15.561 1.00 0.00 N ATOM 765 CA ASP A 58 0.923 3.229 -15.544 1.00 0.00 C ATOM 766 C ASP A 58 -0.257 4.202 -15.580 1.00 0.00 C ATOM 767 O ASP A 58 -1.390 3.801 -15.844 1.00 0.00 O ATOM 768 CB ASP A 58 1.803 3.508 -16.763 1.00 0.00 C ATOM 769 CG ASP A 58 2.570 2.297 -17.299 1.00 0.00 C ATOM 770 OD1 ASP A 58 3.460 1.818 -16.563 1.00 0.00 O ATOM 771 OD2 ASP A 58 2.248 1.878 -18.432 1.00 0.00 O ATOM 0 H ASP A 58 0.809 1.277 -16.299 1.00 0.00 H new ATOM 0 HA ASP A 58 1.513 3.360 -14.637 1.00 0.00 H new ATOM 0 HB2 ASP A 58 1.176 3.904 -17.562 1.00 0.00 H new ATOM 0 HB3 ASP A 58 2.520 4.287 -16.504 1.00 0.00 H new ATOM 775 N LYS A 59 0.048 5.463 -15.311 1.00 0.00 N ATOM 776 CA LYS A 59 -0.974 6.496 -15.310 1.00 0.00 C ATOM 777 C LYS A 59 -1.061 7.124 -16.703 1.00 0.00 C ATOM 778 O LYS A 59 -1.496 8.265 -16.847 1.00 0.00 O ATOM 779 CB LYS A 59 -0.710 7.510 -14.195 1.00 0.00 C ATOM 780 CG LYS A 59 -1.767 7.404 -13.095 1.00 0.00 C ATOM 781 CD LYS A 59 -2.806 8.519 -13.222 1.00 0.00 C ATOM 782 CE LYS A 59 -2.421 9.727 -12.366 1.00 0.00 C ATOM 783 NZ LYS A 59 -3.050 10.958 -12.894 1.00 0.00 N ATOM 0 H LYS A 59 0.988 5.793 -15.092 1.00 0.00 H new ATOM 0 HA LYS A 59 -1.951 6.064 -15.093 1.00 0.00 H new ATOM 0 HB2 LYS A 59 0.280 7.340 -13.771 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -0.710 8.519 -14.608 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -2.261 6.434 -13.153 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -1.287 7.459 -12.118 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -2.894 8.822 -14.265 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -3.783 8.147 -12.914 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -2.735 9.564 -11.335 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -1.337 9.841 -12.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -2.778 11.768 -12.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -2.730 11.120 -13.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -4.084 10.852 -12.882 1.00 0.00 H new ATOM 793 N LYS A 60 -0.641 6.349 -17.692 1.00 0.00 N ATOM 794 CA LYS A 60 -0.666 6.815 -19.069 1.00 0.00 C ATOM 795 C LYS A 60 -1.773 6.083 -19.830 1.00 0.00 C ATOM 796 O LYS A 60 -2.589 6.712 -20.502 1.00 0.00 O ATOM 797 CB LYS A 60 0.717 6.672 -19.708 1.00 0.00 C ATOM 798 CG LYS A 60 1.780 7.397 -18.882 1.00 0.00 C ATOM 799 CD LYS A 60 2.661 6.401 -18.125 1.00 0.00 C ATOM 800 CE LYS A 60 4.145 6.683 -18.371 1.00 0.00 C ATOM 801 NZ LYS A 60 4.980 5.605 -17.795 1.00 0.00 N ATOM 0 H LYS A 60 -0.282 5.402 -17.568 1.00 0.00 H new ATOM 0 HA LYS A 60 -0.901 7.879 -19.107 1.00 0.00 H new ATOM 0 HB2 LYS A 60 0.975 5.616 -19.793 1.00 0.00 H new ATOM 0 HB3 LYS A 60 0.698 7.078 -20.719 1.00 0.00 H new ATOM 0 HG2 LYS A 60 2.399 8.010 -19.537 1.00 0.00 H new ATOM 0 HG3 LYS A 60 1.298 8.072 -18.175 1.00 0.00 H new ATOM 0 HD2 LYS A 60 2.448 6.460 -17.058 1.00 0.00 H new ATOM 0 HD3 LYS A 60 2.423 5.386 -18.442 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.333 6.764 -19.442 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.418 7.640 -17.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 5.984 5.812 -17.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.813 5.546 -16.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.731 4.698 -18.239 1.00 0.00 H new ATOM 811 N SER A 61 -1.767 4.765 -19.699 1.00 0.00 N ATOM 812 CA SER A 61 -2.761 3.941 -20.366 1.00 0.00 C ATOM 813 C SER A 61 -3.550 3.135 -19.333 1.00 0.00 C ATOM 814 O SER A 61 -4.579 2.543 -19.656 1.00 0.00 O ATOM 815 CB SER A 61 -2.107 3.005 -21.384 1.00 0.00 C ATOM 816 OG SER A 61 -2.770 3.041 -22.645 1.00 0.00 O ATOM 0 H SER A 61 -1.089 4.247 -19.140 1.00 0.00 H new ATOM 0 HA SER A 61 -3.445 4.597 -20.904 1.00 0.00 H new ATOM 0 HB2 SER A 61 -1.062 3.286 -21.516 1.00 0.00 H new ATOM 0 HB3 SER A 61 -2.117 1.986 -20.998 1.00 0.00 H new ATOM 0 HG SER A 61 -2.125 2.857 -23.359 1.00 0.00 H new ATOM 821 N MET A 62 -3.038 3.135 -18.111 1.00 0.00 N ATOM 822 CA MET A 62 -3.681 2.410 -17.028 1.00 0.00 C ATOM 823 C MET A 62 -4.099 1.010 -17.480 1.00 0.00 C ATOM 824 O MET A 62 -5.055 0.443 -16.952 1.00 0.00 O ATOM 825 CB MET A 62 -4.915 3.185 -16.558 1.00 0.00 C ATOM 826 CG MET A 62 -6.064 3.046 -17.560 1.00 0.00 C ATOM 827 SD MET A 62 -7.630 3.208 -16.719 1.00 0.00 S ATOM 828 CE MET A 62 -7.400 2.021 -15.406 1.00 0.00 C ATOM 0 H MET A 62 -2.184 3.626 -17.847 1.00 0.00 H new ATOM 0 HA MET A 62 -2.970 2.310 -16.208 1.00 0.00 H new ATOM 0 HB2 MET A 62 -5.231 2.815 -15.583 1.00 0.00 H new ATOM 0 HB3 MET A 62 -4.662 4.238 -16.433 1.00 0.00 H new ATOM 0 HG2 MET A 62 -5.977 3.809 -18.334 1.00 0.00 H new ATOM 0 HG3 MET A 62 -6.008 2.078 -18.058 1.00 0.00 H new ATOM 0 HE1 MET A 62 -8.372 1.702 -15.029 1.00 0.00 H new ATOM 0 HE2 MET A 62 -6.857 1.156 -15.788 1.00 0.00 H new ATOM 0 HE3 MET A 62 -6.830 2.479 -14.598 1.00 0.00 H new ATOM 836 N GLU A 63 -3.361 0.491 -18.450 1.00 0.00 N ATOM 837 CA GLU A 63 -3.643 -0.833 -18.978 1.00 0.00 C ATOM 838 C GLU A 63 -3.173 -1.908 -17.995 1.00 0.00 C ATOM 839 O GLU A 63 -2.038 -1.866 -17.520 1.00 0.00 O ATOM 840 CB GLU A 63 -2.996 -1.025 -20.350 1.00 0.00 C ATOM 841 CG GLU A 63 -3.568 -0.038 -21.370 1.00 0.00 C ATOM 842 CD GLU A 63 -2.587 0.191 -22.522 1.00 0.00 C ATOM 843 OE1 GLU A 63 -1.375 0.270 -22.228 1.00 0.00 O ATOM 844 OE2 GLU A 63 -3.073 0.283 -23.670 1.00 0.00 O ATOM 0 H GLU A 63 -2.568 0.963 -18.884 1.00 0.00 H new ATOM 0 HA GLU A 63 -4.721 -0.930 -19.104 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -1.918 -0.887 -20.270 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -3.162 -2.046 -20.694 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -4.511 -0.420 -21.761 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -3.787 0.911 -20.880 1.00 0.00 H new ATOM 849 N TRP A 64 -4.067 -2.844 -17.719 1.00 0.00 N ATOM 850 CA TRP A 64 -3.758 -3.927 -16.801 1.00 0.00 C ATOM 851 C TRP A 64 -3.241 -5.110 -17.623 1.00 0.00 C ATOM 852 O TRP A 64 -3.949 -5.627 -18.485 1.00 0.00 O ATOM 853 CB TRP A 64 -4.974 -4.282 -15.941 1.00 0.00 C ATOM 854 CG TRP A 64 -5.646 -3.074 -15.287 1.00 0.00 C ATOM 855 CD1 TRP A 64 -6.721 -2.397 -15.713 1.00 0.00 C ATOM 856 CD2 TRP A 64 -5.243 -2.425 -14.063 1.00 0.00 C ATOM 857 NE1 TRP A 64 -7.039 -1.362 -14.856 1.00 0.00 N ATOM 858 CE2 TRP A 64 -6.110 -1.379 -13.821 1.00 0.00 C ATOM 859 CE3 TRP A 64 -4.178 -2.710 -13.190 1.00 0.00 C ATOM 860 CZ2 TRP A 64 -6.004 -0.536 -12.709 1.00 0.00 C ATOM 861 CZ3 TRP A 64 -4.086 -1.858 -12.082 1.00 0.00 C ATOM 862 CH2 TRP A 64 -4.952 -0.801 -11.825 1.00 0.00 C ATOM 0 H TRP A 64 -5.006 -2.876 -18.115 1.00 0.00 H new ATOM 0 HA TRP A 64 -2.982 -3.626 -16.097 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -5.706 -4.801 -16.561 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -4.665 -4.979 -15.162 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -7.270 -2.631 -16.613 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -7.813 -0.706 -14.962 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -3.486 -3.521 -13.360 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -6.697 0.275 -12.542 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -3.286 -2.034 -11.378 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -4.813 -0.187 -10.947 1.00 0.00 H new ATOM 872 N PHE A 65 -2.011 -5.504 -17.325 1.00 0.00 N ATOM 873 CA PHE A 65 -1.392 -6.616 -18.025 