USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1013 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 6 GLN : amide:sc= 0.167 K(o=0.59,f=1.2) USER MOD Set 1.2: A 117 SER OG : rot 180:sc= 0.421 USER MOD Set 2.1: A 27 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 53 CYS SG : rot 170:sc= -0.713 USER MOD Set 3.2: A 74 GLN : amide:sc= 0.265 X(o=-0.45,f=-0.72) USER MOD Set 4.1: A 47 THR OG1 : rot 80:sc= 0.23 USER MOD Set 4.2: A 52 TYR OH : rot -2:sc= 1.26 USER MOD Set 4.3: A 86 HIS : no HD1:sc= 1.02 K(o=2.5,f=-0.95) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0.0162 USER MOD Single : A 17 LYS NZ :NH3+ 173:sc= 1.01 (180deg=0.983) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 136:sc= 1.57 USER MOD Single : A 29 ASN : amide:sc= -0.0466 X(o=-0.047,f=-0.047) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= 0.685 K(o=0.69,f=-2.3) USER MOD Single : A 36 SER OG : rot 180:sc= 0.0438 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 CYS SG : rot -160:sc= -0.836 USER MOD Single : A 43 LYS NZ :NH3+ -162:sc= 1.22 (180deg=1.11) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 115:sc= 0.317 USER MOD Single : A 57 ASN : amide:sc= -0.209 X(o=-0.21,f=0) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 67:sc= 0.531 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 ASN : amide:sc= 1.08 K(o=1.1,f=-0.00042) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 SER OG : rot -173:sc= 1.27 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 MET CE :methyl -170:sc=-0.00318 (180deg=-0.134) USER MOD Single : A 91 GLN : amide:sc= 0.701 K(o=0.7,f=0) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 MET CE :methyl -171:sc= 0 (180deg=-0.0488) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 CYS SG : rot -150:sc= 0.647 USER MOD Single : A 125 MET CE :methyl -173:sc= 0 (180deg=-0.0571) USER MOD ----------------------------------------------------------------- ATOM 63 N GLN A 6 8.742 28.977 0.718 1.00 0.00 N ATOM 64 CA GLN A 6 7.521 28.966 -0.097 1.00 0.00 C ATOM 65 C GLN A 6 7.217 30.333 -0.739 1.00 0.00 C ATOM 66 O GLN A 6 7.756 31.374 -0.352 1.00 0.00 O ATOM 67 CB GLN A 6 6.328 28.439 0.732 1.00 0.00 C ATOM 68 CG GLN A 6 5.697 29.458 1.700 1.00 0.00 C ATOM 69 CD GLN A 6 6.669 29.946 2.779 1.00 0.00 C ATOM 70 OE1 GLN A 6 7.196 31.048 2.755 1.00 0.00 O ATOM 71 NE2 GLN A 6 7.002 29.113 3.741 1.00 0.00 N ATOM 0 HA GLN A 6 7.691 28.283 -0.929 1.00 0.00 H new ATOM 0 HB2 GLN A 6 5.557 28.089 0.046 1.00 0.00 H new ATOM 0 HB3 GLN A 6 6.660 27.574 1.307 1.00 0.00 H new ATOM 0 HG2 GLN A 6 5.336 30.315 1.131 1.00 0.00 H new ATOM 0 HG3 GLN A 6 4.829 29.005 2.180 1.00 0.00 H new ATOM 0 HE21 GLN A 6 6.577 28.187 3.784 1.00 0.00 H new ATOM 0 HE22 GLN A 6 7.686 29.393 4.444 1.00 0.00 H new ATOM 80 N ILE A 7 6.297 30.325 -1.707 1.00 0.00 N ATOM 81 CA ILE A 7 5.808 31.543 -2.372 1.00 0.00 C ATOM 82 C ILE A 7 4.843 32.369 -1.502 1.00 0.00 C ATOM 83 O ILE A 7 4.858 33.598 -1.568 1.00 0.00 O ATOM 84 CB ILE A 7 5.171 31.173 -3.727 1.00 0.00 C ATOM 85 CG1 ILE A 7 4.973 32.455 -4.561 1.00 0.00 C ATOM 86 CG2 ILE A 7 3.858 30.384 -3.543 1.00 0.00 C ATOM 87 CD1 ILE A 7 4.664 32.161 -6.026 1.00 0.00 C ATOM 0 H ILE A 7 5.865 29.469 -2.056 1.00 0.00 H new ATOM 0 HA ILE A 7 6.669 32.190 -2.541 1.00 0.00 H new ATOM 0 HB ILE A 7 5.843 30.508 -4.270 1.00 0.00 H new ATOM 0 HG12 ILE A 7 4.160 33.041 -4.133 1.00 0.00 H new ATOM 0 HG13 ILE A 7 5.873 33.067 -4.499 1.00 0.00 H new ATOM 0 HG21 ILE A 7 3.439 30.142 -4.520 1.00 0.00 H new ATOM 0 HG22 ILE A 7 4.061 29.463 -2.996 1.00 0.00 H new ATOM 0 HG23 ILE A 7 3.145 30.989 -2.983 1.00 0.00 H new ATOM 0 HD11 ILE A 7 4.534 33.099 -6.566 1.00 0.00 H new ATOM 0 HD12 ILE A 7 5.488 31.600 -6.466 1.00 0.00 H new ATOM 0 HD13 ILE A 7 3.748 31.574 -6.094 1.00 0.00 H new ATOM 99 N LEU A 8 3.998 31.712 -0.694 1.00 0.00 N ATOM 100 CA LEU A 8 2.979 32.400 0.114 1.00 0.00 C ATOM 101 C LEU A 8 3.590 33.200 1.271 1.00 0.00 C ATOM 102 O LEU A 8 4.613 32.817 1.842 1.00 0.00 O ATOM 103 CB LEU A 8 1.932 31.416 0.680 1.00 0.00 C ATOM 104 CG LEU A 8 0.998 30.723 -0.327 1.00 0.00 C ATOM 105 CD1 LEU A 8 -0.195 30.148 0.433 1.00 0.00 C ATOM 106 CD2 LEU A 8 0.402 31.682 -1.350 1.00 0.00 C ATOM 0 H LEU A 8 4.000 30.698 -0.582 1.00 0.00 H new ATOM 0 HA LEU A 8 2.487 33.095 -0.567 1.00 0.00 H new ATOM 0 HB2 LEU A 8 2.462 30.643 1.236 1.00 0.00 H new ATOM 0 HB3 LEU A 8 1.314 31.957 1.397 1.00 0.00 H new ATOM 0 HG LEU A 8 1.601 29.973 -0.840 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -0.868 29.653 -0.267 1.00 0.00 H new ATOM 0 HD12 LEU A 8 0.157 29.427 1.170 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.727 30.954 0.939 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.247 31.131 -2.031 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -0.179 32.448 -0.836 1.00 0.00 H new ATOM 0 HD23 LEU A 8 1.204 32.154 -1.917 1.00 0.00 H new ATOM 118 N VAL A 9 2.900 34.272 1.664 1.00 0.00 N ATOM 119 CA VAL A 9 3.191 35.041 2.883 1.00 0.00 C ATOM 120 C VAL A 9 2.137 34.693 3.946 1.00 0.00 C ATOM 121 O VAL A 9 0.936 34.828 3.705 1.00 0.00 O ATOM 122 CB VAL A 9 3.365 36.545 2.568 1.00 0.00 C ATOM 123 CG1 VAL A 9 2.261 37.148 1.690 1.00 0.00 C ATOM 124 CG2 VAL A 9 3.499 37.373 3.850 1.00 0.00 C ATOM 0 H VAL A 9 2.108 34.640 1.137 1.00 0.00 H new ATOM 0 HA VAL A 9 4.155 34.762 3.309 1.00 0.00 H new ATOM 0 HB VAL A 9 4.287 36.593 1.988 1.00 0.00 H new ATOM 0 HG11 VAL A 9 2.467 38.205 1.522 1.00 0.00 H new ATOM 0 HG12 VAL A 9 2.232 36.627 0.733 1.00 0.00 H new ATOM 0 HG13 VAL A 9 1.299 37.041 2.191 1.00 0.00 H new ATOM 0 HG21 VAL A 9 3.620 38.425 3.593 1.00 0.00 H new ATOM 0 HG22 VAL A 9 2.603 37.249 4.459 1.00 0.00 H new ATOM 0 HG23 VAL A 9 4.369 37.035 4.412 1.00 0.00 H new ATOM 134 N LEU A 10 2.592 34.180 5.096 1.00 0.00 N ATOM 135 CA LEU A 10 1.750 33.730 6.215 1.00 0.00 C ATOM 136 C LEU A 10 1.711 34.809 7.319 1.00 0.00 C ATOM 137 O LEU A 10 2.618 35.638 7.419 1.00 0.00 O ATOM 138 CB LEU A 10 2.150 32.336 6.765 1.00 0.00 C ATOM 139 CG LEU A 10 2.536 31.230 5.752 1.00 0.00 C ATOM 140 CD1 LEU A 10 3.981 31.342 5.275 1.00 0.00 C ATOM 141 CD2 LEU A 10 2.404 29.860 6.415 1.00 0.00 C ATOM 0 H LEU A 10 3.588 34.062 5.281 1.00 0.00 H new ATOM 0 HA LEU A 10 0.740 33.597 5.828 1.00 0.00 H new ATOM 0 HB2 LEU A 10 2.993 32.475 7.442 1.00 0.00 H new ATOM 0 HB3 LEU A 10 1.318 31.963 7.363 1.00 0.00 H new ATOM 0 HG LEU A 10 1.865 31.350 4.901 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.194 30.541 4.567 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.130 32.306 4.788 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.653 31.260 6.129 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.676 29.083 5.701 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.068 29.808 7.278 1.00 0.00 H new ATOM 0 HD23 LEU A 10 1.374 29.711 6.739 1.00 0.00 H new ATOM 153 N ASP A 11 0.675 34.804 8.155 1.00 0.00 N ATOM 154 CA ASP A 11 0.421 35.831 9.171 1.00 0.00 C ATOM 155 C ASP A 11 -0.281 35.230 10.407 1.00 0.00 C ATOM 156 O ASP A 11 -1.484 34.948 10.331 1.00 0.00 O ATOM 157 CB ASP A 11 -0.473 36.932 8.581 1.00 0.00 C ATOM 158 CG ASP A 11 -0.607 38.151 9.511 1.00 0.00 C ATOM 159 OD1 ASP A 11 0.350 38.465 10.260 1.00 0.00 O ATOM 160 OD2 ASP A 11 -1.670 38.817 9.482 1.00 0.00 O ATOM 0 H ASP A 11 -0.031 34.068 8.147 1.00 0.00 H new ATOM 0 HA ASP A 11 1.381 36.246 9.478 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -0.062 37.254 7.624 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -1.463 36.522 8.381 1.00 0.00 H new ATOM 165 N PRO A 12 0.417 35.026 11.541 1.00 0.00 N ATOM 166 CA PRO A 12 1.854 35.233 11.755 1.00 0.00 C ATOM 167 C PRO A 12 2.757 34.281 10.925 1.00 0.00 C ATOM 168 O PRO A 12 2.421 33.107 10.755 1.00 0.00 O ATOM 169 CB PRO A 12 2.067 35.024 13.261 1.00 0.00 C ATOM 170 CG PRO A 12 0.913 34.106 13.665 1.00 0.00 C ATOM 171 CD PRO A 12 -0.220 34.595 12.771 1.00 0.00 C ATOM 0 HA PRO A 12 2.143 36.229 11.419 1.00 0.00 H new ATOM 0 HB2 PRO A 12 3.034 34.567 13.469 1.00 0.00 H new ATOM 0 HB3 PRO A 12 2.037 35.968 13.805 1.00 0.00 H new ATOM 0 HG2 PRO A 12 1.147 33.056 13.487 1.00 0.00 H new ATOM 0 HG3 PRO A 12 0.667 34.203 14.723 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -0.942 33.800 12.582 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -0.764 35.415 13.240 1.00 0.00 H new ATOM 179 N PRO A 13 3.918 34.752 10.422 1.00 0.00 N ATOM 180 CA PRO A 13 4.823 33.968 9.566 1.00 0.00 C ATOM 181 C PRO A 13 5.725 32.975 10.310 1.00 0.00 C ATOM 182 O PRO A 13 6.109 31.945 9.753 1.00 0.00 O ATOM 183 CB PRO A 13 5.685 35.009 8.845 1.00 0.00 C ATOM 184 CG PRO A 13 5.708 36.204 9.796 1.00 0.00 C ATOM 185 CD PRO A 13 4.318 36.152 10.422 1.00 0.00 C ATOM 0 HA PRO A 13 4.227 33.340 8.904 1.00 0.00 H new ATOM 0 HB2 PRO A 13 6.690 34.631 8.656 1.00 0.00 H new ATOM 0 HB3 PRO A 13 5.259 35.278 7.879 1.00 0.00 H new ATOM 0 HG2 PRO A 13 6.494 36.112 10.545 1.00 0.00 H new ATOM 0 HG3 PRO A 13 5.880 37.141 9.267 1.00 0.00 H new ATOM 0 HD2 PRO A 13 4.334 36.551 11.436 1.00 0.00 H new ATOM 0 HD3 PRO A 13 3.613 36.757 9.852 1.00 0.00 H new ATOM 193 N THR A 14 6.101 33.306 11.544 1.00 0.00 N ATOM 194 CA THR A 14 7.098 32.567 12.341 1.00 0.00 C ATOM 195 C THR A 14 6.499 31.413 13.149 1.00 0.00 C ATOM 196 O THR A 14 6.885 30.261 12.956 1.00 0.00 O ATOM 197 CB THR A 14 7.859 33.507 13.288 1.00 0.00 C ATOM 198 OG1 THR A 14 6.964 34.389 13.937 1.00 0.00 O ATOM 199 CG2 THR A 14 8.877 34.363 12.534 1.00 0.00 C ATOM 0 H THR A 14 5.716 34.113 12.035 1.00 0.00 H new ATOM 0 HA THR A 14 7.786 32.135 11.614 1.00 0.00 H new ATOM 0 HB THR A 14 8.372 32.872 14.010 1.00 0.00 H new ATOM 0 HG1 THR A 14 7.465 34.980 14.538 1.00 0.00 H new ATOM 0 HG21 THR A 14 9.396 35.015 13.237 1.00 0.00 H new ATOM 0 HG22 THR A 14 9.600 33.716 12.038 1.00 0.00 H new ATOM 0 HG23 THR A 14 8.362 34.969 11.789 1.00 0.00 H new ATOM 207 N ASP A 15 5.552 31.715 14.043 1.00 0.00 N ATOM 208 CA ASP A 15 4.917 30.773 14.974 1.00 0.00 C ATOM 209 C ASP A 15 3.437 31.127 15.206 1.00 0.00 C ATOM 210 O ASP A 15 3.053 32.295 15.110 1.00 0.00 O ATOM 211 CB ASP A 15 5.667 30.777 16.313 1.00 0.00 C ATOM 212 CG ASP A 15 7.111 30.270 16.179 1.00 0.00 C ATOM 213 OD1 ASP A 15 7.309 29.071 15.876 1.00 0.00 O ATOM 214 OD2 ASP A 15 8.060 31.049 16.437 1.00 0.00 O ATOM 0 H ASP A 15 5.191 32.664 14.143 1.00 0.00 H new ATOM 0 HA ASP A 15 4.963 29.778 14.531 1.00 0.00 H new ATOM 0 HB2 ASP A 15 5.677 31.789 16.718 1.00 0.00 H new ATOM 0 HB3 ASP A 15 5.131 30.153 17.028 1.00 0.00 H new ATOM 219 N LEU A 16 2.615 30.142 15.581 1.00 0.00 N ATOM 220 CA LEU A 16 1.222 30.351 15.983 1.00 0.00 C ATOM 221 C LEU A 16 1.191 30.649 17.487 1.00 0.00 C ATOM 222 O LEU A 16 1.621 29.833 18.303 1.00 0.00 O ATOM 223 CB LEU A 16 0.372 29.096 15.689 1.00 0.00 C ATOM 224 CG LEU A 16 -0.228 28.919 14.283 1.00 0.00 C ATOM 225 CD1 LEU A 16 -1.293 29.965 13.968 1.00 0.00 C ATOM 226 CD2 LEU A 16 0.815 28.939 13.172 1.00 0.00 C ATOM 0 H LEU A 16 2.903 29.164 15.614 1.00 0.00 H new ATOM 0 HA LEU A 16 0.805 31.185 15.418 1.00 0.00 H new ATOM 0 HB2 LEU A 16 0.991 28.223 15.896 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.451 29.080 16.403 1.00 0.00 H new ATOM 0 HG LEU A 16 -0.685 27.930 14.310 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -1.684 29.795 12.965 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -2.104 29.887 14.692 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -0.852 30.961 14.022 1.00 0.00 H new ATOM 0 HD21 LEU A 16 0.323 28.809 12.208 1.00 0.00 H new ATOM 0 HD22 LEU A 16 1.342 29.893 13.185 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.528 28.129 13.327 1.00 0.00 H new ATOM 238 N LYS A 17 0.651 31.812 17.858 1.00 0.00 N ATOM 239 CA LYS A 17 0.519 32.242 19.255 1.00 0.00 C ATOM 240 C LYS A 17 -0.907 32.025 19.754 1.00 0.00 C ATOM 241 O LYS A 17 -1.866 32.539 19.181 1.00 0.00 O ATOM 242 CB LYS A 17 0.986 33.695 19.442 1.00 0.00 C ATOM 243 CG LYS A 17 2.484 33.871 19.123 1.00 0.00 C ATOM 244 CD LYS A 17 3.063 35.191 19.660 1.00 0.00 C ATOM 245 CE LYS A 17 3.158 35.154 21.192 1.00 0.00 C ATOM 246 NZ LYS A 17 3.713 36.408 21.769 1.00 0.00 N ATOM 0 H LYS A 17 0.288 32.491 17.189 1.00 0.00 H new ATOM 0 HA LYS A 17 1.176 31.623 19.866 1.00 0.00 H new ATOM 0 HB2 LYS A 17 0.400 34.349 18.797 1.00 0.00 H new ATOM 0 HB3 LYS A 17 0.796 34.007 20.469 1.00 0.00 H new ATOM 0 HG2 LYS A 17 3.041 33.037 19.549 1.00 0.00 H new ATOM 0 HG3 LYS A 17 2.627 33.831 18.043 1.00 0.00 H new ATOM 0 HD2 LYS A 17 4.051 35.362 19.233 1.00 0.00 H new ATOM 0 HD3 LYS A 17 2.433 36.024 19.349 1.00 0.00 H new ATOM 0 HE2 LYS A 17 2.166 34.977 21.608 1.00 0.00 H new ATOM 0 HE3 LYS A 17 3.784 34.314 21.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 3.644 36.373 22.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 4.710 36.506 21.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 3.173 37.223 21.413 1.00 0.00 H new ATOM 260 N PHE A 18 -1.016 31.277 20.845 1.00 0.00 N ATOM 261 CA PHE A 18 -2.256 30.961 21.542 1.00 0.00 C ATOM 262 C PHE A 18 -2.256 31.675 22.899 1.00 0.00 C ATOM 263 O PHE A 18 -1.471 31.339 23.787 1.00 0.00 O ATOM 264 CB PHE A 18 -2.378 29.436 21.671 1.00 0.00 C ATOM 265 CG PHE A 18 -2.451 28.723 20.336 1.00 0.00 C ATOM 266 CD1 PHE A 18 -3.707 28.568 19.727 1.00 0.00 C ATOM 267 CD2 PHE A 18 -1.293 28.247 19.682 1.00 0.00 C ATOM 268 CE1 PHE A 18 -3.818 27.960 18.468 1.00 0.00 C ATOM 269 CE2 PHE A 18 -1.406 27.637 18.422 1.00 0.00 C ATOM 270 CZ PHE A 18 -2.659 27.515 17.802 1.00 0.00 C ATOM 0 H PHE A 18 -0.201 30.853 21.289 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.127 31.312 20.988 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -1.523 29.057 22.231 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -3.270 29.198 22.251 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -4.594 28.920 20.232 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -0.325 28.352 20.149 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -4.788 27.833 18.011 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -0.523 27.260 17.927 1.00 0.00 H new ATOM 0 HZ PHE A 18 -2.735 27.081 16.816 1.00 0.00 H new ATOM 280 N LYS A 19 -3.121 32.685 23.045 1.00 0.00 N ATOM 281 CA LYS A 19 -3.320 33.423 24.303 1.00 0.00 C ATOM 282 C LYS A 19 -4.703 33.123 24.876 1.00 0.00 C ATOM 283 O LYS A 19 -5.703 33.301 24.178 1.00 0.00 O ATOM 284 CB LYS A 19 -3.023 34.917 24.087 1.00 0.00 C ATOM 285 CG LYS A 19 -2.989 35.742 25.392 1.00 0.00 C ATOM 286 CD LYS A 19 -4.334 36.342 25.844 1.00 0.00 C ATOM 287 CE LYS A 19 -4.844 37.407 24.857 1.00 0.00 C ATOM 288 NZ LYS A 19 -6.103 38.048 25.327 1.00 0.00 N ATOM 0 H LYS A 19 -3.712 33.019 22.284 1.00 0.00 H new ATOM 0 HA LYS A 19 -2.613 33.088 25.062 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -2.063 35.017 23.580 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -3.779 35.336 23.423 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -2.610 35.105 26.192 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -2.274 36.555 25.266 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -5.074 35.547 25.936 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -4.220 36.787 26.832 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -4.078 38.170 24.720 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -5.013 36.947 23.