USER MOD reduce.3.24.130724 H: found=0, std=0, add=1696, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1692 hydrogens (26 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 179:sc= -0.0393 (180deg=-0.041) USER MOD Single : A 7 THR OG1 : rot 112:sc= 1.24 USER MOD Single : A 12 SER OG : rot 64:sc= 0.341 USER MOD Single : A 15 THR OG1 : rot 64:sc= 1.16 USER MOD Single : A 18 THR OG1 : rot -118:sc= 0.692 USER MOD Single : A 19 THR OG1 : rot 90:sc= 1.23 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 130:sc= -0.189 USER MOD Single : A 34 SER OG : rot -170:sc= 0 USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 75:sc= 0.77 USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 GLN : amide:sc= -0.0882 K(o=-0.088,f=-0.72) USER MOD Single : A 48 HIS : no HD1:sc= -0.0452 X(o=-0.045,f=-0.45) USER MOD Single : A 51 LYS NZ :NH3+ 171:sc= 0.308 (180deg=0.281) USER MOD Single : A 55 SER OG : rot 23:sc= 0.0698 USER MOD Single : A 59 LYS NZ :NH3+ 155:sc= 0.365 (180deg=0.156) USER MOD Single : A 60 MET CE :methyl -137:sc= 0 (180deg=-0.00355) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 94:sc= 0.436 USER MOD Single : A 66 ASN : amide:sc= 0.00992 X(o=0.0099,f=0) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ -149:sc= 0 (180deg=-0.801) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0.3) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 169:sc= 0.0456 (180deg=-0.14) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ -179:sc= 0.373 (180deg=0.373) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000911) USER MOD Single : A 99 ANW OAV : rot 179:sc= 0.469 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 178:sc= -0.168 (180deg=-0.198) USER MOD Single : B 7 THR OG1 : rot 110:sc= 0.715 USER MOD Single : B 12 SER OG : rot 73:sc= 0.368 USER MOD Single : B 15 THR OG1 : rot 80:sc= 1.26 USER MOD Single : B 18 THR OG1 : rot -136:sc= 0.00723 USER MOD Single : B 19 THR OG1 : rot 96:sc= 1.23 USER MOD Single : B 22 THR OG1 : rot 128:sc= 0.172 USER MOD Single : B 26 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot 176:sc= 0.375 USER MOD Single : B 34 SER OG : rot 180:sc= -0.206 USER MOD Single : B 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 39 LYS NZ :NH3+ 175:sc= -0.0664 (180deg=-0.0842) USER MOD Single : B 43 THR OG1 : rot 79:sc= 0.542 USER MOD Single : B 44 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : B 45 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : B 48 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 55 SER OG : rot 20:sc= 0.955 USER MOD Single : B 59 LYS NZ :NH3+ -117:sc= 0.12 (180deg=0) USER MOD Single : B 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 61 LYS NZ :NH3+ -153:sc= 0.0516 (180deg=0) USER MOD Single : B 62 SER OG : rot 113:sc= 0.119 USER MOD Single : B 66 ASN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : B 67 GLN : amide:sc= -0.284 X(o=-0.28,f=-0.003) USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 72 LYS NZ :NH3+ -175:sc= -0.219 (180deg=-0.228) USER MOD Single : B 74 ASN : amide:sc= 0 X(o=0,f=0.16) USER MOD Single : B 76 TYR OH : rot 180:sc= -0.432 USER MOD Single : B 85 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.0701) USER MOD Single : B 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 90 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0122) USER MOD Single : B 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 97 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0309) USER MOD Single : B 98 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.009) USER MOD Single : B 99 ANW OAV : rot 179:sc= 0.472! USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.290 18.052 7.429 1.00 1.04 N ATOM 2 CA MET A 1 6.479 16.723 6.772 1.00 0.91 C ATOM 3 C MET A 1 7.104 15.704 7.745 1.00 0.73 C ATOM 4 O MET A 1 8.316 15.462 7.730 1.00 0.96 O ATOM 5 CB MET A 1 7.305 16.847 5.460 1.00 1.31 C ATOM 6 CG MET A 1 8.566 17.714 5.558 1.00 1.57 C ATOM 7 SD MET A 1 9.483 17.793 4.001 1.00 2.18 S ATOM 8 CE MET A 1 10.655 19.100 4.350 1.00 2.71 C ATOM 0 H1 MET A 1 5.883 18.722 6.746 1.00 1.04 H new ATOM 0 H2 MET A 1 5.646 17.950 8.239 1.00 1.04 H new ATOM 0 H3 MET A 1 7.209 18.409 7.760 1.00 1.04 H new ATOM 0 HA MET A 1 5.493 16.348 6.495 1.00 0.91 H new ATOM 0 HB2 MET A 1 7.596 15.847 5.138 1.00 1.31 H new ATOM 0 HB3 MET A 1 6.661 17.258 4.682 1.00 1.31 H new ATOM 0 HG2 MET A 1 8.285 18.723 5.861 1.00 1.57 H new ATOM 0 HG3 MET A 1 9.216 17.316 6.338 1.00 1.57 H new ATOM 0 HE1 MET A 1 11.290 19.261 3.479 1.00 2.71 H new ATOM 0 HE2 MET A 1 10.117 20.019 4.582 1.00 2.71 H new ATOM 0 HE3 MET A 1 11.273 18.817 5.202 1.00 2.71 H new ATOM 20 N ALA A 2 6.246 15.123 8.606 1.00 0.77 N ATOM 21 CA ALA A 2 6.664 14.121 9.598 1.00 0.71 C ATOM 22 C ALA A 2 5.549 13.088 9.818 1.00 0.59 C ATOM 23 O ALA A 2 4.367 13.400 9.643 1.00 0.68 O ATOM 24 CB ALA A 2 7.036 14.801 10.917 1.00 1.02 C ATOM 0 H ALA A 2 5.249 15.336 8.631 1.00 0.77 H new ATOM 0 HA ALA A 2 7.544 13.601 9.219 1.00 0.71 H new ATOM 0 HB1 ALA A 2 7.343 14.047 11.641 1.00 1.02 H new ATOM 0 HB2 ALA A 2 7.857 15.498 10.748 1.00 1.02 H new ATOM 0 HB3 ALA A 2 6.173 15.344 11.303 1.00 1.02 H new ATOM 30 N ALA A 3 5.931 11.862 10.212 1.00 0.56 N ATOM 31 CA ALA A 3 4.965 10.777 10.444 1.00 0.54 C ATOM 32 C ALA A 3 4.411 10.820 11.881 1.00 0.55 C ATOM 33 O ALA A 3 5.127 10.502 12.838 1.00 0.70 O ATOM 34 CB ALA A 3 5.609 9.429 10.121 1.00 0.66 C ATOM 0 H ALA A 3 6.902 11.598 10.376 1.00 0.56 H new ATOM 0 HA ALA A 3 4.114 10.915 9.777 1.00 0.54 H new ATOM 0 HB1 ALA A 3 4.888 8.630 10.295 1.00 0.66 H new ATOM 0 HB2 ALA A 3 5.920 9.415 9.077 1.00 0.66 H new ATOM 0 HB3 ALA A 3 6.479 9.279 10.761 1.00 0.66 H new ATOM 40 N GLU A 4 3.125 11.223 12.018 1.00 0.52 N ATOM 41 CA GLU A 4 2.446 11.334 13.327 1.00 0.55 C ATOM 42 C GLU A 4 1.097 10.559 13.314 1.00 0.52 C ATOM 43 O GLU A 4 0.407 10.563 12.287 1.00 0.50 O ATOM 44 CB GLU A 4 2.234 12.833 13.662 1.00 0.61 C ATOM 45 CG GLU A 4 1.943 13.134 15.134 1.00 0.74 C ATOM 46 CD GLU A 4 2.052 14.613 15.475 1.00 0.86 C ATOM 47 OE1 GLU A 4 3.160 15.056 15.843 1.00 1.02 O ATOM 48 OE2 GLU A 4 1.028 15.325 15.377 1.00 0.94 O ATOM 0 H GLU A 4 2.534 11.479 11.227 1.00 0.52 H new ATOM 0 HA GLU A 4 3.068 10.884 14.101 1.00 0.55 H new ATOM 0 HB2 GLU A 4 3.125 13.386 13.363 1.00 0.61 H new ATOM 0 HB3 GLU A 4 1.408 13.211 13.060 1.00 0.61 H new ATOM 0 HG2 GLU A 4 0.940 12.784 15.379 1.00 0.74 H new ATOM 0 HG3 GLU A 4 2.638 12.572 15.758 1.00 0.74 H new ATOM 55 N PRO A 5 0.684 9.894 14.451 1.00 0.57 N ATOM 56 CA PRO A 5 -0.569 9.111 14.506 1.00 0.59 C ATOM 57 C PRO A 5 -1.837 9.963 14.737 1.00 0.53 C ATOM 58 O PRO A 5 -1.789 10.970 15.449 1.00 0.59 O ATOM 59 CB PRO A 5 -0.330 8.140 15.676 1.00 0.74 C ATOM 60 CG PRO A 5 0.702 8.779 16.553 1.00 0.73 C ATOM 61 CD PRO A 5 1.394 9.859 15.756 1.00 0.67 C ATOM 0 HA PRO A 5 -0.768 8.620 13.554 1.00 0.59 H new ATOM 0 HB2 PRO A 5 -1.253 7.963 16.228 1.00 0.74 H new ATOM 0 HB3 PRO A 5 0.015 7.172 15.313 1.00 0.74 H new ATOM 0 HG2 PRO A 5 0.236 9.203 17.443 1.00 0.73 H new ATOM 0 HG3 PRO A 5 1.424 8.037 16.894 1.00 0.73 H new ATOM 0 HD2 PRO A 5 1.334 10.822 16.263 1.00 0.67 H new ATOM 0 HD3 PRO A 5 2.452 9.634 15.623 1.00 0.67 H new ATOM 69 N LEU A 6 -2.970 9.534 14.125 1.00 0.58 N ATOM 70 CA LEU A 6 -4.269 10.239 14.241 1.00 0.67 C ATOM 71 C LEU A 6 -5.453 9.249 14.393 1.00 0.71 C ATOM 72 O LEU A 6 -6.151 9.271 15.411 1.00 1.19 O ATOM 73 CB LEU A 6 -4.506 11.150 13.008 1.00 0.84 C ATOM 74 CG LEU A 6 -3.491 12.301 12.797 1.00 0.91 C ATOM 75 CD1 LEU A 6 -3.678 12.945 11.420 1.00 1.14 C ATOM 76 CD2 LEU A 6 -3.603 13.358 13.901 1.00 1.03 C ATOM 0 H LEU A 6 -3.008 8.697 13.543 1.00 0.58 H new ATOM 0 HA LEU A 6 -4.222 10.851 15.142 1.00 0.67 H new ATOM 0 HB2 LEU A 6 -4.504 10.524 12.115 1.00 0.84 H new ATOM 0 HB3 LEU A 6 -5.502 11.584 13.090 1.00 0.84 H new ATOM 0 HG LEU A 6 -2.491 11.869 12.847 1.00 0.91 H new ATOM 0 HD11 LEU A 6 -2.955 13.751 11.294 1.00 1.14 H new ATOM 0 HD12 LEU A 6 -3.525 12.195 10.644 1.00 1.14 H new ATOM 0 HD13 LEU A 6 -4.688 13.348 11.341 1.00 1.14 H new ATOM 0 HD21 LEU A 6 -2.876 14.150 13.721 1.00 1.03 H new ATOM 0 HD22 LEU A 6 -4.608 13.780 13.900 1.00 1.03 H new ATOM 0 HD23 LEU A 6 -3.404 12.896 14.868 1.00 1.03 H new ATOM 88 N THR A 7 -5.670 8.392 13.366 1.00 0.52 N ATOM 89 CA THR A 7 -6.772 7.400 13.345 