1.00 0.00 C ATOM 874 C PHE A 65 -1.177 -7.804 -17.086 1.00 0.00 C ATOM 875 O PHE A 65 -1.838 -8.833 -17.219 1.00 0.00 O ATOM 876 CB PHE A 65 -0.033 -6.126 -18.529 1.00 0.00 C ATOM 877 CG PHE A 65 0.183 -6.322 -20.030 1.00 0.00 C ATOM 878 CD1 PHE A 65 -0.715 -5.817 -20.917 1.00 0.00 C ATOM 879 CD2 PHE A 65 1.272 -7.001 -20.478 1.00 0.00 C ATOM 880 CE1 PHE A 65 -0.516 -5.999 -22.312 1.00 0.00 C ATOM 881 CE2 PHE A 65 1.472 -7.183 -21.872 1.00 0.00 C ATOM 882 CZ PHE A 65 0.574 -6.678 -22.759 1.00 0.00 C ATOM 0 H PHE A 65 -1.427 -5.073 -16.608 1.00 0.00 H new ATOM 0 HA PHE A 65 -2.034 -6.945 -18.842 1.00 0.00 H new ATOM 0 HB2 PHE A 65 0.070 -5.067 -18.293 1.00 0.00 H new ATOM 0 HB3 PHE A 65 0.754 -6.651 -17.988 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -1.580 -5.277 -20.561 1.00 0.00 H new ATOM 0 HD2 PHE A 65 1.985 -7.402 -19.773 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -1.230 -5.598 -23.017 1.00 0.00 H new ATOM 0 HE2 PHE A 65 2.337 -7.723 -22.228 1.00 0.00 H new ATOM 0 HZ PHE A 65 0.726 -6.816 -23.819 1.00 0.00 H new ATOM 891 N THR A 66 -0.249 -7.623 -16.157 1.00 0.00 N ATOM 892 CA THR A 66 0.060 -8.667 -15.195 1.00 0.00 C ATOM 893 C THR A 66 1.368 -8.350 -14.467 1.00 0.00 C ATOM 894 O THR A 66 2.304 -7.821 -15.065 1.00 0.00 O ATOM 895 CB THR A 66 0.089 -10.003 -15.940 1.00 0.00 C ATOM 896 OG1 THR A 66 -1.203 -10.557 -15.709 1.00 0.00 O ATOM 897 CG2 THR A 66 1.046 -11.010 -15.301 1.00 0.00 C ATOM 0 H THR A 66 0.299 -6.769 -16.050 1.00 0.00 H new ATOM 0 HA THR A 66 -0.702 -8.728 -14.418 1.00 0.00 H new ATOM 0 HB THR A 66 0.380 -9.834 -16.977 1.00 0.00 H new ATOM 0 HG1 THR A 66 -1.868 -10.069 -16.238 1.00 0.00 H new ATOM 0 HG21 THR A 66 1.028 -11.940 -15.869 1.00 0.00 H new ATOM 0 HG22 THR A 66 2.057 -10.603 -15.303 1.00 0.00 H new ATOM 0 HG23 THR A 66 0.736 -11.206 -14.274 1.00 0.00 H new ATOM 905 N VAL A 67 1.390 -8.685 -13.185 1.00 0.00 N ATOM 906 CA VAL A 67 2.567 -8.441 -12.368 1.00 0.00 C ATOM 907 C VAL A 67 3.006 -9.752 -11.711 1.00 0.00 C ATOM 908 O VAL A 67 4.194 -10.071 -11.684 1.00 0.00 O ATOM 909 CB VAL A 67 2.282 -7.331 -11.355 1.00 0.00 C ATOM 910 CG1 VAL A 67 3.345 -7.306 -10.256 1.00 0.00 C ATOM 911 CG2 VAL A 67 2.177 -5.972 -12.048 1.00 0.00 C ATOM 0 H VAL A 67 0.612 -9.123 -12.692 1.00 0.00 H new ATOM 0 HA VAL A 67 3.395 -8.093 -12.986 1.00 0.00 H new ATOM 0 HB VAL A 67 1.321 -7.543 -10.886 1.00 0.00 H new ATOM 0 HG11 VAL A 67 3.119 -6.508 -9.549 1.00 0.00 H new ATOM 0 HG12 VAL A 67 3.351 -8.263 -9.734 1.00 0.00 H new ATOM 0 HG13 VAL A 67 4.324 -7.130 -10.701 1.00 0.00 H new ATOM 0 HG21 VAL A 67 1.974 -5.200 -11.306 1.00 0.00 H new ATOM 0 HG22 VAL A 67 3.115 -5.749 -12.556 1.00 0.00 H new ATOM 0 HG23 VAL A 67 1.367 -5.997 -12.777 1.00 0.00 H new ATOM 921 N ILE A 68 2.023 -10.477 -11.196 1.00 0.00 N ATOM 922 CA ILE A 68 2.292 -11.745 -10.541 1.00 0.00 C ATOM 923 C ILE A 68 1.032 -12.612 -10.580 1.00 0.00 C ATOM 924 O ILE A 68 -0.058 -12.117 -10.861 1.00 0.00 O ATOM 925 CB ILE A 68 2.837 -11.515 -9.130 1.00 0.00 C ATOM 926 CG1 ILE A 68 4.212 -12.162 -8.960 1.00 0.00 C ATOM 927 CG2 ILE A 68 1.842 -11.997 -8.073 1.00 0.00 C ATOM 928 CD1 ILE A 68 4.132 -13.678 -9.152 1.00 0.00 C ATOM 0 H ILE A 68 1.039 -10.210 -11.220 1.00 0.00 H new ATOM 0 HA ILE A 68 3.071 -12.290 -11.073 1.00 0.00 H new ATOM 0 HB ILE A 68 2.967 -10.442 -8.985 1.00 0.00 H new ATOM 0 HG12 ILE A 68 4.910 -11.737 -9.681 1.00 0.00 H new ATOM 0 HG13 ILE A 68 4.603 -11.938 -7.968 1.00 0.00 H new ATOM 0 HG21 ILE A 68 2.254 -11.822 -7.079 1.00 0.00 H new ATOM 0 HG22 ILE A 68 0.905 -11.450 -8.179 1.00 0.00 H new ATOM 0 HG23 ILE A 68 1.657 -13.063 -8.207 1.00 0.00 H new ATOM 0 HD11 ILE A 68 5.123 -14.114 -9.026 1.00 0.00 H new ATOM 0 HD12 ILE A 68 3.452 -14.103 -8.413 1.00 0.00 H new ATOM 0 HD13 ILE A 68 3.763 -13.899 -10.154 1.00 0.00 H new ATOM 939 N GLU A 69 1.224 -13.891 -10.293 1.00 0.00 N ATOM 940 CA GLU A 69 0.116 -14.832 -10.292 1.00 0.00 C ATOM 941 C GLU A 69 0.277 -15.841 -9.151 1.00 0.00 C ATOM 942 O GLU A 69 1.395 -16.141 -8.739 1.00 0.00 O ATOM 943 CB GLU A 69 -0.001 -15.543 -11.641 1.00 0.00 C ATOM 944 CG GLU A 69 -0.390 -14.560 -12.747 1.00 0.00 C ATOM 945 CD GLU A 69 -1.530 -15.119 -13.602 1.00 0.00 C ATOM 946 OE1 GLU A 69 -1.410 -16.296 -14.007 1.00 0.00 O ATOM 947 OE2 GLU A 69 -2.493 -14.358 -13.830 1.00 0.00 O ATOM 0 H GLU A 69 2.130 -14.298 -10.060 1.00 0.00 H new ATOM 0 HA GLU A 69 -0.807 -14.276 -10.131 1.00 0.00 H new ATOM 0 HB2 GLU A 69 0.948 -16.018 -11.889 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -0.747 -16.335 -11.575 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -0.694 -13.611 -12.305 1.00 0.00 H new ATOM 0 HG3 GLU A 69 0.475 -14.355 -13.377 1.00 0.00 H new ATOM 952 N HIS A 70 -0.856 -16.334 -8.676 1.00 0.00 N ATOM 953 CA HIS A 70 -0.855 -17.303 -7.593 1.00 0.00 C ATOM 954 C HIS A 70 0.212 -16.921 -6.566 1.00 0.00 C ATOM 955 O HIS A 70 1.340 -17.408 -6.627 1.00 0.00 O ATOM 956 CB HIS A 70 -0.677 -18.723 -8.134 1.00 0.00 C ATOM 957 CG HIS A 70 0.596 -18.925 -8.922 1.00 0.00 C ATOM 958 ND1 HIS A 70 0.999 -18.400 -10.113 1.00 0.00 N flip ATOM 959 CD2 HIS A 70 1.619 -19.752 -8.493 1.00 0.00 C flip ATOM 960 CE1 HIS A 70 2.204 -18.879 -10.397 1.00 0.00 C flip ATOM 961 NE2 HIS A 70 2.590 -19.719 -9.394 1.00 0.00 N flip ATOM 0 H HIS A 70 -1.782 -16.081 -9.021 1.00 0.00 H new ATOM 0 HA HIS A 70 -1.820 -17.289 -7.086 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -0.690 -19.423 -7.299 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -1.528 -18.968 -8.769 1.00 0.00 H new ATOM 0 HD2 HIS A 70 1.625 -20.327 -7.579 1.00 0.00 H new ATOM 0 HE1 HIS A 70 2.783 -18.643 -11.277 1.00 0.00 H new ATOM 0 HE2 HIS A 70 3.471 -20.231 -9.346 1.00 0.00 H new ATOM 968 N TYR A 71 -0.182 -16.053 -5.645 1.00 0.00 N ATOM 969 CA TYR A 71 0.728 -15.600 -4.606 1.00 0.00 C ATOM 970 C TYR A 71 0.300 -16.129 -3.235 1.00 0.00 C ATOM 971 O TYR A 71 -0.612 -16.949 -3.139 1.00 0.00 O ATOM 972 CB TYR A 71 0.636 -14.074 -4.601 1.00 0.00 C ATOM 973 CG TYR A 71 1.924 -13.374 -4.164 1.00 0.00 C ATOM 974 CD1 TYR A 71 3.119 -13.675 -4.786 1.00 0.00 C ATOM 975 CD2 TYR A 71 1.892 -12.442 -3.146 1.00 0.00 C ATOM 976 CE1 TYR A 71 4.332 -13.017 -4.374 1.00 0.00 C ATOM 977 CE2 TYR A 71 3.104 -11.784 -2.735 1.00 0.00 C ATOM 978 CZ TYR A 71 4.265 -12.103 -3.368 1.00 0.00 C ATOM 979 OH TYR A 71 5.409 -11.481 -2.979 1.00 0.00 O ATOM 0 H TYR A 71 -1.118 -15.652 -5.597 1.00 0.00 H new ATOM 0 HA TYR A 71 1.740 -15.957 -4.799 1.00 0.00 H new ATOM 0 HB2 TYR A 71 0.371 -13.733 -5.602 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -0.173 -13.771 -3.936 1.00 0.00 H new ATOM 0 HD1 TYR A 71 3.144 -14.404 -5.582 1.00 0.00 H new ATOM 0 HD2 TYR A 71 0.958 -12.207 -2.658 1.00 0.00 H new ATOM 0 HE1 TYR A 71 5.273 -13.244 -4.852 1.00 0.00 H new ATOM 0 HE2 TYR A 71 3.092 -11.052 -1.941 1.00 0.00 H new ATOM 0 HH TYR A 71 5.194 -10.771 -2.338 1.00 0.00 H new ATOM 988 N HIS A 72 0.980 -15.640 -2.209 1.00 0.00 N ATOM 989 CA HIS A 72 0.682 -16.053 -0.849 1.00 0.00 C ATOM 990 C HIS A 72 0.609 -14.822 0.057 1.00 0.00 C ATOM 991 O HIS A 72 -0.476 -14.423 0.480 1.00 0.00 O ATOM 992 CB HIS A 72 1.698 -17.089 -0.360 1.00 0.00 C ATOM 993 CG HIS A 72 1.302 -18.518 -0.642 1.00 0.00 C ATOM 994 ND1 HIS A 72 1.454 -19.108 -1.885 1.00 0.00 N ATOM 995 CD2 HIS A 72 0.758 -19.469 0.172 1.00 0.00 C