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -6.411 38.758 24.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -6.842 37.324 25.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -5.936 38.510 26.244 1.00 0.00 H new ATOM 302 N GLY A 20 -4.778 32.683 26.131 1.00 0.00 N ATOM 303 CA GLY A 20 -6.025 32.278 26.760 1.00 0.00 C ATOM 304 C GLY A 20 -5.760 31.509 28.052 1.00 0.00 C ATOM 305 O GLY A 20 -4.607 31.313 28.436 1.00 0.00 O ATOM 0 H GLY A 20 -3.965 32.598 26.742 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -6.631 33.158 26.974 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -6.598 31.656 26.073 1.00 0.00 H new ATOM 309 N PRO A 21 -6.816 31.077 28.751 1.00 0.00 N ATOM 310 CA PRO A 21 -6.655 30.354 30.014 1.00 0.00 C ATOM 311 C PRO A 21 -6.334 28.860 29.893 1.00 0.00 C ATOM 312 O PRO A 21 -5.805 28.199 30.784 1.00 0.00 O ATOM 313 CB PRO A 21 -7.997 30.554 30.696 1.00 0.00 C ATOM 314 CG PRO A 21 -9.017 30.704 29.565 1.00 0.00 C ATOM 315 CD PRO A 21 -8.210 31.425 28.491 1.00 0.00 C ATOM 0 HA PRO A 21 -5.791 30.739 30.556 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -8.242 29.705 31.335 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -7.985 31.439 31.332 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -9.384 29.738 29.218 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -9.887 31.282 29.876 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.514 31.109 27.493 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -8.362 32.503 28.544 1.00 0.00 H new ATOM 323 N PHE A 22 -6.758 28.392 28.740 1.00 0.00 N ATOM 324 CA PHE A 22 -6.861 27.040 28.195 1.00 0.00 C ATOM 325 C PHE A 22 -7.850 26.146 28.960 1.00 0.00 C ATOM 326 O PHE A 22 -7.864 24.933 28.801 1.00 0.00 O ATOM 327 CB PHE A 22 -5.470 26.444 27.959 1.00 0.00 C ATOM 328 CG PHE A 22 -4.532 27.281 27.099 1.00 0.00 C ATOM 329 CD1 PHE A 22 -3.721 28.268 27.693 1.00 0.00 C ATOM 330 CD2 PHE A 22 -4.435 27.058 25.712 1.00 0.00 C ATOM 331 CE1 PHE A 22 -2.793 28.990 26.923 1.00 0.00 C ATOM 332 CE2 PHE A 22 -3.485 27.761 24.946 1.00 0.00 C ATOM 333 CZ PHE A 22 -2.658 28.722 25.552 1.00 0.00 C ATOM 0 H PHE A 22 -7.095 29.058 28.045 1.00 0.00 H new ATOM 0 HA PHE A 22 -7.322 27.103 27.209 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -4.996 26.279 28.927 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -5.588 25.467 27.491 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -3.813 28.472 28.750 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -5.091 26.346 25.234 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -2.183 29.751 27.387 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -3.392 27.561 23.889 1.00 0.00 H new ATOM 0 HZ PHE A 22 -1.922 29.252 24.965 1.00 0.00 H new ATOM 343 N THR A 23 -8.752 26.758 29.729 1.00 0.00 N ATOM 344 CA THR A 23 -9.909 26.113 30.381 1.00 0.00 C ATOM 345 C THR A 23 -11.102 25.934 29.427 1.00 0.00 C ATOM 346 O THR A 23 -12.044 25.197 29.724 1.00 0.00 O ATOM 347 CB THR A 23 -10.322 26.931 31.609 1.00 0.00 C ATOM 348 OG1 THR A 23 -10.695 28.236 31.217 1.00 0.00 O ATOM 349 CG2 THR A 23 -9.138 27.077 32.562 1.00 0.00 C ATOM 0 H THR A 23 -8.701 27.757 29.927 1.00 0.00 H new ATOM 0 HA THR A 23 -9.603 25.112 30.686 1.00 0.00 H new ATOM 0 HB THR A 23 -11.152 26.415 32.092 1.00 0.00 H new ATOM 0 HG1 THR A 23 -10.959 28.752 32.007 1.00 0.00 H new ATOM 0 HG21 THR A 23 -9.441 27.660 33.432 1.00 0.00 H new ATOM 0 HG22 THR A 23 -8.806 26.090 32.884 1.00 0.00 H new ATOM 0 HG23 THR A 23 -8.320 27.586 32.051 1.00 0.00 H new ATOM 357 N ASP A 24 -11.031 26.573 28.256 1.00 0.00 N ATOM 358 CA ASP A 24 -11.924 26.408 27.101 1.00 0.00 C ATOM 359 C ASP A 24 -11.103 26.482 25.788 1.00 0.00 C ATOM 360 O ASP A 24 -9.888 26.704 25.817 1.00 0.00 O ATOM 361 CB ASP A 24 -13.021 27.489 27.144 1.00 0.00 C ATOM 362 CG ASP A 24 -14.371 27.025 26.561 1.00 0.00 C ATOM 363 OD1 ASP A 24 -14.388 26.275 25.556 1.00 0.00 O ATOM 364 OD2 ASP A 24 -15.427 27.429 27.104 1.00 0.00 O ATOM 0 H ASP A 24 -10.303 27.264 28.076 1.00 0.00 H new ATOM 0 HA ASP A 24 -12.406 25.431 27.138 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -13.170 27.802 28.177 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -12.678 28.364 26.592 1.00 0.00 H new ATOM 369 N VAL A 25 -11.754 26.303 24.635 1.00 0.00 N ATOM 370 CA VAL A 25 -11.127 26.356 23.305 1.00 0.00 C ATOM 371 C VAL A 25 -10.497 27.729 23.028 1.00 0.00 C ATOM 372 O VAL A 25 -11.130 28.767 23.239 1.00 0.00 O ATOM 373 CB VAL A 25 -12.147 26.004 22.199 1.00 0.00 C ATOM 374 CG1 VAL A 25 -11.600 26.210 20.779 1.00 0.00 C ATOM 375 CG2 VAL A 25 -12.583 24.536 22.292 1.00 0.00 C ATOM 0 H VAL A 25 -12.755 26.113 24.596 1.00 0.00 H new ATOM 0 HA VAL A 25 -10.330 25.613 23.296 1.00 0.00 H new ATOM 0 HB VAL A 25 -12.983 26.683 22.368 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -12.367 25.944 20.052 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -11.319 27.255 20.645 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -10.725 25.577 20.631 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -13.301 24.319 21.501 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.712 23.890 22.180 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -13.046 24.355 23.262 1.00 0.00 H new ATOM 385 N VAL A 26 -9.276 27.734 22.478 1.00 0.00 N ATOM 386 CA VAL A 26 -8.605 28.937 21.947 1.00 0.00 C ATOM 387 C VAL A 26 -8.789 28.992 20.435 1.00 0.00 C ATOM 388 O VAL A 26 -8.446 28.034 19.745 1.00 0.00 O ATOM 389 CB VAL A 26 -7.098 28.976 22.274 1.00 0.00 C ATOM 390 CG1 VAL A 26 -6.470 30.323 21.891 1.00 0.00 C ATOM 391 CG2 VAL A 26 -6.839 28.776 23.761 1.00 0.00 C ATOM 0 H VAL A 26 -8.713 26.889 22.386 1.00 0.00 H new ATOM 0 HA VAL A 26 -9.065 29.800 22.428 1.00 0.00 H new ATOM 0 HB VAL A 26 -6.652 28.167 21.696 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.408 30.312 22.136 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.594 30.491 20.821 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.962 31.124 22.443 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -5.766 28.810 23.951 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.333 29.567 24.326 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -7.232 27.808 24.072 1.00 0.00 H new ATOM 401 N THR A 27 -9.288 30.113 19.914 1.00 0.00 N ATOM 402 CA THR A 27 -9.380 30.361 18.463 1.00 0.00 C ATOM 403 C THR A 27 -8.240 31.276 18.015 1.00 0.00 C ATOM 404 O THR A 27 -8.061 32.365 18.564 1.00 0.00 O ATOM 405 CB THR A 27 -10.746 30.943 18.063 1.00 0.00 C ATOM 406 OG1 THR A 27 -11.775 30.060 18.460 1.00 0.00 O ATOM 407 CG2 THR A 27 -10.880 31.118 16.550 1.00 0.00 C ATOM 0 H THR A 27 -9.643 30.882 20.483 1.00 0.00 H new ATOM 0 HA THR A 27 -9.285 29.403 17.953 1.00 0.00 H new ATOM 0 HB THR A 27 -10.825 31.914 18.553 1.00 0.00 H new ATOM 0 HG1 THR A 27 -12.644 30.435 18.205 1.00 0.00 H new ATOM 0 HG21 THR A 27 -11.861 31.532 16.317 1.00 0.00 H new ATOM 0 HG22 THR A 27 -10.106 31.797 16.192 1.00 0.00 H new ATOM 0 HG23 THR A 27 -10.769 30.150 16.061 1.00 0.00 H new ATOM 415 N THR A 28 -7.503 30.850 16.989 1.00 0.00 N ATOM 416 CA THR A 28 -6.353 31.560 16.416 1.00 0.00 C ATOM 417 C THR A 28 -6.477 31.508 14.900 1.00 0.00 C ATOM 418 O THR A 28 -6.491 30.421 14.328 1.00 0.00 O ATOM 419 CB THR A 28 -5.036 30.905 16.874 1.00 0.00 C ATOM 420 OG1 THR A 28 -4.896 31.041 18.269 1.00 0.00 O ATOM 421 CG2 THR A 28 -3.787 31.533 16.251 1.00 0.00 C ATOM 0 H THR A 28 -7.696 29.968 16.514 1.00 0.00 H new ATOM 0 HA THR A 28 -6.342 32.596 16.755 1.00 0.00 H new ATOM 0 HB THR A 28 -5.104 29.865 16.555 1.00 0.00 H new ATOM 0 HG1 THR A 28 -4.593 30.191 18.652 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.899 31.020 16.620 1.00 0.00 H new ATOM 0 HG22 THR A 28 -3.835 31.440 15.166 1.00 0.00 H new ATOM 0 HG23 THR A 28 -3.736 32.587 16.522 1.00 0.00 H new ATOM 429 N ASN A 29 -6.584 32.656 14.234 1.00 0.00 N ATOM 430 CA ASN A 29 -6.609 32.717 12.775 1.00 0.00 C ATOM 431 C ASN A 29 -5.203 32.948 12.194 1.00 0.00 C ATOM 432 O ASN A 29 -4.420 33.747 12.713 1.00 0.00 O ATOM 433 CB ASN A 29 -7.661 33.731 12.293 1.00 0.00 C ATOM 434 CG ASN A 29 -7.478 35.140 12.834 1.00 0.00 C ATOM 435 OD1 ASN A 29 -6.743 35.953 12.293 1.00 0.00 O ATOM 436 ND2 ASN A 29 -8.150 35.468 13.917 1.00 0.00 N ATOM 0 H ASN A 29 -6.656 33.566 14.689 1.00 0.00 H new ATOM 0 HA ASN A 29 -6.921 31.748 12.386 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -7.638 33.768 11.204 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -8.650 33.372 12.579 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -8.059 36.405 14.309 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -8.762 34.785 14.364 1.00 0.00 H new ATOM 443 N LEU A 30 -4.909 32.246 11.100 1.00 0.00 N ATOM 444 CA LEU A 30 -3.712 32.390 10.276 1.00 0.00 C ATOM 445 C LEU A 30 -4.137 32.943 8.910 1.00 0.00 C ATOM 446 O LEU A 30 -4.941 32.315 8.220 1.00 0.00 O ATOM 447 CB LEU A 30 -3.029 31.010 10.167 1.00 0.00 C ATOM 448 CG LEU A 30 -1.663 31.041 9.456 1.00 0.00 C ATOM 449 CD1 LEU A 30 -0.553 31.547 10.370 1.00 0.00 C ATOM 450 CD2 LEU A 30 -1.253 29.645 9.000 1.00 0.00 C ATOM 0 H LEU A 30 -5.535 31.522 10.747 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.993 33.084 10.712 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -2.896 30.602 11.169 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -3.691 30.330 9.631 1.00 0.00 H new ATOM 0 HG LEU A 30 -1.786 31.714 8.607 1.00 0.00 H new ATOM 0 HD11 LEU A 30 0.392 31.552 9.827 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -0.787 32.559 10.700 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.469 30.892 11.238 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.285 29.695 8.501 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -1.182 28.986 9.865 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -1.999 29.255 8.307 1.00 0.00 H new ATOM 462 N LYS A 31 -3.621 34.106 8.505 1.00 0.00 N ATOM 463 CA LYS A 31 -3.885 34.699 7.184 1.00 0.00 C ATOM 464 C LYS A 31 -2.798 34.297 6.191 1.00 0.00 C ATOM 465 O LYS A 31 -1.619 34.517 6.455 1.00 0.00 O ATOM 466 CB LYS A 31 -4.032 36.224 7.302 1.00 0.00 C ATOM 467 CG LYS A 31 -5.517 36.530 7.419 1.00 0.00 C ATOM 468 CD LYS A 31 -5.830 38.020 7.524 1.00 0.00 C ATOM 469 CE LYS A 31 -7.356 38.096 7.525 1.00 0.00 C ATOM 470 NZ LYS A 31 -7.851 39.498 7.615 1.00 0.00 N ATOM 0 H LYS A 31 -3.002 34.671 9.087 1.00 0.00 H new ATOM 0 HA LYS A 31 -4.829 34.312 6.800 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.494 36.595 8.174 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -3.606 36.719 6.430 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -6.033 36.120 6.551 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -5.916 36.021 8.297 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -5.411 38.449 8.434 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -5.406 38.574 6.686 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -7.741 37.634 6.616 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -7.746 37.521 8.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -8.891 39.500 7.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -7.506 39.932 8.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -7.502 40.042 6.801 1.00 0.00 H new ATOM 484 N LEU A 32 -3.183 33.713 5.058 1.00 0.00 N ATOM 485 CA LEU A 32 -2.279 33.346 3.967 1.00 0.00 C ATOM 486 C LEU A 32 -2.594 34.193 2.737 1.00 0.00 C ATOM 487 O LEU A 32 -3.695 34.069 2.202 1.00 0.00 O ATOM 488 CB LEU A 32 -2.425 31.849 3.616 1.00 0.00 C ATOM 489 CG LEU A 32 -2.105 30.788 4.682 1.00 0.00 C ATOM 490 CD1 LEU A 32 -0.994 31.197 5.627 1.00 0.00 C ATOM 491 CD2 LEU A 32 -3.325 30.412 5.512 1.00 0.00 C ATOM 0 H LEU A 32 -4.156 33.475 4.867 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.254 33.529 4.288 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -3.453 31.688 3.293 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.786 31.651 2.756 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.771 29.925 4.106 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -0.822 30.402 6.352 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -0.081 31.375 5.059 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -1.279 32.109 6.151 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -3.045 29.660 6.250 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -3.705 31.297 6.022 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -4.099 30.009 4.859 1.00 0.00 H new ATOM 503 N ARG A 33 -1.655 35.024 2.270 1.00 0.00 N ATOM 504 CA ARG A 33 -1.804 35.802 1.025 1.00 0.00 C ATOM 505 C ARG A 33 -0.868 35.282 -0.066 1.00 0.00 C ATOM 506 O ARG A 33 0.259 34.867 0.211 1.00 0.00 O ATOM 507 CB ARG A 33 -1.670 37.317 1.303 1.00 0.00 C ATOM 508 CG ARG A 33 -2.049 38.177 0.086 1.00 0.00 C ATOM 509 CD ARG A 33 -2.037 39.677 0.380 1.00 0.00 C ATOM 510 NE ARG A 33 -2.611 40.420 -0.761 1.00 0.00 N ATOM 511 CZ ARG A 33 -2.476 41.700 -1.050 1.00 0.00 C ATOM 512 NH1 ARG A 33 -1.777 42.517 -0.314 1.00 0.00 N ATOM 513 NH2 ARG A 33 -3.068 42.172 -2.109 1.00 0.00 N ATOM 0 H ARG A 33 -0.765 35.180 2.744 1.00 0.00 H new ATOM 0 HA ARG A 33 -2.812 35.660 0.635 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -2.307 37.586 2.146 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -0.644 37.540 1.595 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -1.356 37.968 -0.729 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -3.042 37.889 -0.259 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -2.610 39.883 1.284 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -1.016 40.011 0.566 1.00 0.00 H new ATOM 0 HE ARG A 33 -3.183 39.875 -1.406 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -1.307 42.174 0.524 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -1.700 43.500 -0.576 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -3.625 41.555 -2.700 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -2.975 43.159 -2.348 1.00 0.00 H new ATOM 527 N ASN A 34 -1.337 35.334 -1.311 1.00 0.00 N ATOM 528 CA ASN A 34 -0.613 34.885 -2.499 1.00 0.00 C ATOM 529 C ASN A 34 -0.085 36.115 -3.264 1.00 0.00 C ATOM 530 O ASN A 34 -0.896 36.883 -3.784 1.00 0.00 O ATOM 531 CB ASN A 34 -1.601 34.034 -3.316 1.00 0.00 C ATOM 532 CG ASN A 34 -1.100 33.569 -4.671 1.00 0.00 C ATOM 533 OD1 ASN A 34 0.049 33.735 -5.053 1.00 0.00 O ATOM 534 ND2 ASN A 34 -1.981 32.959 -5.426 1.00 0.00 N ATOM 0 H ASN A 34 -2.263 35.702 -1.528 1.00 0.00 H new ATOM 0 HA ASN A 34 0.261 34.278 -2.263 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -1.870 33.157 -2.728 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -2.514 34.611 -3.464 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -1.712 32.615 -6.348 