1.00 0.52 C ATOM 90 C THR A 7 -6.207 5.963 13.288 1.00 0.49 C ATOM 91 O THR A 7 -5.033 5.777 12.964 1.00 0.56 O ATOM 92 CB THR A 7 -7.712 7.665 12.122 1.00 0.58 C ATOM 93 OG1 THR A 7 -7.940 9.073 11.981 1.00 0.98 O ATOM 94 CG2 THR A 7 -9.066 6.964 12.253 1.00 0.94 C ATOM 0 H THR A 7 -5.086 8.369 12.530 1.00 0.52 H new ATOM 0 HA THR A 7 -7.352 7.505 14.262 1.00 0.52 H new ATOM 0 HB THR A 7 -7.206 7.260 11.245 1.00 0.58 H new ATOM 0 HG1 THR A 7 -7.505 9.395 11.164 1.00 0.98 H new ATOM 0 HG21 THR A 7 -9.676 7.184 11.377 1.00 0.94 H new ATOM 0 HG22 THR A 7 -8.913 5.887 12.328 1.00 0.94 H new ATOM 0 HG23 THR A 7 -9.575 7.321 13.148 1.00 0.94 H new ATOM 102 N GLU A 8 -7.051 4.950 13.604 1.00 0.51 N ATOM 103 CA GLU A 8 -6.633 3.526 13.599 1.00 0.50 C ATOM 104 C GLU A 8 -6.018 3.089 12.246 1.00 0.46 C ATOM 105 O GLU A 8 -4.940 2.489 12.232 1.00 0.48 O ATOM 106 CB GLU A 8 -7.818 2.604 13.970 1.00 0.55 C ATOM 107 CG GLU A 8 -7.398 1.222 14.475 1.00 0.91 C ATOM 108 CD GLU A 8 -8.576 0.361 14.893 1.00 0.95 C ATOM 109 OE1 GLU A 8 -9.006 0.469 16.061 1.00 1.42 O ATOM 110 OE2 GLU A 8 -9.069 -0.423 14.053 1.00 1.14 O ATOM 0 H GLU A 8 -8.026 5.093 13.866 1.00 0.51 H new ATOM 0 HA GLU A 8 -5.853 3.429 14.354 1.00 0.50 H new ATOM 0 HB2 GLU A 8 -8.419 3.093 14.737 1.00 0.55 H new ATOM 0 HB3 GLU A 8 -8.457 2.481 13.095 1.00 0.55 H new ATOM 0 HG2 GLU A 8 -6.840 0.709 13.692 1.00 0.91 H new ATOM 0 HG3 GLU A 8 -6.723 1.340 15.322 1.00 0.91 H new ATOM 117 N LEU A 9 -6.699 3.385 11.116 1.00 0.45 N ATOM 118 CA LEU A 9 -6.187 3.018 9.772 1.00 0.44 C ATOM 119 C LEU A 9 -5.020 3.928 9.339 1.00 0.42 C ATOM 120 O LEU A 9 -4.076 3.452 8.700 1.00 0.43 O ATOM 121 CB LEU A 9 -7.308 3.046 8.710 1.00 0.48 C ATOM 122 CG LEU A 9 -8.383 1.935 8.817 1.00 0.56 C ATOM 123 CD1 LEU A 9 -9.478 2.153 7.773 1.00 0.65 C ATOM 124 CD2 LEU A 9 -7.766 0.534 8.671 1.00 0.65 C ATOM 0 H LEU A 9 -7.595 3.872 11.105 1.00 0.45 H new ATOM 0 HA LEU A 9 -5.812 1.997 9.847 1.00 0.44 H new ATOM 0 HB2 LEU A 9 -7.808 4.013 8.766 1.00 0.48 H new ATOM 0 HB3 LEU A 9 -6.847 2.982 7.724 1.00 0.48 H new ATOM 0 HG LEU A 9 -8.827 1.995 9.811 1.00 0.56 H new ATOM 0 HD11 LEU A 9 -10.226 1.365 7.860 1.00 0.65 H new ATOM 0 HD12 LEU A 9 -9.950 3.121 7.938 1.00 0.65 H new ATOM 0 HD13 LEU A 9 -9.040 2.128 6.775 1.00 0.65 H new ATOM 0 HD21 LEU A 9 -8.550 -0.219 8.751 1.00 0.65 H new ATOM 0 HD22 LEU A 9 -7.280 0.450 7.699 1.00 0.65 H new ATOM 0 HD23 LEU A 9 -7.030 0.377 9.459 1.00 0.65 H new ATOM 136 N GLU A 10 -5.091 5.236 9.677 1.00 0.42 N ATOM 137 CA GLU A 10 -4.013 6.198 9.347 1.00 0.44 C ATOM 138 C GLU A 10 -2.706 5.816 10.079 1.00 0.44 C ATOM 139 O GLU A 10 -1.618 5.932 9.510 1.00 0.48 O ATOM 140 CB GLU A 10 -4.415 7.639 9.723 1.00 0.49 C ATOM 141 CG GLU A 10 -5.551 8.223 8.884 1.00 0.54 C ATOM 142 CD GLU A 10 -5.833 9.682 9.208 1.00 0.63 C ATOM 143 OE1 GLU A 10 -4.901 10.508 9.096 1.00 1.03 O ATOM 144 OE2 GLU A 10 -6.984 9.999 9.576 1.00 0.96 O ATOM 0 H GLU A 10 -5.879 5.649 10.176 1.00 0.42 H new ATOM 0 HA GLU A 10 -3.850 6.155 8.270 1.00 0.44 H new ATOM 0 HB2 GLU A 10 -4.709 7.658 10.772 1.00 0.49 H new ATOM 0 HB3 GLU A 10 -3.541 8.283 9.626 1.00 0.49 H new ATOM 0 HG2 GLU A 10 -5.300 8.132 7.827 1.00 0.54 H new ATOM 0 HG3 GLU A 10 -6.456 7.638 9.048 1.00 0.54 H new ATOM 151 N GLU A 11 -2.843 5.349 11.343 1.00 0.44 N ATOM 152 CA GLU A 11 -1.704 4.924 12.183 1.00 0.46 C ATOM 153 C GLU A 11 -1.028 3.656 11.625 1.00 0.45 C ATOM 154 O GLU A 11 0.191 3.526 11.720 1.00 0.47 O ATOM 155 CB GLU A 11 -2.179 4.685 13.634 1.00 0.52 C ATOM 156 CG GLU A 11 -1.066 4.378 14.638 1.00 0.61 C ATOM 157 CD GLU A 11 -1.594 4.217 16.052 1.00 0.69 C ATOM 158 OE1 GLU A 11 -1.712 5.239 16.764 1.00 0.79 O ATOM 159 OE2 GLU A 11 -1.901 3.071 16.445 1.00 0.81 O ATOM 0 H GLU A 11 -3.747 5.257 11.806 1.00 0.44 H new ATOM 0 HA GLU A 11 -0.963 5.723 12.173 1.00 0.46 H new ATOM 0 HB2 GLU A 11 -2.720 5.569 13.973 1.00 0.52 H new ATOM 0 HB3 GLU A 11 -2.888 3.857 13.636 1.00 0.52 H new ATOM 0 HG2 GLU A 11 -0.551 3.465 14.339 1.00 0.61 H new ATOM 0 HG3 GLU A 11 -0.329 5.181 14.617 1.00 0.61 H new ATOM 166 N SER A 12 -1.824 2.724 11.045 1.00 0.45 N ATOM 167 CA SER A 12 -1.286 1.472 10.467 1.00 0.47 C ATOM 168 C SER A 12 -0.202 1.768 9.410 1.00 0.44 C ATOM 169 O SER A 12 0.936 1.318 9.548 1.00 0.49 O ATOM 170 CB SER A 12 -2.410 0.619 9.846 1.00 0.52 C ATOM 171 OG SER A 12 -3.420 0.328 10.799 1.00 0.63 O ATOM 0 H SER A 12 -2.837 2.817 10.966 1.00 0.45 H new ATOM 0 HA SER A 12 -0.831 0.907 11.281 1.00 0.47 H new ATOM 0 HB2 SER A 12 -2.847 1.149 9.000 1.00 0.52 H new ATOM 0 HB3 SER A 12 -1.993 -0.311 9.459 1.00 0.52 H new ATOM 0 HG SER A 12 -3.855 1.160 11.079 1.00 0.63 H new ATOM 177 N ILE A 13 -0.564 2.556 8.375 1.00 0.42 N ATOM 178 CA ILE A 13 0.379 2.938 7.297 1.00 0.43 C ATOM 179 C ILE A 13 1.447 3.957 7.784 1.00 0.41 C ATOM 180 O ILE A 13 2.511 4.071 7.170 1.00 0.46 O ATOM 181 CB ILE A 13 -0.355 3.490 6.016 1.00 0.47 C ATOM 182 CG1 ILE A 13 -1.298 4.696 6.315 1.00 0.46 C ATOM 183 CG2 ILE A 13 -1.131 2.364 5.324 1.00 0.56 C ATOM 184 CD1 ILE A 13 -0.616 6.054 6.305 1.00 0.44 C ATOM 0 H ILE A 13 -1.502 2.941 8.262 1.00 0.42 H new ATOM 0 HA ILE A 13 0.890 2.017 7.016 1.00 0.43 H new ATOM 0 HB ILE A 13 0.422 3.865 5.350 1.00 0.47 H new ATOM 0 HG12 ILE A 13 -2.101 4.703 5.578 1.00 0.46 H new ATOM 0 HG13 ILE A 13 -1.761 4.544 7.290 1.00 0.46 H new ATOM 0 HG21 ILE A 13 -1.634 2.758 4.441 1.00 0.56 H new ATOM 0 HG22 ILE A 13 -0.440 1.575 5.027 1.00 0.56 H new ATOM 0 HG23 ILE A 13 -1.872 1.957 6.012 1.00 0.56 H new ATOM 0 HD11 ILE A 13 -1.349 6.831 6.523 1.00 0.44 H new ATOM 0 HD12 ILE A 13 0.168 6.073 7.062 1.00 0.44 H new ATOM 0 HD13 ILE A 13 -0.177 6.234 5.323 1.00 0.44 H new ATOM 196 N GLU A 14 1.154 4.687 8.886 1.00 0.39 N ATOM 197 CA GLU A 14 2.078 5.687 9.462 1.00 0.40 C ATOM 198 C GLU A 14 3.176 5.029 10.327 1.00 0.41 C ATOM 199 O GLU A 14 4.317 5.505 10.333 1.00 0.44 O ATOM 200 CB GLU A 14 1.277 6.722 10.288 1.00 0.43 C ATOM 201 CG GLU A 14 2.098 7.866 10.895 1.00 0.52 C ATOM 202 CD GLU A 14 2.654 7.542 12.277 1.00 0.61 C ATOM 203 OE1 GLU A 14 1.851 7.374 13.219 1.00 0.93 O ATOM 204 OE2 GLU A 14 3.890 7.447 12.414 1.00 1.00 O ATOM 0 H GLU A 14 0.275 4.599 9.397 1.00 0.39 H new ATOM 0 HA GLU A 14 2.583 6.194 8.639 1.00 0.40 H new ATOM 0 HB2 GLU A 14 0.506 7.152 9.648 1.00 0.43 H new ATOM 0 HB3 GLU A 14 0.766 6.198 11.095 1.00 0.43 H new ATOM 0 HG2 GLU A 14 2.924 8.106 10.226 1.00 0.52 H new ATOM 0 HG3 GLU A 14 1.473 8.757 10.962 1.00 0.52 H new ATOM 211 N THR A 15 2.828 3.946 11.061 1.00 0.42 N ATOM 212 CA THR A 15 3.794 3.227 11.923 1.00 0.45 C ATOM 213 C THR A 15 4.919 2.569 11.094 1.00 0.43 C ATOM 214 O THR A 15 6.060 2.493 11.556 1.00 0.45 O ATOM 215 CB THR A 15 3.095 2.147 12.806 1.00 0.50 C ATOM 216 OG1 THR A 15 1.979 2.730 13.486 1.00 0.65 O ATOM 217 CG2 THR A 15 4.038 1.551 13.853 1.00 0.77 C ATOM 0 H THR A 15 1.887 3.552 11.073 1.00 0.42 H new ATOM 0 HA THR A 15 4.235 3.978 12.579 1.00 0.45 H new ATOM 0 HB THR A 15 2.775 1.348 12.138 1.00 0.50 H new ATOM 0 HG1 THR A 15 1.308 3.013 12.830 1.00 0.65 H new ATOM 0 HG21 THR A 15 3.504 0.805 14.441 1.00 0.77 H new ATOM 0 HG22 THR A 15 4.885 1.081 13.354 1.00 0.77 H new ATOM 0 HG23 THR A 15 4.398 2.342 14.511 1.00 0.77 H new ATOM 225 N VAL A 16 4.590 2.103 9.866 1.00 0.41 N ATOM 226 CA VAL A 16 5.577 1.462 8.966 1.00 0.42 C ATOM 227 C VAL A 16 6.718 2.445 8.601 1.00 0.42 C ATOM 228 O VAL A 16 7.871 2.027 8.447 1.00 0.46 O ATOM 229 CB VAL A 16 4.902 0.911 7.655 1.00 0.44 C ATOM 230 CG1 VAL A 16 5.915 0.227 6.729 1.00 0.50 C ATOM 231 CG2 VAL A 16 3.764 -0.060 7.990 1.00 0.49 C ATOM 0 H VAL A 16 3.649 2.159 9.476 1.00 0.41 H new ATOM 0 HA VAL A 16 6.000 0.617 9.509 1.00 0.42 H new ATOM 0 HB VAL A 16 4.492 1.772 7.127 1.00 0.44 H new ATOM 0 HG11 VAL A 16 5.405 -0.138 5.838 1.00 0.50 H new ATOM 0 HG12 VAL A 16 6.684 0.943 6.440 1.00 0.50 H new ATOM 0 HG13 VAL A 16 6.377 -0.611 7.251 1.00 0.50 H new ATOM 0 HG21 VAL A 16 3.314 -0.426 7.067 1.00 0.49 H new ATOM 0 HG22 VAL A 16 4.159 -0.901 8.560 1.00 0.49 H new ATOM 0 HG23 VAL A 16 3.008 0.456 8.582 1.00 0.49 H new ATOM 241 N VAL A 17 6.383 3.747 8.483 1.00 0.42 N ATOM 242 CA VAL A 17 7.366 4.794 8.144 1.00 0.47 C ATOM 243 C VAL A 17 8.183 5.225 9.388 1.00 0.55 C ATOM 244 O VAL A 17 9.406 5.325 9.300 1.00 0.95 O ATOM 245 CB VAL A 17 6.681 