ATOM 996 CE1 HIS A 72 1.019 -20.357 -1.811 1.00 0.00 C ATOM 997 NE2 HIS A 72 0.586 -20.579 -0.536 1.00 0.00 N ATOM 0 H HIS A 72 1.737 -14.961 -2.292 1.00 0.00 H new ATOM 0 HA HIS A 72 -0.292 -16.542 -0.819 1.00 0.00 H new ATOM 0 HB2 HIS A 72 2.660 -16.890 -0.832 1.00 0.00 H new ATOM 0 HB3 HIS A 72 1.838 -16.967 0.714 1.00 0.00 H new ATOM 0 HD2 HIS A 72 0.510 -19.340 1.215 1.00 0.00 H new ATOM 0 HE1 HIS A 72 1.009 -21.074 -2.618 1.00 0.00 H new ATOM 0 HE2 HIS A 72 0.195 -21.453 -0.185 1.00 0.00 H new ATOM 1004 N ARG A 73 1.775 -14.256 0.328 1.00 0.00 N ATOM 1005 CA ARG A 73 1.856 -13.079 1.176 1.00 0.00 C ATOM 1006 C ARG A 73 0.836 -12.031 0.729 1.00 0.00 C ATOM 1007 O ARG A 73 0.140 -12.223 -0.267 1.00 0.00 O ATOM 1008 CB ARG A 73 3.258 -12.466 1.136 1.00 0.00 C ATOM 1009 CG ARG A 73 3.789 -12.215 2.548 1.00 0.00 C ATOM 1010 CD ARG A 73 4.794 -13.294 2.956 1.00 0.00 C ATOM 1011 NE ARG A 73 4.295 -14.027 4.141 1.00 0.00 N ATOM 1012 CZ ARG A 73 4.807 -15.186 4.577 1.00 0.00 C ATOM 1013 NH1 ARG A 73 5.835 -15.751 3.929 1.00 0.00 N ATOM 1014 NH2 ARG A 73 4.291 -15.781 5.662 1.00 0.00 N ATOM 0 H ARG A 73 2.672 -14.590 -0.025 1.00 0.00 H new ATOM 0 HA ARG A 73 1.637 -13.391 2.197 1.00 0.00 H new ATOM 0 HB2 ARG A 73 3.935 -13.133 0.603 1.00 0.00 H new ATOM 0 HB3 ARG A 73 3.233 -11.528 0.581 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.264 -11.235 2.593 1.00 0.00 H new ATOM 0 HG3 ARG A 73 2.959 -12.200 3.255 1.00 0.00 H new ATOM 0 HD2 ARG A 73 4.952 -13.987 2.129 1.00 0.00 H new ATOM 0 HD3 ARG A 73 5.759 -12.839 3.179 1.00 0.00 H new ATOM 0 HE ARG A 73 3.513 -13.625 4.658 1.00 0.00 H new ATOM 0 HH11 ARG A 73 6.228 -15.299 3.104 1.00 0.00 H new ATOM 0 HH12 ARG A 73 6.224 -16.633 4.261 1.00 0.00 H new ATOM 0 HH21 ARG A 73 3.509 -15.351 6.156 1.00 0.00 H new ATOM 0 HH22 ARG A 73 4.681 -16.663 5.994 1.00 0.00 H new ATOM 1025 N THR A 74 0.777 -10.946 1.487 1.00 0.00 N ATOM 1026 CA THR A 74 -0.147 -9.868 1.182 1.00 0.00 C ATOM 1027 C THR A 74 0.616 -8.632 0.699 1.00 0.00 C ATOM 1028 O THR A 74 0.043 -7.549 0.587 1.00 0.00 O ATOM 1029 CB THR A 74 -1.000 -9.608 2.425 1.00 0.00 C ATOM 1030 OG1 THR A 74 -0.067 -9.140 3.395 1.00 0.00 O ATOM 1031 CG2 THR A 74 -1.554 -10.899 3.033 1.00 0.00 C ATOM 0 H THR A 74 1.355 -10.791 2.313 1.00 0.00 H new ATOM 0 HA THR A 74 -0.814 -10.140 0.364 1.00 0.00 H new ATOM 0 HB THR A 74 -1.825 -8.944 2.168 1.00 0.00 H new ATOM 0 HG1 THR A 74 -0.536 -8.945 4.233 1.00 0.00 H new ATOM 0 HG21 THR A 74 -2.152 -10.660 3.912 1.00 0.00 H new ATOM 0 HG22 THR A 74 -2.177 -11.409 2.298 1.00 0.00 H new ATOM 0 HG23 THR A 74 -0.728 -11.549 3.322 1.00 0.00 H new ATOM 1039 N SER A 75 1.897 -8.836 0.428 1.00 0.00 N ATOM 1040 CA SER A 75 2.744 -7.751 -0.039 1.00 0.00 C ATOM 1041 C SER A 75 3.712 -8.265 -1.107 1.00 0.00 C ATOM 1042 O SER A 75 4.209 -9.386 -1.010 1.00 0.00 O ATOM 1043 CB SER A 75 3.519 -7.119 1.120 1.00 0.00 C ATOM 1044 OG SER A 75 3.467 -7.921 2.296 1.00 0.00 O ATOM 0 H SER A 75 2.369 -9.735 0.523 1.00 0.00 H new ATOM 0 HA SER A 75 2.106 -6.983 -0.476 1.00 0.00 H new ATOM 0 HB2 SER A 75 4.558 -6.975 0.825 1.00 0.00 H new ATOM 0 HB3 SER A 75 3.109 -6.132 1.335 1.00 0.00 H new ATOM 0 HG SER A 75 3.974 -7.485 3.012 1.00 0.00 H new ATOM 1049 N ALA A 76 3.948 -7.421 -2.100 1.00 0.00 N ATOM 1050 CA ALA A 76 4.847 -7.777 -3.185 1.00 0.00 C ATOM 1051 C ALA A 76 5.527 -6.512 -3.713 1.00 0.00 C ATOM 1052 O ALA A 76 4.910 -5.449 -3.770 1.00 0.00 O ATOM 1053 CB ALA A 76 4.066 -8.517 -4.273 1.00 0.00 C ATOM 0 H ALA A 76 3.533 -6.492 -2.176 1.00 0.00 H new ATOM 0 HA ALA A 76 5.629 -8.449 -2.831 1.00 0.00 H new ATOM 0 HB1 ALA A 76 4.740 -8.784 -5.087 1.00 0.00 H new ATOM 0 HB2 ALA A 76 3.627 -9.422 -3.854 1.00 0.00 H new ATOM 0 HB3 ALA A 76 3.274 -7.873 -4.655 1.00 0.00 H new ATOM 1059 N THR A 77 6.788 -6.669 -4.087 1.00 0.00 N ATOM 1060 CA THR A 77 7.558 -5.553 -4.609 1.00 0.00 C ATOM 1061 C THR A 77 7.469 -5.511 -6.136 1.00 0.00 C ATOM 1062 O THR A 77 7.778 -6.495 -6.807 1.00 0.00 O ATOM 1063 CB THR A 77 8.991 -5.682 -4.087 1.00 0.00 C ATOM 1064 OG1 THR A 77 8.849 -5.647 -2.670 1.00 0.00 O ATOM 1065 CG2 THR A 77 9.844 -4.452 -4.407 1.00 0.00 C ATOM 0 H THR A 77 7.296 -7.552 -4.039 1.00 0.00 H new ATOM 0 HA THR A 77 7.156 -4.600 -4.265 1.00 0.00 H new ATOM 0 HB THR A 77 9.456 -6.568 -4.519 1.00 0.00 H new ATOM 0 HG1 THR A 77 9.731 -5.727 -2.251 1.00 0.00 H new ATOM 0 HG21 THR A 77 10.851 -4.595 -4.015 1.00 0.00 H new ATOM 0 HG22 THR A 77 9.892 -4.313 -5.487 1.00 0.00 H new ATOM 0 HG23 THR A 77 9.398 -3.570 -3.947 1.00 0.00 H new ATOM 1073 N ILE A 78 7.046 -4.361 -6.641 1.00 0.00 N ATOM 1074 CA ILE A 78 6.912 -4.178 -8.076 1.00 0.00 C ATOM 1075 C ILE A 78 8.224 -3.630 -8.640 1.00 0.00 C ATOM 1076 O ILE A 78 8.845 -2.755 -8.039 1.00 0.00 O ATOM 1077 CB ILE A 78 5.694 -3.307 -8.393 1.00 0.00 C ATOM 1078 CG1 ILE A 78 4.489 -3.720 -7.546 1.00 0.00 C ATOM 1079 CG2 ILE A 78 5.379 -3.330 -9.890 1.00 0.00 C ATOM 1080 CD1 ILE A 78 3.984 -5.107 -7.950 1.00 0.00 C ATOM 0 H ILE A 78 6.792 -3.547 -6.082 1.00 0.00 H new ATOM 0 HA ILE A 78 6.728 -5.134 -8.567 1.00 0.00 H new ATOM 0 HB ILE A 78 5.933 -2.276 -8.130 1.00 0.00 H new ATOM 0 HG12 ILE A 78 4.765 -3.722 -6.492 1.00 0.00 H new ATOM 0 HG13 ILE A 78 3.689 -2.989 -7.664 1.00 0.00 H new ATOM 0 HG21 ILE A 78 4.509 -2.703 -10.089 1.00 0.00 H new ATOM 0 HG22 ILE A 78 6.235 -2.950 -10.448 1.00 0.00 H new ATOM 0 HG23 ILE A 78 5.168 -4.353 -10.202 1.00 0.00 H new ATOM 0 HD11 ILE A 78 3.127 -5.376 -7.332 1.00 0.00 H new ATOM 0 HD12 ILE A 78 3.686 -5.095 -8.998 1.00 0.00 H new ATOM 0 HD13 ILE A 78 4.779 -5.839 -7.807 1.00 0.00 H new ATOM 1091 N THR A 79 8.607 -4.167 -9.789 1.00 0.00 N ATOM 1092 CA THR A 79 9.834 -3.743 -10.442 1.00 0.00 C ATOM 1093 C THR A 79 9.528 -3.146 -11.817 1.00 0.00 C ATOM 1094 O THR A 79 8.374 -3.111 -12.239 1.00 0.00 O ATOM 1095 CB THR A 79 10.779 -4.943 -10.496 1.00 0.00 C ATOM 1096 OG1 THR A 79 9.924 -6.046 -10.783 1.00 0.00 O ATOM 1097 CG2 THR A 79 11.378 -5.281 -9.130 1.00 0.00 C ATOM 0 H THR A 79 8.089 -4.892 -10.285 1.00 0.00 H new ATOM 0 HA THR A 79 10.327 -2.949 -9.881 1.00 0.00 H new ATOM 0 HB THR A 79 11.583 -4.739 -11.203 1.00 0.00 H new ATOM 0 HG1 THR A 79 10.456 -6.867 -10.837 1.00 0.00 H new ATOM 0 HG21 THR A 79 12.041 -6.141 -9.226 1.00 0.00 H new ATOM 0 HG22 THR A 79 11.944 -4.426 -8.759 1.00 0.00 H new ATOM 0 HG23 THR A 79 10.577 -5.517 -8.430 1.00 0.00 H new ATOM 1105 N GLU A 80 10.583 -2.693 -12.478 1.00 0.00 N ATOM 1106 CA GLU A 80 10.442 -2.099 -13.797 1.00 0.00 C ATOM 1107 C GLU A 80 9.557 -0.853 -13.727 1.00 0.00 C ATOM 1108 O GLU A 80 8.507 -0.797 -14.366 1.00 0.00 O ATOM 1109 CB GLU A 80 9.883 -3.113 -14.797 1.00 0.00 C ATOM 1110 CG GLU A 80 11.007 -3.761 -15.608 1.00 0.00 C ATOM 1111 CD GLU A 80 10.595 -3.940 -17.070 1.00 0.00 C ATOM 1112 OE1 GLU A 80 9.500 -4.502 -17.286 1.00 0.00 O ATOM 1113 OE2 GLU A 80 11.384 -3.510 -17.939 1.00 0.00 O ATOM 0 H GLU A 80 11.539 -2.725 -12.125 1.00 0.00 H new ATOM 0 HA GLU A 80 11.430 -1.799 -14.147 1.00 0.00 H new ATOM 0 HB2 GLU A 80 9.323 -3.883 -14.265 1.00 0.00 H new ATOM 0 HB3 GLU A 80 9.183 -2.617 -15.470 1.00 0.00 H new ATOM 0 HG2 GLU A 80 11.903 -3.143 -15.552 1.00 0.00 H new ATOM 0 HG3 GLU A 80 11.260 -4.729 -15.177 1.00 0.00 H new ATOM 1118 N LEU A 81 10.013 0.114 -12.944 1.00 0.00 N ATOM 1119 CA LEU A 81 9.276 1.356 -12.783 