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -2.936 32.829 -5.092 1.00 0.00 H new ATOM 541 N PRO A 35 1.246 36.316 -3.356 1.00 0.00 N ATOM 542 CA PRO A 35 1.829 37.474 -4.045 1.00 0.00 C ATOM 543 C PRO A 35 1.625 37.433 -5.569 1.00 0.00 C ATOM 544 O PRO A 35 1.533 38.469 -6.232 1.00 0.00 O ATOM 545 CB PRO A 35 3.335 37.426 -3.758 1.00 0.00 C ATOM 546 CG PRO A 35 3.464 36.498 -2.561 1.00 0.00 C ATOM 547 CD PRO A 35 2.286 35.546 -2.694 1.00 0.00 C ATOM 0 HA PRO A 35 1.344 38.382 -3.686 1.00 0.00 H new ATOM 0 HB2 PRO A 35 3.891 37.047 -4.616 1.00 0.00 H new ATOM 0 HB3 PRO A 35 3.729 38.418 -3.536 1.00 0.00 H new ATOM 0 HG2 PRO A 35 4.413 35.961 -2.574 1.00 0.00 H new ATOM 0 HG3 PRO A 35 3.424 37.051 -1.623 1.00 0.00 H new ATOM 0 HD2 PRO A 35 2.555 34.665 -3.277 1.00 0.00 H new ATOM 0 HD3 PRO A 35 1.953 35.193 -1.718 1.00 0.00 H new ATOM 555 N SER A 36 1.618 36.211 -6.111 1.00 0.00 N ATOM 556 CA SER A 36 1.653 35.906 -7.551 1.00 0.00 C ATOM 557 C SER A 36 0.333 36.143 -8.306 1.00 0.00 C ATOM 558 O SER A 36 -0.722 36.404 -7.726 1.00 0.00 O ATOM 559 CB SER A 36 2.125 34.460 -7.751 1.00 0.00 C ATOM 560 OG SER A 36 2.685 34.297 -9.044 1.00 0.00 O ATOM 0 H SER A 36 1.586 35.369 -5.536 1.00 0.00 H new ATOM 0 HA SER A 36 2.355 36.617 -7.988 1.00 0.00 H new ATOM 0 HB2 SER A 36 2.865 34.204 -6.992 1.00 0.00 H new ATOM 0 HB3 SER A 36 1.286 33.776 -7.622 1.00 0.00 H new ATOM 0 HG SER A 36 2.983 33.370 -9.157 1.00 0.00 H new ATOM 566 N ASP A 37 0.407 35.995 -9.631 1.00 0.00 N ATOM 567 CA ASP A 37 -0.676 36.159 -10.614 1.00 0.00 C ATOM 568 C ASP A 37 -1.221 34.798 -11.117 1.00 0.00 C ATOM 569 O ASP A 37 -1.635 34.650 -12.270 1.00 0.00 O ATOM 570 CB ASP A 37 -0.185 37.090 -11.735 1.00 0.00 C ATOM 571 CG ASP A 37 -1.316 37.577 -12.662 1.00 0.00 C ATOM 572 OD1 ASP A 37 -2.389 37.988 -12.155 1.00 0.00 O ATOM 573 OD2 ASP A 37 -1.113 37.606 -13.902 1.00 0.00 O ATOM 0 H ASP A 37 1.286 35.739 -10.081 1.00 0.00 H new ATOM 0 HA ASP A 37 -1.538 36.630 -10.141 1.00 0.00 H new ATOM 0 HB2 ASP A 37 0.308 37.954 -11.290 1.00 0.00 H new ATOM 0 HB3 ASP A 37 0.564 36.567 -12.330 1.00 0.00 H new ATOM 578 N ARG A 38 -1.184 33.778 -10.243 1.00 0.00 N ATOM 579 CA ARG A 38 -1.570 32.375 -10.491 1.00 0.00 C ATOM 580 C ARG A 38 -2.314 31.808 -9.280 1.00 0.00 C ATOM 581 O ARG A 38 -2.149 32.310 -8.167 1.00 0.00 O ATOM 582 CB ARG A 38 -0.310 31.530 -10.775 1.00 0.00 C ATOM 583 CG ARG A 38 0.467 31.973 -12.021 1.00 0.00 C ATOM 584 CD ARG A 38 1.683 31.068 -12.240 1.00 0.00 C ATOM 585 NE ARG A 38 2.481 31.504 -13.405 1.00 0.00 N ATOM 586 CZ ARG A 38 2.279 31.209 -14.679 1.00 0.00 C ATOM 587 NH1 ARG A 38 1.293 30.454 -15.076 1.00 0.00 N ATOM 588 NH2 ARG A 38 3.080 31.678 -15.594 1.00 0.00 N ATOM 0 H ARG A 38 -0.864 33.918 -9.285 1.00 0.00 H new ATOM 0 HA ARG A 38 -2.231 32.339 -11.357 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.351 31.579 -9.910 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -0.603 30.487 -10.893 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -0.183 31.937 -12.895 1.00 0.00 H new ATOM 0 HG3 ARG A 38 0.791 33.007 -11.907 1.00 0.00 H new ATOM 0 HD2 ARG A 38 2.308 31.074 -11.347 1.00 0.00 H new ATOM 0 HD3 ARG A 38 1.351 30.041 -12.389 1.00 0.00 H new ATOM 0 HE ARG A 38 3.282 32.103 -13.203 1.00 0.00 H new ATOM 0 HH11 ARG A 38 0.641 30.066 -14.394 1.00 0.00 H new ATOM 0 HH12 ARG A 38 1.173 30.251 -16.068 1.00 0.00 H new ATOM 0 HH21 ARG A 38 3.864 32.274 -15.329 1.00 0.00 H new ATOM 0 HH22 ARG A 38 2.923 31.449 -16.575 1.00 0.00 H new ATOM 602 N LYS A 39 -3.097 30.745 -9.477 1.00 0.00 N ATOM 603 CA LYS A 39 -3.809 30.028 -8.401 1.00 0.00 C ATOM 604 C LYS A 39 -2.900 28.977 -7.758 1.00 0.00 C ATOM 605 O LYS A 39 -2.038 28.402 -8.417 1.00 0.00 O ATOM 606 CB LYS A 39 -5.133 29.420 -8.913 1.00 0.00 C ATOM 607 CG LYS A 39 -6.139 30.492 -9.367 1.00 0.00 C ATOM 608 CD LYS A 39 -6.088 30.797 -10.876 1.00 0.00 C ATOM 609 CE LYS A 39 -6.743 32.155 -11.167 1.00 0.00 C ATOM 610 NZ LYS A 39 -6.946 32.371 -12.627 1.00 0.00 N ATOM 0 H LYS A 39 -3.261 30.347 -10.402 1.00 0.00 H new ATOM 0 HA LYS A 39 -4.074 30.747 -7.626 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -4.922 28.749 -9.746 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -5.581 28.817 -8.123 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -7.146 30.165 -9.106 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -5.949 31.412 -8.814 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -5.053 30.804 -11.218 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -6.602 30.011 -11.430 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -7.703 32.212 -10.654 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -6.119 32.953 -10.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -7.390 33.298 -12.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -6.027 32.341 -13.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -7.562 31.624 -13.006 1.00 0.00 H new ATOM 624 N VAL A 40 -3.078 28.716 -6.465 1.00 0.00 N ATOM 625 CA VAL A 40 -2.186 27.840 -5.677 1.00 0.00 C ATOM 626 C VAL A 40 -2.979 27.054 -4.636 1.00 0.00 C ATOM 627 O VAL A 40 -3.762 27.634 -3.889 1.00 0.00 O ATOM 628 CB VAL A 40 -1.032 28.680 -5.084 1.00 0.00 C ATOM 629 CG1 VAL A 40 -1.502 29.765 -4.120 1.00 0.00 C ATOM 630 CG2 VAL A 40 0.049 27.854 -4.381 1.00 0.00 C ATOM 0 H VAL A 40 -3.849 29.105 -5.922 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.730 27.088 -6.321 1.00 0.00 H new ATOM 0 HB VAL A 40 -0.596 29.145 -5.968 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -0.640 30.315 -3.743 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -2.170 30.451 -4.642 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -2.033 29.306 -3.286 1.00 0.00 H new ATOM 0 HG21 VAL A 40 0.821 28.519 -3.994 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -0.397 27.297 -3.557 1.00 0.00 H new ATOM 0 HG23 VAL A 40 0.494 27.157 -5.091 1.00 0.00 H new ATOM 640 N CYS A 41 -2.771 25.740 -4.568 1.00 0.00 N ATOM 641 CA CYS A 41 -3.427 24.862 -3.603 1.00 0.00 C ATOM 642 C CYS A 41 -2.656 24.920 -2.285 1.00 0.00 C ATOM 643 O CYS A 41 -1.425 24.850 -2.295 1.00 0.00 O ATOM 644 CB CYS A 41 -3.434 23.411 -4.113 1.00 0.00 C ATOM 645 SG CYS A 41 -4.556 23.188 -5.518 1.00 0.00 S ATOM 0 H CYS A 41 -2.131 25.249 -5.192 1.00 0.00 H new ATOM 0 HA CYS A 41 -4.456 25.192 -3.462 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -2.424 23.126 -4.407 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -3.730 22.744 -3.303 1.00 0.00 H new ATOM 0 HG CYS A 41 -4.852 21.928 -5.642 1.00 0.00 H new ATOM 651 N PHE A 42 -3.371 25.000 -1.164 1.00 0.00 N ATOM 652 CA PHE A 42 -2.790 24.877 0.183 1.00 0.00 C ATOM 653 C PHE A 42 -3.356 23.684 0.971 1.00 0.00 C ATOM 654 O PHE A 42 -4.532 23.343 0.838 1.00 0.00 O ATOM 655 CB PHE A 42 -2.912 26.201 0.960 1.00 0.00 C ATOM 656 CG PHE A 42 -4.273 26.496 1.568 1.00 0.00 C ATOM 657 CD1 PHE A 42 -5.258 27.146 0.804 1.00 0.00 C ATOM 658 CD2 PHE A 42 -4.546 26.144 2.905 1.00 0.00 C ATOM 659 CE1 PHE A 42 -6.507 27.450 1.373 1.00 0.00 C ATOM 660 CE2 PHE A 42 -5.801 26.436 3.473 1.00 0.00 C ATOM 661 CZ PHE A 42 -6.781 27.091 2.705 1.00 0.00 C ATOM 0 H PHE A 42 -4.379 25.153 -1.159 1.00 0.00 H new ATOM 0 HA PHE A 42 -1.728 24.666 0.054 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -2.172 26.199 1.760 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -2.652 27.019 0.288 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -5.055 27.412 -0.223 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -3.790 25.649 3.496 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -7.257 27.960 0.787 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -6.011 26.158 4.495 1.00 0.00 H new ATOM 0 HZ PHE A 42 -7.744 27.318 3.138 1.00 0.00 H new ATOM 671 N LYS A 43 -2.524 23.078 1.824 1.00 0.00 N ATOM 672 CA LYS A 43 -2.914 22.049 2.809 1.00 0.00 C ATOM 673 C LYS A 43 -2.284 22.281 4.187 1.00 0.00 C ATOM 674 O LYS A 43 -1.144 22.733 4.260 1.00 0.00 O ATOM 675 CB LYS A 43 -2.552 20.645 2.280 1.00 0.00 C ATOM 676 CG LYS A 43 -3.614 20.079 1.328 1.00 0.00 C ATOM 677 CD LYS A 43 -3.248 18.662 0.861 1.00 0.00 C ATOM 678 CE LYS A 43 -4.431 18.048 0.099 1.00 0.00 C ATOM 679 NZ LYS A 43 -4.109 16.700 -0.439 1.00 0.00 N ATOM 0 H LYS A 43 -1.527 23.293 1.853 1.00 0.00 H new ATOM 0 HA LYS A 43 -3.994 22.122 2.940 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -1.594 20.692 1.762 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -2.426 19.965 3.123 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -4.582 20.060 1.829 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -3.716 20.734 0.463 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -2.368 18.696 0.219 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -2.993 18.040 1.719 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -5.292 17.977 0.763 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -4.715 18.707 -0.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -4.791 16.452 -1.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -3.148 16.705 -0.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -4.162 15.999 0.327 1.00 0.00 H new ATOM 693 N VAL A 44 -3.003 21.947 5.268 1.00 0.00 N ATOM 694 CA VAL A 44 -2.565 22.128 6.669 1.00 0.00 C ATOM 695 C VAL A 44 -2.475 20.785 7.412 1.00 0.00 C ATOM 696 O VAL A 44 -3.396 19.972 7.334 1.00 0.00 O ATOM 697 CB VAL A 44 -3.475 23.125 7.433 1.00 0.00 C ATOM 698 CG1 VAL A 44 -2.802 23.536 8.746 1.00 0.00 C ATOM 699 CG2 VAL A 44 -3.727 24.403 6.617 1.00 0.00 C ATOM 0 H VAL A 44 -3.932 21.532 5.195 1.00 0.00 H new ATOM 0 HA VAL A 44 -1.564 22.557 6.634 1.00 0.00 H new ATOM 0 HB VAL A 44 -4.424 22.622 7.616 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -3.444 24.236 9.280 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -2.637 22.652 9.362 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -1.845 24.012 8.531 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -4.368 25.077 7.185 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.777 24.895 6.409 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.215 24.144 5.677 1.00 0.00 H new ATOM 709 N LYS A 45 -1.390 20.573 8.172 1.00 0.00 N ATOM 710 CA LYS A 45 -1.175 19.428 9.084 1.00 0.00 C ATOM 711 C LYS A 45 -0.777 19.904 10.487 1.00 0.00 C ATOM 712 O LYS A 45 -0.232 20.997 10.640 1.00 0.00 O ATOM 713 CB LYS A 45 -0.131 18.456 8.496 1.00 0.00 C ATOM 714 CG LYS A 45 -0.622 17.784 7.203 1.00 0.00 C ATOM 715 CD LYS A 45 0.377 16.767 6.629 1.00 0.00 C ATOM 716 CE LYS A 45 0.540 15.522 7.520 1.00 0.00 C ATOM 717 NZ LYS A 45 1.444 14.517 6.890 1.00 0.00 N ATOM 0 H LYS A 45 -0.602 21.220 8.171 1.00 0.00 H new ATOM 0 HA LYS A 45 -2.116 18.887 9.183 1.00 0.00 H new ATOM 0 HB2 LYS A 45 0.793 18.998 8.293 1.00 0.00 H new ATOM 0 HB3 LYS A 45 0.105 17.690 9.234 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -1.569 17.281 7.400 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -0.819 18.552 6.455 1.00 0.00 H new ATOM 0 HD2 LYS A 45 0.045 16.458 5.638 1.00 0.00 H new ATOM 0 HD3 LYS A 45 1.347 17.248 6.504 1.00 0.00 H new ATOM 0 HE2 LYS A 45 0.941 15.817 8.490 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -0.436 15.072 7.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 1.533 13.690 7.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 1.048 14.219 5.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 2.382 14.940 6.740 1.00 0.00 H new ATOM 731 N THR A 46 -1.055 19.090 11.506 1.00 0.00 N ATOM 732 CA THR A 46 -0.900 19.448 12.934 1.00 0.00 C ATOM 733 C THR A 46 -0.381 18.268 13.765 1.00 0.00 C ATOM 734 O THR A 46 -0.424 17.125 13.317 1.00 0.00 O ATOM 735 CB THR A 46 -2.234 19.988 13.489 1.00 0.00 C ATOM 736 OG1 THR A 46 -2.037 20.535 14.768 1.00 0.00 O ATOM 737 CG2 THR A 46 -3.335 18.932 13.613 1.00 0.00 C ATOM 0 H THR A 46 -1.402 18.141 11.369 1.00 0.00 H new ATOM 0 HA THR A 46 -0.149 20.235 13.009 1.00 0.00 H new ATOM 0 HB THR A 46 -2.562 20.734 12.765 1.00 0.00 H new ATOM 0 HG1 THR A 46 -2.215 21.498 14.743 1.00 0.00 H new ATOM 0 HG21 THR A 46 -4.239 19.394 14.010 1.00 0.00 H new ATOM 0 HG22 THR A 46 -3.545 18.509 12.631 1.00 0.00 H new ATOM 0 HG23 THR A 46 -3.006 18.140 14.286 1.00 0.00 H new ATOM 745 N THR A 47 0.110 18.520 14.979 1.00 0.00 N ATOM 746 CA THR A 47 0.709 17.501 15.864 1.00 0.00 C ATOM 747 C THR A 47 -0.272 16.760 16.780 1.00 0.00 C ATOM 748 O THR A 47 0.129 15.888 17.549 1.00 0.00 O ATOM 749 CB THR A 47 1.825 18.117 16.709 1.00 0.00 C ATOM 750 OG1 THR A 47 1.398 19.325 17.307 1.00 0.00 O ATOM 751 CG2 THR A 47 3.022 18.462 15.841 1.00 0.00 C ATOM 0 H THR A 47 0.106 19.454 15.389 1.00 0.00 H new ATOM 0 HA THR A 47 1.100 16.746 15.182 1.00 0.00 H new ATOM 0 HB THR A 47 2.089 17.381 17.469 1.00 0.00 H new ATOM 0 HG1 THR A 47 0.860 19.125 18.101 1.00 0.00 H new ATOM 0 HG21 THR A 47 3.806 18.899 16.459 1.00 0.00 H new ATOM 0 HG22 THR A 47 3.398 17.557 15.364 1.00 0.00 H new ATOM 0 HG23 THR A 47 2.722 19.178 15.076 1.00 0.00 H new ATOM 759 N ALA A 48 -1.555 17.128 16.757 1.00 0.00 N ATOM 760 CA ALA A 48 -2.570 16.508 17.624 1.00 0.00 C ATOM 761 C ALA A 48 -4.007 16.723 17.104 1.00 0.00 C ATOM 762 O ALA A 48 -4.616 17.745 17.421 1.00 0.00 O ATOM 763 CB ALA A 48 -2.398 17.079 19.048 1.00 0.00 C ATOM 0 H ALA A 48 -1.921 17.857 16.144 1.00 0.00 H new ATOM 0 HA ALA A 48 -2.419 15.429 17.628 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -3.140 16.634 19.711 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -1.398 16.846 19.415 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -2.534 18.160 19.025 1.00 0.00 H new ATOM 769 N PRO A 49 -4.628 15.765 16.384 1.00 0.00 N ATOM 770 CA PRO A 49 -5.960 15.965 15.793 1.00 0.00 C ATOM 771 C PRO A 49 -7.070 16.012 16.861 1.00 0.00 C ATOM 772 O PRO A 49 -8.089 16.670 16.678 1.00 0.00 O ATOM 773 CB PRO A 49 -6.124 14.804 14.808 1.00 0.00 C ATOM 774 CG PRO A 49 -5.308 13.678 15.437 1.00 0.00 C ATOM 775 CD PRO A 49 -4.142 14.417 16.097 1.00 0.00 C ATOM 0 HA PRO A 49 -6.047 16.928 15.290 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -7.171 14.523 14.691 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -5.751 15.064 13.817 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -5.892 13.116 16.165 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -4.961 12.966 14.689 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -3.828 13.913 17.011 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -3.276 14.447 15.436 1.00 0.00 H new ATOM 783 N ARG A 50 -6.823 15.389 18.026 1.00 0.00 N ATOM 784 CA ARG A 50 -7.660 15.450 19.243 1.00 0.00 C ATOM 785 C ARG A 50 -7.377 16.649 20.169 1.00 0.00 C ATOM 786 O ARG A 50 -7.965 16.741 21.243 1.00 0.00 O ATOM 787 CB ARG A 50 -7.680 14.061 19.930 1.00 0.00 C ATOM 788 CG ARG A 50 -6.318 13.399 20.228 1.00 0.00 C ATOM 789 CD ARG A 50 -5.482 14.182 21.245 1.00 0.00 C ATOM 790 NE ARG A 50 -4.296 13.420 21.682 1.00 0.00 N ATOM 791 CZ ARG A 50 -4.191 12.653 22.754 1.00 0.00 C ATOM 792 NH1 ARG A 50 -5.172 12.436 23.573 1.00 0.00 N ATOM 