6.046 7.486 1.00 0.51 C ATOM 246 CG1 VAL A 17 7.716 7.092 7.047 1.00 0.60 C ATOM 247 CG2 VAL A 17 5.802 5.638 6.297 1.00 0.52 C ATOM 0 H VAL A 17 5.435 4.098 8.618 1.00 0.42 H new ATOM 0 HA VAL A 17 8.049 4.360 7.414 1.00 0.47 H new ATOM 0 HB VAL A 17 6.045 6.498 8.247 1.00 0.51 H new ATOM 0 HG11 VAL A 17 7.205 7.943 6.597 1.00 0.60 H new ATOM 0 HG12 VAL A 17 8.284 7.428 7.914 1.00 0.60 H new ATOM 0 HG13 VAL A 17 8.394 6.649 6.318 1.00 0.60 H new ATOM 0 HG21 VAL A 17 5.342 6.526 5.863 1.00 0.52 H new ATOM 0 HG22 VAL A 17 6.415 5.142 5.544 1.00 0.52 H new ATOM 0 HG23 VAL A 17 5.023 4.955 6.637 1.00 0.52 H new ATOM 257 N THR A 18 7.504 5.462 10.542 1.00 0.47 N ATOM 258 CA THR A 18 8.184 5.892 11.799 1.00 0.51 C ATOM 259 C THR A 18 9.181 4.842 12.325 1.00 0.51 C ATOM 260 O THR A 18 10.247 5.209 12.833 1.00 0.60 O ATOM 261 CB THR A 18 7.176 6.232 12.947 1.00 0.56 C ATOM 262 OG1 THR A 18 5.929 5.567 12.728 1.00 0.57 O ATOM 263 CG2 THR A 18 6.931 7.735 13.070 1.00 0.62 C ATOM 0 H THR A 18 6.493 5.364 10.630 1.00 0.47 H new ATOM 0 HA THR A 18 8.727 6.795 11.520 1.00 0.51 H new ATOM 0 HB THR A 18 7.624 5.884 13.878 1.00 0.56 H new ATOM 0 HG1 THR A 18 5.218 6.233 12.620 1.00 0.57 H new ATOM 0 HG21 THR A 18 6.225 7.924 13.879 1.00 0.62 H new ATOM 0 HG22 THR A 18 7.872 8.241 13.284 1.00 0.62 H new ATOM 0 HG23 THR A 18 6.520 8.114 12.134 1.00 0.62 H new ATOM 271 N THR A 19 8.829 3.541 12.211 1.00 0.49 N ATOM 272 CA THR A 19 9.706 2.445 12.679 1.00 0.53 C ATOM 273 C THR A 19 11.044 2.421 11.910 1.00 0.53 C ATOM 274 O THR A 19 12.097 2.221 12.521 1.00 0.62 O ATOM 275 CB THR A 19 9.014 1.051 12.569 1.00 0.55 C ATOM 276 OG1 THR A 19 7.694 1.114 13.121 1.00 0.56 O ATOM 277 CG2 THR A 19 9.801 -0.037 13.305 1.00 0.66 C ATOM 0 H THR A 19 7.949 3.226 11.802 1.00 0.49 H new ATOM 0 HA THR A 19 9.907 2.645 13.731 1.00 0.53 H new ATOM 0 HB THR A 19 8.974 0.794 11.510 1.00 0.55 H new ATOM 0 HG1 THR A 19 7.058 1.366 12.420 1.00 0.56 H new ATOM 0 HG21 THR A 19 9.285 -0.991 13.203 1.00 0.66 H new ATOM 0 HG22 THR A 19 10.800 -0.117 12.876 1.00 0.66 H new ATOM 0 HG23 THR A 19 9.880 0.222 14.361 1.00 0.66 H new ATOM 285 N PHE A 20 10.992 2.623 10.574 1.00 0.53 N ATOM 286 CA PHE A 20 12.203 2.632 9.732 1.00 0.57 C ATOM 287 C PHE A 20 12.476 4.046 9.165 1.00 0.57 C ATOM 288 O PHE A 20 12.837 4.197 7.989 1.00 0.89 O ATOM 289 CB PHE A 20 12.071 1.581 8.600 1.00 0.64 C ATOM 290 CG PHE A 20 13.403 1.084 8.059 1.00 0.71 C ATOM 291 CD1 PHE A 20 14.233 0.287 8.845 1.00 0.83 C ATOM 292 CD2 PHE A 20 13.825 1.410 6.773 1.00 0.76 C ATOM 293 CE1 PHE A 20 15.444 -0.165 8.362 1.00 0.95 C ATOM 294 CE2 PHE A 20 15.039 0.954 6.289 1.00 0.86 C ATOM 295 CZ PHE A 20 15.845 0.168 7.085 1.00 0.93 C ATOM 0 H PHE A 20 10.125 2.781 10.060 1.00 0.53 H new ATOM 0 HA PHE A 20 13.060 2.362 10.349 1.00 0.57 H new ATOM 0 HB2 PHE A 20 11.502 0.730 8.973 1.00 0.64 H new ATOM 0 HB3 PHE A 20 11.497 2.014 7.781 1.00 0.64 H new ATOM 0 HD1 PHE A 20 13.925 0.020 9.845 1.00 0.83 H new ATOM 0 HD2 PHE A 20 13.198 2.026 6.146 1.00 0.76 H new ATOM 0 HE1 PHE A 20 16.078 -0.780 8.984 1.00 0.95 H new ATOM 0 HE2 PHE A 20 15.354 1.214 5.289 1.00 0.86 H new ATOM 0 HZ PHE A 20 16.792 -0.188 6.708 1.00 0.93 H new ATOM 305 N PHE A 21 12.319 5.079 10.022 1.00 0.71 N ATOM 306 CA PHE A 21 12.555 6.483 9.633 1.00 0.73 C ATOM 307 C PHE A 21 14.010 6.885 9.936 1.00 0.66 C ATOM 308 O PHE A 21 14.644 7.567 9.126 1.00 0.67 O ATOM 309 CB PHE A 21 11.576 7.427 10.368 1.00 1.04 C ATOM 310 CG PHE A 21 11.674 8.882 9.943 1.00 1.67 C ATOM 311 CD1 PHE A 21 11.042 9.331 8.788 1.00 1.97 C ATOM 312 CD2 PHE A 21 12.408 9.795 10.693 1.00 2.34 C ATOM 313 CE1 PHE A 21 11.139 10.650 8.397 1.00 2.74 C ATOM 314 CE2 PHE A 21 12.507 11.115 10.301 1.00 3.02 C ATOM 315 CZ PHE A 21 11.871 11.543 9.152 1.00 3.17 C ATOM 0 H PHE A 21 12.028 4.963 10.993 1.00 0.71 H new ATOM 0 HA PHE A 21 12.381 6.574 8.561 1.00 0.73 H new ATOM 0 HB2 PHE A 21 10.557 7.079 10.198 1.00 1.04 H new ATOM 0 HB3 PHE A 21 11.761 7.360 11.440 1.00 1.04 H new ATOM 0 HD1 PHE A 21 10.468 8.638 8.190 1.00 1.97 H new ATOM 0 HD2 PHE A 21 12.907 9.467 11.593 1.00 2.34 H new ATOM 0 HE1 PHE A 21 10.641 10.984 7.499 1.00 2.74 H new ATOM 0 HE2 PHE A 21 13.081 11.813 10.892 1.00 3.02 H new ATOM 0 HZ PHE A 21 11.947 12.576 8.845 1.00 3.17 H new ATOM 325 N THR A 22 14.522 6.455 11.111 1.00 0.75 N ATOM 326 CA THR A 22 15.901 6.751 11.547 1.00 0.89 C ATOM 327 C THR A 22 16.945 6.151 10.574 1.00 0.82 C ATOM 328 O THR A 22 18.007 6.746 10.365 1.00 0.97 O ATOM 329 CB THR A 22 16.154 6.222 12.995 1.00 1.11 C ATOM 330 OG1 THR A 22 15.029 6.523 13.845 1.00 1.25 O ATOM 331 CG2 THR A 22 17.415 6.825 13.612 1.00 1.37 C ATOM 0 H THR A 22 13.992 5.896 11.779 1.00 0.75 H new ATOM 0 HA THR A 22 16.015 7.835 11.543 1.00 0.89 H new ATOM 0 HB THR A 22 16.288 5.143 12.919 1.00 1.11 H new ATOM 0 HG1 THR A 22 15.201 6.184 14.748 1.00 1.25 H new ATOM 0 HG21 THR A 22 17.552 6.430 14.618 1.00 1.37 H new ATOM 0 HG22 THR A 22 18.279 6.567 13.000 1.00 1.37 H new ATOM 0 HG23 THR A 22 17.314 7.909 13.659 1.00 1.37 H new ATOM 339 N PHE A 23 16.633 4.975 9.988 1.00 0.69 N ATOM 340 CA PHE A 23 17.526 4.310 9.019 1.00 0.76 C ATOM 341 C PHE A 23 17.410 4.955 7.622 1.00 0.69 C ATOM 342 O PHE A 23 18.418 5.103 6.925 1.00 0.82 O ATOM 343 CB PHE A 23 17.209 2.804 8.923 1.00 0.87 C ATOM 344 CG PHE A 23 17.715 1.989 10.098 1.00 1.04 C ATOM 345 CD1 PHE A 23 18.994 1.437 10.078 1.00 1.34 C ATOM 346 CD2 PHE A 23 16.914 1.763 11.213 1.00 1.01 C ATOM 347 CE1 PHE A 23 19.456 0.684 11.140 1.00 1.55 C ATOM 348 CE2 PHE A 23 17.378 1.012 12.275 1.00 1.24 C ATOM 349 CZ PHE A 23 18.649 0.471 12.238 1.00 1.49 C ATOM 0 H PHE A 23 15.767 4.467 10.171 1.00 0.69 H new ATOM 0 HA PHE A 23 18.548 4.435 9.378 1.00 0.76 H new ATOM 0 HB2 PHE A 23 16.130 2.675 8.843 1.00 0.87 H new ATOM 0 HB3 PHE A 23 17.646 2.409 8.006 1.00 0.87 H new ATOM 0 HD1 PHE A 23 19.632 1.600 9.222 1.00 1.34 H new ATOM 0 HD2 PHE A 23 15.918 2.180 11.248 1.00 1.01 H new ATOM 0 HE1 PHE A 23 20.450 0.262 11.110 1.00 1.55 H new ATOM 0 HE2 PHE A 23 16.747 0.847 13.136 1.00 1.24 H new ATOM 0 HZ PHE A 23 19.010 -0.118 13.068 1.00 1.49 H new ATOM 359 N ALA A 24 16.175 5.345 7.228 1.00 0.59 N ATOM 360 CA ALA A 24 15.914 5.971 5.911 1.00 0.67 C ATOM 361 C ALA A 24 16.612 7.337 5.750 1.00 0.62 C ATOM 362 O ALA A 24 16.970 7.710 4.629 1.00 0.83 O ATOM 363 CB ALA A 24 14.411 6.113 5.667 1.00 0.82 C ATOM 0 H ALA A 24 15.342 5.236 7.806 1.00 0.59 H new ATOM 0 HA ALA A 24 16.339 5.304 5.161 1.00 0.67 H new ATOM 0 HB1 ALA A 24 14.242 6.575 4.694 1.00 0.82 H new ATOM 0 HB2 ALA A 24 13.945 5.128 5.687 1.00 0.82 H new ATOM 0 HB3 ALA A 24 13.973 6.737 6.446 1.00 0.82 H new ATOM 369 N ARG A 25 16.804 8.080 6.867 1.00 0.61 N ATOM 370 CA ARG A 25 17.476 9.397 6.828 1.00 0.65 C ATOM 371 C ARG A 25 19.021 9.269 6.758 1.00 0.69 C ATOM 372 O ARG A 25 19.706 10.262 6.492 1.00 0.88 O ATOM 373 CB ARG A 25 17.054 10.295 8.024 1.00 0.75 C ATOM 374 CG ARG A 25 17.408 9.758 9.421 1.00 0.78 C ATOM 375 CD ARG A 25 17.212 10.816 10.512 1.00 0.97 C ATOM 376 NE ARG A 25 17.685 10.362 11.839 1.00 1.09 N ATOM 377 CZ ARG A 25 17.511 11.037 12.998 1.00 1.32 C ATOM 378 NH1 ARG A 25 16.839 12.199 13.036 1.00 1.55 N ATOM 379 NH2 ARG A 25 18.017 10.547 14.136 1.00 1.47 N ATOM 0 H ARG A 25 16.505 7.791 7.798 1.00 0.61 H new ATOM 0 HA ARG A 25 17.146 9.881 5.909 1.00 0.65 H new ATOM 0 HB2 ARG A 25 17.520 11.273 7.902 1.00 0.75 H new ATOM 0 HB3 ARG A 25 15.976 10.448 7.977 1.00 0.75 H new ATOM 0 HG2 ARG A 25 16.788 8.890 9.643 1.00 0.78 H new ATOM 0 HG3 ARG A 25 18.444 9.419 9.427 1.00 0.78 H new ATOM 0 HD2 ARG A 25 17.746 11.724 10.232 1.00 0.97 H new ATOM 0 HD3 ARG A 25 16.155 11.074 10.576 1.00 0.97 H new ATOM 0 HE ARG A 25 18.180 9.471 11.883 1.00 1.09 H new ATOM 0 HH11 ARG A 25 16.447 12.590 12.179 1.00 1.55 H new ATOM 0 HH12 ARG A 25 16.720 12.691 13.922 1.00 1.55 H new ATOM 0 HH21 ARG A 25 18.532 9.667 14.128 1.00 1.47 H new ATOM 0 HH22 ARG A 25 17.887 11.054 15.012 1.00 1.47 H new ATOM 393 N GLN A 26 19.565 8.046 6.988 1.00 0.73 N ATOM 394 CA GLN A 26 21.024 7.806 6.934 1.00 0.84 C ATOM 395 C GLN A 26 21.574 8.038 5.506 1.00 0.78 C ATOM 396 O GLN A 26 22.594 8.712 5.339 1.00 0.89 O ATOM 397 CB GLN A 26 21.358 6.377 7.427 1.00 1.01 C ATOM 398 CG GLN A 26 22.841 6.145 7.730 1.00 1.22 C ATOM 399 CD GLN A 26 23.151 