1.00 0.00 C ATOM 1120 C LEU A 81 10.163 2.529 -13.204 1.00 0.00 C ATOM 1121 O LEU A 81 11.340 2.581 -12.851 1.00 0.00 O ATOM 1122 CB LEU A 81 8.734 1.475 -11.357 1.00 0.00 C ATOM 1123 CG LEU A 81 7.684 0.440 -10.950 1.00 0.00 C ATOM 1124 CD1 LEU A 81 7.464 0.449 -9.436 1.00 0.00 C ATOM 1125 CD2 LEU A 81 6.379 0.651 -11.720 1.00 0.00 C ATOM 0 H LEU A 81 10.883 0.062 -12.414 1.00 0.00 H new ATOM 0 HA LEU A 81 8.402 1.368 -13.434 1.00 0.00 H new ATOM 0 HB2 LEU A 81 9.572 1.405 -10.664 1.00 0.00 H new ATOM 0 HB3 LEU A 81 8.302 2.468 -11.235 1.00 0.00 H new ATOM 0 HG LEU A 81 8.058 -0.549 -11.215 1.00 0.00 H new ATOM 0 HD11 LEU A 81 6.713 -0.296 -9.173 1.00 0.00 H new ATOM 0 HD12 LEU A 81 8.401 0.214 -8.931 1.00 0.00 H new ATOM 0 HD13 LEU A 81 7.121 1.436 -9.124 1.00 0.00 H new ATOM 0 HD21 LEU A 81 5.650 -0.098 -11.412 1.00 0.00 H new ATOM 0 HD22 LEU A 81 5.989 1.646 -11.508 1.00 0.00 H new ATOM 0 HD23 LEU A 81 6.568 0.555 -12.789 1.00 0.00 H new ATOM 1136 N VAL A 82 9.564 3.443 -13.954 1.00 0.00 N ATOM 1137 CA VAL A 82 10.285 4.613 -14.427 1.00 0.00 C ATOM 1138 C VAL A 82 10.115 5.752 -13.421 1.00 0.00 C ATOM 1139 O VAL A 82 9.002 6.033 -12.978 1.00 0.00 O ATOM 1140 CB VAL A 82 9.815 4.983 -15.835 1.00 0.00 C ATOM 1141 CG1 VAL A 82 10.315 6.373 -16.233 1.00 0.00 C ATOM 1142 CG2 VAL A 82 10.254 3.929 -16.855 1.00 0.00 C ATOM 0 H VAL A 82 8.588 3.397 -14.246 1.00 0.00 H new ATOM 0 HA VAL A 82 11.352 4.401 -14.500 1.00 0.00 H new ATOM 0 HB VAL A 82 8.725 5.009 -15.828 1.00 0.00 H new ATOM 0 HG11 VAL A 82 9.967 6.611 -17.238 1.00 0.00 H new ATOM 0 HG12 VAL A 82 9.930 7.113 -15.531 1.00 0.00 H new ATOM 0 HG13 VAL A 82 11.405 6.387 -16.214 1.00 0.00 H new ATOM 0 HG21 VAL A 82 9.907 4.216 -17.847 1.00 0.00 H new ATOM 0 HG22 VAL A 82 11.342 3.856 -16.858 1.00 0.00 H new ATOM 0 HG23 VAL A 82 9.826 2.963 -16.587 1.00 0.00 H new ATOM 1152 N ILE A 83 11.234 6.379 -13.091 1.00 0.00 N ATOM 1153 CA ILE A 83 11.223 7.483 -12.144 1.00 0.00 C ATOM 1154 C ILE A 83 10.676 8.734 -12.834 1.00 0.00 C ATOM 1155 O ILE A 83 11.007 9.007 -13.987 1.00 0.00 O ATOM 1156 CB ILE A 83 12.612 7.676 -11.531 1.00 0.00 C ATOM 1157 CG1 ILE A 83 13.002 6.476 -10.666 1.00 0.00 C ATOM 1158 CG2 ILE A 83 12.688 8.992 -10.753 1.00 0.00 C ATOM 1159 CD1 ILE A 83 14.475 6.545 -10.265 1.00 0.00 C ATOM 0 H ILE A 83 12.155 6.144 -13.462 1.00 0.00 H new ATOM 0 HA ILE A 83 10.559 7.263 -11.308 1.00 0.00 H new ATOM 0 HB ILE A 83 13.338 7.737 -12.342 1.00 0.00 H new ATOM 0 HG12 ILE A 83 12.379 6.450 -9.772 1.00 0.00 H new ATOM 0 HG13 ILE A 83 12.813 5.552 -11.213 1.00 0.00 H new ATOM 0 HG21 ILE A 83 13.685 9.106 -10.327 1.00 0.00 H new ATOM 0 HG22 ILE A 83 12.484 9.825 -11.426 1.00 0.00 H new ATOM 0 HG23 ILE A 83 11.950 8.984 -9.951 1.00 0.00 H new ATOM 0 HD11 ILE A 83 14.726 5.680 -9.651 1.00 0.00 H new ATOM 0 HD12 ILE A 83 15.096 6.546 -11.161 1.00 0.00 H new ATOM 0 HD13 ILE A 83 14.655 7.458 -9.697 1.00 0.00 H new ATOM 1170 N GLY A 84 9.847 9.460 -12.099 1.00 0.00 N ATOM 1171 CA GLY A 84 9.250 10.676 -12.625 1.00 0.00 C ATOM 1172 C GLY A 84 7.849 10.405 -13.178 1.00 0.00 C ATOM 1173 O GLY A 84 7.406 11.071 -14.111 1.00 0.00 O ATOM 0 H GLY A 84 9.574 9.230 -11.143 1.00 0.00 H new ATOM 0 HA2 GLY A 84 9.195 11.428 -11.838 1.00 0.00 H new ATOM 0 HA3 GLY A 84 9.883 11.085 -13.413 1.00 0.00 H new ATOM 1177 N ASN A 85 7.191 9.425 -12.576 1.00 0.00 N ATOM 1178 CA ASN A 85 5.849 9.058 -12.996 1.00 0.00 C ATOM 1179 C ASN A 85 5.200 8.192 -11.915 1.00 0.00 C ATOM 1180 O ASN A 85 5.890 7.646 -11.055 1.00 0.00 O ATOM 1181 CB ASN A 85 5.880 8.248 -14.294 1.00 0.00 C ATOM 1182 CG ASN A 85 5.896 9.170 -15.516 1.00 0.00 C ATOM 1183 OD1 ASN A 85 5.066 10.049 -15.671 1.00 0.00 O ATOM 1184 ND2 ASN A 85 6.884 8.920 -16.369 1.00 0.00 N ATOM 0 H ASN A 85 7.562 8.874 -11.802 1.00 0.00 H new ATOM 0 HA ASN A 85 5.283 9.976 -13.157 1.00 0.00 H new ATOM 0 HB2 ASN A 85 6.762 7.607 -14.306 1.00 0.00 H new ATOM 0 HB3 ASN A 85 5.010 7.593 -14.339 1.00 0.00 H new ATOM 0 HD21 ASN A 85 6.981 9.481 -17.215 1.00 0.00 H new ATOM 0 HD22 ASN A 85 7.545 8.167 -16.177 1.00 0.00 H new ATOM 1190 N GLU A 86 3.881 8.093 -11.993 1.00 0.00 N ATOM 1191 CA GLU A 86 3.132 7.304 -11.031 1.00 0.00 C ATOM 1192 C GLU A 86 2.447 6.126 -11.729 1.00 0.00 C ATOM 1193 O GLU A 86 2.326 6.112 -12.953 1.00 0.00 O ATOM 1194 CB GLU A 86 2.111 8.168 -10.287 1.00 0.00 C ATOM 1195 CG GLU A 86 0.964 8.580 -11.213 1.00 0.00 C ATOM 1196 CD GLU A 86 1.348 9.799 -12.053 1.00 0.00 C ATOM 1197 OE1 GLU A 86 1.376 10.904 -11.471 1.00 0.00 O ATOM 1198 OE2 GLU A 86 1.604 9.597 -13.260 1.00 0.00 O ATOM 0 H GLU A 86 3.312 8.546 -12.708 1.00 0.00 H new ATOM 0 HA GLU A 86 3.831 6.909 -10.293 1.00 0.00 H new ATOM 0 HB2 GLU A 86 1.715 7.616 -9.434 1.00 0.00 H new ATOM 0 HB3 GLU A 86 2.601 9.057 -9.891 1.00 0.00 H new ATOM 0 HG2 GLU A 86 0.705 7.749 -11.869 1.00 0.00 H new ATOM 0 HG3 GLU A 86 0.077 8.807 -10.621 1.00 0.00 H new ATOM 1203 N TYR A 87 2.019 5.168 -10.921 1.00 0.00 N ATOM 1204 CA TYR A 87 1.351 3.989 -11.445 1.00 0.00 C ATOM 1205 C TYR A 87 0.314 3.459 -10.453 1.00 0.00 C ATOM 1206 O TYR A 87 0.282 3.881 -9.298 1.00 0.00 O ATOM 1207 CB TYR A 87 2.442 2.935 -11.637 1.00 0.00 C ATOM 1208 CG TYR A 87 3.621 3.407 -12.489 1.00 0.00 C ATOM 1209 CD1 TYR A 87 4.513 4.331 -11.984 1.00 0.00 C ATOM 1210 CD2 TYR A 87 3.794 2.909 -13.764 1.00 0.00 C ATOM 1211 CE1 TYR A 87 5.622 4.776 -12.787 1.00 0.00 C ATOM 1212 CE2 TYR A 87 4.903 3.352 -14.568 1.00 0.00 C ATOM 1213 CZ TYR A 87 5.763 4.265 -14.039 1.00 0.00 C ATOM 1214 OH TYR A 87 6.811 4.684 -14.798 1.00 0.00 O ATOM 0 H TYR A 87 2.122 5.184 -9.906 1.00 0.00 H new ATOM 0 HA TYR A 87 0.831 4.225 -12.373 1.00 0.00 H new ATOM 0 HB2 TYR A 87 2.813 2.629 -10.659 1.00 0.00 H new ATOM 0 HB3 TYR A 87 2.002 2.052 -12.101 1.00 0.00 H new ATOM 0 HD1 TYR A 87 4.379 4.721 -10.986 1.00 0.00 H new ATOM 0 HD2 TYR A 87 3.096 2.186 -14.160 1.00 0.00 H new ATOM 0 HE1 TYR A 87 6.326 5.500 -12.403 1.00 0.00 H new ATOM 0 HE2 TYR A 87 5.049 2.969 -15.567 1.00 0.00 H new ATOM 0 HH TYR A 87 7.485 5.102 -14.223 1.00 0.00 H new ATOM 1223 N TYR A 88 -0.509 2.543 -10.939 1.00 0.00 N ATOM 1224 CA TYR A 88 -1.545 1.950 -10.110 1.00 0.00 C ATOM 1225 C TYR A 88 -1.211 0.496 -9.771 1.00 0.00 C ATOM 1226 O TYR A 88 -0.137 0.006 -10.115 1.00 0.00 O ATOM 1227 CB TYR A 88 -2.826 1.985 -10.945 1.00 0.00 C ATOM 1228 CG TYR A 88 -3.474 3.369 -11.032 1.00 0.00 C ATOM 1229 CD1 TYR A 88 -3.576 4.156 -9.903 1.00 0.00 C ATOM 1230 CD2 TYR A 88 -3.958 3.829 -12.240 1.00 0.00 C ATOM 1231 CE1 TYR A 88 -4.186 5.457 -9.985 1.00 0.00 C ATOM 1232 CE2 TYR A 88 -4.568 5.131 -12.322 1.00 0.00 C ATOM 1233 CZ TYR A 88 -4.651 5.881 -11.190 1.00 0.00 C ATOM 1234 OH TYR A 88 -5.227 7.111 -11.268 1.00 0.00 O ATOM 0 H TYR A 88 -0.480 2.196 -11.898 1.00 0.00 H new ATOM 0 HA TYR A 88 -1.643 2.495 -9.171 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -2.600 1.637 -11.953 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -3.545 1.285 -10.519 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -3.198 3.796 -8.958 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -3.879 3.213 -13.123 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -4.272 6.082 -9.109 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -4.951 5.503 -13.261 1.00 0.00 H new ATOM 0 HH TYR A 88 -4.827 7.703 -10.597 1.00 0.00 