793 NH2 ARG A 50 -3.071 12.066 23.049 1.00 0.00 N ATOM 0 H ARG A 50 -5.998 14.802 18.154 1.00 0.00 H new ATOM 0 HA ARG A 50 -8.682 15.671 18.937 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -8.221 14.158 20.871 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -8.255 13.382 19.301 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -6.485 12.390 20.604 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -5.755 13.304 19.299 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -5.165 15.127 20.804 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -6.097 14.425 22.111 1.00 0.00 H new ATOM 0 HE ARG A 50 -3.467 13.493 21.093 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -6.081 12.867 23.405 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -5.035 11.835 24.385 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -2.255 12.193 22.450 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -3.007 11.478 23.880 1.00 0.00 H new ATOM 807 N ARG A 51 -6.479 17.569 19.784 1.00 0.00 N ATOM 808 CA ARG A 51 -6.254 18.869 20.466 1.00 0.00 C ATOM 809 C ARG A 51 -6.297 20.090 19.539 1.00 0.00 C ATOM 810 O ARG A 51 -6.435 21.187 20.055 1.00 0.00 O ATOM 811 CB ARG A 51 -4.938 18.872 21.275 1.00 0.00 C ATOM 812 CG ARG A 51 -4.885 17.897 22.459 1.00 0.00 C ATOM 813 CD ARG A 51 -5.843 18.259 23.603 1.00 0.00 C ATOM 814 NE ARG A 51 -5.791 17.226 24.653 1.00 0.00 N ATOM 815 CZ ARG A 51 -6.507 16.118 24.705 1.00 0.00 C ATOM 816 NH1 ARG A 51 -7.454 15.827 23.868 1.00 0.00 N ATOM 817 NH2 ARG A 51 -6.258 15.215 25.594 1.00 0.00 N ATOM 0 H ARG A 51 -5.873 17.435 18.975 1.00 0.00 H new ATOM 0 HA ARG A 51 -7.100 18.966 21.146 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -4.116 18.639 20.598 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -4.765 19.881 21.650 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -5.122 16.894 22.103 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -3.867 17.866 22.846 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -5.572 19.228 24.022 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -6.860 18.350 23.221 1.00 0.00 H new ATOM 0 HE ARG A 51 -5.135 17.383 25.418 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -7.683 16.473 23.113 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -7.969 14.952 23.965 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -5.502 15.354 26.265 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -6.817 14.363 25.626 1.00 0.00 H new ATOM 831 N TYR A 52 -6.226 19.943 18.219 1.00 0.00 N ATOM 832 CA TYR A 52 -6.261 21.065 17.272 1.00 0.00 C ATOM 833 C TYR A 52 -7.205 20.763 16.102 1.00 0.00 C ATOM 834 O TYR A 52 -7.083 19.737 15.431 1.00 0.00 O ATOM 835 CB TYR A 52 -4.849 21.366 16.743 1.00 0.00 C ATOM 836 CG TYR A 52 -3.841 21.871 17.764 1.00 0.00 C ATOM 837 CD1 TYR A 52 -3.290 20.979 18.699 1.00 0.00 C ATOM 838 CD2 TYR A 52 -3.412 23.211 17.748 1.00 0.00 C ATOM 839 CE1 TYR A 52 -2.297 21.402 19.601 1.00 0.00 C ATOM 840 CE2 TYR A 52 -2.390 23.638 18.621 1.00 0.00 C ATOM 841 CZ TYR A 52 -1.837 22.736 19.557 1.00 0.00 C ATOM 842 OH TYR A 52 -0.895 23.153 20.441 1.00 0.00 O ATOM 0 H TYR A 52 -6.141 19.033 17.767 1.00 0.00 H new ATOM 0 HA TYR A 52 -6.635 21.941 17.801 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -4.452 20.457 16.291 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -4.932 22.107 15.948 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -3.633 19.955 18.726 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -3.866 23.914 17.066 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -1.889 20.710 20.323 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -2.030 24.655 18.574 1.00 0.00 H new ATOM 0 HH TYR A 52 -0.672 22.420 21.052 1.00 0.00 H new ATOM 852 N CYS A 53 -8.110 21.705 15.832 1.00 0.00 N ATOM 853 CA CYS A 53 -9.101 21.645 14.756 1.00 0.00 C ATOM 854 C CYS A 53 -8.813 22.760 13.735 1.00 0.00 C ATOM 855 O CYS A 53 -8.542 23.894 14.126 1.00 0.00 O ATOM 856 CB CYS A 53 -10.495 21.738 15.397 1.00 0.00 C ATOM 857 SG CYS A 53 -10.747 20.330 16.522 1.00 0.00 S ATOM 0 H CYS A 53 -8.175 22.564 16.378 1.00 0.00 H new ATOM 0 HA CYS A 53 -9.052 20.708 14.202 1.00 0.00 H new ATOM 0 HB2 CYS A 53 -10.592 22.675 15.944 1.00 0.00 H new ATOM 0 HB3 CYS A 53 -11.263 21.740 14.623 1.00 0.00 H new ATOM 0 HG CYS A 53 -11.827 20.520 17.220 1.00 0.00 H new ATOM 863 N VAL A 54 -8.840 22.443 12.440 1.00 0.00 N ATOM 864 CA VAL A 54 -8.394 23.303 11.321 1.00 0.00 C ATOM 865 C VAL A 54 -9.550 23.410 10.328 1.00 0.00 C ATOM 866 O VAL A 54 -9.596 22.650 9.368 1.00 0.00 O ATOM 867 CB VAL A 54 -7.121 22.731 10.677 1.00 0.00 C ATOM 868 CG1 VAL A 54 -6.549 23.779 9.714 1.00 0.00 C ATOM 869 CG2 VAL A 54 -6.028 22.458 11.719 1.00 0.00 C ATOM 0 H VAL A 54 -9.188 21.540 12.118 1.00 0.00 H new ATOM 0 HA VAL A 54 -8.134 24.301 11.675 1.00 0.00 H new ATOM 0 HB VAL A 54 -7.393 21.801 10.179 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.644 23.389 9.248 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -7.286 24.006 8.943 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -6.310 24.688 10.266 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -5.145 22.055 11.223 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.767 23.388 12.225 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -6.394 21.738 12.450 1.00 0.00 H new ATOM 879 N ARG A 55 -10.490 24.344 10.532 1.00 0.00 N ATOM 880 CA ARG A 55 -11.776 24.389 9.792 1.00 0.00 C ATOM 881 C ARG A 55 -11.756 24.085 8.291 1.00 0.00 C ATOM 882 O ARG A 55 -12.466 23.173 7.867 1.00 0.00 O ATOM 883 CB ARG A 55 -12.587 25.654 10.128 1.00 0.00 C ATOM 884 CG ARG A 55 -14.094 25.422 9.935 1.00 0.00 C ATOM 885 CD ARG A 55 -14.902 26.621 10.446 1.00 0.00 C ATOM 886 NE ARG A 55 -16.352 26.397 10.287 1.00 0.00 N ATOM 887 CZ ARG A 55 -17.324 27.195 10.698 1.00 0.00 C ATOM 888 NH1 ARG A 55 -17.083 28.322 11.307 1.00 0.00 N ATOM 889 NH2 ARG A 55 -18.570 26.870 10.502 1.00 0.00 N ATOM 0 H ARG A 55 -10.387 25.095 11.215 1.00 0.00 H new ATOM 0 HA ARG A 55 -12.297 23.514 10.181 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -12.392 25.950 11.159 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -12.260 26.477 9.493 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -14.308 25.257 8.879 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -14.398 24.520 10.466 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -14.672 26.796 11.497 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -14.609 27.519 9.902 1.00 0.00 H new ATOM 0 HE ARG A 55 -16.634 25.540 9.812 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -16.121 28.613 11.480 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -17.857 28.913 11.611 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -18.801 25.996 10.029 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -19.315 27.489 10.821 1.00 0.00 H new ATOM 903 N PRO A 56 -10.955 24.791 7.484 1.00 0.00 N ATOM 904 CA PRO A 56 -10.781 24.452 6.076 1.00 0.00 C ATOM 905 C PRO A 56 -9.995 23.150 5.813 1.00 0.00 C ATOM 906 O PRO A 56 -10.313 22.405 4.891 1.00 0.00 O ATOM 907 CB PRO A 56 -9.985 25.625 5.488 1.00 0.00 C ATOM 908 CG PRO A 56 -9.292 26.210 6.721 1.00 0.00 C ATOM 909 CD PRO A 56 -10.338 26.067 7.791 1.00 0.00 C ATOM 0 HA PRO A 56 -11.762 24.287 5.631 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -9.266 25.292 4.739 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -10.635 26.354 5.004 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -8.382 25.665 6.970 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -9.008 27.251 6.569 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -9.897 26.071 8.788 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -11.061 26.882 7.759 1.00 0.00 H new ATOM 917 N ASN A 57 -8.908 22.948 6.578 1.00 0.00 N ATOM 918 CA ASN A 57 -7.815 21.956 6.476 1.00 0.00 C ATOM 919 C ASN A 57 -7.053 21.950 5.133 1.00 0.00 C ATOM 920 O ASN A 57 -5.954 21.404 5.042 1.00 0.00 O ATOM 921 CB ASN A 57 -8.243 20.565 6.992 1.00 0.00 C ATOM 922 CG ASN A 57 -9.004 19.704 5.996 1.00 0.00 C ATOM 923 OD1 ASN A 57 -10.208 19.516 6.083 1.00 0.00 O ATOM 924 ND2 ASN A 57 -8.318 19.118 5.034 1.00 0.00 N ATOM 0 H ASN A 57 -8.753 23.552 7.385 1.00 0.00 H new ATOM 0 HA ASN A 57 -7.044 22.302 7.165 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -7.351 20.023 7.307 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -8.864 20.700 7.878 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -8.793 18.511 4.366 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -7.313 19.272 4.958 1.00 0.00 H new ATOM 931 N SER A 58 -7.617 22.574 4.100 1.00 0.00 N ATOM 932 CA SER A 58 -7.091 22.670 2.733 1.00 0.00 C ATOM 933 C SER A 58 -7.888 23.688 1.905 1.00 0.00 C ATOM 934 O SER A 58 -8.973 24.119 2.310 1.00 0.00 O ATOM 935 CB SER A 58 -7.162 21.297 2.042 1.00 0.00 C ATOM 936 OG SER A 58 -8.499 20.842 1.906 1.00 0.00 O ATOM 0 H SER A 58 -8.510 23.057 4.198 1.00 0.00 H new ATOM 0 HA SER A 58 -6.054 23.001 2.797 1.00 0.00 H new ATOM 0 HB2 SER A 58 -6.699 21.362 1.058 1.00 0.00 H new ATOM 0 HB3 SER A 58 -6.588 20.571 2.618 1.00 0.00 H new ATOM 0 HG SER A 58 -8.504 19.969 1.462 1.00 0.00 H new ATOM 942 N GLY A 59 -7.377 24.044 0.726 1.00 0.00 N ATOM 943 CA GLY A 59 -8.104 24.849 -0.259 1.00 0.00 C ATOM 944 C GLY A 59 -7.209 25.371 -1.374 1.00 0.00 C ATOM 945 O GLY A 59 -6.137 24.829 -1.626 1.00 0.00 O ATOM 0 H GLY A 59 -6.439 23.780 0.424 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -8.903 24.248 -0.693 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -8.576 25.692 0.246 1.00 0.00 H new ATOM 949 N ILE A 60 -7.648 26.434 -2.048 1.00 0.00 N ATOM 950 CA ILE A 60 -6.889 27.129 -3.097 1.00 0.00 C ATOM 951 C ILE A 60 -6.971 28.649 -2.865 1.00 0.00 C ATOM 952 O ILE A 60 -8.043 29.170 -2.549 1.00 0.00 O ATOM 953 CB ILE A 60 -7.408 26.734 -4.500 1.00 0.00 C ATOM 954 CG1 ILE A 60 -7.545 25.203 -4.688 1.00 0.00 C ATOM 955 CG2 ILE A 60 -6.556 27.361 -5.624 1.00 0.00 C ATOM 956 CD1 ILE A 60 -7.881 24.746 -6.119 1.00 0.00 C ATOM 0 H ILE A 60 -8.564 26.849 -1.878 1.00 0.00 H new ATOM 0 HA ILE A 60 -5.842 26.830 -3.048 1.00 0.00 H new ATOM 0 HB ILE A 60 -8.415 27.146 -4.572 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -6.611 24.731 -4.383 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -8.322 24.838 -4.016 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -6.953 27.059 -6.593 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.587 28.447 -5.541 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -5.525 27.020 -5.532 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -7.955 23.659 -6.146 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -8.831 25.182 -6.427 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -7.095 25.073 -6.799 1.00 0.00 H new ATOM 968 N ILE A 61 -5.851 29.359 -3.036 1.00 0.00 N ATOM 969 CA ILE A 61 -5.763 30.827 -2.942 1.00 0.00 C ATOM 970 C ILE A 61 -5.698 31.458 -4.338 1.00 0.00 C ATOM 971 O ILE A 61 -4.923 31.026 -5.196 1.00 0.00 O ATOM 972 CB ILE A 61 -4.590 31.281 -2.042 1.00 0.00 C ATOM 973 CG1 ILE A 61 -4.609 30.485 -0.716 1.00 0.00 C ATOM 974 CG2 ILE A 61 -4.653 32.808 -1.824 1.00 0.00 C ATOM 975 CD1 ILE A 61 -3.734 31.052 0.398 1.00 0.00 C ATOM 0 H ILE A 61 -4.955 28.921 -3.249 1.00 0.00 H new ATOM 0 HA ILE A 61 -6.673 31.184 -2.460 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.639 31.069 -2.530 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.637 30.433 -0.357 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.291 29.463 -0.921 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.823 33.119 -1.189 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -4.584 33.316 -2.786 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -5.596 33.068 -1.343 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -3.818 30.422 1.283 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -2.696 31.077 0.068 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.062 32.063 0.640 1.00 0.00 H new ATOM 987 N ASP A 62 -6.489 32.509 -4.544 1.00 0.00 N ATOM 988 CA ASP A 62 -6.539 33.293 -5.784 1.00 0.00 C ATOM 989 C ASP A 62 -5.361 34.284 -5.907 1.00 0.00 C ATOM 990 O ASP A 62 -4.776 34.679 -4.893 1.00 0.00 O ATOM 991 CB ASP A 62 -7.898 34.014 -5.858 1.00 0.00 C ATOM 992 CG ASP A 62 -9.030 33.056 -6.254 1.00 0.00 C ATOM 993 OD1 ASP A 62 -9.087 32.649 -7.439 1.00 0.00 O ATOM 994 OD2 ASP A 62 -9.877 32.723 -5.389 1.00 0.00 O ATOM 0 H ASP A 62 -7.134 32.852 -3.833 1.00 0.00 H new ATOM 0 HA ASP A 62 -6.438 32.613 -6.630 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -8.124 34.464 -4.891 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -7.839 34.827 -6.582 1.00 0.00 H new ATOM 999 N PRO A 63 -4.991 34.722 -7.127 1.00 0.00 N ATOM 1000 CA PRO A 63 -3.914 35.692 -7.335 1.00 0.00 C ATOM 1001 C PRO A 63 -4.133 36.993 -6.547 1.00 0.00 C ATOM 1002 O PRO A 63 -5.228 37.563 -6.547 1.00 0.00 O ATOM 1003 CB PRO A 63 -3.884 35.950 -8.842 1.00 0.00 C ATOM 1004 CG PRO A 63 -5.279 35.557 -9.322 1.00 0.00 C ATOM 1005 CD PRO A 63 -5.589 34.377 -8.408 1.00 0.00 C ATOM 0 HA PRO A 63 -2.964 35.302 -6.969 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -3.668 36.995 -9.062 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -3.113 35.355 -9.332 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -5.998 36.368 -9.204 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -5.287 35.275 -10.375 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -6.664 34.224 -8.313 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -5.169 33.452 -8.803 1.00 0.00 H new ATOM 1013 N GLY A 64 -3.092 37.449 -5.840 1.00 0.00 N ATOM 1014 CA GLY A 64 -3.103 38.689 -5.049 1.00 0.00 C ATOM 1015 C GLY A 64 -4.043 38.673 -3.843 1.00 0.00 C ATOM 1016 O GLY A 64 -4.182 39.694 -3.164 1.00 0.00 O ATOM 0 H GLY A 64 -2.199 36.957 -5.800 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -2.090 38.889 -4.700 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -3.385 39.516 -5.700 1.00 0.00 H new ATOM 1020 N SER A 65 -4.674 37.531 -3.563 1.00 0.00 N ATOM 1021 CA SER A 65 -5.763 37.393 -2.596 1.00 0.00 C ATOM 1022 C SER A 65 -5.349 36.618 -1.341 1.00 0.00 C ATOM 1023 O SER A 65 -4.292 35.982 -1.311 1.00 0.00 O ATOM 1024 CB SER A 65 -6.967 36.732 -3.286 1.00 0.00 C ATOM 1025 OG SER A 65 -7.331 37.433 -4.467 1.00 0.00 O ATOM 0 H SER A 65 -4.433 36.650 -4.017 1.00 0.00 H new ATOM 0 HA SER A 65 -6.037 38.390 -2.252 1.00 0.00 H new ATOM 0 HB2 SER A 65 -6.725 35.698 -3.533 1.00 0.00 H new ATOM 0 HB3 SER A 65 -7.814 36.706 -2.600 1.00 0.00 H new ATOM 0 HG SER A 65 -6.617 37.346 -5.132 1.00 0.00 H new ATOM 1031 N THR A 66 -6.187 36.679 -0.301 1.00 0.00 N ATOM 1032 CA THR A 66 -5.908 36.127 1.040 1.00 0.00 C ATOM 1033 C THR A 66 -6.989 35.133 1.474 1.00 0.00 C ATOM 1034 O THR A 66 -8.179 35.372 1.257 1.00 0.00 O ATOM 1035 CB THR A 66 -5.787 37.243 2.102 1.00 0.00 C ATOM 1036 OG1 THR A 66 -4.984 38.301 1.626 1.00 0.00 O ATOM 1037 CG2 THR A 66 -5.151 36.780 3.419 1.00 0.00 