4.716 8.172 1.00 1.49 C ATOM 400 OE1 GLN A 26 23.432 3.852 7.339 1.00 1.63 O ATOM 401 NE2 GLN A 26 23.110 4.455 9.481 1.00 1.80 N ATOM 0 H GLN A 26 19.015 7.217 7.211 1.00 0.73 H new ATOM 0 HA GLN A 26 21.510 8.521 7.598 1.00 0.84 H new ATOM 0 HB2 GLN A 26 20.779 6.171 8.327 1.00 1.01 H new ATOM 0 HB3 GLN A 26 21.037 5.660 6.671 1.00 1.01 H new ATOM 0 HG2 GLN A 26 23.427 6.378 6.841 1.00 1.22 H new ATOM 0 HG3 GLN A 26 23.158 6.836 8.511 1.00 1.22 H new ATOM 0 HE21 GLN A 26 22.874 5.195 10.142 1.00 1.80 H new ATOM 0 HE22 GLN A 26 23.315 3.515 9.820 1.00 1.80 H new ATOM 410 N GLU A 27 20.882 7.484 4.488 1.00 0.70 N ATOM 411 CA GLU A 27 21.280 7.641 3.076 1.00 0.76 C ATOM 412 C GLU A 27 20.553 8.849 2.436 1.00 0.93 C ATOM 413 O GLU A 27 19.772 9.530 3.112 1.00 1.59 O ATOM 414 CB GLU A 27 21.013 6.326 2.299 1.00 0.92 C ATOM 415 CG GLU A 27 22.053 5.226 2.551 1.00 1.09 C ATOM 416 CD GLU A 27 23.417 5.530 1.946 1.00 1.27 C ATOM 417 OE1 GLU A 27 23.543 5.472 0.705 1.00 1.52 O ATOM 418 OE2 GLU A 27 24.354 5.828 2.716 1.00 1.46 O ATOM 0 H GLU A 27 20.041 6.922 4.621 1.00 0.70 H new ATOM 0 HA GLU A 27 22.349 7.846 3.026 1.00 0.76 H new ATOM 0 HB2 GLU A 27 20.028 5.949 2.573 1.00 0.92 H new ATOM 0 HB3 GLU A 27 20.985 6.547 1.232 1.00 0.92 H new ATOM 0 HG2 GLU A 27 22.165 5.082 3.626 1.00 1.09 H new ATOM 0 HG3 GLU A 27 21.683 4.286 2.140 1.00 1.09 H new ATOM 425 N GLY A 28 20.823 9.111 1.134 1.00 0.79 N ATOM 426 CA GLY A 28 20.228 10.247 0.409 1.00 0.92 C ATOM 427 C GLY A 28 18.705 10.363 0.502 1.00 0.73 C ATOM 428 O GLY A 28 18.001 9.354 0.420 1.00 0.72 O ATOM 0 H GLY A 28 21.453 8.544 0.567 1.00 0.79 H new ATOM 0 HA2 GLY A 28 20.669 11.169 0.788 1.00 0.92 H new ATOM 0 HA3 GLY A 28 20.506 10.170 -0.642 1.00 0.92 H new ATOM 432 N ARG A 29 18.210 11.622 0.661 1.00 0.72 N ATOM 433 CA ARG A 29 16.766 11.955 0.764 1.00 0.71 C ATOM 434 C ARG A 29 16.133 11.429 2.068 1.00 0.68 C ATOM 435 O ARG A 29 16.395 10.296 2.484 1.00 0.76 O ATOM 436 CB ARG A 29 15.965 11.460 -0.470 1.00 0.73 C ATOM 437 CG ARG A 29 16.155 12.319 -1.724 1.00 0.92 C ATOM 438 CD ARG A 29 15.525 11.679 -2.960 1.00 1.31 C ATOM 439 NE ARG A 29 15.732 12.481 -4.185 1.00 1.46 N ATOM 440 CZ ARG A 29 15.621 12.013 -5.452 1.00 1.91 C ATOM 441 NH1 ARG A 29 15.324 10.728 -5.699 1.00 2.60 N ATOM 442 NH2 ARG A 29 15.806 12.845 -6.480 1.00 2.05 N ATOM 0 H ARG A 29 18.813 12.442 0.722 1.00 0.72 H new ATOM 0 HA ARG A 29 16.710 13.043 0.787 1.00 0.71 H new ATOM 0 HB2 ARG A 29 16.262 10.436 -0.696 1.00 0.73 H new ATOM 0 HB3 ARG A 29 14.905 11.436 -0.216 1.00 0.73 H new ATOM 0 HG2 ARG A 29 15.713 13.302 -1.560 1.00 0.92 H new ATOM 0 HG3 ARG A 29 17.220 12.474 -1.899 1.00 0.92 H new ATOM 0 HD2 ARG A 29 15.948 10.685 -3.105 1.00 1.31 H new ATOM 0 HD3 ARG A 29 14.456 11.549 -2.792 1.00 1.31 H new ATOM 0 HE ARG A 29 15.978 13.464 -4.067 1.00 1.46 H new ATOM 0 HH11 ARG A 29 15.177 10.081 -4.925 1.00 2.60 H new ATOM 0 HH12 ARG A 29 15.246 10.399 -6.661 1.00 2.60 H new ATOM 0 HH21 ARG A 29 16.029 13.825 -6.309 1.00 2.05 H new ATOM 0 HH22 ARG A 29 15.724 12.500 -7.436 1.00 2.05 H new ATOM 456 N LYS A 30 15.287 12.273 2.700 1.00 0.67 N ATOM 457 CA LYS A 30 14.597 11.922 3.961 1.00 0.67 C ATOM 458 C LYS A 30 13.448 10.927 3.710 1.00 0.66 C ATOM 459 O LYS A 30 13.225 10.022 4.524 1.00 0.72 O ATOM 460 CB LYS A 30 14.044 13.189 4.652 1.00 0.76 C ATOM 461 CG LYS A 30 15.112 14.167 5.162 1.00 0.82 C ATOM 462 CD LYS A 30 15.800 13.667 6.436 1.00 0.89 C ATOM 463 CE LYS A 30 16.784 14.691 7.006 1.00 1.00 C ATOM 464 NZ LYS A 30 18.001 14.862 6.155 1.00 1.22 N ATOM 0 H LYS A 30 15.065 13.207 2.355 1.00 0.67 H new ATOM 0 HA LYS A 30 15.330 11.449 4.614 1.00 0.67 H new ATOM 0 HB2 LYS A 30 13.397 13.715 3.950 1.00 0.76 H new ATOM 0 HB3 LYS A 30 13.421 12.884 5.493 1.00 0.76 H new ATOM 0 HG2 LYS A 30 15.860 14.321 4.385 1.00 0.82 H new ATOM 0 HG3 LYS A 30 14.651 15.135 5.357 1.00 0.82 H new ATOM 0 HD2 LYS A 30 15.045 13.435 7.187 1.00 0.89 H new ATOM 0 HD3 LYS A 30 16.330 12.739 6.220 1.00 0.89 H new ATOM 0 HE2 LYS A 30 16.281 15.652 7.110 1.00 1.00 H new ATOM 0 HE3 LYS A 30 17.086 14.380 8.006 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 18.632 15.566 6.589 1.00 1.22 H new ATOM 0 HZ2 LYS A 30 18.500 13.953 6.076 1.00 1.22 H new ATOM 0 HZ3 LYS A 30 17.719 15.186 5.208 1.00 1.22 H new ATOM 478 N ASP A 31 12.726 11.098 2.579 1.00 0.66 N ATOM 479 CA ASP A 31 11.604 10.212 2.208 1.00 0.71 C ATOM 480 C ASP A 31 12.073 9.143 1.199 1.00 0.64 C ATOM 481 O ASP A 31 11.387 8.870 0.205 1.00 0.89 O ATOM 482 CB ASP A 31 10.434 11.040 1.613 1.00 0.87 C ATOM 483 CG ASP A 31 9.964 12.181 2.512 1.00 1.03 C ATOM 484 OD1 ASP A 31 10.135 12.088 3.746 1.00 1.43 O ATOM 485 OD2 ASP A 31 9.420 13.169 1.973 1.00 1.38 O ATOM 0 H ASP A 31 12.903 11.845 1.907 1.00 0.66 H new ATOM 0 HA ASP A 31 11.250 9.708 3.107 1.00 0.71 H new ATOM 0 HB2 ASP A 31 10.745 11.451 0.653 1.00 0.87 H new ATOM 0 HB3 ASP A 31 9.593 10.374 1.418 1.00 0.87 H new ATOM 490 N SER A 32 13.247 8.525 1.468 1.00 0.65 N ATOM 491 CA SER A 32 13.822 7.507 0.575 1.00 0.58 C ATOM 492 C SER A 32 14.596 6.425 1.345 1.00 0.56 C ATOM 493 O SER A 32 15.295 6.723 2.320 1.00 0.63 O ATOM 494 CB SER A 32 14.759 8.184 -0.435 1.00 0.58 C ATOM 495 OG SER A 32 15.309 7.251 -1.353 1.00 1.09 O ATOM 0 H SER A 32 13.809 8.718 2.297 1.00 0.65 H new ATOM 0 HA SER A 32 12.996 7.017 0.061 1.00 0.58 H new ATOM 0 HB2 SER A 32 14.211 8.951 -0.982 1.00 0.58 H new ATOM 0 HB3 SER A 32 15.565 8.687 0.098 1.00 0.58 H new ATOM 0 HG SER A 32 15.185 7.580 -2.268 1.00 1.09 H new ATOM 501 N LEU A 33 14.458 5.167 0.886 1.00 0.54 N ATOM 502 CA LEU A 33 15.163 4.017 1.471 1.00 0.54 C ATOM 503 C LEU A 33 16.360 3.645 0.574 1.00 0.52 C ATOM 504 O LEU A 33 16.403 4.043 -0.594 1.00 0.66 O ATOM 505 CB LEU A 33 14.208 2.810 1.636 1.00 0.55 C ATOM 506 CG LEU A 33 13.058 2.989 2.663 1.00 0.67 C ATOM 507 CD1 LEU A 33 11.865 3.728 2.043 1.00 0.76 C ATOM 508 CD2 LEU A 33 12.609 1.639 3.226 1.00 0.75 C ATOM 0 H LEU A 33 13.855 4.922 0.100 1.00 0.54 H new ATOM 0 HA LEU A 33 15.526 4.288 2.462 1.00 0.54 H new ATOM 0 HB2 LEU A 33 13.769 2.584 0.664 1.00 0.55 H new ATOM 0 HB3 LEU A 33 14.799 1.942 1.929 1.00 0.55 H new ATOM 0 HG LEU A 33 13.446 3.595 3.482 1.00 0.67 H new ATOM 0 HD11 LEU A 33 11.077 3.837 2.788 1.00 0.76 H new ATOM 0 HD12 LEU A 33 12.184 4.714 1.705 1.00 0.76 H new ATOM 0 HD13 LEU A 33 11.485 3.159 1.194 1.00 0.76 H new ATOM 0 HD21 LEU A 33 11.803 1.794 3.943 1.00 0.75 H new ATOM 0 HD22 LEU A 33 12.255 1.005 2.413 1.00 0.75 H new ATOM 0 HD23 LEU A 33 13.449 1.155 3.724 1.00 0.75 H new ATOM 520 N SER A 34 17.339 2.899 1.122 1.00 0.50 N ATOM 521 CA SER A 34 18.535 2.484 0.354 1.00 0.52 C ATOM 522 C SER A 34 18.382 1.057 -0.209 1.00 0.47 C ATOM 523 O SER A 34 17.532 0.291 0.255 1.00 0.47 O ATOM 524 CB SER A 34 19.791 2.578 1.235 1.00 0.62 C ATOM 525 OG SER A 34 20.971 2.430 0.461 1.00 0.68 O ATOM 0 H SER A 34 17.328 2.572 2.088 1.00 0.50 H new ATOM 0 HA SER A 34 18.640 3.164 -0.492 1.00 0.52 H new ATOM 0 HB2 SER A 34 19.808 3.539 1.748 1.00 0.62 H new ATOM 0 HB3 SER A 34 19.758 1.806 2.004 1.00 0.62 H new ATOM 0 HG SER A 34 21.743 2.335 1.057 1.00 0.68 H new ATOM 531 N VAL A 35 19.225 0.708 -1.210 1.00 0.50 N ATOM 532 CA VAL A 35 19.201 -0.624 -1.859 1.00 0.49 C ATOM 533 C VAL A 35 19.616 -1.758 -0.881 1.00 0.45 C ATOM 534 O VAL A 35 19.140 -2.892 -1.000 1.00 0.46 O ATOM 535 CB VAL A 35 20.095 -0.641 -3.150 1.00 0.59 C ATOM 536 CG1 VAL A 35 21.592 -0.507 -2.829 1.00 0.63 C ATOM 537 CG2 VAL A 35 19.822 -1.884 -4.006 1.00 0.64 C ATOM 0 H VAL A 35 19.935 1.336 -1.587 1.00 0.50 H new ATOM 0 HA VAL A 35 18.170 -0.815 -2.156 1.00 0.49 H new ATOM 0 HB VAL A 35 19.816 0.237 -3.733 1.00 0.59 H new ATOM 0 HG11 VAL A 35 22.166 -0.524 -3.756 1.00 0.63 H new ATOM 0 HG12 VAL A 35 21.770 0.435 -2.310 1.00 0.63 H new ATOM 0 HG13 VAL A 35 21.904 -1.336 -2.194 1.00 0.63 H new ATOM 0 HG21 VAL A 35 20.458 -1.863 -4.891 1.00 0.64 H new ATOM 0 HG22 VAL A 35 20.038 -2.781 -3.425 1.00 0.64 H new ATOM 0 HG23 VAL A 35 18.776 -1.893 -4.311 1.00 0.64 H new ATOM 547 N ASN A 36 20.506 -1.434 0.078 1.00 0.45 N ATOM 548 CA ASN A 36 20.986 -2.399 1.079 1.00 0.46 C ATOM 549 C ASN A 36 20.110 -2.356 2.353 1.00 0.44 C ATOM 550 O ASN A 36 19.951 -3.378 3.026 1.00 0.55 O ATOM 551 CB ASN A 36 22.465 -2.097 1.411 1.00 0.55 C ATOM 552 CG ASN A 