H new ATOM 1243 N PHE A 89 -2.152 -0.153 -9.099 1.00 0.00 N ATOM 1244 CA PHE A 89 -1.971 -1.541 -8.711 1.00 0.00 C ATOM 1245 C PHE A 89 -3.311 -2.194 -8.369 1.00 0.00 C ATOM 1246 O PHE A 89 -4.235 -1.521 -7.914 1.00 0.00 O ATOM 1247 CB PHE A 89 -1.083 -1.545 -7.465 1.00 0.00 C ATOM 1248 CG PHE A 89 0.329 -1.005 -7.704 1.00 0.00 C ATOM 1249 CD1 PHE A 89 1.198 -1.699 -8.487 1.00 0.00 C ATOM 1250 CD2 PHE A 89 0.714 0.168 -7.137 1.00 0.00 C ATOM 1251 CE1 PHE A 89 2.508 -1.200 -8.710 1.00 0.00 C ATOM 1252 CE2 PHE A 89 2.025 0.668 -7.359 1.00 0.00 C ATOM 1253 CZ PHE A 89 2.894 -0.026 -8.141 1.00 0.00 C ATOM 0 H PHE A 89 -3.041 0.257 -8.814 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.523 -2.101 -9.532 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -1.562 -0.949 -6.688 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.012 -2.564 -7.086 1.00 0.00 H new ATOM 0 HD1 PHE A 89 0.891 -2.630 -8.939 1.00 0.00 H new ATOM 0 HD2 PHE A 89 0.023 0.720 -6.517 1.00 0.00 H new ATOM 0 HE1 PHE A 89 3.198 -1.752 -9.331 1.00 0.00 H new ATOM 0 HE2 PHE A 89 2.331 1.600 -6.907 1.00 0.00 H new ATOM 0 HZ PHE A 89 3.890 0.355 -8.310 1.00 0.00 H new ATOM 1262 N ARG A 90 -3.375 -3.497 -8.601 1.00 0.00 N ATOM 1263 CA ARG A 90 -4.588 -4.248 -8.323 1.00 0.00 C ATOM 1264 C ARG A 90 -4.259 -5.505 -7.516 1.00 0.00 C ATOM 1265 O ARG A 90 -3.123 -5.976 -7.527 1.00 0.00 O ATOM 1266 CB ARG A 90 -5.294 -4.652 -9.619 1.00 0.00 C ATOM 1267 CG ARG A 90 -6.496 -3.746 -9.893 1.00 0.00 C ATOM 1268 CD ARG A 90 -7.682 -4.554 -10.425 1.00 0.00 C ATOM 1269 NE ARG A 90 -7.784 -4.397 -11.893 1.00 0.00 N ATOM 1270 CZ ARG A 90 -7.064 -5.102 -12.776 1.00 0.00 C ATOM 1271 NH1 ARG A 90 -6.185 -6.017 -12.346 1.00 0.00 N ATOM 1272 NH2 ARG A 90 -7.222 -4.892 -14.090 1.00 0.00 N ATOM 0 H ARG A 90 -2.607 -4.052 -8.978 1.00 0.00 H new ATOM 0 HA ARG A 90 -5.253 -3.605 -7.746 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -4.593 -4.595 -10.452 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -5.624 -5.689 -9.550 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -6.784 -3.231 -8.977 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -6.220 -2.979 -10.617 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -7.558 -5.607 -10.171 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -8.604 -4.218 -9.950 1.00 0.00 H new ATOM 0 HE ARG A 90 -8.444 -3.709 -12.255 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -6.064 -6.177 -11.346 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -5.637 -6.553 -13.019 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -7.891 -4.195 -14.418 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -6.674 -5.429 -14.762 1.00 0.00 H new ATOM 1283 N VAL A 91 -5.276 -6.014 -6.834 1.00 0.00 N ATOM 1284 CA VAL A 91 -5.110 -7.209 -6.023 1.00 0.00 C ATOM 1285 C VAL A 91 -6.395 -8.037 -6.074 1.00 0.00 C ATOM 1286 O VAL A 91 -7.376 -7.710 -5.408 1.00 0.00 O ATOM 1287 CB VAL A 91 -4.705 -6.822 -4.599 1.00 0.00 C ATOM 1288 CG1 VAL A 91 -4.518 -8.063 -3.725 1.00 0.00 C ATOM 1289 CG2 VAL A 91 -3.440 -5.960 -4.604 1.00 0.00 C ATOM 0 H VAL A 91 -6.217 -5.621 -6.827 1.00 0.00 H new ATOM 0 HA VAL A 91 -4.307 -7.831 -6.418 1.00 0.00 H new ATOM 0 HB VAL A 91 -5.513 -6.230 -4.171 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -4.230 -7.759 -2.718 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -5.453 -8.622 -3.682 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -3.737 -8.693 -4.151 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -3.174 -5.699 -3.580 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -2.622 -6.517 -5.061 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -3.622 -5.050 -5.175 1.00 0.00 H new ATOM 1299 N PHE A 92 -6.348 -9.095 -6.871 1.00 0.00 N ATOM 1300 CA PHE A 92 -7.496 -9.973 -7.019 1.00 0.00 C ATOM 1301 C PHE A 92 -7.587 -10.956 -5.850 1.00 0.00 C ATOM 1302 O PHE A 92 -6.834 -10.849 -4.883 1.00 0.00 O ATOM 1303 CB PHE A 92 -7.296 -10.757 -8.316 1.00 0.00 C ATOM 1304 CG PHE A 92 -7.392 -9.902 -9.581 1.00 0.00 C ATOM 1305 CD1 PHE A 92 -8.308 -8.901 -9.658 1.00 0.00 C ATOM 1306 CD2 PHE A 92 -6.561 -10.144 -10.630 1.00 0.00 C ATOM 1307 CE1 PHE A 92 -8.397 -8.108 -10.831 1.00 0.00 C ATOM 1308 CE2 PHE A 92 -6.650 -9.352 -11.805 1.00 0.00 C ATOM 1309 CZ PHE A 92 -7.566 -8.350 -11.880 1.00 0.00 C ATOM 0 H PHE A 92 -5.532 -9.364 -7.421 1.00 0.00 H new ATOM 0 HA PHE A 92 -8.414 -9.386 -7.038 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -6.319 -11.240 -8.290 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -8.042 -11.550 -8.368 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -8.969 -8.709 -8.826 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -5.833 -10.939 -10.569 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -9.125 -7.312 -10.891 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -5.991 -9.545 -12.638 1.00 0.00 H new ATOM 0 HZ PHE A 92 -7.634 -7.746 -12.773 1.00 0.00 H new ATOM 1318 N SER A 93 -8.514 -11.894 -5.978 1.00 0.00 N ATOM 1319 CA SER A 93 -8.713 -12.896 -4.945 1.00 0.00 C ATOM 1320 C SER A 93 -8.794 -14.288 -5.575 1.00 0.00 C ATOM 1321 O SER A 93 -9.872 -14.738 -5.958 1.00 0.00 O ATOM 1322 CB SER A 93 -9.978 -12.606 -4.133 1.00 0.00 C ATOM 1323 OG SER A 93 -9.849 -11.424 -3.348 1.00 0.00 O ATOM 0 H SER A 93 -9.136 -11.981 -6.782 1.00 0.00 H new ATOM 0 HA SER A 93 -7.861 -12.861 -4.265 1.00 0.00 H new ATOM 0 HB2 SER A 93 -10.827 -12.501 -4.809 1.00 0.00 H new ATOM 0 HB3 SER A 93 -10.192 -13.453 -3.481 1.00 0.00 H new ATOM 0 HG SER A 93 -10.647 -10.867 -3.461 1.00 0.00 H new ATOM 1328 N GLU A 94 -7.639 -14.931 -5.662 1.00 0.00 N ATOM 1329 CA GLU A 94 -7.565 -16.262 -6.239 1.00 0.00 C ATOM 1330 C GLU A 94 -8.431 -17.236 -5.438 1.00 0.00 C ATOM 1331 O GLU A 94 -8.520 -17.132 -4.215 1.00 0.00 O ATOM 1332 CB GLU A 94 -6.115 -16.748 -6.311 1.00 0.00 C ATOM 1333 CG GLU A 94 -5.688 -16.984 -7.761 1.00 0.00 C ATOM 1334 CD GLU A 94 -5.815 -18.462 -8.137 1.00 0.00 C ATOM 1335 OE1 GLU A 94 -6.765 -19.097 -7.632 1.00 0.00 O ATOM 1336 OE2 GLU A 94 -4.957 -18.922 -8.922 1.00 0.00 O ATOM 0 H GLU A 94 -6.747 -14.555 -5.342 1.00 0.00 H new ATOM 0 HA GLU A 94 -7.950 -16.218 -7.258 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -5.457 -16.011 -5.850 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -6.008 -17.671 -5.742 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -6.304 -16.381 -8.428 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -4.657 -16.658 -7.898 1.00 0.00 H new ATOM 1341 N ASN A 95 -9.047 -18.161 -6.159 1.00 0.00 N ATOM 1342 CA ASN A 95 -9.902 -19.153 -5.532 1.00 0.00 C ATOM 1343 C ASN A 95 -10.328 -20.188 -6.575 1.00 0.00 C ATOM 1344 O ASN A 95 -10.463 -19.866 -7.754 1.00 0.00 O ATOM 1345 CB ASN A 95 -11.169 -18.508 -4.963 1.00 0.00 C ATOM 1346 CG ASN A 95 -11.962 -17.798 -6.062 1.00 0.00 C ATOM 1347 OD1 ASN A 95 -12.897 -18.334 -6.634 1.00 0.00 O ATOM 1348 ND2 ASN A 95 -11.540 -16.564 -6.324 1.00 0.00 N ATOM 0 H ASN A 95 -8.971 -18.244 -7.173 1.00 0.00 H new ATOM 0 HA ASN A 95 -9.339 -19.619 -4.724 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -11.791 -19.271 -4.495 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -10.900 -17.794 -4.184 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -12.006 -16.007 -7.041 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -10.751 -16.175 -5.808 