C ATOM 0 H THR A 66 -7.103 37.124 -0.364 1.00 0.00 H new ATOM 0 HA THR A 66 -4.954 35.605 0.967 1.00 0.00 H new ATOM 0 HB THR A 66 -6.815 37.554 2.291 1.00 0.00 H new ATOM 0 HG1 THR A 66 -4.921 38.998 2.312 1.00 0.00 H new ATOM 0 HG21 THR A 66 -5.101 37.619 4.113 1.00 0.00 H new ATOM 0 HG22 THR A 66 -5.755 35.984 3.855 1.00 0.00 H new ATOM 0 HG23 THR A 66 -4.145 36.408 3.226 1.00 0.00 H new ATOM 1045 N VAL A 67 -6.583 34.044 2.136 1.00 0.00 N ATOM 1046 CA VAL A 67 -7.473 33.086 2.820 1.00 0.00 C ATOM 1047 C VAL A 67 -7.121 33.043 4.307 1.00 0.00 C ATOM 1048 O VAL A 67 -5.947 33.044 4.677 1.00 0.00 O ATOM 1049 CB VAL A 67 -7.415 31.686 2.173 1.00 0.00 C ATOM 1050 CG1 VAL A 67 -8.271 30.651 2.918 1.00 0.00 C ATOM 1051 CG2 VAL A 67 -7.925 31.739 0.726 1.00 0.00 C ATOM 0 H VAL A 67 -5.598 33.793 2.216 1.00 0.00 H new ATOM 0 HA VAL A 67 -8.504 33.425 2.713 1.00 0.00 H new ATOM 0 HB VAL A 67 -6.369 31.384 2.216 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -8.192 29.686 2.418 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -7.918 30.558 3.945 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -9.312 30.974 2.920 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -7.877 30.743 0.286 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -8.957 32.090 0.717 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -7.304 32.422 0.146 1.00 0.00 H new ATOM 1061 N THR A 68 -8.140 32.992 5.166 1.00 0.00 N ATOM 1062 CA THR A 68 -8.005 32.911 6.621 1.00 0.00 C ATOM 1063 C THR A 68 -8.311 31.489 7.082 1.00 0.00 C ATOM 1064 O THR A 68 -9.411 30.973 6.877 1.00 0.00 O ATOM 1065 CB THR A 68 -8.942 33.913 7.310 1.00 0.00 C ATOM 1066 OG1 THR A 68 -8.772 35.208 6.774 1.00 0.00 O ATOM 1067 CG2 THR A 68 -8.645 34.012 8.800 1.00 0.00 C ATOM 0 H THR A 68 -9.112 33.006 4.859 1.00 0.00 H new ATOM 0 HA THR A 68 -6.981 33.165 6.897 1.00 0.00 H new ATOM 0 HB THR A 68 -9.957 33.552 7.145 1.00 0.00 H new ATOM 0 HG1 THR A 68 -9.379 35.831 7.225 1.00 0.00 H new ATOM 0 HG21 THR A 68 -9.325 34.729 9.260 1.00 0.00 H new ATOM 0 HG22 THR A 68 -8.781 33.035 9.264 1.00 0.00 H new ATOM 0 HG23 THR A 68 -7.617 34.343 8.945 1.00 0.00 H new ATOM 1075 N VAL A 69 -7.333 30.861 7.726 1.00 0.00 N ATOM 1076 CA VAL A 69 -7.419 29.519 8.316 1.00 0.00 C ATOM 1077 C VAL A 69 -7.626 29.658 9.822 1.00 0.00 C ATOM 1078 O VAL A 69 -6.746 30.138 10.530 1.00 0.00 O ATOM 1079 CB VAL A 69 -6.149 28.713 7.980 1.00 0.00 C ATOM 1080 CG1 VAL A 69 -6.112 27.342 8.666 1.00 0.00 C ATOM 1081 CG2 VAL A 69 -6.031 28.474 6.470 1.00 0.00 C ATOM 0 H VAL A 69 -6.416 31.288 7.860 1.00 0.00 H new ATOM 0 HA VAL A 69 -8.266 28.973 7.900 1.00 0.00 H new ATOM 0 HB VAL A 69 -5.319 29.318 8.347 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -5.194 26.822 8.391 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -6.143 27.475 9.747 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -6.972 26.753 8.348 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -5.126 27.903 6.262 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -6.900 27.917 6.121 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -5.983 29.432 5.953 1.00 0.00 H new ATOM 1091 N SER A 70 -8.788 29.236 10.316 1.00 0.00 N ATOM 1092 CA SER A 70 -9.108 29.235 11.752 1.00 0.00 C ATOM 1093 C SER A 70 -8.627 27.942 12.405 1.00 0.00 C ATOM 1094 O SER A 70 -8.996 26.843 11.983 1.00 0.00 O ATOM 1095 CB SER A 70 -10.611 29.439 11.983 1.00 0.00 C ATOM 1096 OG SER A 70 -11.008 30.693 11.455 1.00 0.00 O ATOM 0 H SER A 70 -9.544 28.881 9.730 1.00 0.00 H new ATOM 0 HA SER A 70 -8.585 30.070 12.218 1.00 0.00 H new ATOM 0 HB2 SER A 70 -11.175 28.637 11.506 1.00 0.00 H new ATOM 0 HB3 SER A 70 -10.835 29.395 13.049 1.00 0.00 H new ATOM 0 HG SER A 70 -11.968 30.821 11.602 1.00 0.00 H new ATOM 1102 N VAL A 71 -7.819 28.085 13.457 1.00 0.00 N ATOM 1103 CA VAL A 71 -7.321 27.000 14.305 1.00 0.00 C ATOM 1104 C VAL A 71 -8.050 27.073 15.640 1.00 0.00 C ATOM 1105 O VAL A 71 -8.110 28.141 16.248 1.00 0.00 O ATOM 1106 CB VAL A 71 -5.794 27.084 14.505 1.00 0.00 C ATOM 1107 CG1 VAL A 71 -5.301 25.923 15.375 1.00 0.00 C ATOM 1108 CG2 VAL A 71 -5.053 27.027 13.163 1.00 0.00 C ATOM 0 H VAL A 71 -7.479 29.000 13.754 1.00 0.00 H new ATOM 0 HA VAL A 71 -7.515 26.043 13.820 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.586 28.036 14.994 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -4.221 25.999 15.505 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -5.788 25.966 16.349 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -5.542 24.977 14.890 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -3.979 27.088 13.338 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -5.286 26.089 12.658 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -5.367 27.863 12.538 1.00 0.00 H new ATOM 1118 N MET A 72 -8.592 25.949 16.099 1.00 0.00 N ATOM 1119 CA MET A 72 -9.285 25.823 17.381 1.00 0.00 C ATOM 1120 C MET A 72 -8.569 24.792 18.259 1.00 0.00 C ATOM 1121 O MET A 72 -8.658 23.586 18.020 1.00 0.00 O ATOM 1122 CB MET A 72 -10.766 25.494 17.132 1.00 0.00 C ATOM 1123 CG MET A 72 -11.525 26.741 16.666 1.00 0.00 C ATOM 1124 SD MET A 72 -13.278 26.448 16.311 1.00 0.00 S ATOM 1125 CE MET A 72 -13.761 28.134 15.850 1.00 0.00 C ATOM 0 H MET A 72 -8.561 25.074 15.575 1.00 0.00 H new ATOM 0 HA MET A 72 -9.259 26.765 17.928 1.00 0.00 H new ATOM 0 HB2 MET A 72 -10.848 24.709 16.380 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.217 25.108 18.046 1.00 0.00 H new ATOM 0 HG2 MET A 72 -11.444 27.511 17.433 1.00 0.00 H new ATOM 0 HG3 MET A 72 -11.044 27.133 15.770 1.00 0.00 H new ATOM 0 HE1 MET A 72 -14.821 28.152 15.595 1.00 0.00 H new ATOM 0 HE2 MET A 72 -13.578 28.807 16.688 1.00 0.00 H new ATOM 0 HE3 MET A 72 -13.175 28.458 14.990 1.00 0.00 H new ATOM 1135 N LEU A 73 -7.870 25.272 19.288 1.00 0.00 N ATOM 1136 CA LEU A 73 -7.041 24.466 20.186 1.00 0.00 C ATOM 1137 C LEU A 73 -7.882 24.083 21.408 1.00 0.00 C ATOM 1138 O LEU A 73 -8.420 24.952 22.094 1.00 0.00 O ATOM 1139 CB LEU A 73 -5.783 25.267 20.571 1.00 0.00 C ATOM 1140 CG LEU A 73 -4.599 24.433 21.094 1.00 0.00 C ATOM 1141 CD1 LEU A 73 -3.436 25.375 21.399 1.00 0.00 C ATOM 1142 CD2 LEU A 73 -4.851 23.599 22.347 1.00 0.00 C ATOM 0 H LEU A 73 -7.865 26.264 19.527 1.00 0.00 H new ATOM 0 HA LEU A 73 -6.707 23.549 19.701 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -5.451 25.830 19.698 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -6.057 25.995 21.334 1.00 0.00 H new ATOM 0 HG LEU A 73 -4.397 23.717 20.297 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -2.589 24.799 21.771 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -3.146 25.901 20.490 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -3.742 26.098 22.155 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -3.942 23.059 22.613 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -5.138 24.255 23.169 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -5.653 22.887 22.155 1.00 0.00 H new ATOM 1154 N GLN A 74 -8.031 22.784 21.645 1.00 0.00 N ATOM 1155 CA GLN A 74 -8.902 22.234 22.687 1.00 0.00 C ATOM 1156 C GLN A 74 -8.285 22.411 24.097 1.00 0.00 C ATOM 1157 O GLN A 74 -7.061 22.336 24.237 1.00 0.00 O ATOM 1158 CB GLN A 74 -9.245 20.763 22.377 1.00 0.00 C ATOM 1159 CG GLN A 74 -9.782 20.503 20.953 1.00 0.00 C ATOM 1160 CD GLN A 74 -10.997 21.355 20.591 1.00 0.00 C ATOM 1161 OE1 GLN A 74 -12.080 21.197 21.137 1.00 0.00 O ATOM 1162 NE2 GLN A 74 -10.872 22.300 19.677 1.00 0.00 N ATOM 0 H GLN A 74 -7.542 22.067 21.110 1.00 0.00 H new ATOM 0 HA GLN A 74 -9.835 22.797 22.690 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -8.351 20.158 22.528 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -9.988 20.419 23.097 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -8.986 20.696 20.233 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -10.047 19.450 20.861 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -9.976 22.445 19.212 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -11.672 22.885 19.436 1.00 0.00 H new ATOM 1171 N PRO A 75 -9.097 22.644 25.149 1.00 0.00 N ATOM 1172 CA PRO A 75 -8.606 23.039 26.473 1.00 0.00 C ATOM 1173 C PRO A 75 -7.637 22.044 27.140 1.00 0.00 C ATOM 1174 O PRO A 75 -7.781 20.825 27.000 1.00 0.00 O ATOM 1175 CB PRO A 75 -9.863 23.277 27.317 1.00 0.00 C ATOM 1176 CG PRO A 75 -10.994 22.567 26.582 1.00 0.00 C ATOM 1177 CD PRO A 75 -10.554 22.651 25.126 1.00 0.00 C ATOM 0 HA PRO A 75 -7.988 23.932 26.378 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -9.740 22.879 28.324 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -10.070 24.342 27.419 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -11.105 21.534 26.912 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -11.953 23.059 26.744 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -10.940 21.809 24.552 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -10.933 23.558 24.655 1.00 0.00 H new ATOM 1185 N PHE A 76 -6.672 22.573 27.903 1.00 0.00 N ATOM 1186 CA PHE A 76 -5.693 21.806 28.689 1.00 0.00 C ATOM 1187 C PHE A 76 -5.214 22.554 29.950 1.00 0.00 C ATOM 1188 O PHE A 76 -5.450 23.752 30.120 1.00 0.00 O ATOM 1189 CB PHE A 76 -4.502 21.388 27.808 1.00 0.00 C ATOM 1190 CG PHE A 76 -3.612 22.516 27.321 1.00 0.00 C ATOM 1191 CD1 PHE A 76 -2.531 22.946 28.115 1.00 0.00 C ATOM 1192 CD2 PHE A 76 -3.837 23.116 26.066 1.00 0.00 C ATOM 1193 CE1 PHE A 76 -1.696 23.983 27.673 1.00 0.00 C ATOM 1194 CE2 PHE A 76 -2.988 24.142 25.617 1.00 0.00 C ATOM 1195 CZ PHE A 76 -1.924 24.584 26.422 1.00 0.00 C ATOM 0 H PHE A 76 -6.546 23.581 27.994 1.00 0.00 H new ATOM 0 HA PHE A 76 -6.204 20.910 29.042 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -3.889 20.683 28.370 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -4.887 20.854 26.939 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -2.344 22.475 29.069 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -4.661 22.788 25.450 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -0.878 24.320 28.293 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -3.154 24.593 24.650 1.00 0.00 H new ATOM 0 HZ PHE A 76 -1.283 25.383 26.081 1.00 0.00 H new ATOM 1205 N ASP A 77 -4.521 21.847 30.847 1.00 0.00 N ATOM 1206 CA ASP A 77 -3.986 22.421 32.089 1.00 0.00 C ATOM 1207 C ASP A 77 -2.675 23.194 31.828 1.00 0.00 C ATOM 1208 O ASP A 77 -1.578 22.625 31.825 1.00 0.00 O ATOM 1209 CB ASP A 77 -3.810 21.329 33.153 1.00 0.00 C ATOM 1210 CG ASP A 77 -5.149 20.800 33.701 1.00 0.00 C ATOM 1211 OD1 ASP A 77 -5.927 21.615 34.257 1.00 0.00 O ATOM 1212 OD2 ASP A 77 -5.403 19.573 33.629 1.00 0.00 O ATOM 0 H ASP A 77 -4.313 20.855 30.733 1.00 0.00 H new ATOM 0 HA ASP A 77 -4.706 23.143 32.475 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -3.246 20.500 32.725 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -3.218 21.725 33.978 1.00 0.00 H new ATOM 1217 N TYR A 78 -2.795 24.504 31.587 1.00 0.00 N ATOM 1218 CA TYR A 78 -1.681 25.410 31.286 1.00 0.00 C ATOM 1219 C TYR A 78 -0.655 25.526 32.430 1.00 0.00 C ATOM 1220 O TYR A 78 -1.015 25.690 33.600 1.00 0.00 O ATOM 1221 CB TYR A 78 -2.249 26.791 30.924 1.00 0.00 C ATOM 1222 CG TYR A 78 -1.206 27.881 30.734 1.00 0.00 C ATOM 1223 CD1 TYR A 78 -0.612 28.084 29.475 1.00 0.00 C ATOM 1224 CD2 TYR A 78 -0.829 28.689 31.826 1.00 0.00 C ATOM 1225 CE1 TYR A 78 0.336 29.112 29.302 1.00 0.00 C ATOM 1226 CE2 TYR A 78 0.130 29.707 31.659 1.00 0.00 C ATOM 1227 CZ TYR A 78 0.703 29.931 30.390 1.00 0.00 C ATOM 1228 OH TYR A 78 1.596 30.941 30.205 1.00 0.00 O ATOM 0 H TYR A 78 -3.698 24.978 31.596 1.00 0.00 H new ATOM 0 HA TYR A 78 -1.133 24.988 30.444 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -2.830 26.700 30.006 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -2.939 27.101 31.709 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -0.882 27.452 28.642 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -1.278 28.527 32.795 1.00 0.00 H new ATOM 0 HE1 TYR A 78 0.783 29.273 28.332 1.00 0.00 H new ATOM 0 HE2 TYR A 78 0.426 30.315 32.501 1.00 0.00 H new ATOM 0 HH TYR A 78 1.740 31.410 31.053 1.00 0.00 H new ATOM 1238 N ASP A 79 0.633 25.472 32.075 1.00 0.00 N ATOM 1239 CA ASP A 79 1.773 25.771 32.951 1.00 0.00 C ATOM 1240 C ASP A 79 2.681 26.838 32.290 1.00 0.00 C ATOM 1241 O ASP A 79 3.158 26.596 31.174 1.00 0.00 O ATOM 1242 CB ASP A 79 2.543 24.472 33.238 1.00 0.00 C ATOM 1243 CG ASP A 79 3.534 24.584 34.402 1.00 0.00 C ATOM 1244 OD1 ASP A 79 4.139 25.662 34.591 1.00 0.00 O ATOM 1245 OD2 ASP A 79 3.728 23.573 35.117 1.00 0.00 O ATOM 0 H ASP A 79 0.922 25.209 31.133 1.00 0.00 H new ATOM 0 HA ASP A 79 1.421 26.179 33.899 1.00 0.00 H new ATOM 0 HB2 ASP A 79 1.829 23.678 33.456 1.00 0.00 H new ATOM 0 HB3 ASP A 79 3.084 24.176 32.340 1.00 0.00 H new ATOM 1250 N PRO A 80 2.980 27.986 32.936 1.00 0.00 N ATOM 1251 CA PRO A 80 3.881 28.998 32.380 1.00 0.00 C ATOM 1252 C PRO A 80 5.358 28.553 32.368 1.00 0.00 C ATOM 1253 O PRO A 80 6.183 29.177 31.695 1.00 0.00 O ATOM 1254 CB PRO A 80 3.669 30.242 33.253 1.00 0.00 C ATOM 1255 CG PRO A 80 3.266 29.667 34.607 1.00 0.00 C ATOM 1256 CD PRO A 80 2.482 28.408 34.236 1.00 0.00 C ATOM 0 HA PRO A 80 3.653 29.186 31.331 1.00 0.00 H new ATOM 0 HB2 PRO A 80 4.577 30.840 33.326 1.00 0.00 H new ATOM 0 HB3 PRO A 80 2.893 30.890 32.846 1.00 0.00 H new ATOM 0 HG2 PRO A 80 4.137 29.433 35.220 1.00 0.00 H new ATOM 0 HG3 PRO A 80 2.655 30.368 35.176 1.00 0.00 H new ATOM 0 HD2 PRO A 80 2.627 27.626 34.981 1.00 0.00 H new ATOM 0 HD3 PRO A 80 1.412 28.614 34.195 1.00 0.00 H new ATOM 1264 N ASN A 81 5.701 27.481 33.094 1.00 0.00 N ATOM 1265 CA ASN A 81 7.050 26.913 33.180 1.00 0.00 C ATOM 1266 C ASN A 81 7.296 25.776 32.167 1.00 0.00 C ATOM 1267 O ASN A 81 8.452 25.496 31.839 1.00 0.00 O ATOM 1268 CB ASN A 81 7.311 26.393 34.608 1.00 0.00 C ATOM 1269 CG ASN A 81 6.945 27.367 35.716 1.00 0.00 C ATOM 1270 OD1 ASN A 81 7.742 28.189 36.151 1.00 0.00 O ATOM 1271 ND2 ASN A 81 5.730 27.293 36.207 1.00 0.00 N ATOM 0 H ASN A 81 5.022 26.968 33.657 1.00 0.00 H new ATOM 0 HA ASN A 81 7.743 27.718 32.933 1.00 0.00 H new ATOM 0 HB2 ASN A 81 6.748 25.471 34.753 1.00 0.00 H new ATOM 0 HB3 ASN A 81 8.367 26.139 34.700 1.00 0.00 H new ATOM 0 HD21 ASN A 81 5.444 27.923 36.956 1.00 0.00 H new ATOM 0 HD22 ASN A 81 5.072 26.606 35.839 1.00 0.00 H new ATOM 1278 N GLU A 82 6.246 25.092 31.692 1.00 0.00 N ATOM 1279 CA GLU A 82 6.396 23.924 30.807 1.00 0.00 C ATOM 1280 C GLU A 82 6.617 24.292 29.323 1.00 0.00 C ATOM 1281 O GLU A 82 6.173 25.341 28.841 1.00 0.00 O ATOM 1282 CB GLU A 82 5.223 22.949 31.004 1.00 0.00 C ATOM 1283 CG GLU A 82 5.453 21.565 30.380 1.00 0.00 C ATOM 1284 CD GLU A 82 6.691 20.859 30.959 1.00 0.00 C ATOM 1285 OE1 GLU A 82 6.569 20.152 31.989 1.00 0.00 O ATOM 1286 OE2 GLU A 82 7.791 21.032 30.380 1.00 0.00 O ATOM 0 H GLU A 82 5.277 25.328 31.906 1.00 0.00 H new ATOM 0 HA GLU A 82 7.315 23.418 31.102 1.00 0.00 H new ATOM 0 HB2 GLU A 82 5.038 22.829 32.072 1.00 0.00 H new ATOM 0 HB3 GLU A 82 4.323 23.387 30.572 1.00 0.00 H new ATOM 0 HG2 GLU A 82 4.573 20.944 30.546 1.00 0.00 H new ATOM 0 HG3 GLU A 82 5.570 21.671 29.301 1.00 0.00 H new ATOM 1293 N LYS A 83 7.324 23.415 28.597 1.00 0.00 N ATOM 1294 CA LYS A 83 7.773 23.608 27.208 1.00 0.00 C ATOM 1295 C LYS A 83 6.748 23.057 26.205 1.00 0.00 C ATOM 1296 O LYS A 83 6.133 22.015 26.444 1.00 0.00 O ATOM 1297 CB LYS A 83 9.151 22.943 26.998 1.00 0.00 C ATOM 1298 CG LYS A 83 10.334 23.593 27.743 1.00 0.00 C ATOM 1299 CD LYS A 83 10.257 23.505 29.276 1.00 0.00 C ATOM 1300 CE LYS A 83 11.593 23.904 29.915 1.00 0.00 C ATOM 1301 NZ LYS A 83 11.502 23.909 31.402 1.00 0.00 N ATOM 0 H LYS A 83 7.612 22.513 28.976 1.00 0.00 H new ATOM 0 HA LYS A 83 7.866 24.679 27.028 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.080 21.900 27.308 1.00 0.00 H new ATOM 0 HB3 LYS A 83 9.374 22.944 25.931 1.00 0.00 H new ATOM 0 HG2 LYS A 83 11.258 23.119 27.412 1.00 0.00 H new ATOM 0 HG3 LYS A 83 10.393 24.643 27.456 1.00 0.00 H new ATOM 0 HD2 LYS A 83 9.465 24.158 29.642 1.00 0.00 H new ATOM 0 HD3 LYS A 83 9.996 22.489 29.573 1.00 0.00 H new ATOM 0 HE2 LYS A 83 12.372 23.210 29.599 1.00 0.00 H new ATOM 0 HE3 LYS A 83 11.886 24.893 29.