36 23.147 -3.192 2.227 1.00 0.64 C ATOM 553 OD1 ASN A 36 23.707 -4.138 1.670 1.00 0.82 O ATOM 554 ND2 ASN A 36 23.115 -3.065 3.555 1.00 0.77 N ATOM 0 H ASN A 36 20.908 -0.502 0.178 1.00 0.45 H new ATOM 0 HA ASN A 36 20.912 -3.406 0.669 1.00 0.46 H new ATOM 0 HB2 ASN A 36 23.015 -1.954 0.481 1.00 0.55 H new ATOM 0 HB3 ASN A 36 22.520 -1.158 1.962 1.00 0.55 H new ATOM 0 HD21 ASN A 36 23.564 -3.765 4.145 1.00 0.77 H new ATOM 0 HD22 ASN A 36 22.641 -2.268 3.980 1.00 0.77 H new ATOM 561 N GLU A 37 19.541 -1.170 2.673 1.00 0.44 N ATOM 562 CA GLU A 37 18.677 -0.993 3.863 1.00 0.46 C ATOM 563 C GLU A 37 17.329 -1.719 3.721 1.00 0.41 C ATOM 564 O GLU A 37 16.811 -2.240 4.715 1.00 0.43 O ATOM 565 CB GLU A 37 18.444 0.502 4.145 1.00 0.55 C ATOM 566 CG GLU A 37 19.654 1.207 4.764 1.00 0.70 C ATOM 567 CD GLU A 37 19.416 2.683 5.070 1.00 0.83 C ATOM 568 OE1 GLU A 37 18.243 3.121 5.071 1.00 1.54 O ATOM 569 OE2 GLU A 37 20.409 3.404 5.309 1.00 1.25 O ATOM 0 H GLU A 37 19.665 -0.321 2.122 1.00 0.44 H new ATOM 0 HA GLU A 37 19.203 -1.442 4.706 1.00 0.46 H new ATOM 0 HB2 GLU A 37 18.181 1.002 3.213 1.00 0.55 H new ATOM 0 HB3 GLU A 37 17.591 0.608 4.815 1.00 0.55 H new ATOM 0 HG2 GLU A 37 19.929 0.694 5.686 1.00 0.70 H new ATOM 0 HG3 GLU A 37 20.502 1.118 4.084 1.00 0.70 H new ATOM 576 N PHE A 38 16.752 -1.745 2.496 1.00 0.40 N ATOM 577 CA PHE A 38 15.471 -2.445 2.259 1.00 0.39 C ATOM 578 C PHE A 38 15.687 -3.971 2.325 1.00 0.37 C ATOM 579 O PHE A 38 14.838 -4.696 2.846 1.00 0.40 O ATOM 580 CB PHE A 38 14.813 -2.003 0.912 1.00 0.43 C ATOM 581 CG PHE A 38 15.038 -2.922 -0.290 1.00 0.41 C ATOM 582 CD1 PHE A 38 14.297 -4.096 -0.438 1.00 0.50 C ATOM 583 CD2 PHE A 38 15.987 -2.613 -1.258 1.00 0.49 C ATOM 584 CE1 PHE A 38 14.504 -4.931 -1.519 1.00 0.61 C ATOM 585 CE2 PHE A 38 16.194 -3.449 -2.340 1.00 0.61 C ATOM 586 CZ PHE A 38 15.454 -4.609 -2.469 1.00 0.65 C ATOM 0 H PHE A 38 17.147 -1.296 1.670 1.00 0.40 H new ATOM 0 HA PHE A 38 14.771 -2.166 3.047 1.00 0.39 H new ATOM 0 HB2 PHE A 38 13.739 -1.907 1.072 1.00 0.43 H new ATOM 0 HB3 PHE A 38 15.187 -1.011 0.658 1.00 0.43 H new ATOM 0 HD1 PHE A 38 13.553 -4.354 0.301 1.00 0.50 H new ATOM 0 HD2 PHE A 38 16.570 -1.709 -1.164 1.00 0.49 H new ATOM 0 HE1 PHE A 38 13.923 -5.836 -1.621 1.00 0.61 H new ATOM 0 HE2 PHE A 38 16.934 -3.195 -3.084 1.00 0.61 H new ATOM 0 HZ PHE A 38 15.618 -5.264 -3.312 1.00 0.65 H new ATOM 596 N LYS A 39 16.839 -4.444 1.789 1.00 0.37 N ATOM 597 CA LYS A 39 17.191 -5.876 1.792 1.00 0.40 C ATOM 598 C LYS A 39 17.373 -6.391 3.232 1.00 0.38 C ATOM 599 O LYS A 39 16.955 -7.509 3.549 1.00 0.42 O ATOM 600 CB LYS A 39 18.469 -6.120 0.962 1.00 0.46 C ATOM 601 CG LYS A 39 18.704 -7.587 0.583 1.00 0.55 C ATOM 602 CD LYS A 39 19.938 -7.763 -0.305 1.00 0.64 C ATOM 603 CE LYS A 39 20.182 -9.231 -0.666 1.00 0.76 C ATOM 604 NZ LYS A 39 19.194 -9.748 -1.664 1.00 0.87 N ATOM 0 H LYS A 39 17.539 -3.847 1.349 1.00 0.37 H new ATOM 0 HA LYS A 39 16.372 -6.430 1.334 1.00 0.40 H new ATOM 0 HB2 LYS A 39 18.415 -5.525 0.050 1.00 0.46 H new ATOM 0 HB3 LYS A 39 19.329 -5.760 1.527 1.00 0.46 H new ATOM 0 HG2 LYS A 39 18.823 -8.180 1.490 1.00 0.55 H new ATOM 0 HG3 LYS A 39 17.826 -7.972 0.063 1.00 0.55 H new ATOM 0 HD2 LYS A 39 19.813 -7.181 -1.218 1.00 0.64 H new ATOM 0 HD3 LYS A 39 20.814 -7.366 0.209 1.00 0.64 H new ATOM 0 HE2 LYS A 39 21.190 -9.340 -1.067 1.00 0.76 H new ATOM 0 HE3 LYS A 39 20.131 -9.837 0.238 1.00 0.76 H new ATOM 0 HZ1 LYS A 39 19.402 -10.745 -1.874 1.00 0.87 H new ATOM 0 HZ2 LYS A 39 18.233 -9.670 -1.274 1.00 0.87 H new ATOM 0 HZ3 LYS A 39 19.259 -9.189 -2.538 1.00 0.87 H new ATOM 618 N GLU A 40 18.004 -5.562 4.097 1.00 0.38 N ATOM 619 CA GLU A 40 18.214 -5.906 5.519 1.00 0.40 C ATOM 620 C GLU A 40 16.874 -5.909 6.284 1.00 0.40 C ATOM 621 O GLU A 40 16.707 -6.676 7.233 1.00 0.44 O ATOM 622 CB GLU A 40 19.208 -4.927 6.184 1.00 0.45 C ATOM 623 CG GLU A 40 20.661 -5.130 5.757 1.00 0.49 C ATOM 624 CD GLU A 40 21.626 -4.211 6.486 1.00 0.59 C ATOM 625 OE1 GLU A 40 21.655 -3.003 6.165 1.00 0.64 O ATOM 626 OE2 GLU A 40 22.351 -4.699 7.378 1.00 0.73 O ATOM 0 H GLU A 40 18.376 -4.650 3.832 1.00 0.38 H new ATOM 0 HA GLU A 40 18.640 -6.908 5.561 1.00 0.40 H new ATOM 0 HB2 GLU A 40 18.910 -3.906 5.947 1.00 0.45 H new ATOM 0 HB3 GLU A 40 19.140 -5.036 7.266 1.00 0.45 H new ATOM 0 HG2 GLU A 40 20.946 -6.166 5.939 1.00 0.49 H new ATOM 0 HG3 GLU A 40 20.746 -4.960 4.684 1.00 0.49 H new ATOM 633 N LEU A 41 15.925 -5.041 5.858 1.00 0.39 N ATOM 634 CA LEU A 41 14.584 -4.954 6.477 1.00 0.41 C ATOM 635 C LEU A 41 13.731 -6.204 6.165 1.00 0.40 C ATOM 636 O LEU A 41 12.899 -6.602 6.984 1.00 0.44 O ATOM 637 CB LEU A 41 13.855 -3.678 5.988 1.00 0.44 C ATOM 638 CG LEU A 41 12.588 -3.251 6.775 1.00 0.55 C ATOM 639 CD1 LEU A 41 12.909 -3.001 8.254 1.00 0.65 C ATOM 640 CD2 LEU A 41 11.951 -2.009 6.136 1.00 0.58 C ATOM 0 H LEU A 41 16.066 -4.390 5.086 1.00 0.39 H new ATOM 0 HA LEU A 41 14.718 -4.903 7.558 1.00 0.41 H new ATOM 0 HB2 LEU A 41 14.565 -2.851 6.012 1.00 0.44 H new ATOM 0 HB3 LEU A 41 13.573 -3.826 4.945 1.00 0.44 H new ATOM 0 HG LEU A 41 11.870 -4.070 6.727 1.00 0.55 H new ATOM 0 HD11 LEU A 41 12.001 -2.703 8.778 1.00 0.65 H new ATOM 0 HD12 LEU A 41 13.303 -3.914 8.700 1.00 0.65 H new ATOM 0 HD13 LEU A 41 13.652 -2.207 8.336 1.00 0.65 H new ATOM 0 HD21 LEU A 41 11.064 -1.724 6.701 1.00 0.58 H new ATOM 0 HD22 LEU A 41 12.667 -1.187 6.145 1.00 0.58 H new ATOM 0 HD23 LEU A 41 11.669 -2.233 5.107 1.00 0.58 H new ATOM 652 N VAL A 42 13.942 -6.802 4.972 1.00 0.36 N ATOM 653 CA VAL A 42 13.209 -8.008 4.531 1.00 0.37 C ATOM 654 C VAL A 42 13.841 -9.296 5.109 1.00 0.38 C ATOM 655 O VAL A 42 13.141 -10.299 5.272 1.00 0.41 O ATOM 656 CB VAL A 42 13.139 -8.088 2.961 1.00 0.40 C ATOM 657 CG1 VAL A 42 12.507 -9.403 2.463 1.00 0.45 C ATOM 658 CG2 VAL A 42 12.379 -6.878 2.396 1.00 0.41 C ATOM 0 H VAL A 42 14.622 -6.464 4.291 1.00 0.36 H new ATOM 0 HA VAL A 42 12.192 -7.928 4.916 1.00 0.37 H new ATOM 0 HB VAL A 42 14.165 -8.071 2.595 1.00 0.40 H new ATOM 0 HG11 VAL A 42 12.483 -9.406 1.373 1.00 0.45 H new ATOM 0 HG12 VAL A 42 13.099 -10.248 2.815 1.00 0.45 H new ATOM 0 HG13 VAL A 42 11.491 -9.487 2.848 1.00 0.45 H new ATOM 0 HG21 VAL A 42 12.339 -6.948 1.309 1.00 0.41 H new ATOM 0 HG22 VAL A 42 11.365 -6.866 2.796 1.00 0.41 H new ATOM 0 HG23 VAL A 42 12.893 -5.960 2.682 1.00 0.41 H new ATOM 668 N THR A 43 15.154 -9.265 5.422 1.00 0.39 N ATOM 669 CA THR A 43 15.861 -10.436 5.973 1.00 0.42 C ATOM 670 C THR A 43 16.182 -10.258 7.485 1.00 0.49 C ATOM 671 O THR A 43 17.201 -10.768 7.969 1.00 0.80 O ATOM 672 CB THR A 43 17.177 -10.706 5.166 1.00 0.45 C ATOM 673 OG1 THR A 43 16.982 -10.397 3.773 1.00 0.46 O ATOM 674 CG2 THR A 43 17.643 -12.160 5.289 1.00 0.50 C ATOM 0 H THR A 43 15.744 -8.441 5.302 1.00 0.39 H new ATOM 0 HA THR A 43 15.199 -11.296 5.876 1.00 0.42 H new ATOM 0 HB THR A 43 17.946 -10.062 5.592 1.00 0.45 H new ATOM 0 HG1 THR A 43 16.981 -9.425 3.651 1.00 0.46 H new ATOM 0 HG21 THR A 43 18.558 -12.299 4.713 1.00 0.50 H new ATOM 0 HG22 THR A 43 17.834 -12.393 6.336 1.00 0.50 H new ATOM 0 HG23 THR A 43 16.869 -12.824 4.905 1.00 0.50 H new ATOM 682 N GLN A 44 15.302 -9.552 8.240 1.00 0.41 N ATOM 683 CA GLN A 44 15.519 -9.328 9.690 1.00 0.44 C ATOM 684 C GLN A 44 14.202 -9.012 10.433 1.00 0.44 C ATOM 685 O GLN A 44 13.841 -9.731 11.369 1.00 0.50 O ATOM 686 CB GLN A 44 16.555 -8.198 9.920 1.00 0.48 C ATOM 687 CG GLN A 44 17.193 -8.196 11.315 1.00 0.65 C ATOM 688 CD GLN A 44 18.223 -7.083 11.498 1.00 0.77 C ATOM 689 OE1 GLN A 44 19.405 -7.273 11.206 1.00 1.02 O ATOM 690 NE2 GLN A 44 17.792 -5.917 11.988 1.00 1.10 N ATOM 0 H GLN A 44 14.447 -9.134 7.874 1.00 0.41 H new ATOM 0 HA GLN A 44 15.911 -10.257 10.104 1.00 0.44 H new ATOM 0 HB2 GLN A 44 17.344 -8.288 9.173 1.00 0.48 H new ATOM 0 HB3 GLN A 44 16.068 -7.237 9.755 1.00 0.48 H new ATOM 0 HG2 GLN A 44 16.411 -8.087 12.066 1.00 0.65 H new ATOM 0 HG3 GLN A 44 17.672 -9.159 11.491 1.00 0.65 H new ATOM 0 HE21 GLN A 44 16.806 -5.794 12.219 1.00 1.10 H new ATOM 0 HE22 GLN A 44 18.449 -5.150 12.131 1.00 1.10 H new ATOM 699 N GLN A 45 13.499 -7.933 10.020 1.00 0.41 N ATOM 700 CA GLN A 45 12.231 -7.515 10.661 1.00 0.43 C ATOM 701 C GLN A 45 10.987 -7.878 9.810 1.00 0.41 C ATOM 702 O GLN A 45 9.862 -7.811 10.316 1.00 0.45 O ATOM 703 CB GLN A 45 12.275 -5.995 10.956 1.00 0.47 