1.00 0.00 H new ATOM 1354 N MET A 96 -10.525 -21.411 -6.103 1.00 0.00 N ATOM 1355 CA MET A 96 -10.932 -22.495 -6.981 1.00 0.00 C ATOM 1356 C MET A 96 -11.960 -22.014 -8.007 1.00 0.00 C ATOM 1357 O MET A 96 -11.951 -22.457 -9.154 1.00 0.00 O ATOM 1358 CB MET A 96 -11.534 -23.628 -6.148 1.00 0.00 C ATOM 1359 CG MET A 96 -12.768 -23.148 -5.381 1.00 0.00 C ATOM 1360 SD MET A 96 -13.305 -24.411 -4.239 1.00 0.00 S ATOM 1361 CE MET A 96 -12.154 -24.133 -2.903 1.00 0.00 C ATOM 0 H MET A 96 -10.410 -21.675 -5.124 1.00 0.00 H new ATOM 0 HA MET A 96 -10.053 -22.853 -7.516 1.00 0.00 H new ATOM 0 HB2 MET A 96 -11.806 -24.458 -6.800 1.00 0.00 H new ATOM 0 HB3 MET A 96 -10.789 -24.004 -5.447 1.00 0.00 H new ATOM 0 HG2 MET A 96 -12.536 -22.231 -4.839 1.00 0.00 H new ATOM 0 HG3 MET A 96 -13.571 -22.912 -6.079 1.00 0.00 H new ATOM 0 HE1 MET A 96 -12.580 -24.506 -1.972 1.00 0.00 H new ATOM 0 HE2 MET A 96 -11.222 -24.658 -3.111 1.00 0.00 H new ATOM 0 HE3 MET A 96 -11.956 -23.065 -2.809 1.00 0.00 H new ATOM 1369 N CYS A 97 -12.821 -21.113 -7.557 1.00 0.00 N ATOM 1370 CA CYS A 97 -13.853 -20.567 -8.422 1.00 0.00 C ATOM 1371 C CYS A 97 -13.174 -19.768 -9.536 1.00 0.00 C ATOM 1372 O CYS A 97 -13.117 -20.216 -10.680 1.00 0.00 O ATOM 1373 CB CYS A 97 -14.855 -19.715 -7.639 1.00 0.00 C ATOM 1374 SG CYS A 97 -16.560 -20.288 -7.974 1.00 0.00 S ATOM 0 H CYS A 97 -12.825 -20.747 -6.605 1.00 0.00 H new ATOM 0 HA CYS A 97 -14.431 -21.381 -8.860 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -14.644 -19.780 -6.572 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -14.753 -18.667 -7.921 1.00 0.00 H new ATOM 0 HG CYS A 97 -17.402 -19.560 -7.303 1.00 0.00 H new ATOM 1379 N GLY A 98 -12.674 -18.599 -9.163 1.00 0.00 N ATOM 1380 CA GLY A 98 -12.000 -17.735 -10.116 1.00 0.00 C ATOM 1381 C GLY A 98 -11.748 -16.350 -9.517 1.00 0.00 C ATOM 1382 O GLY A 98 -12.563 -15.844 -8.748 1.00 0.00 O ATOM 0 H GLY A 98 -12.722 -18.230 -8.213 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -11.053 -18.185 -10.413 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -12.605 -17.641 -11.018 1.00 0.00 H new ATOM 1386 N LEU A 99 -10.614 -15.776 -9.893 1.00 0.00 N ATOM 1387 CA LEU A 99 -10.244 -14.458 -9.402 1.00 0.00 C ATOM 1388 C LEU A 99 -11.471 -13.545 -9.427 1.00 0.00 C ATOM 1389 O LEU A 99 -12.465 -13.854 -10.084 1.00 0.00 O ATOM 1390 CB LEU A 99 -9.052 -13.909 -10.189 1.00 0.00 C ATOM 1391 CG LEU A 99 -7.728 -14.654 -10.009 1.00 0.00 C ATOM 1392 CD1 LEU A 99 -7.418 -15.522 -11.230 1.00 0.00 C ATOM 1393 CD2 LEU A 99 -6.591 -13.682 -9.692 1.00 0.00 C ATOM 0 H LEU A 99 -9.940 -16.199 -10.531 1.00 0.00 H new ATOM 0 HA LEU A 99 -9.913 -14.517 -8.365 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -9.308 -13.915 -11.248 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -8.902 -12.868 -9.903 1.00 0.00 H new ATOM 0 HG LEU A 99 -7.825 -15.324 -9.155 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -6.472 -16.041 -11.077 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -8.215 -16.253 -11.368 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -7.347 -14.891 -12.116 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -5.661 -14.237 -9.569 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -6.483 -12.970 -10.510 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -6.818 -13.145 -8.771 1.00 0.00 H new ATOM 1404 N SER A 100 -11.362 -12.440 -8.704 1.00 0.00 N ATOM 1405 CA SER A 100 -12.452 -11.481 -8.636 1.00 0.00 C ATOM 1406 C SER A 100 -12.427 -10.573 -9.867 1.00 0.00 C ATOM 1407 O SER A 100 -11.377 -10.046 -10.233 1.00 0.00 O ATOM 1408 CB SER A 100 -12.369 -10.644 -7.358 1.00 0.00 C ATOM 1409 OG SER A 100 -11.047 -10.168 -7.116 1.00 0.00 O ATOM 0 H SER A 100 -10.537 -12.187 -8.161 1.00 0.00 H new ATOM 0 HA SER A 100 -13.392 -12.032 -8.618 1.00 0.00 H new ATOM 0 HB2 SER A 100 -13.051 -9.797 -7.434 1.00 0.00 H new ATOM 0 HB3 SER A 100 -12.699 -11.244 -6.510 1.00 0.00 H new ATOM 0 HG SER A 100 -11.003 -9.210 -7.316 1.00 0.00 H new ATOM 1414 N GLU A 101 -13.595 -10.418 -10.472 1.00 0.00 N ATOM 1415 CA GLU A 101 -13.721 -9.583 -11.654 1.00 0.00 C ATOM 1416 C GLU A 101 -13.070 -8.220 -11.414 1.00 0.00 C ATOM 1417 O GLU A 101 -12.382 -7.693 -12.287 1.00 0.00 O ATOM 1418 CB GLU A 101 -15.188 -9.426 -12.061 1.00 0.00 C ATOM 1419 CG GLU A 101 -15.448 -10.056 -13.430 1.00 0.00 C ATOM 1420 CD GLU A 101 -16.296 -9.132 -14.308 1.00 0.00 C ATOM 1421 OE1 GLU A 101 -15.684 -8.300 -15.013 1.00 0.00 O ATOM 1422 OE2 GLU A 101 -17.536 -9.279 -14.253 1.00 0.00 O ATOM 0 H GLU A 101 -14.463 -10.857 -10.166 1.00 0.00 H new ATOM 0 HA GLU A 101 -13.200 -10.072 -12.477 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -15.828 -9.894 -11.314 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -15.450 -8.368 -12.088 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -14.499 -10.263 -13.925 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -15.957 -11.011 -13.304 1.00 0.00 H new ATOM 1427 N ASP A 102 -13.308 -7.688 -10.225 1.00 0.00 N ATOM 1428 CA ASP A 102 -12.754 -6.396 -9.857 1.00 0.00 C ATOM 1429 C ASP A 102 -11.808 -6.572 -8.668 1.00 0.00 C ATOM 1430 O ASP A 102 -11.958 -7.507 -7.883 1.00 0.00 O ATOM 1431 CB ASP A 102 -13.856 -5.420 -9.444 1.00 0.00 C ATOM 1432 CG ASP A 102 -15.024 -6.048 -8.682 1.00 0.00 C ATOM 1433 OD1 ASP A 102 -14.769 -6.543 -7.561 1.00 0.00 O ATOM 1434 OD2 ASP A 102 -16.144 -6.020 -9.234 1.00 0.00 O ATOM 0 H ASP A 102 -13.878 -8.129 -9.503 1.00 0.00 H new ATOM 0 HA ASP A 102 -12.227 -5.997 -10.723 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -13.415 -4.639 -8.824 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -14.245 -4.935 -10.339 1.00 0.00 H new ATOM 1438 N ALA A 103 -10.853 -5.657 -8.571 1.00 0.00 N ATOM 1439 CA ALA A 103 -9.882 -5.699 -7.491 1.00 0.00 C ATOM 1440 C ALA A 103 -9.779 -4.315 -6.850 1.00 0.00 C ATOM 1441 O ALA A 103 -9.893 -3.299 -7.535 1.00 0.00 O ATOM 1442 CB ALA A 103 -8.539 -6.194 -8.030 1.00 0.00 C ATOM 0 H ALA A 103 -10.732 -4.882 -9.223 1.00 0.00 H new ATOM 0 HA ALA A 103 -10.199 -6.398 -6.717 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -7.811 -6.225 -7.219 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -8.661 -7.194 -8.447 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -8.187 -5.516 -8.808 1.00 0.00 H new ATOM 1448 N THR A 104 -9.565 -4.317 -5.542 1.00 0.00 N ATOM 1449 CA THR A 104 -9.445 -3.072 -4.801 1.00 0.00 C ATOM 1450 C THR A 104 -8.119 -2.383 -5.128 1.00 0.00 C ATOM 1451 O THR A 104 -7.083 -2.719 -4.557 1.00 0.00 O ATOM 1452 CB THR A 104 -9.614 -3.390 -3.314 1.00 0.00 C ATOM 1453 OG1 THR A 104 -10.993 -3.729 -3.186 1.00 0.00 O ATOM 1454 CG2 THR A 104 -9.451 -2.152 -2.429 1.00 0.00 C ATOM 0 H THR A 104 -9.472 -5.161 -4.976 1.00 0.00 H new ATOM 0 HA THR A 104 -10.222 -2.364 -5.088 1.00 0.00 H new ATOM 0 HB THR A 104 -8.886 -4.146 -3.019 1.00 0.00 H new ATOM 0 HG1 THR A 104 -11.190 -3.951 -2.252 1.00 0.00 H new ATOM 0 HG21 THR A 104 -9.580 -2.432 -1.384 1.00 0.00 H new ATOM 0 HG22 THR A 104 -8.456 -1.731 -2.571 1.00 0.00 H new ATOM 0 HG23 THR A 104 -10.201 -1.409 -2.701 1.00 0.00 H new ATOM 1462 N MET A 105 -8.195 -1.431 -6.046 1.00 0.00 N ATOM 1463 CA MET A 105 -7.014 -0.691 -6.457 1.00 0.00 C ATOM 1464 C MET A 105 -6.713 0.447 -5.479 1.00 0.00 C ATOM 1465 O MET A 105 -7.628 1.112 -4.995 1.00 0.00 O ATOM 1466 CB