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 12.421 24.183 31.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 10.775 24.589 31.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 11.246 22.958 31.737 1.00 0.00 H new ATOM 1315 N SER A 84 6.599 23.727 25.059 1.00 0.00 N ATOM 1316 CA SER A 84 5.704 23.293 23.973 1.00 0.00 C ATOM 1317 C SER A 84 6.381 22.294 23.024 1.00 0.00 C ATOM 1318 O SER A 84 7.528 22.491 22.611 1.00 0.00 O ATOM 1319 CB SER A 84 5.187 24.503 23.189 1.00 0.00 C ATOM 1320 OG SER A 84 4.276 24.082 22.194 1.00 0.00 O ATOM 0 H SER A 84 7.098 24.593 24.853 1.00 0.00 H new ATOM 0 HA SER A 84 4.862 22.779 24.438 1.00 0.00 H new ATOM 0 HB2 SER A 84 4.700 25.204 23.866 1.00 0.00 H new ATOM 0 HB3 SER A 84 6.022 25.032 22.729 1.00 0.00 H new ATOM 0 HG SER A 84 4.036 24.844 21.627 1.00 0.00 H new ATOM 1326 N LYS A 85 5.646 21.237 22.648 1.00 0.00 N ATOM 1327 CA LYS A 85 6.019 20.266 21.594 1.00 0.00 C ATOM 1328 C LYS A 85 5.237 20.462 20.296 1.00 0.00 C ATOM 1329 O LYS A 85 5.654 19.992 19.235 1.00 0.00 O ATOM 1330 CB LYS A 85 5.722 18.828 22.065 1.00 0.00 C ATOM 1331 CG LYS A 85 6.156 18.469 23.485 1.00 0.00 C ATOM 1332 CD LYS A 85 7.673 18.571 23.702 1.00 0.00 C ATOM 1333 CE LYS A 85 8.023 18.146 25.135 1.00 0.00 C ATOM 1334 NZ LYS A 85 9.494 18.147 25.367 1.00 0.00 N ATOM 0 H LYS A 85 4.747 21.023 23.079 1.00 0.00 H new ATOM 0 HA LYS A 85 7.080 20.431 21.408 1.00 0.00 H new ATOM 0 HB2 LYS A 85 4.648 18.658 21.984 1.00 0.00 H new ATOM 0 HB3 LYS A 85 6.207 18.137 21.376 1.00 0.00 H new ATOM 0 HG2 LYS A 85 5.650 19.129 24.190 1.00 0.00 H new ATOM 0 HG3 LYS A 85 5.831 17.453 23.711 1.00 0.00 H new ATOM 0 HD2 LYS A 85 8.195 17.936 22.987 1.00 0.00 H new ATOM 0 HD3 LYS A 85 8.007 19.593 23.524 1.00 0.00 H new ATOM 0 HE2 LYS A 85 7.543 18.822 25.842 1.00 0.00 H new ATOM 0 HE3 LYS A 85 7.625 17.149 25.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 9.691 17.855 26.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 9.950 17.483 24.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 9.870 19.104 25.209 1.00 0.00 H new ATOM 1348 N HIS A 86 4.068 21.096 20.393 1.00 0.00 N ATOM 1349 CA HIS A 86 3.102 21.153 19.303 1.00 0.00 C ATOM 1350 C HIS A 86 3.519 22.083 18.159 1.00 0.00 C ATOM 1351 O HIS A 86 4.072 23.163 18.378 1.00 0.00 O ATOM 1352 CB HIS A 86 1.713 21.527 19.833 1.00 0.00 C ATOM 1353 CG HIS A 86 1.116 20.577 20.843 1.00 0.00 C ATOM 1354 ND1 HIS A 86 0.302 20.969 21.908 1.00 0.00 N ATOM 1355 CD2 HIS A 86 1.232 19.216 20.854 1.00 0.00 C ATOM 1356 CE1 HIS A 86 -0.040 19.838 22.548 1.00 0.00 C ATOM 1357 NE2 HIS A 86 0.502 18.772 21.935 1.00 0.00 N ATOM 0 H HIS A 86 3.766 21.586 21.235 1.00 0.00 H new ATOM 0 HA HIS A 86 3.066 20.151 18.875 1.00 0.00 H new ATOM 0 HB2 HIS A 86 1.772 22.517 20.285 1.00 0.00 H new ATOM 0 HB3 HIS A 86 1.031 21.603 18.987 1.00 0.00 H new ATOM 0 HD2 HIS A 86 1.786 18.608 20.154 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -0.662 19.792 23.430 1.00 0.00 H new ATOM 0 HE2 HIS A 86 0.392 17.799 22.221 1.00 0.00 H new ATOM 1365 N LYS A 87 3.217 21.667 16.926 1.00 0.00 N ATOM 1366 CA LYS A 87 3.633 22.338 15.684 1.00 0.00 C ATOM 1367 C LYS A 87 2.540 22.272 14.604 1.00 0.00 C ATOM 1368 O LYS A 87 1.660 21.412 14.627 1.00 0.00 O ATOM 1369 CB LYS A 87 4.958 21.732 15.170 1.00 0.00 C ATOM 1370 CG LYS A 87 6.170 21.977 16.085 1.00 0.00 C ATOM 1371 CD LYS A 87 7.475 21.425 15.480 1.00 0.00 C ATOM 1372 CE LYS A 87 8.617 21.518 16.507 1.00 0.00 C ATOM 1373 NZ LYS A 87 9.841 20.788 16.066 1.00 0.00 N ATOM 0 H LYS A 87 2.660 20.830 16.756 1.00 0.00 H new ATOM 0 HA LYS A 87 3.794 23.392 15.910 1.00 0.00 H new ATOM 0 HB2 LYS A 87 4.826 20.657 15.043 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.173 22.145 14.185 1.00 0.00 H new ATOM 0 HG2 LYS A 87 6.278 23.047 16.264 1.00 0.00 H new ATOM 0 HG3 LYS A 87 5.993 21.508 17.053 1.00 0.00 H new ATOM 0 HD2 LYS A 87 7.333 20.388 15.176 1.00 0.00 H new ATOM 0 HD3 LYS A 87 7.735 21.988 14.584 1.00 0.00 H new ATOM 0 HE2 LYS A 87 8.864 22.566 16.677 1.00 0.00 H new ATOM 0 HE3 LYS A 87 8.279 21.111 17.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 10.581 20.881 16.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 9.615 19.782 15.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 10.182 21.192 15.170 1.00 0.00 H new ATOM 1387 N PHE A 88 2.648 23.164 13.627 1.00 0.00 N ATOM 1388 CA PHE A 88 1.873 23.201 12.387 1.00 0.00 C ATOM 1389 C PHE A 88 2.784 23.089 11.167 1.00 0.00 C ATOM 1390 O PHE A 88 3.921 23.561 11.181 1.00 0.00 O ATOM 1391 CB PHE A 88 1.044 24.492 12.318 1.00 0.00 C ATOM 1392 CG PHE A 88 -0.298 24.331 12.984 1.00 0.00 C ATOM 1393 CD1 PHE A 88 -1.349 23.728 12.273 1.00 0.00 C ATOM 1394 CD2 PHE A 88 -0.480 24.714 14.323 1.00 0.00 C ATOM 1395 CE1 PHE A 88 -2.578 23.492 12.906 1.00 0.00 C ATOM 1396 CE2 PHE A 88 -1.707 24.468 14.958 1.00 0.00 C ATOM 1397 CZ PHE A 88 -2.753 23.847 14.253 1.00 0.00 C ATOM 0 H PHE A 88 3.320 23.929 13.680 1.00 0.00 H new ATOM 0 HA PHE A 88 1.197 22.346 12.383 1.00 0.00 H new ATOM 0 HB2 PHE A 88 1.593 25.303 12.797 1.00 0.00 H new ATOM 0 HB3 PHE A 88 0.901 24.777 11.276 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -1.211 23.446 11.240 1.00 0.00 H new ATOM 0 HD2 PHE A 88 0.322 25.196 14.862 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -3.390 23.037 12.357 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -1.848 24.756 15.989 1.00 0.00 H new ATOM 0 HZ PHE A 88 -3.691 23.643 14.748 1.00 0.00 H new ATOM 1407 N MET A 89 2.247 22.510 10.093 1.00 0.00 N ATOM 1408 CA MET A 89 2.880 22.469 8.777 1.00 0.00 C ATOM 1409 C MET A 89 1.877 22.900 7.700 1.00 0.00 C ATOM 1410 O MET A 89 0.726 22.465 7.720 1.00 0.00 O ATOM 1411 CB MET A 89 3.451 21.065 8.533 1.00 0.00 C ATOM 1412 CG MET A 89 4.341 20.995 7.285 1.00 0.00 C ATOM 1413 SD MET A 89 4.958 19.335 6.884 1.00 0.00 S ATOM 1414 CE MET A 89 6.010 18.999 8.327 1.00 0.00 C ATOM 0 H MET A 89 1.339 22.046 10.116 1.00 0.00 H new ATOM 0 HA MET A 89 3.711 23.173 8.731 1.00 0.00 H new ATOM 0 HB2 MET A 89 4.029 20.756 9.404 1.00 0.00 H new ATOM 0 HB3 MET A 89 2.629 20.356 8.428 1.00 0.00 H new ATOM 0 HG2 MET A 89 3.778 21.374 6.432 1.00 0.00 H new ATOM 0 HG3 MET A 89 5.193 21.660 7.425 1.00 0.00 H new ATOM 0 HE1 MET A 89 6.597 18.098 8.148 1.00 0.00 H new ATOM 0 HE2 MET A 89 6.681 19.842 8.492 1.00 0.00 H new ATOM 0 HE3 MET A 89 5.384 18.855 9.208 1.00 0.00 H new ATOM 1424 N VAL A 90 2.309 23.747 6.761 1.00 0.00 N ATOM 1425 CA VAL A 90 1.489 24.247 5.642 1.00 0.00 C ATOM 1426 C VAL A 90 2.207 23.958 4.324 1.00 0.00 C ATOM 1427 O VAL A 90 3.229 24.577 4.031 1.00 0.00 O ATOM 1428 CB VAL A 90 1.154 25.748 5.794 1.00 0.00 C ATOM 1429 CG1 VAL A 90 0.214 26.223 4.677 1.00 0.00 C ATOM 1430 CG2 VAL A 90 0.468 26.050 7.134 1.00 0.00 C ATOM 0 H VAL A 90 3.260 24.115 6.753 1.00 0.00 H new ATOM 0 HA VAL A 90 0.533 23.723 5.648 1.00 0.00 H new ATOM 0 HB VAL A 90 2.107 26.274 5.741 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -0.004 27.283 4.811 1.00 0.00 H new ATOM 0 HG12 VAL A 90 0.692 26.070 3.709 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -0.715 25.654 4.717 1.00 0.00 H new ATOM 0 HG21 VAL A 90 0.250 27.116 7.199 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -0.462 25.485 7.202 1.00 0.00 H new ATOM 0 HG23 VAL A 90 1.128 25.764 7.953 1.00 0.00 H new ATOM 1440 N GLN A 91 1.681 23.022 3.533 1.00 0.00 N ATOM 1441 CA GLN A 91 2.196 22.630 2.215 1.00 0.00 C ATOM 1442 C GLN A 91 1.441 23.381 1.108 1.00 0.00 C ATOM 1443 O GLN A 91 0.221 23.514 1.180 1.00 0.00 O ATOM 1444 CB GLN A 91 2.076 21.102 2.065 1.00 0.00 C ATOM 1445 CG GLN A 91 2.801 20.554 0.824 1.00 0.00 C ATOM 1446 CD GLN A 91 2.639 19.039 0.702 1.00 0.00 C ATOM 1447 OE1 GLN A 91 3.421 18.260 1.228 1.00 0.00 O ATOM 1448 NE2 GLN A 91 1.616 18.560 0.022 1.00 0.00 N ATOM 0 H GLN A 91 0.851 22.493 3.801 1.00 0.00 H new ATOM 0 HA GLN A 91 3.248 22.900 2.124 1.00 0.00 H new ATOM 0 HB2 GLN A 91 2.483 20.623 2.956 1.00 0.00 H new ATOM 0 HB3 GLN A 91 1.022 20.831 2.011 1.00 0.00 H new ATOM 0 HG2 GLN A 91 2.407 21.036 -0.071 1.00 0.00 H new ATOM 0 HG3 GLN A 91 3.860 20.804 0.881 1.00 0.00 H new ATOM 0 HE21 GLN A 91 0.955 19.198 -0.422 1.00 0.00 H new ATOM 0 HE22 GLN A 91 1.485 17.552 -0.060 1.00 0.00 H new ATOM 1457 N THR A 92 2.139 23.852 0.071 1.00 0.00 N ATOM 1458 CA THR A 92 1.554 24.589 -1.069 1.00 0.00 C ATOM 1459 C THR A 92 2.154 24.195 -2.421 1.00 0.00 C ATOM 1460 O THR A 92 3.344 23.896 -2.524 1.00 0.00 O ATOM 1461 CB THR A 92 1.631 26.112 -0.885 1.00 0.00 C ATOM 1462 OG1 THR A 92 2.861 26.528 -0.330 1.00 0.00 O ATOM 1463 CG2 THR A 92 0.503 26.606 0.015 1.00 0.00 C ATOM 0 H THR A 92 3.149 23.733 -0.008 1.00 0.00 H new ATOM 0 HA THR A 92 0.505 24.294 -1.079 1.00 0.00 H new ATOM 0 HB THR A 92 1.537 26.543 -1.882 1.00 0.00 H new ATOM 0 HG1 THR A 92 2.863 27.503 -0.234 1.00 0.00 H new ATOM 0 HG21 THR A 92 0.577 27.687 0.131 1.00 0.00 H new ATOM 0 HG22 THR A 92 -0.458 26.355 -0.434 1.00 0.00 H new ATOM 0 HG23 THR A 92 0.582 26.130 0.992 1.00 0.00 H new ATOM 1471 N ILE A 93 1.325 24.184 -3.470 1.00 0.00 N ATOM 1472 CA ILE A 93 1.762 23.966 -4.866 1.00 0.00 C ATOM 1473 C ILE A 93 0.840 24.690 -5.860 1.00 0.00 C ATOM 1474 O ILE A 93 -0.354 24.829 -5.603 1.00 0.00 O ATOM 1475 CB ILE A 93 1.881 22.446 -5.138 1.00 0.00 C ATOM 1476 CG1 ILE A 93 2.906 22.095 -6.241 1.00 0.00 C ATOM 1477 CG2 ILE A 93 0.509 21.776 -5.330 1.00 0.00 C ATOM 1478 CD1 ILE A 93 2.394 21.975 -7.680 1.00 0.00 C ATOM 0 H ILE A 93 0.319 24.327 -3.380 1.00 0.00 H new ATOM 0 HA ILE A 93 2.749 24.404 -5.013 1.00 0.00 H new ATOM 0 HB ILE A 93 2.299 22.009 -4.231 1.00 0.00 H new ATOM 0 HG12 ILE A 93 3.688 22.855 -6.226 1.00 0.00 H new ATOM 0 HG13 ILE A 93 3.376 21.149 -5.973 1.00 0.00 H new ATOM 0 HG21 ILE A 93 0.647 20.711 -5.518 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.091 21.911 -4.430 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -0.002 22.231 -6.178 1.00 0.00 H new ATOM 0 HD11 ILE A 93 3.223 21.725 -8.342 1.00 0.00 H new ATOM 0 HD12 ILE A 93 1.639 21.191 -7.733 1.00 0.00 H new ATOM 0 HD13 ILE A 93 1.955 22.923 -7.990 1.00 0.00 H new ATOM 1490 N PHE A 94 1.361 25.179 -6.989 1.00 0.00 N ATOM 1491 CA PHE A 94 0.546 25.857 -8.008 1.00 0.00 C ATOM 1492 C PHE A 94 -0.579 24.968 -8.566 1.00 0.00 C ATOM 1493 O PHE A 94 -0.360 23.814 -8.937 1.00 0.00 O ATOM 1494 CB PHE A 94 1.424 26.365 -9.156 1.00 0.00 C ATOM 1495 CG PHE A 94 2.217 27.615 -8.836 1.00 0.00 C ATOM 1496 CD1 PHE A 94 1.538 28.821 -8.572 1.00 0.00 C ATOM 1497 CD2 PHE A 94 3.624 27.591 -8.847 1.00 0.00 C ATOM 1498 CE1 PHE A 94 2.260 30.005 -8.359 1.00 0.00 C ATOM 1499 CE2 PHE A 94 4.346 28.779 -8.635 1.00 0.00 C ATOM 1500 CZ PHE A 94 3.662 29.988 -8.425 1.00 0.00 C ATOM 0 H PHE A 94 2.352 25.118 -7.224 1.00 0.00 H new ATOM 0 HA PHE A 94 0.073 26.702 -7.507 1.00 0.00 H new ATOM 0 HB2 PHE A 94 2.117 25.574 -9.444 1.00 0.00 H new ATOM 0 HB3 PHE A 94 0.790 26.564 -10.020 1.00 0.00 H new ATOM 0 HD1 PHE A 94 0.459 28.834 -8.533 1.00 0.00 H new ATOM 0 HD2 PHE A 94 4.148 26.662 -9.018 1.00 0.00 H new ATOM 0 HE1 PHE A 94 1.739 30.926 -8.145 1.00 0.00 H new ATOM 0 HE2 PHE A 94 5.426 28.762 -8.634 1.00 0.00 H new ATOM 0 HZ PHE A 94 4.217 30.908 -8.314 1.00 0.00 H new ATOM 1510 N ALA A 95 -1.776 25.546 -8.674 1.00 0.00 N ATOM 1511 CA ALA A 95 -2.939 24.928 -9.317 1.00 0.00 C ATOM 1512 C ALA A 95 -3.010 25.347 -10.808 1.00 0.00 C ATOM 1513 O ALA A 95 -2.819 26.532 -11.112 1.00 0.00 O ATOM 1514 CB ALA A 95 -4.204 25.334 -8.551 1.00 0.00 C ATOM 0 H ALA A 95 -1.969 26.478 -8.309 1.00 0.00 H new ATOM 0 HA ALA A 95 -2.851 23.842 -9.290 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -5.076 24.879 -9.021 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.129 24.993 -7.518 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -4.307 26.419 -8.568 1.00 0.00 H new ATOM 1520 N PRO A 96 -3.297 24.428 -11.751 1.00 0.00 N ATOM 1521 CA PRO A 96 -3.437 24.752 -13.172 1.00 0.00 C ATOM 1522 C PRO A 96 -4.781 25.447 -13.480 1.00 0.00 C ATOM 1523 O PRO A 96 -5.733 25.329 -12.702 1.00 0.00 O ATOM 1524 CB PRO A 96 -3.302 23.402 -13.888 1.00 0.00 C ATOM 1525 CG PRO A 96 -3.923 22.424 -12.892 1.00 0.00 C ATOM 1526 CD PRO A 96 -3.518 23.007 -11.536 1.00 0.00 C ATOM 0 HA PRO A 96 -2.684 25.466 -13.506 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -3.829 23.396 -14.842 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -2.261 23.158 -14.098 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -5.006 22.371 -13.001 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -3.539 21.413 -13.027 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -4.299 22.843 -10.794 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -2.615 22.526 -11.160 1.00 0.00 H new ATOM 1599 N MET A 102 -9.222 20.065 -6.614 1.00 0.00 N ATOM 1600 CA MET A 102 -8.060 20.489 -5.826 1.00 0.00 C ATOM 1601 C MET A 102 -7.157 19.314 -5.425 1.00 0.00 C ATOM 1602 O MET A 102 -5.962 19.513 -5.220 1.00 0.00 O ATOM 1603 CB MET A 102 -8.499 21.302 -4.594 1.00 0.00 C ATOM 1604 CG MET A 102 -9.123 20.496 -3.450 1.00 0.00 C ATOM 1605 SD MET A 102 -10.723 19.712 -3.800 1.00 0.00 S ATOM 1606 CE MET A 102 -10.952 18.803 -2.247 1.00 0.00 C ATOM 0 HA MET A 102 -7.460 21.134 -6.468 1.00 0.00 H new ATOM 0 HB2 MET A 102 -7.631 21.835 -4.206 1.00 0.00 H new ATOM 0 HB3 MET A 102 -9.218 22.055 -4.917 1.00 0.00 H new ATOM 0 HG2 MET A 102 -8.418 19.719 -3.155 1.00 0.00 H new ATOM 0 HG3 MET A 102 -9.246 21.157 -2.592 1.00 0.00 H new ATOM 0 HE1 MET A 102 -11.894 18.256 -2.281 1.00 0.00 H new ATOM 0 HE2 MET A 102 -10.129 18.101 -2.112 1.00 0.00 H new ATOM 0 HE3 MET A 102 -10.970 19.505 -1.414 1.00 0.00 H new ATOM 1616 N GLU A 103 -7.695 18.091 -5.342 1.00 0.00 N ATOM 1617 CA GLU A 103 -6.930 16.904 -4.939 1.00 0.00 C ATOM 1618 C GLU A 103 -6.078 