C ATOM 704 CG GLN A 45 11.268 -5.518 12.014 1.00 0.59 C ATOM 705 CD GLN A 45 11.565 -4.113 12.549 1.00 0.64 C ATOM 706 OE1 GLN A 45 12.074 -3.251 11.826 1.00 0.65 O ATOM 707 NE2 GLN A 45 11.260 -3.872 13.826 1.00 0.84 N ATOM 0 H GLN A 45 13.788 -7.336 9.245 1.00 0.41 H new ATOM 0 HA GLN A 45 12.134 -8.065 11.597 1.00 0.43 H new ATOM 0 HB2 GLN A 45 13.280 -5.731 11.285 1.00 0.47 H new ATOM 0 HB3 GLN A 45 12.091 -5.453 10.028 1.00 0.47 H new ATOM 0 HG2 GLN A 45 10.267 -5.530 11.583 1.00 0.59 H new ATOM 0 HG3 GLN A 45 11.266 -6.222 12.846 1.00 0.59 H new ATOM 0 HE21 GLN A 45 10.840 -4.605 14.397 1.00 0.84 H new ATOM 0 HE22 GLN A 45 11.447 -2.954 14.231 1.00 0.84 H new ATOM 716 N LEU A 46 11.187 -8.268 8.525 1.00 0.40 N ATOM 717 CA LEU A 46 10.075 -8.636 7.623 1.00 0.40 C ATOM 718 C LEU A 46 10.380 -9.930 6.794 1.00 0.40 C ATOM 719 O LEU A 46 10.107 -9.962 5.587 1.00 0.42 O ATOM 720 CB LEU A 46 9.783 -7.431 6.690 1.00 0.41 C ATOM 721 CG LEU A 46 8.421 -7.455 5.945 1.00 0.40 C ATOM 722 CD1 LEU A 46 7.500 -6.337 6.443 1.00 0.59 C ATOM 723 CD2 LEU A 46 8.620 -7.358 4.425 1.00 0.67 C ATOM 0 H LEU A 46 12.109 -8.334 8.094 1.00 0.40 H new ATOM 0 HA LEU A 46 9.197 -8.867 8.225 1.00 0.40 H new ATOM 0 HB2 LEU A 46 9.833 -6.518 7.284 1.00 0.41 H new ATOM 0 HB3 LEU A 46 10.579 -7.372 5.947 1.00 0.41 H new ATOM 0 HG LEU A 46 7.942 -8.410 6.163 1.00 0.40 H new ATOM 0 HD11 LEU A 46 6.554 -6.378 5.904 1.00 0.59 H new ATOM 0 HD12 LEU A 46 7.316 -6.465 7.510 1.00 0.59 H new ATOM 0 HD13 LEU A 46 7.974 -5.371 6.270 1.00 0.59 H new ATOM 0 HD21 LEU A 46 7.650 -7.377 3.929 1.00 0.67 H new ATOM 0 HD22 LEU A 46 9.132 -6.427 4.184 1.00 0.67 H new ATOM 0 HD23 LEU A 46 9.219 -8.201 4.082 1.00 0.67 H new ATOM 735 N PRO A 47 10.936 -11.033 7.414 1.00 0.42 N ATOM 736 CA PRO A 47 11.243 -12.291 6.685 1.00 0.45 C ATOM 737 C PRO A 47 10.037 -13.247 6.512 1.00 0.47 C ATOM 738 O PRO A 47 9.996 -14.010 5.541 1.00 0.52 O ATOM 739 CB PRO A 47 12.317 -12.926 7.574 1.00 0.49 C ATOM 740 CG PRO A 47 11.936 -12.526 8.957 1.00 0.49 C ATOM 741 CD PRO A 47 11.338 -11.145 8.846 1.00 0.46 C ATOM 0 HA PRO A 47 11.548 -12.093 5.657 1.00 0.45 H new ATOM 0 HB2 PRO A 47 12.334 -14.010 7.464 1.00 0.49 H new ATOM 0 HB3 PRO A 47 13.312 -12.564 7.315 1.00 0.49 H new ATOM 0 HG2 PRO A 47 11.218 -13.228 9.382 1.00 0.49 H new ATOM 0 HG3 PRO A 47 12.805 -12.522 9.615 1.00 0.49 H new ATOM 0 HD2 PRO A 47 10.482 -11.027 9.510 1.00 0.46 H new ATOM 0 HD3 PRO A 47 12.060 -10.375 9.118 1.00 0.46 H new ATOM 749 N HIS A 48 9.065 -13.210 7.452 1.00 0.47 N ATOM 750 CA HIS A 48 7.877 -14.094 7.395 1.00 0.52 C ATOM 751 C HIS A 48 6.848 -13.629 6.353 1.00 0.50 C ATOM 752 O HIS A 48 6.099 -14.457 5.824 1.00 0.57 O ATOM 753 CB HIS A 48 7.202 -14.202 8.777 1.00 0.57 C ATOM 754 CG HIS A 48 8.094 -14.785 9.841 1.00 0.65 C ATOM 755 ND1 HIS A 48 8.983 -14.027 10.573 1.00 0.69 N ATOM 756 CD2 HIS A 48 8.250 -16.062 10.264 1.00 0.79 C ATOM 757 CE1 HIS A 48 9.654 -14.813 11.396 1.00 0.80 C ATOM 758 NE2 HIS A 48 9.226 -16.051 11.233 1.00 0.85 N ATOM 0 H HIS A 48 9.079 -12.581 8.255 1.00 0.47 H new ATOM 0 HA HIS A 48 8.239 -15.076 7.091 1.00 0.52 H new ATOM 0 HB2 HIS A 48 6.876 -13.210 9.091 1.00 0.57 H new ATOM 0 HB3 HIS A 48 6.307 -14.818 8.688 1.00 0.57 H new ATOM 0 HD2 HIS A 48 7.710 -16.926 9.907 1.00 0.79 H new ATOM 0 HE1 HIS A 48 10.423 -14.496 12.085 1.00 0.80 H new ATOM 0 HE2 HIS A 48 9.564 -16.867 11.743 1.00 0.85 H new ATOM 767 N LEU A 49 6.808 -12.311 6.057 1.00 0.46 N ATOM 768 CA LEU A 49 5.855 -11.762 5.077 1.00 0.46 C ATOM 769 C LEU A 49 6.239 -12.164 3.645 1.00 0.45 C ATOM 770 O LEU A 49 5.471 -12.862 2.974 1.00 0.53 O ATOM 771 CB LEU A 49 5.750 -10.223 5.215 1.00 0.47 C ATOM 772 CG LEU A 49 4.722 -9.509 4.307 1.00 0.50 C ATOM 773 CD1 LEU A 49 3.322 -10.093 4.486 1.00 0.87 C ATOM 774 CD2 LEU A 49 4.712 -8.004 4.589 1.00 0.53 C ATOM 0 H LEU A 49 7.421 -11.615 6.481 1.00 0.46 H new ATOM 0 HA LEU A 49 4.874 -12.187 5.287 1.00 0.46 H new ATOM 0 HB2 LEU A 49 5.506 -9.991 6.252 1.00 0.47 H new ATOM 0 HB3 LEU A 49 6.733 -9.796 5.016 1.00 0.47 H new ATOM 0 HG LEU A 49 5.023 -9.671 3.272 1.00 0.50 H new ATOM 0 HD11 LEU A 49 2.623 -9.569 3.834 1.00 0.87 H new ATOM 0 HD12 LEU A 49 3.334 -11.152 4.229 1.00 0.87 H new ATOM 0 HD13 LEU A 49 3.008 -9.975 5.523 1.00 0.87 H new ATOM 0 HD21 LEU A 49 3.983 -7.517 3.941 1.00 0.53 H new ATOM 0 HD22 LEU A 49 4.444 -7.831 5.631 1.00 0.53 H new ATOM 0 HD23 LEU A 49 5.702 -7.591 4.396 1.00 0.53 H new ATOM 786 N LEU A 50 7.425 -11.718 3.184 1.00 0.43 N ATOM 787 CA LEU A 50 7.914 -12.056 1.841 1.00 0.45 C ATOM 788 C LEU A 50 8.636 -13.407 1.900 1.00 0.48 C ATOM 789 O LEU A 50 9.708 -13.515 2.508 1.00 0.54 O ATOM 790 CB LEU A 50 8.851 -10.949 1.292 1.00 0.48 C ATOM 791 CG LEU A 50 8.269 -9.512 1.261 1.00 0.57 C ATOM 792 CD1 LEU A 50 9.310 -8.514 0.756 1.00 0.66 C ATOM 793 CD2 LEU A 50 7.007 -9.432 0.401 1.00 0.73 C ATOM 0 H LEU A 50 8.056 -11.125 3.723 1.00 0.43 H new ATOM 0 HA LEU A 50 7.068 -12.127 1.158 1.00 0.45 H new ATOM 0 HB2 LEU A 50 9.759 -10.938 1.896 1.00 0.48 H new ATOM 0 HB3 LEU A 50 9.146 -11.221 0.278 1.00 0.48 H new ATOM 0 HG LEU A 50 7.998 -9.253 2.284 1.00 0.57 H new ATOM 0 HD11 LEU A 50 8.878 -7.513 0.743 1.00 0.66 H new ATOM 0 HD12 LEU A 50 10.177 -8.527 1.417 1.00 0.66 H new ATOM 0 HD13 LEU A 50 9.618 -8.789 -0.253 1.00 0.66 H new ATOM 0 HD21 LEU A 50 6.629 -8.410 0.404 1.00 0.73 H new ATOM 0 HD22 LEU A 50 7.244 -9.728 -0.621 1.00 0.73 H new ATOM 0 HD23 LEU A 50 6.248 -10.101 0.806 1.00 0.73 H new ATOM 805 N LYS A 51 8.030 -14.445 1.280 1.00 0.55 N ATOM 806 CA LYS A 51 8.599 -15.810 1.288 1.00 0.66 C ATOM 807 C LYS A 51 10.010 -15.868 0.661 1.00 0.63 C ATOM 808 O LYS A 51 10.833 -16.688 1.079 1.00 0.76 O ATOM 809 CB LYS A 51 7.627 -16.833 0.635 1.00 0.78 C ATOM 810 CG LYS A 51 7.649 -16.949 -0.900 1.00 0.78 C ATOM 811 CD LYS A 51 7.053 -15.728 -1.609 1.00 1.18 C ATOM 812 CE LYS A 51 6.900 -15.966 -3.113 1.00 1.16 C ATOM 813 NZ LYS A 51 5.709 -16.811 -3.439 1.00 1.32 N ATOM 0 H LYS A 51 7.150 -14.363 0.770 1.00 0.55 H new ATOM 0 HA LYS A 51 8.721 -16.096 2.333 1.00 0.66 H new ATOM 0 HB2 LYS A 51 7.844 -17.817 1.051 1.00 0.78 H new ATOM 0 HB3 LYS A 51 6.612 -16.575 0.939 1.00 0.78 H new ATOM 0 HG2 LYS A 51 8.678 -17.087 -1.232 1.00 0.78 H new ATOM 0 HG3 LYS A 51 7.096 -17.840 -1.198 1.00 0.78 H new ATOM 0 HD2 LYS A 51 6.080 -15.495 -1.177 1.00 1.18 H new ATOM 0 HD3 LYS A 51 7.692 -14.861 -1.441 1.00 1.18 H new ATOM 0 HE2 LYS A 51 6.812 -15.007 -3.623 1.00 1.16 H new ATOM 0 HE3 LYS A 51 7.800 -16.448 -3.495 1.00 1.16 H new ATOM 0 HZ1 LYS A 51 5.560 -16.818 -4.468 1.00 1.32 H new ATOM 0 HZ2 LYS A 51 5.871 -17.783 -3.106 1.00 1.32 H new ATOM 0 HZ3 LYS A 51 4.867 -16.420 -2.970 1.00 1.32 H new ATOM 827 N ASP A 52 10.278 -14.997 -0.335 1.00 0.64 N ATOM 828 CA ASP A 52 11.590 -14.933 -0.991 1.00 0.71 C ATOM 829 C ASP A 52 12.491 -13.924 -0.244 1.00 0.59 C ATOM 830 O ASP A 52 12.453 -12.720 -0.520 1.00 0.73 O ATOM 831 CB ASP A 52 11.431 -14.551 -2.483 1.00 0.99 C ATOM 832 CG ASP A 52 12.541 -15.108 -3.371 1.00 1.46 C ATOM 833 OD1 ASP A 52 13.716 -15.093 -2.944 1.00 2.02 O ATOM 834 OD2 ASP A 52 12.230 -15.554 -4.495 1.00 2.08 O ATOM 0 H ASP A 52 9.598 -14.330 -0.699 1.00 0.64 H new ATOM 0 HA ASP A 52 12.064 -15.914 -0.953 1.00 0.71 H new ATOM 0 HB2 ASP A 52 10.469 -14.916 -2.844 1.00 0.99 H new ATOM 0 HB3 ASP A 52 11.414 -13.465 -2.573 1.00 0.99 H new ATOM 839 N VAL A 53 13.272 -14.432 0.729 1.00 0.51 N ATOM 840 CA VAL A 53 14.182 -13.590 1.538 1.00 0.52 C ATOM 841 C VAL A 53 15.590 -13.447 0.908 1.00 0.56 C ATOM 842 O VAL A 53 16.323 -12.523 1.272 1.00 0.71 O ATOM 843 CB VAL A 53 14.323 -14.114 3.015 1.00 0.59 C ATOM 844 CG1 VAL A 53 13.007 -13.943 3.781 1.00 0.65 C ATOM 845 CG2 VAL A 53 14.806 -15.578 3.077 1.00 0.64 C ATOM 0 H VAL A 53 13.293 -15.421 0.976 1.00 0.51 H new ATOM 0 HA VAL A 53 13.715 -12.605 1.556 1.00 0.52 H new ATOM 0 HB VAL A 53 15.089 -13.506 3.496 1.00 0.59 H new ATOM 0 HG11 VAL A 53 13.128 -14.312 4.799 1.00 0.65 H new ATOM 0 HG12 VAL A 53 12.736 -12.888 3.807 1.00 0.65 H new ATOM 0 HG13 VAL A 53 12.219 -14.508 3.282 1.00 0.65 H new ATOM 0 HG21 VAL A 53 14.887 -15.891 4.118 1.00 0.64 H new ATOM 0 HG22 VAL A 53 14.092 -16.219 2.560 1.00 0.64 H new ATOM 0 HG23 VAL A 53 15.781 -15.660 2.597 1.00 0.64 H new ATOM 855 N GLY A 54 15.958 -14.348 -0.035 