MET A 105 -7.232 -0.116 -7.857 1.00 0.00 C ATOM 1467 CG MET A 105 -6.052 0.763 -8.280 1.00 0.00 C ATOM 1468 SD MET A 105 -6.610 2.433 -8.571 1.00 0.00 S ATOM 1469 CE MET A 105 -6.710 2.420 -10.353 1.00 0.00 C ATOM 0 H MET A 105 -9.057 -1.155 -6.517 1.00 0.00 H new ATOM 0 HA MET A 105 -6.165 -1.374 -6.464 1.00 0.00 H new ATOM 0 HB2 MET A 105 -7.359 -0.929 -8.572 1.00 0.00 H new ATOM 0 HB3 MET A 105 -8.151 0.470 -7.874 1.00 0.00 H new ATOM 0 HG2 MET A 105 -5.286 0.756 -7.504 1.00 0.00 H new ATOM 0 HG3 MET A 105 -5.594 0.361 -9.184 1.00 0.00 H new ATOM 0 HE1 MET A 105 -6.569 3.432 -10.733 1.00 0.00 H new ATOM 0 HE2 MET A 105 -5.934 1.770 -10.756 1.00 0.00 H new ATOM 0 HE3 MET A 105 -7.689 2.051 -10.660 1.00 0.00 H new ATOM 1477 N THR A 106 -5.428 0.636 -5.217 1.00 0.00 N ATOM 1478 CA THR A 106 -4.996 1.682 -4.307 1.00 0.00 C ATOM 1479 C THR A 106 -5.827 2.949 -4.516 1.00 0.00 C ATOM 1480 O THR A 106 -5.832 3.519 -5.606 1.00 0.00 O ATOM 1481 CB THR A 106 -3.494 1.898 -4.514 1.00 0.00 C ATOM 1482 OG1 THR A 106 -3.353 2.012 -5.926 1.00 0.00 O ATOM 1483 CG2 THR A 106 -2.670 0.662 -4.154 1.00 0.00 C ATOM 0 H THR A 106 -4.672 0.082 -5.619 1.00 0.00 H new ATOM 0 HA THR A 106 -5.158 1.394 -3.268 1.00 0.00 H new ATOM 0 HB THR A 106 -3.161 2.743 -3.911 1.00 0.00 H new ATOM 0 HG1 THR A 106 -3.317 2.959 -6.176 1.00 0.00 H new ATOM 0 HG21 THR A 106 -1.613 0.869 -4.319 1.00 0.00 H new ATOM 0 HG22 THR A 106 -2.831 0.410 -3.106 1.00 0.00 H new ATOM 0 HG23 THR A 106 -2.978 -0.175 -4.780 1.00 0.00 H new ATOM 1491 N LYS A 107 -6.509 3.352 -3.454 1.00 0.00 N ATOM 1492 CA LYS A 107 -7.342 4.543 -3.509 1.00 0.00 C ATOM 1493 C LYS A 107 -6.630 5.621 -4.327 1.00 0.00 C ATOM 1494 O LYS A 107 -7.279 6.442 -4.975 1.00 0.00 O ATOM 1495 CB LYS A 107 -7.724 4.994 -2.097 1.00 0.00 C ATOM 1496 CG LYS A 107 -9.229 4.852 -1.865 1.00 0.00 C ATOM 1497 CD LYS A 107 -9.936 6.200 -2.018 1.00 0.00 C ATOM 1498 CE LYS A 107 -10.575 6.638 -0.698 1.00 0.00 C ATOM 1499 NZ LYS A 107 -11.053 8.035 -0.792 1.00 0.00 N ATOM 0 H LYS A 107 -6.502 2.876 -2.552 1.00 0.00 H new ATOM 0 HA LYS A 107 -8.282 4.327 -4.016 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -7.181 4.399 -1.362 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -7.426 6.032 -1.950 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -9.644 4.137 -2.575 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -9.411 4.453 -0.867 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -9.221 6.954 -2.348 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -10.702 6.127 -2.790 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -11.408 5.978 -0.454 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -9.850 6.549 0.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -11.484 8.316 0.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -10.251 8.663 -1.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -11.761 8.110 -1.551 1.00 0.00 H new ATOM 1509 N GLU A 108 -5.308 5.586 -4.271 1.00 0.00 N ATOM 1510 CA GLU A 108 -4.501 6.550 -5.000 1.00 0.00 C ATOM 1511 C GLU A 108 -3.429 5.833 -5.822 1.00 0.00 C ATOM 1512 O GLU A 108 -3.412 4.605 -5.889 1.00 0.00 O ATOM 1513 CB GLU A 108 -3.872 7.569 -4.047 1.00 0.00 C ATOM 1514 CG GLU A 108 -4.902 8.605 -3.592 1.00 0.00 C ATOM 1515 CD GLU A 108 -4.405 9.371 -2.365 1.00 0.00 C ATOM 1516 OE1 GLU A 108 -4.027 8.692 -1.386 1.00 0.00 O ATOM 1517 OE2 GLU A 108 -4.411 10.619 -2.435 1.00 0.00 O ATOM 0 H GLU A 108 -4.774 4.905 -3.732 1.00 0.00 H new ATOM 0 HA GLU A 108 -5.151 7.094 -5.685 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -3.461 7.054 -3.179 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -3.041 8.071 -4.543 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -5.103 9.304 -4.404 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -5.844 8.108 -3.358 1.00 0.00 H new ATOM 1522 N SER A 109 -2.560 6.629 -6.427 1.00 0.00 N ATOM 1523 CA SER A 109 -1.488 6.086 -7.243 1.00 0.00 C ATOM 1524 C SER A 109 -0.154 6.210 -6.504 1.00 0.00 C ATOM 1525 O SER A 109 -0.044 6.965 -5.538 1.00 0.00 O ATOM 1526 CB SER A 109 -1.413 6.793 -8.597 1.00 0.00 C ATOM 1527 OG SER A 109 -0.547 6.119 -9.505 1.00 0.00 O ATOM 0 H SER A 109 -2.577 7.647 -6.368 1.00 0.00 H new ATOM 0 HA SER A 109 -1.698 5.032 -7.426 1.00 0.00 H new ATOM 0 HB2 SER A 109 -2.412 6.856 -9.028 1.00 0.00 H new ATOM 0 HB3 SER A 109 -1.063 7.815 -8.453 1.00 0.00 H new ATOM 0 HG SER A 109 -0.341 5.226 -9.159 1.00 0.00 H new ATOM 1532 N ALA A 110 0.825 5.460 -6.985 1.00 0.00 N ATOM 1533 CA ALA A 110 2.147 5.476 -6.381 1.00 0.00 C ATOM 1534 C ALA A 110 3.110 6.238 -7.295 1.00 0.00 C ATOM 1535 O ALA A 110 3.258 5.898 -8.468 1.00 0.00 O ATOM 1536 CB ALA A 110 2.606 4.041 -6.118 1.00 0.00 C ATOM 0 H ALA A 110 0.730 4.837 -7.787 1.00 0.00 H new ATOM 0 HA ALA A 110 2.125 5.992 -5.421 1.00 0.00 H new ATOM 0 HB1 ALA A 110 3.597 4.053 -5.665 1.00 0.00 H new ATOM 0 HB2 ALA A 110 1.904 3.553 -5.442 1.00 0.00 H new ATOM 0 HB3 ALA A 110 2.644 3.493 -7.059 1.00 0.00 H new ATOM 1542 N VAL A 111 3.739 7.253 -6.723 1.00 0.00 N ATOM 1543 CA VAL A 111 4.684 8.065 -7.470 1.00 0.00 C ATOM 1544 C VAL A 111 6.089 7.481 -7.313 1.00 0.00 C ATOM 1545 O VAL A 111 6.549 7.255 -6.195 1.00 0.00 O ATOM 1546 CB VAL A 111 4.589 9.525 -7.021 1.00 0.00 C ATOM 1547 CG1 VAL A 111 5.738 10.353 -7.601 1.00 0.00 C ATOM 1548 CG2 VAL A 111 3.235 10.128 -7.398 1.00 0.00 C ATOM 0 H VAL A 111 3.613 7.532 -5.750 1.00 0.00 H new ATOM 0 HA VAL A 111 4.443 8.050 -8.533 1.00 0.00 H new ATOM 0 HB VAL A 111 4.675 9.547 -5.935 1.00 0.00 H new ATOM 0 HG11 VAL A 111 5.647 11.386 -7.267 1.00 0.00 H new ATOM 0 HG12 VAL A 111 6.689 9.944 -7.260 1.00 0.00 H new ATOM 0 HG13 VAL A 111 5.697 10.319 -8.690 1.00 0.00 H new ATOM 0 HG21 VAL A 111 3.194 11.166 -7.067 1.00 0.00 H new ATOM 0 HG22 VAL A 111 3.107 10.086 -8.480 1.00 0.00 H new ATOM 0 HG23 VAL A 111 2.438 9.562 -6.916 1.00 0.00 H new ATOM 1558 N ILE A 112 6.732 7.255 -8.450 1.00 0.00 N ATOM 1559 CA ILE A 112 8.075 6.701 -8.452 1.00 0.00 C ATOM 1560 C ILE A 112 9.087 7.828 -8.239 1.00 0.00 C ATOM 1561 O ILE A 112 8.852 8.965 -8.649 1.00 0.00 O ATOM 1562 CB ILE A 112 8.318 5.890 -9.726 1.00 0.00 C ATOM 1563 CG1 ILE A 112 7.162 4.923 -9.990 1.00 0.00 C ATOM 1564 CG2 ILE A 112 9.666 5.169 -9.668 1.00 0.00 C ATOM 1565 CD1 ILE A 112 7.042 3.893 -8.864 1.00 0.00 C ATOM 0 H ILE A 112 6.348 7.446 -9.375 1.00 0.00 H new ATOM 0 HA ILE A 112 8.199 6.000 -7.627 1.00 0.00 H new ATOM 0 HB ILE A 112 8.358 6.581 -10.568 1.00 0.00 H new ATOM 0 HG12 ILE A 112 6.230 5.481 -10.079 1.00 0.00 H new ATOM 0 HG13 ILE A 112 7.320 4.412 -10.940 1.00 0.00 H new ATOM 0 HG21 ILE A 112 9.814 4.600 -10.586 1.00 0.00 H new ATOM 0 HG22 ILE A 112 10.466 5.902 -9.562 1.00 0.00 H new ATOM 0 HG23 ILE A 112 9.680 4.491 -8.815 1.00 0.00 H new ATOM 0 HD11 ILE A 112 6.213 3.218 -9.076 1.00 0.00 H new ATOM 0 HD12 ILE A 112 7.967 3.321 -8.794 1.00 0.00 H new ATOM 0 HD13 ILE A 112 6.860 4.406 -7.920 1.00 0.00 H new ATOM 1576 N ALA A 113 10.192 7.476 -7.598 1.00 0.00 N ATOM 1577 CA ALA A 113 11.240 8.444 -7.325 1.00 0.00 C ATOM 1578 C ALA A 113 12.406 7.743 -6.625 1.00 0.00 C ATOM 1579 O ALA A 113 12.214 6.731 -5.953 1.00 0.00 O ATOM 1580 CB ALA A 113 10.669 9.595 -6.494 1.00 0.00 C ATOM 0 H ALA A 113 10.384 6.533 -7.260 1.00 0.00 H new ATOM 0 HA ALA A 113 11.620 8.870 -8.254 1.00 0.00 H new ATOM 0 