16.380 -6.099 1.00 0.00 C ATOM 1619 O GLU A 103 -4.947 15.945 -5.885 1.00 0.00 O ATOM 1620 CB GLU A 103 -7.869 15.824 -4.372 1.00 0.00 C ATOM 1621 CG GLU A 103 -7.142 14.600 -3.784 1.00 0.00 C ATOM 1622 CD GLU A 103 -6.168 14.922 -2.630 1.00 0.00 C ATOM 1623 OE1 GLU A 103 -6.324 15.955 -1.934 1.00 0.00 O ATOM 1624 OE2 GLU A 103 -5.227 14.130 -2.390 1.00 0.00 O ATOM 0 H GLU A 103 -8.674 17.896 -5.553 1.00 0.00 H new ATOM 0 HA GLU A 103 -6.241 17.186 -4.143 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -8.491 16.270 -3.596 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -8.539 15.489 -5.164 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -7.887 13.890 -3.425 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -6.588 14.105 -4.582 1.00 0.00 H new ATOM 1631 N ALA A 104 -6.565 16.508 -7.337 1.00 0.00 N ATOM 1632 CA ALA A 104 -5.835 16.112 -8.537 1.00 0.00 C ATOM 1633 C ALA A 104 -4.527 16.901 -8.706 1.00 0.00 C ATOM 1634 O ALA A 104 -3.527 16.332 -9.151 1.00 0.00 O ATOM 1635 CB ALA A 104 -6.746 16.310 -9.748 1.00 0.00 C ATOM 0 H ALA A 104 -7.489 16.895 -7.532 1.00 0.00 H new ATOM 0 HA ALA A 104 -5.554 15.063 -8.445 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -6.215 16.018 -10.654 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -7.639 15.694 -9.636 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -7.035 17.359 -9.818 1.00 0.00 H new ATOM 1641 N VAL A 105 -4.499 18.171 -8.274 1.00 0.00 N ATOM 1642 CA VAL A 105 -3.284 19.003 -8.313 1.00 0.00 C ATOM 1643 C VAL A 105 -2.156 18.369 -7.507 1.00 0.00 C ATOM 1644 O VAL A 105 -1.011 18.370 -7.942 1.00 0.00 O ATOM 1645 CB VAL A 105 -3.526 20.448 -7.838 1.00 0.00 C ATOM 1646 CG1 VAL A 105 -2.273 21.315 -7.976 1.00 0.00 C ATOM 1647 CG2 VAL A 105 -4.634 21.061 -8.678 1.00 0.00 C ATOM 0 H VAL A 105 -5.313 18.650 -7.889 1.00 0.00 H new ATOM 0 HA VAL A 105 -2.990 19.055 -9.361 1.00 0.00 H new ATOM 0 HB VAL A 105 -3.800 20.413 -6.784 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -2.490 22.325 -7.629 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -1.469 20.890 -7.375 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -1.967 21.348 -9.022 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -4.815 22.085 -8.351 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -4.337 21.062 -9.727 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -5.546 20.476 -8.560 1.00 0.00 H new ATOM 1657 N TRP A 106 -2.467 17.753 -6.369 1.00 0.00 N ATOM 1658 CA TRP A 106 -1.464 17.096 -5.536 1.00 0.00 C ATOM 1659 C TRP A 106 -0.966 15.760 -6.109 1.00 0.00 C ATOM 1660 O TRP A 106 0.155 15.343 -5.808 1.00 0.00 O ATOM 1661 CB TRP A 106 -2.058 16.895 -4.149 1.00 0.00 C ATOM 1662 CG TRP A 106 -2.395 18.173 -3.445 1.00 0.00 C ATOM 1663 CD1 TRP A 106 -3.633 18.681 -3.272 1.00 0.00 C ATOM 1664 CD2 TRP A 106 -1.484 19.176 -2.907 1.00 0.00 C ATOM 1665 NE1 TRP A 106 -3.561 19.883 -2.595 1.00 0.00 N ATOM 1666 CE2 TRP A 106 -2.256 20.226 -2.330 1.00 0.00 C ATOM 1667 CE3 TRP A 106 -0.082 19.323 -2.889 1.00 0.00 C ATOM 1668 CZ2 TRP A 106 -1.672 21.320 -1.683 1.00 0.00 C ATOM 1669 CZ3 TRP A 106 0.516 20.457 -2.311 1.00 0.00 C ATOM 1670 CH2 TRP A 106 -0.274 21.424 -1.666 1.00 0.00 C ATOM 0 H TRP A 106 -3.416 17.695 -6.000 1.00 0.00 H new ATOM 0 HA TRP A 106 -0.585 17.740 -5.498 1.00 0.00 H new ATOM 0 HB2 TRP A 106 -2.960 16.289 -4.235 1.00 0.00 H new ATOM 0 HB3 TRP A 106 -1.352 16.331 -3.540 1.00 0.00 H new ATOM 0 HD1 TRP A 106 -4.546 18.216 -3.613 1.00 0.00 H new ATOM 0 HE1 TRP A 106 -4.370 20.443 -2.327 1.00 0.00 H new ATOM 0 HE3 TRP A 106 0.540 18.555 -3.324 1.00 0.00 H new ATOM 0 HZ2 TRP A 106 -2.286 22.070 -1.206 1.00 0.00 H new ATOM 0 HZ3 TRP A 106 1.587 20.585 -2.363 1.00 0.00 H new ATOM 0 HH2 TRP A 106 0.198 22.250 -1.155 1.00 0.00 H new ATOM 1681 N LYS A 107 -1.777 15.100 -6.949 1.00 0.00 N ATOM 1682 CA LYS A 107 -1.408 13.867 -7.664 1.00 0.00 C ATOM 1683 C LYS A 107 -0.539 14.147 -8.897 1.00 0.00 C ATOM 1684 O LYS A 107 0.352 13.357 -9.207 1.00 0.00 O ATOM 1685 CB LYS A 107 -2.677 13.083 -8.047 1.00 0.00 C ATOM 1686 CG LYS A 107 -3.631 12.773 -6.880 1.00 0.00 C ATOM 1687 CD LYS A 107 -2.986 12.010 -5.713 1.00 0.00 C ATOM 1688 CE LYS A 107 -3.993 11.918 -4.561 1.00 0.00 C ATOM 1689 NZ LYS A 107 -3.447 11.160 -3.403 1.00 0.00 N ATOM 0 H LYS A 107 -2.726 15.413 -7.155 1.00 0.00 H new ATOM 0 HA LYS A 107 -0.804 13.260 -6.990 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -3.223 13.651 -8.800 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -2.378 12.143 -8.511 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -4.039 13.711 -6.503 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -4.470 12.190 -7.259 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -2.689 11.012 -6.034 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -2.082 12.521 -5.383 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -4.269 12.922 -4.239 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -4.904 11.435 -4.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -4.159 11.121 -2.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -3.207 10.193 -3.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -2.592 11.635 -3.049 1.00 0.00 H new ATOM 1703 N GLU A 108 -0.762 15.278 -9.571 1.00 0.00 N ATOM 1704 CA GLU A 108 0.071 15.737 -10.695 1.00 0.00 C ATOM 1705 C GLU A 108 1.335 16.496 -10.252 1.00 0.00 C ATOM 1706 O GLU A 108 2.342 16.503 -10.967 1.00 0.00 O ATOM 1707 CB GLU A 108 -0.776 16.565 -11.668 1.00 0.00 C ATOM 1708 CG GLU A 108 -1.151 17.964 -11.201 1.00 0.00 C ATOM 1709 CD GLU A 108 -2.015 18.681 -12.256 1.00 0.00 C ATOM 1710 OE1 GLU A 108 -1.440 19.285 -13.195 1.00 0.00 O ATOM 1711 OE2 GLU A 108 -3.265 18.642 -12.158 1.00 0.00 O ATOM 0 H GLU A 108 -1.532 15.910 -9.353 1.00 0.00 H new ATOM 0 HA GLU A 108 0.437 14.848 -11.208 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -0.233 16.651 -12.609 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -1.693 16.015 -11.878 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -1.696 17.904 -10.259 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -0.247 18.543 -11.010 1.00 0.00 H new ATOM 1718 N ALA A 109 1.295 17.111 -9.068 1.00 0.00 N ATOM 1719 CA ALA A 109 2.430 17.766 -8.424 1.00 0.00 C ATOM 1720 C ALA A 109 3.588 16.782 -8.215 1.00 0.00 C ATOM 1721 O ALA A 109 3.398 15.667 -7.715 1.00 0.00 O ATOM 1722 CB ALA A 109 2.015 18.364 -7.073 1.00 0.00 C ATOM 0 H ALA A 109 0.440 17.167 -8.514 1.00 0.00 H new ATOM 0 HA ALA A 109 2.765 18.567 -9.083 1.00 0.00 H new ATOM 0 HB1 ALA A 109 2.875 18.847 -6.609 1.00 0.00 H new ATOM 0 HB2 ALA A 109 1.225 19.099 -7.228 1.00 0.00 H new ATOM 0 HB3 ALA A 109 1.650 17.571 -6.421 1.00 0.00 H new ATOM 1728 N LYS A 110 4.799 17.221 -8.568 1.00 0.00 N ATOM 1729 CA LYS A 110 6.020 16.432 -8.414 1.00 0.00 C ATOM 1730 C LYS A 110 6.749 16.764 -7.111 1.00 0.00 C ATOM 1731 O LYS A 110 6.673 17.906 -6.657 1.00 0.00 O ATOM 1732 CB LYS A 110 6.905 16.619 -9.657 1.00 0.00 C ATOM 1733 CG LYS A 110 6.272 16.023 -10.927 1.00 0.00 C ATOM 1734 CD LYS A 110 7.263 15.959 -12.102 1.00 0.00 C ATOM 1735 CE LYS A 110 7.813 17.321 -12.560 1.00 0.00 C ATOM 1736 NZ LYS A 110 6.786 18.147 -13.256 1.00 0.00 N ATOM 0 H LYS A 110 4.959 18.144 -8.973 1.00 0.00 H new ATOM 0 HA LYS A 110 5.759 15.376 -8.339 1.00 0.00 H new ATOM 0 HB2 LYS A 110 7.089 17.682 -9.811 1.00 0.00 H new ATOM 0 HB3 LYS A 110 7.873 16.150 -9.483 1.00 0.00 H new ATOM 0 HG2 LYS A 110 5.905 15.020 -10.710 1.00 0.00 H new ATOM 0 HG3 LYS A 110 5.409 16.623 -11.215 1.00 0.00 H new ATOM 0 HD2 LYS A 110 8.101 15.322 -11.818 1.00 0.00 H new ATOM 0 HD3 LYS A 110 6.771 15.479 -12.948 1.00 0.00 H new ATOM 0 HE2 LYS A 110 8.188 17.867 -11.695 1.00 0.00 H new ATOM 0 HE3 LYS A 110 8.660 17.161 -13.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 7.207 19.054 -13.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 6.445 17.640 -14.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 5.989 18.324 -12.612 1.00 0.00 H new ATOM 1750 N PRO A 111 7.490 15.810 -6.520 1.00 0.00 N ATOM 1751 CA PRO A 111 8.138 15.975 -5.215 1.00 0.00 C ATOM 1752 C PRO A 111 9.159 17.124 -5.162 1.00 0.00 C ATOM 1753 O PRO A 111 9.466 17.630 -4.082 1.00 0.00 O ATOM 1754 CB PRO A 111 8.768 14.612 -4.893 1.00 0.00 C ATOM 1755 CG PRO A 111 8.910 13.935 -6.256 1.00 0.00 C ATOM 1756 CD PRO A 111 7.717 14.467 -7.029 1.00 0.00 C ATOM 0 HA PRO A 111 7.404 16.269 -4.465 1.00 0.00 H new ATOM 0 HB2 PRO A 111 9.734 14.726 -4.402 1.00 0.00 H new ATOM 0 HB3 PRO A 111 8.136 14.029 -4.222 1.00 0.00 H new ATOM 0 HG2 PRO A 111 9.852 14.195 -6.739 1.00 0.00 H new ATOM 0 HG3 PRO A 111 8.884 12.849 -6.171 1.00 0.00 H new ATOM 0 HD2 PRO A 111 7.919 14.482 -8.100 1.00 0.00 H new ATOM 0 HD3 PRO A 111 6.840 13.837 -6.879 1.00 0.00 H new ATOM 1764 N ASP A 112 9.649 17.569 -6.322 1.00 0.00 N ATOM 1765 CA ASP A 112 10.545 18.724 -6.473 1.00 0.00 C ATOM 1766 C ASP A 112 9.838 20.083 -6.671 1.00 0.00 C ATOM 1767 O ASP A 112 10.465 21.135 -6.529 1.00 0.00 O ATOM 1768 CB ASP A 112 11.552 18.451 -7.592 1.00 0.00 C ATOM 1769 CG ASP A 112 10.929 18.453 -8.999 1.00 0.00 C ATOM 1770 OD1 ASP A 112 10.099 17.562 -9.295 1.00 0.00 O ATOM 1771 OD2 ASP A 112 11.300 19.324 -9.823 1.00 0.00 O ATOM 0 H ASP A 112 9.427 17.123 -7.212 1.00 0.00 H new ATOM 0 HA ASP A 112 11.061 18.831 -5.519 1.00 0.00 H new ATOM 0 HB2 ASP A 112 12.339 19.204 -7.552 1.00 0.00 H new ATOM 0 HB3 ASP A 112 12.025 17.485 -7.415 1.00 0.00 H new ATOM 1776 N GLU A 113 8.536 20.073 -6.973 1.00 0.00 N ATOM 1777 CA GLU A 113 7.694 21.266 -7.187 1.00 0.00 C ATOM 1778 C GLU A 113 6.899 21.669 -5.928 1.00 0.00 C ATOM 1779 O GLU A 113 6.326 22.761 -5.879 1.00 0.00 O ATOM 1780 CB GLU A 113 6.723 21.006 -8.355 1.00 0.00 C ATOM 1781 CG GLU A 113 7.397 20.842 -9.726 1.00 0.00 C ATOM 1782 CD GLU A 113 7.820 22.197 -10.331 1.00 0.00 C ATOM 1783 OE1 GLU A 113 8.849 22.777 -9.908 1.00 0.00 O ATOM 1784 OE2 GLU A 113 7.121 22.690 -11.250 1.00 0.00 O ATOM 0 H GLU A 113 8.015 19.203 -7.080 1.00 0.00 H new ATOM 0 HA GLU A 113 8.360 22.096 -7.423 1.00 0.00 H new ATOM 0 HB2 GLU A 113 6.148 20.106 -8.138 1.00 0.00 H new ATOM 0 HB3 GLU A 113 6.014 21.832 -8.411 1.00 0.00 H new ATOM 0 HG2 GLU A 113 8.273 20.202 -9.624 1.00 0.00 H new ATOM 0 HG3 GLU A 113 6.712 20.339 -10.408 1.00 0.00 H new ATOM 1791 N LEU A 114 6.858 20.802 -4.909 1.00 0.00 N ATOM 1792 CA LEU A 114 6.118 21.011 -3.662 1.00 0.00 C ATOM 1793 C LEU A 114 6.863 22.011 -2.764 1.00 0.00 C ATOM 1794 O LEU A 114 8.074 21.885 -2.555 1.00 0.00 O ATOM 1795 CB LEU A 114 5.918 19.663 -2.936 1.00 0.00 C ATOM 1796 CG LEU A 114 5.026 18.651 -3.683 1.00 0.00 C ATOM 1797 CD1 LEU A 114 5.169 17.244 -3.107 1.00 0.00 C ATOM 1798 CD2 LEU A 114 3.546 19.008 -3.603 1.00 0.00 C ATOM 0 H LEU A 114 7.353 19.911 -4.932 1.00 0.00 H new ATOM 0 HA LEU A 114 5.137 21.427 -3.894 1.00 0.00 H new ATOM 0 HB2 LEU A 114 6.895 19.209 -2.767 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.482 19.856 -1.956 1.00 0.00 H new ATOM 0 HG LEU A 114 5.364 18.686 -4.719 1.00 0.00 H new ATOM 0 HD11 LEU A 114 4.526 16.558 -3.658 1.00 0.00 H new ATOM 0 HD12 LEU A 114 6.206 16.919 -3.194 1.00 0.00 H new ATOM 0 HD13 LEU A 114 4.878 17.249 -2.057 1.00 0.00 H new ATOM 0 HD21 LEU A 114 2.962 18.264 -4.145 1.00 0.00 H new ATOM 0 HD22 LEU A 114 3.232 19.026 -2.559 1.00 0.00 H new ATOM 0 HD23 LEU A 114 3.384 19.990 -4.047 1.00 0.00 H new ATOM 1810 N MET A 115 6.133 22.977 -2.202 1.00 0.00 N ATOM 1811 CA MET A 115 6.639 23.930 -1.209 1.00 0.00 C ATOM 1812 C MET A 115 6.009 23.651 0.160 1.00 0.00 C ATOM 1813 O MET A 115 4.876 23.175 0.234 1.00 0.00 O ATOM 1814 CB MET A 115 6.328 25.371 -1.647 1.00 0.00 C ATOM 1815 CG MET A 115 6.980 25.765 -2.979 1.00 0.00 C ATOM 1816 SD MET A 115 6.412 27.359 -3.637 1.00 0.00 S ATOM 1817 CE MET A 115 4.780 26.872 -4.270 1.00 0.00 C ATOM 0 H MET A 115 5.149 23.123 -2.430 1.00 0.00 H new ATOM 0 HA MET A 115 7.720 23.812 -1.131 1.00 0.00 H new ATOM 0 HB2 MET A 115 5.248 25.490 -1.732 1.00 0.00 H new ATOM 0 HB3 MET A 115 6.665 26.058 -0.871 1.00 0.00 H new ATOM 0 HG2 MET A 115 8.061 25.803 -2.845 1.00 0.00 H new ATOM 0 HG3 MET A 115 6.777 24.987 -3.715 1.00 0.00 H new ATOM 0 HE1 MET A 115 4.356 27.691 -4.851 1.00 0.00 H new ATOM 0 HE2 MET A 115 4.884 25.992 -4.905 1.00 0.00 H new ATOM 0 HE3 MET A 115 4.120 26.640 -3.434 1.00 0.00 H new ATOM 1827 N ASP A 116 6.694 23.978 1.256 1.00 0.00 N ATOM 1828 CA ASP A 116 6.137 23.847 2.609 1.00 0.00 C ATOM 1829 C ASP A 116 6.685 24.872 3.616 1.00 0.00 C ATOM 1830 O ASP A 116 7.664 25.582 3.365 1.00 0.00 O ATOM 1831 CB ASP A 116 6.274 22.403 3.126 1.00 0.00 C ATOM 1832 CG ASP A 116 7.737 21.974 3.319 1.00 0.00 C ATOM 1833 OD1 ASP A 116 8.317 22.269 4.392 1.00 0.00 O ATOM 1834 OD2 ASP A 116 8.305 21.314 2.415 1.00 0.00 O ATOM 0 H ASP A 116 7.647 24.340 1.235 1.00 0.00 H new ATOM 0 HA ASP A 116 5.076 24.081 2.520 1.00 0.00 H new ATOM 0 HB2 ASP A 116 5.745 22.310 4.075 1.00 0.00 H new ATOM 0 HB3 ASP A 116 5.791 21.724 2.424 1.00 0.00 H new ATOM 1839 N SER A 117 5.993 24.957 4.753 1.00 0.00 N ATOM 1840 CA SER A 117 6.213 25.899 5.856 1.00 0.00 C ATOM 1841 C SER A 117 6.005 25.159 7.179 1.00 0.00 C ATOM 1842 O SER A 117 5.063 24.372 7.262 1.00 0.00 O ATOM 1843 CB SER A 117 5.202 27.064 5.781 1.00 0.00 C ATOM 1844 OG SER A 117 4.838 27.370 4.441 1.00 0.00 O ATOM 0 H SER A 117 5.212 24.329 4.942 1.00 0.00 H new ATOM 0 HA SER A 117 7.225 26.298 5.787 1.00 0.00 H new ATOM 0 HB2 SER A 117 4.308 26.805 6.349 1.00 0.00 H new ATOM 0 HB3 SER A 117 5.633 27.948 6.250 1.00 0.00 H new ATOM 0 HG SER A 117 4.196 28.111 4.437 1.00 0.00 H new ATOM 1850 N LYS A 118 6.805 25.428 8.219 1.00 0.00 N ATOM 1851 CA LYS A 118 6.594 24.872 9.574 1.00 0.00 C ATOM 1852 C LYS A 118 6.647 25.944 10.670 1.00 0.00 C ATOM 1853 O LYS A 118 7.434 26.886 10.584 1.00 0.00 O ATOM 1854 CB LYS A 118 7.515 23.662 9.837 1.00 0.00 C ATOM 1855 CG LYS A 118 8.957 23.952 10.292 1.00 0.00 C ATOM 1856 CD LYS A 118 9.788 24.807 9.326 1.00 0.00 C ATOM 1857 CE LYS A 118 11.254 24.833 9.784 1.00 0.00 C ATOM 1858 NZ LYS A 118 12.106 25.646 8.872 1.00 0.00 N ATOM 0 H LYS A 118 7.620 26.038 8.151 1.00 0.00 H new ATOM 0 HA LYS A 118 5.574 24.489 9.615 1.00 0.00 H new ATOM 0 HB2 LYS A 118 7.042 23.038 10.595 1.00 0.00 H new ATOM 0 HB3 LYS A 118 7.563 23.071 8.922 1.00 0.00 H new ATOM 0 HG2 LYS A 118 8.922 24.455 11.258 1.00 0.00 H new ATOM 0 HG3 LYS A 118 9.470 23.003 10.445 1.00 0.00 H new ATOM 0 HD2 LYS A 118 9.720 24.402 8.316 1.00 0.00 H new ATOM 0 HD3 LYS A 118 9.391 25.821 9.290 1.00 0.00 H new ATOM 0 HE2 LYS A 118 11.312 25.240 10.794 1.00 0.00 H new ATOM 0 HE3 LYS A 118 11.639 23.814 9.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 13.088 25.639 9.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 12.071 25.243 7.