1.00 0.53 N ATOM 856 CA GLY A 54 17.277 -14.301 -0.673 1.00 0.64 C ATOM 857 C GLY A 54 17.257 -13.703 -2.075 1.00 0.61 C ATOM 858 O GLY A 54 17.910 -12.682 -2.323 1.00 0.83 O ATOM 0 H GLY A 54 15.359 -15.106 -0.362 1.00 0.53 H new ATOM 0 HA2 GLY A 54 17.953 -13.717 -0.048 1.00 0.64 H new ATOM 0 HA3 GLY A 54 17.683 -15.311 -0.724 1.00 0.64 H new ATOM 862 N SER A 55 16.502 -14.336 -2.993 1.00 0.57 N ATOM 863 CA SER A 55 16.414 -13.880 -4.392 1.00 0.58 C ATOM 864 C SER A 55 15.371 -12.754 -4.568 1.00 0.51 C ATOM 865 O SER A 55 14.196 -13.021 -4.848 1.00 0.62 O ATOM 866 CB SER A 55 16.103 -15.071 -5.325 1.00 0.74 C ATOM 867 OG SER A 55 16.153 -14.687 -6.691 1.00 0.85 O ATOM 0 H SER A 55 15.944 -15.165 -2.790 1.00 0.57 H new ATOM 0 HA SER A 55 17.383 -13.463 -4.666 1.00 0.58 H new ATOM 0 HB2 SER A 55 16.819 -15.873 -5.145 1.00 0.74 H new ATOM 0 HB3 SER A 55 15.115 -15.468 -5.093 1.00 0.74 H new ATOM 0 HG SER A 55 16.713 -13.889 -6.786 1.00 0.85 H new ATOM 873 N LEU A 56 15.817 -11.488 -4.396 1.00 0.49 N ATOM 874 CA LEU A 56 14.941 -10.303 -4.547 1.00 0.53 C ATOM 875 C LEU A 56 15.234 -9.549 -5.867 1.00 0.58 C ATOM 876 O LEU A 56 14.996 -8.341 -5.955 1.00 1.03 O ATOM 877 CB LEU A 56 15.096 -9.338 -3.332 1.00 0.67 C ATOM 878 CG LEU A 56 14.416 -9.751 -1.999 1.00 0.83 C ATOM 879 CD1 LEU A 56 12.909 -9.979 -2.174 1.00 1.22 C ATOM 880 CD2 LEU A 56 15.095 -10.977 -1.386 1.00 1.21 C ATOM 0 H LEU A 56 16.781 -11.261 -4.152 1.00 0.49 H new ATOM 0 HA LEU A 56 13.912 -10.661 -4.580 1.00 0.53 H new ATOM 0 HB2 LEU A 56 16.161 -9.207 -3.140 1.00 0.67 H new ATOM 0 HB3 LEU A 56 14.702 -8.364 -3.623 1.00 0.67 H new ATOM 0 HG LEU A 56 14.538 -8.920 -1.304 1.00 0.83 H new ATOM 0 HD11 LEU A 56 12.471 -10.266 -1.218 1.00 1.22 H new ATOM 0 HD12 LEU A 56 12.440 -9.060 -2.526 1.00 1.22 H new ATOM 0 HD13 LEU A 56 12.743 -10.773 -2.902 1.00 1.22 H new ATOM 0 HD21 LEU A 56 14.596 -11.241 -0.454 1.00 1.21 H new ATOM 0 HD22 LEU A 56 15.031 -11.814 -2.081 1.00 1.21 H new ATOM 0 HD23 LEU A 56 16.142 -10.751 -1.185 1.00 1.21 H new ATOM 892 N ASP A 57 15.724 -10.263 -6.907 1.00 0.49 N ATOM 893 CA ASP A 57 16.025 -9.633 -8.214 1.00 0.53 C ATOM 894 C ASP A 57 14.730 -9.239 -8.967 1.00 0.47 C ATOM 895 O ASP A 57 14.747 -8.310 -9.778 1.00 0.50 O ATOM 896 CB ASP A 57 16.931 -10.533 -9.098 1.00 0.67 C ATOM 897 CG ASP A 57 16.397 -11.944 -9.316 1.00 0.70 C ATOM 898 OD1 ASP A 57 15.374 -12.090 -10.018 1.00 0.77 O ATOM 899 OD2 ASP A 57 17.007 -12.899 -8.789 1.00 0.77 O ATOM 0 H ASP A 57 15.918 -11.264 -6.868 1.00 0.49 H new ATOM 0 HA ASP A 57 16.580 -8.719 -8.003 1.00 0.53 H new ATOM 0 HB2 ASP A 57 17.063 -10.054 -10.068 1.00 0.67 H new ATOM 0 HB3 ASP A 57 17.917 -10.598 -8.638 1.00 0.67 H new ATOM 904 N GLU A 58 13.611 -9.946 -8.683 1.00 0.46 N ATOM 905 CA GLU A 58 12.303 -9.658 -9.310 1.00 0.51 C ATOM 906 C GLU A 58 11.706 -8.332 -8.783 1.00 0.47 C ATOM 907 O GLU A 58 11.071 -7.594 -9.544 1.00 0.56 O ATOM 908 CB GLU A 58 11.324 -10.830 -9.058 1.00 0.60 C ATOM 909 CG GLU A 58 10.033 -10.780 -9.877 1.00 0.79 C ATOM 910 CD GLU A 58 9.127 -11.975 -9.614 1.00 0.92 C ATOM 911 OE1 GLU A 58 9.324 -13.023 -10.264 1.00 1.09 O ATOM 912 OE2 GLU A 58 8.227 -11.861 -8.754 1.00 1.02 O ATOM 0 H GLU A 58 13.590 -10.722 -8.021 1.00 0.46 H new ATOM 0 HA GLU A 58 12.458 -9.548 -10.383 1.00 0.51 H new ATOM 0 HB2 GLU A 58 11.838 -11.766 -9.275 1.00 0.60 H new ATOM 0 HB3 GLU A 58 11.065 -10.846 -7.999 1.00 0.60 H new ATOM 0 HG2 GLU A 58 9.494 -9.862 -9.644 1.00 0.79 H new ATOM 0 HG3 GLU A 58 10.281 -10.743 -10.938 1.00 0.79 H new ATOM 919 N LYS A 59 11.918 -8.036 -7.482 1.00 0.42 N ATOM 920 CA LYS A 59 11.399 -6.803 -6.854 1.00 0.47 C ATOM 921 C LYS A 59 12.438 -5.659 -6.861 1.00 0.53 C ATOM 922 O LYS A 59 12.050 -4.496 -6.765 1.00 0.91 O ATOM 923 CB LYS A 59 10.924 -7.079 -5.409 1.00 0.52 C ATOM 924 CG LYS A 59 9.576 -7.810 -5.299 1.00 0.60 C ATOM 925 CD LYS A 59 9.661 -9.283 -5.722 1.00 0.81 C ATOM 926 CE LYS A 59 8.347 -10.029 -5.499 1.00 1.17 C ATOM 927 NZ LYS A 59 8.499 -11.501 -5.689 1.00 1.55 N ATOM 0 H LYS A 59 12.445 -8.635 -6.847 1.00 0.42 H new ATOM 0 HA LYS A 59 10.548 -6.479 -7.454 1.00 0.47 H new ATOM 0 HB2 LYS A 59 11.684 -7.671 -4.899 1.00 0.52 H new ATOM 0 HB3 LYS A 59 10.850 -6.130 -4.879 1.00 0.52 H new ATOM 0 HG2 LYS A 59 9.220 -7.752 -4.271 1.00 0.60 H new ATOM 0 HG3 LYS A 59 8.840 -7.300 -5.921 1.00 0.60 H new ATOM 0 HD2 LYS A 59 9.934 -9.341 -6.776 1.00 0.81 H new ATOM 0 HD3 LYS A 59 10.455 -9.775 -5.160 1.00 0.81 H new ATOM 0 HE2 LYS A 59 7.984 -9.829 -4.491 1.00 1.17 H new ATOM 0 HE3 LYS A 59 7.594 -9.650 -6.190 1.00 1.17 H new ATOM 0 HZ1 LYS A 59 7.765 -11.999 -5.146 1.00 1.55 H new ATOM 0 HZ2 LYS A 59 8.400 -11.733 -6.698 1.00 1.55 H new ATOM 0 HZ3 LYS A 59 9.438 -11.799 -5.356 1.00 1.55 H new ATOM 941 N MET A 60 13.753 -5.983 -6.962 1.00 0.39 N ATOM 942 CA MET A 60 14.825 -4.954 -6.989 1.00 0.41 C ATOM 943 C MET A 60 14.714 -4.086 -8.260 1.00 0.42 C ATOM 944 O MET A 60 14.856 -2.861 -8.191 1.00 0.46 O ATOM 945 CB MET A 60 16.220 -5.616 -6.899 1.00 0.45 C ATOM 946 CG MET A 60 17.376 -4.644 -6.654 1.00 0.53 C ATOM 947 SD MET A 60 18.997 -5.447 -6.685 1.00 0.66 S ATOM 948 CE MET A 60 19.272 -5.616 -8.448 1.00 0.84 C ATOM 0 H MET A 60 14.095 -6.942 -7.026 1.00 0.39 H new ATOM 0 HA MET A 60 14.699 -4.306 -6.121 1.00 0.41 H new ATOM 0 HB2 MET A 60 16.206 -6.352 -6.095 1.00 0.45 H new ATOM 0 HB3 MET A 60 16.410 -6.158 -7.825 1.00 0.45 H new ATOM 0 HG2 MET A 60 17.351 -3.860 -7.411 1.00 0.53 H new ATOM 0 HG3 MET A 60 17.236 -4.158 -5.688 1.00 0.53 H new ATOM 0 HE1 MET A 60 19.680 -6.604 -8.659 1.00 0.84 H new ATOM 0 HE2 MET A 60 18.327 -5.493 -8.977 1.00 0.84 H new ATOM 0 HE3 MET A 60 19.976 -4.854 -8.781 1.00 0.84 H new ATOM 958 N LYS A 61 14.460 -4.738 -9.416 1.00 0.44 N ATOM 959 CA LYS A 61 14.295 -4.032 -10.703 1.00 0.49 C ATOM 960 C LYS A 61 12.977 -3.230 -10.711 1.00 0.46 C ATOM 961 O LYS A 61 12.914 -2.144 -11.298 1.00 0.49 O ATOM 962 CB LYS A 61 14.331 -5.031 -11.884 1.00 0.59 C ATOM 963 CG LYS A 61 15.720 -5.624 -12.175 1.00 0.70 C ATOM 964 CD LYS A 61 16.723 -4.606 -12.758 1.00 1.11 C ATOM 965 CE LYS A 61 16.316 -4.063 -14.139 1.00 1.90 C ATOM 966 NZ LYS A 61 16.340 -5.110 -15.209 1.00 2.56 N ATOM 0 H LYS A 61 14.365 -5.751 -9.483 1.00 0.44 H new ATOM 0 HA LYS A 61 15.125 -3.335 -10.822 1.00 0.49 H new ATOM 0 HB2 LYS A 61 13.638 -5.846 -11.675 1.00 0.59 H new ATOM 0 HB3 LYS A 61 13.970 -4.527 -12.781 1.00 0.59 H new ATOM 0 HG2 LYS A 61 16.129 -6.036 -11.252 1.00 0.70 H new ATOM 0 HG3 LYS A 61 15.611 -6.454 -12.874 1.00 0.70 H new ATOM 0 HD2 LYS A 61 16.826 -3.771 -12.064 1.00 1.11 H new ATOM 0 HD3 LYS A 61 17.703 -5.078 -12.836 1.00 1.11 H new ATOM 0 HE2 LYS A 61 15.314 -3.639 -14.076 1.00 1.90 H new ATOM 0 HE3 LYS A 61 16.989 -3.252 -14.417 1.00 1.90 H new ATOM 0 HZ1 LYS A 61 16.057 -4.686 -16.116 1.00 2.56 H new ATOM 0 HZ2 LYS A 61 17.301 -5.498 -15.293 1.00 2.56 H new ATOM 0 HZ3 LYS A 61 15.678 -5.874 -14.962 1.00 2.56 H new ATOM 980 N SER A 62 11.929 -3.780 -10.052 1.00 0.44 N ATOM 981 CA SER A 62 10.620 -3.108 -9.930 1.00 0.46 C ATOM 982 C SER A 62 10.727 -1.876 -9.008 1.00 0.43 C ATOM 983 O SER A 62 10.078 -0.854 -9.254 1.00 0.47 O ATOM 984 CB SER A 62 9.557 -4.080 -9.385 1.00 0.53 C ATOM 985 OG SER A 62 9.393 -5.190 -10.253 1.00 0.61 O ATOM 0 H SER A 62 11.969 -4.692 -9.596 1.00 0.44 H new ATOM 0 HA SER A 62 10.316 -2.779 -10.924 1.00 0.46 H new ATOM 0 HB2 SER A 62 9.851 -4.428 -8.395 1.00 0.53 H new ATOM 0 HB3 SER A 62 8.606 -3.559 -9.271 1.00 0.53 H new ATOM 0 HG SER A 62 9.970 -5.925 -9.957 1.00 0.61 H new ATOM 991 N LEU A 63 11.563 -1.987 -7.948 1.00 0.40 N ATOM 992 CA LEU A 63 11.798 -0.894 -6.988 1.00 0.43 C ATOM 993 C LEU A 63 12.524 0.281 -7.668 1.00 0.45 C ATOM 994 O LEU A 63 11.976 1.381 -7.759 1.00 0.53 O ATOM 995 CB LEU A 63 12.631 -1.402 -5.783 1.00 0.45 C ATOM 996 CG LEU A 63 11.865 -2.211 -4.711 1.00 0.42 C ATOM 997 CD1 LEU A 63 12.823 -3.072 -3.887 1.00 0.48 C ATOM 998 CD2 LEU A 63 11.069 -1.284 -3.795 1.00 0.68 C ATOM 0 H LEU A 63 12.089 -2.835 -7.739 1.00 0.40 H new ATOM 0 HA LEU A 63 10.830 -0.545 -6.628 1.00 0.43 H new ATOM 0 HB2 LEU A 63 13.441 -2.023 -6.165 1.00 0.45 H new ATOM 0 HB3 LEU A 63 13.090 -0.541 -5.298 1.00 0.45 H new ATOM 0 HG LEU A 63 11.167 -2.870 -5.228 1.00 0.42 H new ATOM 0 HD11 LEU A 63 12.259 -3.631 -3.140 