HB1 ALA A 113 11.456 10.321 -6.289 1.00 0.00 H new ATOM 0 HB2 ALA A 113 9.864 10.079 -7.047 1.00 0.00 H new ATOM 0 HB3 ALA A 113 10.280 9.206 -5.553 1.00 0.00 H new ATOM 1586 N ARG A 114 13.591 8.310 -6.807 1.00 0.00 N ATOM 1587 CA ARG A 114 14.787 7.751 -6.202 1.00 0.00 C ATOM 1588 C ARG A 114 14.975 8.306 -4.787 1.00 0.00 C ATOM 1589 O ARG A 114 16.087 8.664 -4.400 1.00 0.00 O ATOM 1590 CB ARG A 114 16.028 8.073 -7.037 1.00 0.00 C ATOM 1591 CG ARG A 114 16.865 6.816 -7.282 1.00 0.00 C ATOM 1592 CD ARG A 114 18.356 7.153 -7.344 1.00 0.00 C ATOM 1593 NE ARG A 114 19.103 6.331 -6.365 1.00 0.00 N ATOM 1594 CZ ARG A 114 20.438 6.313 -6.263 1.00 0.00 C ATOM 1595 NH1 ARG A 114 21.184 7.072 -7.079 1.00 0.00 N ATOM 1596 NH2 ARG A 114 21.030 5.536 -5.345 1.00 0.00 N ATOM 0 H ARG A 114 13.747 9.150 -7.364 1.00 0.00 H new ATOM 0 HA ARG A 114 14.662 6.669 -6.159 1.00 0.00 H new ATOM 0 HB2 ARG A 114 15.727 8.505 -7.991 1.00 0.00 H new ATOM 0 HB3 ARG A 114 16.632 8.822 -6.524 1.00 0.00 H new ATOM 0 HG2 ARG A 114 16.685 6.094 -6.486 1.00 0.00 H new ATOM 0 HG3 ARG A 114 16.556 6.345 -8.215 1.00 0.00 H new ATOM 0 HD2 ARG A 114 18.737 6.971 -8.349 1.00 0.00 H new ATOM 0 HD3 ARG A 114 18.507 8.212 -7.132 1.00 0.00 H new ATOM 0 HE ARG A 114 18.567 5.741 -5.728 1.00 0.00 H new ATOM 0 HH11 ARG A 114 20.734 7.664 -7.778 1.00 0.00 H new ATOM 0 HH12 ARG A 114 22.201 7.058 -7.001 1.00 0.00 H new ATOM 0 HH21 ARG A 114 20.463 4.958 -4.724 1.00 0.00 H new ATOM 0 HH22 ARG A 114 22.047 5.522 -5.268 1.00 0.00 H new ATOM 1607 N ASP A 115 13.872 8.359 -4.056 1.00 0.00 N ATOM 1608 CA ASP A 115 13.901 8.864 -2.694 1.00 0.00 C ATOM 1609 C ASP A 115 12.760 8.229 -1.895 1.00 0.00 C ATOM 1610 O ASP A 115 11.697 7.945 -2.444 1.00 0.00 O ATOM 1611 CB ASP A 115 13.710 10.381 -2.664 1.00 0.00 C ATOM 1612 CG ASP A 115 14.327 11.087 -1.455 1.00 0.00 C ATOM 1613 OD1 ASP A 115 15.573 11.065 -1.361 1.00 0.00 O ATOM 1614 OD2 ASP A 115 13.539 11.633 -0.654 1.00 0.00 O ATOM 0 H ASP A 115 12.952 8.061 -4.381 1.00 0.00 H new ATOM 0 HA ASP A 115 14.870 8.614 -2.263 1.00 0.00 H new ATOM 0 HB2 ASP A 115 14.141 10.804 -3.572 1.00 0.00 H new ATOM 0 HB3 ASP A 115 12.642 10.598 -2.687 1.00 0.00 H new ATOM 1618 N GLY A 116 13.022 8.025 -0.612 1.00 0.00 N ATOM 1619 CA GLY A 116 12.030 7.429 0.267 1.00 0.00 C ATOM 1620 C GLY A 116 11.881 8.241 1.556 1.00 0.00 C ATOM 1621 O GLY A 116 11.641 9.446 1.510 1.00 0.00 O ATOM 0 H GLY A 116 13.906 8.261 -0.161 1.00 0.00 H new ATOM 0 HA2 GLY A 116 11.070 7.375 -0.246 1.00 0.00 H new ATOM 0 HA3 GLY A 116 12.320 6.407 0.509 1.00 0.00 H new ATOM 1625 N LYS A 117 12.032 7.548 2.675 1.00 0.00 N ATOM 1626 CA LYS A 117 11.917 8.189 3.973 1.00 0.00 C ATOM 1627 C LYS A 117 10.449 8.519 4.248 1.00 0.00 C ATOM 1628 O LYS A 117 9.656 8.659 3.316 1.00 0.00 O ATOM 1629 CB LYS A 117 12.846 9.401 4.056 1.00 0.00 C ATOM 1630 CG LYS A 117 13.319 9.635 5.492 1.00 0.00 C ATOM 1631 CD LYS A 117 12.394 10.612 6.221 1.00 0.00 C ATOM 1632 CE LYS A 117 13.166 11.842 6.702 1.00 0.00 C ATOM 1633 NZ LYS A 117 12.237 12.958 6.988 1.00 0.00 N ATOM 0 H LYS A 117 12.233 6.549 2.709 1.00 0.00 H new ATOM 0 HA LYS A 117 12.244 7.511 4.762 1.00 0.00 H new ATOM 0 HB2 LYS A 117 13.708 9.248 3.406 1.00 0.00 H new ATOM 0 HB3 LYS A 117 12.326 10.287 3.692 1.00 0.00 H new ATOM 0 HG2 LYS A 117 13.348 8.687 6.028 1.00 0.00 H new ATOM 0 HG3 LYS A 117 14.336 10.028 5.484 1.00 0.00 H new ATOM 0 HD2 LYS A 117 11.588 10.921 5.555 1.00 0.00 H new ATOM 0 HD3 LYS A 117 11.930 10.113 7.072 1.00 0.00 H new ATOM 0 HE2 LYS A 117 13.734 11.595 7.599 1.00 0.00 H new ATOM 0 HE3 LYS A 117 13.886 12.146 5.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 12.777 13.785 7.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 11.714 13.204 6.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 11.566 12.670 7.728 1.00 0.00 H new ATOM 1643 N ILE A 118 10.130 8.633 5.528 1.00 0.00 N ATOM 1644 CA ILE A 118 8.770 8.944 5.936 1.00 0.00 C ATOM 1645 C ILE A 118 8.650 10.448 6.191 1.00 0.00 C ATOM 1646 O ILE A 118 9.239 11.252 5.471 1.00 0.00 O ATOM 1647 CB ILE A 118 8.359 8.082 7.132 1.00 0.00 C ATOM 1648 CG1 ILE A 118 9.079 6.733 7.108 1.00 0.00 C ATOM 1649 CG2 ILE A 118 6.839 7.921 7.194 1.00 0.00 C ATOM 1650 CD1 ILE A 118 8.606 5.838 8.256 1.00 0.00 C ATOM 0 H ILE A 118 10.790 8.516 6.297 1.00 0.00 H new ATOM 0 HA ILE A 118 8.067 8.699 5.140 1.00 0.00 H new ATOM 0 HB ILE A 118 8.666 8.593 8.044 1.00 0.00 H new ATOM 0 HG12 ILE A 118 8.896 6.236 6.155 1.00 0.00 H new ATOM 0 HG13 ILE A 118 10.155 6.890 7.184 1.00 0.00 H new ATOM 0 HG21 ILE A 118 6.573 7.304 8.053 1.00 0.00 H new ATOM 0 HG22 ILE A 118 6.373 8.901 7.293 1.00 0.00 H new ATOM 0 HG23 ILE A 118 6.486 7.442 6.280 1.00 0.00 H new ATOM 0 HD11 ILE A 118 9.134 4.885 8.216 1.00 0.00 H new ATOM 0 HD12 ILE A 118 8.813 6.327 9.208 1.00 0.00 H new ATOM 0 HD13 ILE A 118 7.534 5.663 8.163 1.00 0.00 H new ATOM 1661 N TYR A 119 7.883 10.782 7.218 1.00 0.00 N ATOM 1662 CA TYR A 119 7.679 12.175 7.578 1.00 0.00 C ATOM 1663 C TYR A 119 7.857 12.385 9.083 1.00 0.00 C ATOM 1664 O TYR A 119 7.414 13.394 9.628 1.00 0.00 O ATOM 1665 CB TYR A 119 6.232 12.500 7.197 1.00 0.00 C ATOM 1666 CG TYR A 119 6.099 13.345 5.929 1.00 0.00 C ATOM 1667 CD1 TYR A 119 6.126 12.738 4.690 1.00 0.00 C ATOM 1668 CD2 TYR A 119 5.949 14.714 6.024 1.00 0.00 C ATOM 1669 CE1 TYR A 119 5.998 13.534 3.496 1.00 0.00 C ATOM 1670 CE2 TYR A 119 5.823 15.508 4.830 1.00 0.00 C ATOM 1671 CZ TYR A 119 5.854 14.880 3.625 1.00 0.00 C ATOM 1672 OH TYR A 119 5.734 15.631 2.497 1.00 0.00 O ATOM 0 H TYR A 119 7.395 10.112 7.813 1.00 0.00 H new ATOM 0 HA TYR A 119 8.400 12.813 7.068 1.00 0.00 H new ATOM 0 HB2 TYR A 119 5.685 11.567 7.059 1.00 0.00 H new ATOM 0 HB3 TYR A 119 5.759 13.028 8.025 1.00 0.00 H new ATOM 0 HD1 TYR A 119 6.243 11.667 4.615 1.00 0.00 H new ATOM 0 HD2 TYR A 119 5.926 15.189 6.994 1.00 0.00 H new ATOM 0 HE1 TYR A 119 6.016 13.072 2.520 1.00 0.00 H new ATOM 0 HE2 TYR A 119 5.706 16.580 4.890 1.00 0.00 H new ATOM 0 HH TYR A 119 5.637 16.575 2.741 1.00 0.00 H new ATOM 1681 N LYS A 120 8.507 11.416 9.710 1.00 0.00 N ATOM 1682 CA LYS A 120 8.750 11.483 11.140 1.00 0.00 C ATOM 1683 C LYS A 120 10.059 10.759 11.466 1.00 0.00 C ATOM 1684 O LYS A 120 10.070 9.810 12.248 1.00 0.00 O ATOM 1685 CB LYS A 120 7.543 10.947 11.915 1.00 0.00 C ATOM 1686 CG LYS A 120 6.883 12.055 12.737 1.00 0.00 C ATOM 1687 CD LYS A 120 5.760 11.494 13.611 1.00 0.00 C ATOM 1688 CE LYS A 120 4.405 11.624 12.912 1.00 0.00 C ATOM 1689 NZ LYS A 120 3.984 10.321 12.351 1.00 0.00 N ATOM 0 H LYS A 120 8.873 10.580 9.254 1.00 0.00 H new ATOM 0 HA LYS A 120 8.870 12.519 11.457 1.00 0.00 H new ATOM 0 HB2 LYS A 120 6.818 10.525 11.219 1.00 0.00 H new ATOM 0 HB3 LYS A 120 7.860 10.139 12.575 1.00 0.00 H new ATOM 0 HG2 LYS A 120 7.630 12.541 13.365 1.00 0.00 H new ATOM 0 HG3 LYS A 120 6.483 12.818 12.070 1.00 0.00 H new ATOM 0 HD2 LYS A 120 5.958 10.446 13.836 1.00 0.00 H new ATOM 0 HD3 LYS A 120 5.735 12.025 14.563 1.00 0.00 H new ATOM 0 HE2 LYS A 120 3.657 11.981 13.620 1.00 0.00 H new ATOM 0 HE3 LYS A 120 4.470 12.366 12.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 3.063 10.427 11.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 4.690 9.996 11.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 3.903 9.623 13.118 1.00 0.00 H new TER 1699 LYS A 120