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 11.755 26.625 8.849 1.00 0.00 H new ATOM 1872 N LEU A 119 5.775 25.811 11.669 1.00 0.00 N ATOM 1873 CA LEU A 119 5.544 26.799 12.730 1.00 0.00 C ATOM 1874 C LEU A 119 5.281 26.090 14.069 1.00 0.00 C ATOM 1875 O LEU A 119 4.697 25.008 14.079 1.00 0.00 O ATOM 1876 CB LEU A 119 4.339 27.698 12.353 1.00 0.00 C ATOM 1877 CG LEU A 119 4.520 28.597 11.104 1.00 0.00 C ATOM 1878 CD1 LEU A 119 3.975 27.953 9.821 1.00 0.00 C ATOM 1879 CD2 LEU A 119 3.751 29.912 11.252 1.00 0.00 C ATOM 0 H LEU A 119 5.187 24.983 11.768 1.00 0.00 H new ATOM 0 HA LEU A 119 6.433 27.421 12.837 1.00 0.00 H new ATOM 0 HB2 LEU A 119 3.472 27.058 12.192 1.00 0.00 H new ATOM 0 HB3 LEU A 119 4.109 28.338 13.205 1.00 0.00 H new ATOM 0 HG LEU A 119 5.596 28.752 11.030 1.00 0.00 H new ATOM 0 HD11 LEU A 119 4.130 28.629 8.980 1.00 0.00 H new ATOM 0 HD12 LEU A 119 4.498 27.015 9.634 1.00 0.00 H new ATOM 0 HD13 LEU A 119 2.909 27.757 9.937 1.00 0.00 H new ATOM 0 HD21 LEU A 119 3.897 30.521 10.360 1.00 0.00 H new ATOM 0 HD22 LEU A 119 2.689 29.700 11.377 1.00 0.00 H new ATOM 0 HD23 LEU A 119 4.118 30.452 12.125 1.00 0.00 H new ATOM 1891 N ARG A 120 5.666 26.681 15.205 1.00 0.00 N ATOM 1892 CA ARG A 120 5.400 26.125 16.552 1.00 0.00 C ATOM 1893 C ARG A 120 4.114 26.708 17.143 1.00 0.00 C ATOM 1894 O ARG A 120 3.684 27.785 16.736 1.00 0.00 O ATOM 1895 CB ARG A 120 6.601 26.378 17.481 1.00 0.00 C ATOM 1896 CG ARG A 120 7.943 25.900 16.890 1.00 0.00 C ATOM 1897 CD ARG A 120 9.136 26.422 17.697 1.00 0.00 C ATOM 1898 NE ARG A 120 9.294 27.878 17.508 1.00 0.00 N ATOM 1899 CZ ARG A 120 10.244 28.652 17.990 1.00 0.00 C ATOM 1900 NH1 ARG A 120 11.212 28.188 18.731 1.00 0.00 N ATOM 1901 NH2 ARG A 120 10.230 29.924 17.729 1.00 0.00 N ATOM 0 H ARG A 120 6.175 27.565 15.224 1.00 0.00 H new ATOM 0 HA ARG A 120 5.260 25.048 16.458 1.00 0.00 H new ATOM 0 HB2 ARG A 120 6.666 27.445 17.696 1.00 0.00 H new ATOM 0 HB3 ARG A 120 6.430 25.871 18.431 1.00 0.00 H new ATOM 0 HG2 ARG A 120 7.965 24.810 16.872 1.00 0.00 H new ATOM 0 HG3 ARG A 120 8.027 26.238 15.857 1.00 0.00 H new ATOM 0 HD2 ARG A 120 8.991 26.201 18.754 1.00 0.00 H new ATOM 0 HD3 ARG A 120 10.046 25.909 17.385 1.00 0.00 H new ATOM 0 HE ARG A 120 8.584 28.338 16.937 1.00 0.00 H new ATOM 0 HH11 ARG A 120 11.251 27.194 18.955 1.00 0.00 H new ATOM 0 HH12 ARG A 120 11.930 28.819 19.086 1.00 0.00 H new ATOM 0 HH21 ARG A 120 9.486 30.318 17.154 1.00 0.00 H new ATOM 0 HH22 ARG A 120 10.963 30.529 18.099 1.00 0.00 H new ATOM 1915 N CYS A 121 3.518 26.024 18.120 1.00 0.00 N ATOM 1916 CA CYS A 121 2.406 26.528 18.922 1.00 0.00 C ATOM 1917 C CYS A 121 2.953 27.104 20.237 1.00 0.00 C ATOM 1918 O CYS A 121 3.614 26.395 20.999 1.00 0.00 O ATOM 1919 CB CYS A 121 1.406 25.394 19.180 1.00 0.00 C ATOM 1920 SG CYS A 121 0.913 24.608 17.618 1.00 0.00 S ATOM 0 H CYS A 121 3.803 25.080 18.381 1.00 0.00 H new ATOM 0 HA CYS A 121 1.884 27.323 18.389 1.00 0.00 H new ATOM 0 HB2 CYS A 121 1.852 24.652 19.842 1.00 0.00 H new ATOM 0 HB3 CYS A 121 0.526 25.787 19.689 1.00 0.00 H new ATOM 0 HG CYS A 121 -0.300 24.153 17.725 1.00 0.00 H new ATOM 1926 N VAL A 122 2.676 28.379 20.504 1.00 0.00 N ATOM 1927 CA VAL A 122 3.137 29.113 21.697 1.00 0.00 C ATOM 1928 C VAL A 122 1.966 29.341 22.640 1.00 0.00 C ATOM 1929 O VAL A 122 0.900 29.735 22.182 1.00 0.00 O ATOM 1930 CB VAL A 122 3.742 30.473 21.308 1.00 0.00 C ATOM 1931 CG1 VAL A 122 4.156 31.290 22.538 1.00 0.00 C ATOM 1932 CG2 VAL A 122 4.944 30.287 20.384 1.00 0.00 C ATOM 0 H VAL A 122 2.108 28.954 19.882 1.00 0.00 H new ATOM 0 HA VAL A 122 3.905 28.516 22.189 1.00 0.00 H new ATOM 0 HB VAL A 122 2.965 31.027 20.781 1.00 0.00 H new ATOM 0 HG11 VAL A 122 4.578 32.242 22.217 1.00 0.00 H new ATOM 0 HG12 VAL A 122 3.283 31.473 23.164 1.00 0.00 H new ATOM 0 HG13 VAL A 122 4.902 30.736 23.108 1.00 0.00 H new ATOM 0 HG21 VAL A 122 5.356 31.262 20.122 1.00 0.00 H new ATOM 0 HG22 VAL A 122 5.706 29.696 20.893 1.00 0.00 H new ATOM 0 HG23 VAL A 122 4.629 29.770 19.477 1.00 0.00 H new ATOM 1942 N PHE A 123 2.174 29.158 23.944 1.00 0.00 N ATOM 1943 CA PHE A 123 1.122 29.284 24.955 1.00 0.00 C ATOM 1944 C PHE A 123 1.366 30.491 25.876 1.00 0.00 C ATOM 1945 O PHE A 123 2.455 30.640 26.437 1.00 0.00 O ATOM 1946 CB PHE A 123 1.003 27.967 25.738 1.00 0.00 C ATOM 1947 CG PHE A 123 0.961 26.715 24.874 1.00 0.00 C ATOM 1948 CD1 PHE A 123 0.173 26.679 23.708 1.00 0.00 C ATOM 1949 CD2 PHE A 123 1.747 25.596 25.214 1.00 0.00 C ATOM 1950 CE1 PHE A 123 0.185 25.550 22.878 1.00 0.00 C ATOM 1951 CE2 PHE A 123 1.739 24.453 24.393 1.00 0.00 C ATOM 1952 CZ PHE A 123 0.963 24.433 23.221 1.00 0.00 C ATOM 0 H PHE A 123 3.085 28.916 24.333 1.00 0.00 H new ATOM 0 HA PHE A 123 0.171 29.472 24.458 1.00 0.00 H new ATOM 0 HB2 PHE A 123 1.847 27.890 26.424 1.00 0.00 H new ATOM 0 HB3 PHE A 123 0.099 28.002 26.347 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -0.445 27.527 23.452 1.00 0.00 H new ATOM 0 HD2 PHE A 123 2.356 25.616 26.106 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -0.405 25.539 21.973 1.00 0.00 H new ATOM 0 HE2 PHE A 123 2.330 23.590 24.664 1.00 0.00 H new ATOM 0 HZ PHE A 123 0.965 23.560 22.586 1.00 0.00 H new ATOM 1962 N GLU A 124 0.351 31.343 26.048 1.00 0.00 N ATOM 1963 CA GLU A 124 0.392 32.549 26.888 1.00 0.00 C ATOM 1964 C GLU A 124 -0.900 32.711 27.711 1.00 0.00 C ATOM 1965 O GLU A 124 -1.998 32.469 27.208 1.00 0.00 O ATOM 1966 CB GLU A 124 0.592 33.810 26.025 1.00 0.00 C ATOM 1967 CG GLU A 124 1.893 33.818 25.209 1.00 0.00 C ATOM 1968 CD GLU A 124 2.116 35.157 24.479 1.00 0.00 C ATOM 1969 OE1 GLU A 124 1.171 35.698 23.860 1.00 0.00 O ATOM 1970 OE2 GLU A 124 3.267 35.663 24.463 1.00 0.00 O ATOM 0 H GLU A 124 -0.552 31.210 25.593 1.00 0.00 H new ATOM 0 HA GLU A 124 1.234 32.431 27.570 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -0.252 33.906 25.342 1.00 0.00 H new ATOM 0 HB3 GLU A 124 0.578 34.686 26.674 1.00 0.00 H new ATOM 0 HG2 GLU A 124 2.736 33.623 25.872 1.00 0.00 H new ATOM 0 HG3 GLU A 124 1.867 33.009 24.479 1.00 0.00 H new ATOM 1977 N MET A 125 -0.783 33.182 28.957 1.00 0.00 N ATOM 1978 CA MET A 125 -1.930 33.486 29.826 1.00 0.00 C ATOM 1979 C MET A 125 -2.329 34.977 29.775 1.00 0.00 C ATOM 1980 O MET A 125 -1.452 35.837 29.631 1.00 0.00 O ATOM 1981 CB MET A 125 -1.665 33.006 31.264 1.00 0.00 C ATOM 1982 CG MET A 125 -0.499 33.726 31.959 1.00 0.00 C ATOM 1983 SD MET A 125 -0.074 33.090 33.607 1.00 0.00 S ATOM 1984 CE MET A 125 -1.541 33.599 34.547 1.00 0.00 C ATOM 0 H MET A 125 0.119 33.365 29.397 1.00 0.00 H new ATOM 0 HA MET A 125 -2.788 32.934 29.442 1.00 0.00 H new ATOM 0 HB2 MET A 125 -2.570 33.147 31.855 1.00 0.00 H new ATOM 0 HB3 MET A 125 -1.459 31.936 31.247 1.00 0.00 H new ATOM 0 HG2 MET A 125 0.382 33.657 31.321 1.00 0.00 H new ATOM 0 HG3 MET A 125 -0.746 34.784 32.047 1.00 0.00 H new ATOM 0 HE1 MET A 125 -1.384 33.394 35.606 1.00 0.00 H new ATOM 0 HE2 MET A 125 -1.711 34.666 34.406 1.00 0.00 H new ATOM 0 HE3 MET A 125 -2.410 33.043 34.195 1.00 0.00 H new ATOM 2301 N GLU B 358 4.697 13.792 16.886 1.00 0.00 N ATOM 2302 CA GLU B 358 3.857 13.076 15.915 1.00 0.00 C ATOM 2303 C GLU B 358 2.884 13.962 15.111 1.00 0.00 C ATOM 2304 O GLU B 358 1.916 14.493 15.645 1.00 0.00 O ATOM 2305 CB GLU B 358 3.178 11.857 16.546 1.00 0.00 C ATOM 2306 CG GLU B 358 2.689 10.893 15.461 1.00 0.00 C ATOM 2307 CD GLU B 358 3.842 10.160 14.745 1.00 0.00 C ATOM 2308 OE1 GLU B 358 4.358 10.685 13.728 1.00 0.00 O ATOM 2309 OE2 GLU B 358 4.227 9.052 15.185 1.00 0.00 O ATOM 0 HA GLU B 358 4.549 12.711 15.156 1.00 0.00 H new ATOM 0 HB2 GLU B 358 3.878 11.345 17.207 1.00 0.00 H new ATOM 0 HB3 GLU B 358 2.337 12.179 17.160 1.00 0.00 H new ATOM 0 HG2 GLU B 358 2.021 10.158 15.910 1.00 0.00 H new ATOM 0 HG3 GLU B 358 2.106 11.447 14.726 1.00 0.00 H new ATOM 2316 N PHE B 359 3.099 14.083 13.796 1.00 0.00 N ATOM 2317 CA PHE B 359 2.183 14.804 12.900 1.00 0.00 C ATOM 2318 C PHE B 359 1.054 13.924 12.346 1.00 0.00 C ATOM 2319 O PHE B 359 1.229 12.731 12.083 1.00 0.00 O ATOM 2320 CB PHE B 359 2.949 15.499 11.775 1.00 0.00 C ATOM 2321 CG PHE B 359 3.604 16.798 12.193 1.00 0.00 C ATOM 2322 CD1 PHE B 359 2.891 18.010 12.092 1.00 0.00 C ATOM 2323 CD2 PHE B 359 4.927 16.800 12.674 1.00 0.00 C ATOM 2324 CE1 PHE B 359 3.549 19.228 12.339 1.00 0.00 C ATOM 2325 CE2 PHE B 359 5.562 18.013 12.983 1.00 0.00 C ATOM 2326 CZ PHE B 359 4.894 19.229 12.753 1.00 0.00 C ATOM 0 H PHE B 359 3.910 13.686 13.322 1.00 0.00 H new ATOM 0 HA PHE B 359 1.697 15.565 13.510 1.00 0.00 H new ATOM 0 HB2 PHE B 359 3.715 14.822 11.397 1.00 0.00 H new ATOM 0 HB3 PHE B 359 2.264 15.697 10.950 1.00 0.00 H new ATOM 0 HD1 PHE B 359 1.844 18.003 11.826 1.00 0.00 H new ATOM 0 HD2 PHE B 359 5.454 15.867 12.805 1.00 0.00 H new ATOM 0 HE1 PHE B 359 3.022 20.162 12.211 1.00 0.00 H new ATOM 0 HE2 PHE B 359 6.560 18.013 13.396 1.00 0.00 H new ATOM 0 HZ PHE B 359 5.414 20.165 12.894 1.00 0.00 H new ATOM 2336 N PHE B 360 -0.100 14.557 12.131 1.00 0.00 N ATOM 2337 CA PHE B 360 -1.356 13.955 11.692 1.00 0.00 C ATOM 2338 C PHE B 360 -1.999 14.806 10.583 1.00 0.00 C ATOM 2339 O PHE B 360 -1.803 16.023 10.517 1.00 0.00 O ATOM 2340 CB PHE B 360 -2.293 13.862 12.905 1.00 0.00 C ATOM 2341 CG PHE B 360 -1.987 12.710 13.848 1.00 0.00 C ATOM 2342 CD1 PHE B 360 -0.953 12.800 14.801 1.00 0.00 C ATOM 2343 CD2 PHE B 360 -2.762 11.538 13.779 1.00 0.00 C ATOM 2344 CE1 PHE B 360 -0.711 11.731 15.681 1.00 0.00 C ATOM 2345 CE2 PHE B 360 -2.503 10.462 14.641 1.00 0.00 C ATOM 2346 CZ PHE B 360 -1.480 10.558 15.600 1.00 0.00 C ATOM 0 H PHE B 360 -0.186 15.564 12.267 1.00 0.00 H new ATOM 0 HA PHE B 360 -1.171 12.961 11.286 1.00 0.00 H new ATOM 0 HB2 PHE B 360 -2.239 14.797 13.463 1.00 0.00 H new ATOM 0 HB3 PHE B 360 -3.319 13.762 12.550 1.00 0.00 H new ATOM 0 HD1 PHE B 360 -0.346 13.691 14.855 1.00 0.00 H new ATOM 0 HD2 PHE B 360 -3.562 11.466 13.057 1.00 0.00 H new ATOM 0 HE1 PHE B 360 0.070 11.812 16.423 1.00 0.00 H new ATOM 0 HE2 PHE B 360 -3.090 9.559 14.568 1.00 0.00 H new ATOM 0 HZ PHE B 360 -1.286 9.734 16.271 1.00 0.00 H new ATOM 2356 N ASP B 361 -2.800 14.174 9.724 1.00 0.00 N ATOM 2357 CA ASP B 361 -3.647 14.885 8.761 1.00 0.00 C ATOM 2358 C ASP B 361 -4.755 15.631 9.527 1.00 0.00 C ATOM 2359 O ASP B 361 -5.589 15.011 10.195 1.00 0.00 O ATOM 2360 CB ASP B 361 -4.220 13.890 7.746 1.00 0.00 C ATOM 2361 CG ASP B 361 -5.159 14.576 6.740 1.00 0.00 C ATOM 2362 OD1 ASP B 361 -4.739 15.575 6.109 1.00 0.00 O ATOM 2363 OD2 ASP B 361 -6.310 14.107 6.568 1.00 0.00 O ATOM 0 H ASP B 361 -2.881 13.158 9.675 1.00 0.00 H new ATOM 0 HA ASP B 361 -3.064 15.619 8.205 1.00 0.00 H new ATOM 0 HB2 ASP B 361 -3.403 13.407 7.210 1.00 0.00 H new ATOM 0 HB3 ASP B 361 -4.763 13.105 8.273 1.00 0.00 H new ATOM 2368 N ALA B 362 -4.728 16.965 9.481 1.00 0.00 N ATOM 2369 CA ALA B 362 -5.576 17.799 10.331 1.00 0.00 C ATOM 2370 C ALA B 362 -7.083 17.670 9.999 1.00 0.00 C ATOM 2371 O ALA B 362 -7.464 17.823 8.831 1.00 0.00 O ATOM 2372 CB ALA B 362 -5.119 19.257 10.233 1.00 0.00 C ATOM 0 H ALA B 362 -4.120 17.494 8.856 1.00 0.00 H new ATOM 0 HA ALA B 362 -5.463 17.443 11.355 1.00 0.00 H new ATOM 0 HB1 ALA B 362 -5.751 19.880 10.866 1.00 0.00 H new ATOM 0 HB2 ALA B 362 -4.083 19.337 10.563 1.00 0.00 H new ATOM 0 HB3 ALA B 362 -5.197 19.594 9.199 1.00 0.00 H new ATOM 2378 N PRO B 363 -7.959 17.449 11.001 1.00 0.00 N ATOM 2379 CA PRO B 363 -9.406 17.444 10.810 1.00 0.00 C ATOM 2380 C PRO B 363 -9.973 18.871 10.790 1.00 0.00 C ATOM 2381 O PRO B 363 -9.411 19.789 11.392 1.00 0.00 O ATOM 2382 CB PRO B 363 -9.948 16.638 11.995 1.00 0.00 C ATOM 2383 CG PRO B 363 -8.980 17.000 13.123 1.00 0.00 C ATOM 2384 CD PRO B 363 -7.642 17.141 12.393 1.00 0.00 C ATOM 0 HA PRO B 363 -9.694 17.008 9.854 1.00 0.00 H new ATOM 0 HB2 PRO B 363 -10.974 16.916 12.238 1.00 0.00 H new ATOM 0 HB3 PRO B 363 -9.948 15.567 11.790 1.00 0.00 H new ATOM 0 HG2 PRO B 363 -9.268 17.926 13.621 1.00 0.00 H new ATOM 0 HG3 PRO B 363 -8.943 16.225 13.888 1.00 0.00 H new ATOM 0 HD2 PRO B 363 -7.039 17.933 12.838 1.00 0.00 H new ATOM 0 HD3 PRO B 363 -7.062 16.221 12.464 1.00 0.00 H new ATOM 2392 N GLU B 364 -11.143 19.051 10.171 1.00 0.00 N ATOM 2393 CA GLU B 364 -11.892 20.310 10.276 1.00 0.00 C ATOM 2394 C GLU B 364 -12.363 20.532 11.714 1.00 0.00 C ATOM 2395 O GLU B 364 -12.212 21.625 12.262 1.00 0.00 O ATOM 2396 CB GLU B 364 -13.050 20.373 9.276 1.00 0.00 C ATOM 2397 CG GLU B 364 -14.047 19.205 9.303 1.00 0.00 C ATOM 2398 CD GLU B 364 -15.138 19.394 8.232 1.00 0.00 C ATOM 2399 OE1 GLU B 364 -16.127 20.124 8.487 1.00 0.00 O ATOM 2400 OE2 GLU B 364 -15.026 18.801 7.130 1.00 0.00 O ATOM 0 H GLU B 364 -11.593 18.342 9.592 1.00 0.00 H new ATOM 0 HA GLU B 364 -11.218 21.126 10.014 1.00 0.00 H new ATOM 0 HB2 GLU B 364 -13.602 21.296 9.452 1.00 0.00 H new ATOM 0 HB3 GLU B 364 -12.630 20.439 8.272 1.00 0.00 H new ATOM 0 HG2 GLU B 364 -13.520 18.267 9.130 1.00 0.00 H new ATOM 0 HG3 GLU B 364 -14.507 19.136 10.289 1.00 0.00 H new ATOM 2407 N ILE B 365 -12.870 19.461 12.332 1.00 0.00 N ATOM 2408 CA ILE B 365 -13.174 19.369 13.755 1.00 0.00 C ATOM 2409 C ILE B 365 -13.166 17.900 14.205 1.00 0.00 C ATOM 2410 O ILE B 365 -13.449 16.996 13.415 1.00 0.00 O ATOM 2411 CB ILE B 365 -14.487 20.106 14.102 1.00 0.00 C ATOM 2412 CG1 ILE B 365 -14.479 20.512 15.595 1.00 0.00 C ATOM 2413 CG2 ILE B 365 -15.740 19.290 13.735 1.00 0.00 C ATOM 2414 CD1 ILE B 365 -15.566 21.530 15.960 1.00 0.00 C ATOM 0 H ILE B 365 -13.087 18.601 11.829 1.00 0.00 H new ATOM 0 HA ILE B 365 -12.393 19.880 14.318 1.00 0.00 H new ATOM 0 HB ILE B 365 -14.537 21.009 13.493 1.00 0.00 H new ATOM 0 HG12 ILE B 365 -14.609 19.619 16.206 1.00 0.00 H new ATOM 0 HG13 ILE B 365 -13.503 20.930 15.844 1.00 0.00 H new ATOM 0 HG21 ILE B 365 -16.633 19.856 14.001 1.00 0.00 H new ATOM 0 HG22 ILE B 365 -15.743 19.089 12.664 1.00 0.00 H new ATOM 0 HG23 ILE B 365 -15.732 18.346 14.281 1.00 0.00 H new ATOM 0 HD11 ILE B 365 -15.500 21.768 17.022 1.00 0.00 H new ATOM 0 HD12 ILE B 365 -15.425 22.439 15.375 1.00 0.00 H new ATOM 0 HD13 ILE B 365 -16.547 21.108 15.743 1.00 0.00 H new ATOM 2426 N ILE B 366 -12.840 17.664 15.476 1.00 0.00 N ATOM 2427 CA ILE B 366 -12.827 16.338 16.108 1.00 0.00 C ATOM 2428 C ILE B 366 -14.120 16.143 16.921 1.00 0.00 C ATOM 2429 O ILE B 366 -14.535 17.035 17.664 1.00 0.00 O ATOM 2430 CB ILE B 366 -11.498 16.173 16.884 1.00 0.00 C ATOM 2431 CG1 ILE B 366 -11.081 14.700 17.069 1.00 0.00 C ATOM 2432 CG2 ILE B 366 -11.459 17.022 18.169 1.00 0.00 C ATOM 2433 CD1 ILE B 366 -11.705 13.973 18.257 1.00 0.00 C ATOM 0 H ILE B 366 -12.569 18.410 16.116 1.00 0.00 H new ATOM 0 HA ILE B 366 -12.839 15.526 15.381 1.00 0.00 H new ATOM 0 HB ILE B 366 -10.713 16.588 16.252 1.00 0.00 H new ATOM 0 HG12 ILE B 366 -11.335 14.154 16.160 1.00 0.00 H new ATOM 0 HG13 ILE B 366 -9.997 14.660 17.173 1.00 0.00 H new ATOM 0 HG21 ILE B 366 -10.506 16.871 18.676 1.00 0.00 H new ATOM 0 HG22 ILE B 366 -11.570 18.076 17.913 1.00 0.00 H new ATOM 0 HG23 ILE B 366 -12.273 16.721 18.829 1.00 0.00 H new ATOM 0 HD11 ILE B 366 -11.340 12.946 18.288 1.00 0.00 H new ATOM 0 HD12 ILE B 366 -11.431 14.483 19.180 1.00 0.00 H new ATOM 0 HD13 ILE B 366 -12.790 13.969 18.152 1.00 0.00 H new