1.00 0.48 H new ATOM 0 HD12 LEU A 63 13.344 -3.768 -4.545 1.00 0.48 H new ATOM 0 HD13 LEU A 63 13.550 -2.431 -3.388 1.00 0.48 H new ATOM 0 HD21 LEU A 63 10.539 -1.877 -3.049 1.00 0.68 H new ATOM 0 HD22 LEU A 63 11.749 -0.595 -3.294 1.00 0.68 H new ATOM 0 HD23 LEU A 63 10.350 -0.718 -4.387 1.00 0.68 H new ATOM 1010 N ASP A 64 13.751 0.021 -8.170 1.00 0.45 N ATOM 1011 CA ASP A 64 14.570 1.046 -8.836 1.00 0.51 C ATOM 1012 C ASP A 64 14.170 1.195 -10.320 1.00 0.50 C ATOM 1013 O ASP A 64 14.793 0.599 -11.208 1.00 0.54 O ATOM 1014 CB ASP A 64 16.075 0.700 -8.689 1.00 0.60 C ATOM 1015 CG ASP A 64 17.005 1.766 -9.257 1.00 0.83 C ATOM 1016 OD1 ASP A 64 17.073 2.866 -8.669 1.00 1.28 O ATOM 1017 OD2 ASP A 64 17.655 1.499 -10.290 1.00 1.39 O ATOM 0 H ASP A 64 14.194 -0.897 -8.124 1.00 0.45 H new ATOM 0 HA ASP A 64 14.390 2.007 -8.353 1.00 0.51 H new ATOM 0 HB2 ASP A 64 16.304 0.555 -7.633 1.00 0.60 H new ATOM 0 HB3 ASP A 64 16.272 -0.247 -9.191 1.00 0.60 H new ATOM 1022 N VAL A 65 13.099 1.979 -10.571 1.00 0.51 N ATOM 1023 CA VAL A 65 12.612 2.247 -11.940 1.00 0.55 C ATOM 1024 C VAL A 65 13.162 3.599 -12.471 1.00 0.55 C ATOM 1025 O VAL A 65 13.300 3.779 -13.686 1.00 0.60 O ATOM 1026 CB VAL A 65 11.042 2.203 -12.022 1.00 0.64 C ATOM 1027 CG1 VAL A 65 10.372 3.366 -11.274 1.00 0.67 C ATOM 1028 CG2 VAL A 65 10.571 2.138 -13.484 1.00 0.73 C ATOM 0 H VAL A 65 12.555 2.438 -9.841 1.00 0.51 H new ATOM 0 HA VAL A 65 12.991 1.451 -12.581 1.00 0.55 H new ATOM 0 HB VAL A 65 10.728 1.290 -11.516 1.00 0.64 H new ATOM 0 HG11 VAL A 65 9.289 3.282 -11.366 1.00 0.67 H new ATOM 0 HG12 VAL A 65 10.651 3.330 -10.221 1.00 0.67 H new ATOM 0 HG13 VAL A 65 10.700 4.312 -11.704 1.00 0.67 H new ATOM 0 HG21 VAL A 65 9.482 2.108 -13.514 1.00 0.73 H new ATOM 0 HG22 VAL A 65 10.925 3.019 -14.020 1.00 0.73 H new ATOM 0 HG23 VAL A 65 10.972 1.241 -13.956 1.00 0.73 H new ATOM 1038 N ASN A 66 13.473 4.539 -11.548 1.00 0.56 N ATOM 1039 CA ASN A 66 14.015 5.870 -11.898 1.00 0.60 C ATOM 1040 C ASN A 66 15.523 5.795 -12.250 1.00 0.59 C ATOM 1041 O ASN A 66 15.995 6.556 -13.100 1.00 0.66 O ATOM 1042 CB ASN A 66 13.786 6.847 -10.720 1.00 0.67 C ATOM 1043 CG ASN A 66 13.863 8.320 -11.117 1.00 0.94 C ATOM 1044 OD1 ASN A 66 12.845 8.944 -11.417 1.00 1.29 O ATOM 1045 ND2 ASN A 66 15.072 8.887 -11.117 1.00 1.44 N ATOM 0 H ASN A 66 13.355 4.396 -10.545 1.00 0.56 H new ATOM 0 HA ASN A 66 13.490 6.233 -12.781 1.00 0.60 H new ATOM 0 HB2 ASN A 66 12.808 6.649 -10.281 1.00 0.67 H new ATOM 0 HB3 ASN A 66 14.528 6.649 -9.947 1.00 0.67 H new ATOM 0 HD21 ASN A 66 15.175 9.869 -11.371 1.00 1.44 H new ATOM 0 HD22 ASN A 66 15.893 8.338 -10.862 1.00 1.44 H new ATOM 1052 N GLN A 67 16.265 4.876 -11.583 1.00 0.55 N ATOM 1053 CA GLN A 67 17.722 4.668 -11.787 1.00 0.60 C ATOM 1054 C GLN A 67 18.566 5.862 -11.279 1.00 0.63 C ATOM 1055 O GLN A 67 19.319 6.483 -12.040 1.00 0.78 O ATOM 1056 CB GLN A 67 18.075 4.335 -13.262 1.00 0.70 C ATOM 1057 CG GLN A 67 17.474 3.029 -13.782 1.00 0.88 C ATOM 1058 CD GLN A 67 18.119 2.565 -15.088 1.00 1.20 C ATOM 1059 OE1 GLN A 67 19.094 1.814 -15.068 1.00 1.96 O ATOM 1060 NE2 GLN A 67 17.588 3.007 -16.233 1.00 1.86 N ATOM 0 H GLN A 67 15.866 4.252 -10.882 1.00 0.55 H new ATOM 0 HA GLN A 67 17.981 3.799 -11.183 1.00 0.60 H new ATOM 0 HB2 GLN A 67 17.736 5.154 -13.897 1.00 0.70 H new ATOM 0 HB3 GLN A 67 19.159 4.285 -13.360 1.00 0.70 H new ATOM 0 HG2 GLN A 67 17.593 2.252 -13.026 1.00 0.88 H new ATOM 0 HG3 GLN A 67 16.403 3.162 -13.937 1.00 0.88 H new ATOM 0 HE21 GLN A 67 16.780 3.629 -16.214 1.00 1.86 H new ATOM 0 HE22 GLN A 67 17.991 2.722 -17.126 1.00 1.86 H new ATOM 1069 N ASP A 68 18.431 6.165 -9.973 1.00 0.62 N ATOM 1070 CA ASP A 68 19.187 7.253 -9.313 1.00 0.71 C ATOM 1071 C ASP A 68 19.841 6.761 -7.996 1.00 0.77 C ATOM 1072 O ASP A 68 20.288 7.582 -7.185 1.00 1.32 O ATOM 1073 CB ASP A 68 18.252 8.458 -9.038 1.00 0.78 C ATOM 1074 CG ASP A 68 18.216 9.463 -10.182 1.00 1.08 C ATOM 1075 OD1 ASP A 68 18.052 9.042 -11.348 1.00 1.41 O ATOM 1076 OD2 ASP A 68 18.343 10.676 -9.908 1.00 1.37 O ATOM 0 H ASP A 68 17.799 5.667 -9.347 1.00 0.62 H new ATOM 0 HA ASP A 68 19.986 7.570 -9.983 1.00 0.71 H new ATOM 0 HB2 ASP A 68 17.242 8.091 -8.853 1.00 0.78 H new ATOM 0 HB3 ASP A 68 18.579 8.963 -8.129 1.00 0.78 H new ATOM 1081 N SER A 69 19.908 5.414 -7.793 1.00 0.62 N ATOM 1082 CA SER A 69 20.492 4.775 -6.586 1.00 0.67 C ATOM 1083 C SER A 69 19.546 4.856 -5.367 1.00 0.68 C ATOM 1084 O SER A 69 19.267 3.831 -4.743 1.00 1.24 O ATOM 1085 CB SER A 69 21.886 5.345 -6.239 1.00 0.82 C ATOM 1086 OG SER A 69 22.648 4.419 -5.476 1.00 1.31 O ATOM 0 H SER A 69 19.554 4.739 -8.471 1.00 0.62 H new ATOM 0 HA SER A 69 20.620 3.721 -6.835 1.00 0.67 H new ATOM 0 HB2 SER A 69 22.420 5.589 -7.157 1.00 0.82 H new ATOM 0 HB3 SER A 69 21.772 6.274 -5.680 1.00 0.82 H new ATOM 0 HG SER A 69 23.525 4.806 -5.273 1.00 1.31 H new ATOM 1092 N GLU A 70 19.066 6.071 -5.023 1.00 0.66 N ATOM 1093 CA GLU A 70 18.146 6.268 -3.881 1.00 0.77 C ATOM 1094 C GLU A 70 16.722 5.780 -4.220 1.00 0.64 C ATOM 1095 O GLU A 70 16.137 6.210 -5.221 1.00 0.75 O ATOM 1096 CB GLU A 70 18.106 7.759 -3.472 1.00 1.13 C ATOM 1097 CG GLU A 70 19.457 8.324 -3.021 1.00 1.41 C ATOM 1098 CD GLU A 70 19.630 9.798 -3.355 1.00 1.90 C ATOM 1099 OE1 GLU A 70 19.005 10.640 -2.677 1.00 2.42 O ATOM 1100 OE2 GLU A 70 20.395 10.107 -4.293 1.00 2.41 O ATOM 0 H GLU A 70 19.300 6.930 -5.520 1.00 0.66 H new ATOM 0 HA GLU A 70 18.522 5.677 -3.046 1.00 0.77 H new ATOM 0 HB2 GLU A 70 17.743 8.346 -4.316 1.00 1.13 H new ATOM 0 HB3 GLU A 70 17.385 7.883 -2.664 1.00 1.13 H new ATOM 0 HG2 GLU A 70 19.560 8.187 -1.945 1.00 1.41 H new ATOM 0 HG3 GLU A 70 20.258 7.754 -3.493 1.00 1.41 H new ATOM 1107 N LEU A 71 16.173 4.873 -3.380 1.00 0.57 N ATOM 1108 CA LEU A 71 14.817 4.326 -3.582 1.00 0.51 C ATOM 1109 C LEU A 71 13.770 5.189 -2.844 1.00 0.51 C ATOM 1110 O LEU A 71 13.455 4.925 -1.680 1.00 0.53 O ATOM 1111 CB LEU A 71 14.723 2.853 -3.091 1.00 0.53 C ATOM 1112 CG LEU A 71 15.383 1.765 -3.975 1.00 0.66 C ATOM 1113 CD1 LEU A 71 16.908 1.898 -4.005 1.00 0.95 C ATOM 1114 CD2 LEU A 71 14.977 0.373 -3.484 1.00 0.74 C ATOM 0 H LEU A 71 16.650 4.506 -2.557 1.00 0.57 H new ATOM 0 HA LEU A 71 14.610 4.346 -4.652 1.00 0.51 H new ATOM 0 HB2 LEU A 71 15.171 2.799 -2.099 1.00 0.53 H new ATOM 0 HB3 LEU A 71 13.668 2.602 -2.978 1.00 0.53 H new ATOM 0 HG LEU A 71 15.026 1.906 -4.995 1.00 0.66 H new ATOM 0 HD11 LEU A 71 17.329 1.115 -4.636 1.00 0.95 H new ATOM 0 HD12 LEU A 71 17.180 2.874 -4.407 1.00 0.95 H new ATOM 0 HD13 LEU A 71 17.302 1.799 -2.993 1.00 0.95 H new ATOM 0 HD21 LEU A 71 15.446 -0.385 -4.111 1.00 0.74 H new ATOM 0 HD22 LEU A 71 15.303 0.242 -2.452 1.00 0.74 H new ATOM 0 HD23 LEU A 71 13.893 0.270 -3.538 1.00 0.74 H new ATOM 1126 N LYS A 72 13.242 6.232 -3.522 1.00 0.53 N ATOM 1127 CA LYS A 72 12.217 7.131 -2.933 1.00 0.56 C ATOM 1128 C LYS A 72 10.900 6.361 -2.689 1.00 0.50 C ATOM 1129 O LYS A 72 10.735 5.261 -3.222 1.00 0.48 O ATOM 1130 CB LYS A 72 11.991 8.347 -3.866 1.00 0.63 C ATOM 1131 CG LYS A 72 11.276 9.538 -3.214 1.00 0.86 C ATOM 1132 CD LYS A 72 11.347 10.825 -4.057 1.00 1.00 C ATOM 1133 CE LYS A 72 10.368 10.840 -5.241 1.00 1.43 C ATOM 1134 NZ LYS A 72 10.881 10.096 -6.435 1.00 1.89 N ATOM 0 H LYS A 72 13.507 6.474 -4.477 1.00 0.53 H new ATOM 0 HA LYS A 72 12.570 7.497 -1.969 1.00 0.56 H new ATOM 0 HB2 LYS A 72 12.958 8.683 -4.241 1.00 0.63 H new ATOM 0 HB3 LYS A 72 11.410 8.021 -4.729 1.00 0.63 H new ATOM 0 HG2 LYS A 72 10.231 9.278 -3.047 1.00 0.86 H new ATOM 0 HG3 LYS A 72 11.718 9.727 -2.236 1.00 0.86 H new ATOM 0 HD2 LYS A 72 11.141 11.682 -3.415 1.00 1.00 H new ATOM 0 HD3 LYS A 72 12.362 10.947 -4.434 1.00 1.00 H new ATOM 0 HE2 LYS A 72 9.420 10.403 -4.927 1.00 1.43 H new ATOM 0 HE3 LYS A 72 10.164 11.873 -5.524 1.00 1.43 H new ATOM 0 HZ1 LYS A 72 10.510 10.534 -7.302 1.00 1.89 H new ATOM 0 HZ2 LYS A 72 11.920 10.132 -6.446 1.00 1.89 H new ATOM 0 HZ3 LYS A 72 10.569 9.105 -6.387 1.00 1.89 H new ATOM 1148 N PHE A 73 9.963 6.926 -1.884 1.00 0.53 N ATOM 1149 CA PHE A 73 8.669 6.247 -1.597 1.00 0.50 C ATOM 1150 C PHE A 73 7.869 5.938 -2.885 1.00 0.47 C ATOM 1151 O PHE A 73 7.039 5.028 -2.882 1.00 0.47 O ATOM 1152 CB PHE A 73 7.807 7.036 -0.578 1.00 0.56 C ATOM 1153 CG PHE A 73 7.051 6.131 0.381 1.00 0.69 C ATOM 1154 CD1 PHE A 73 5.799 5.627 0.047 1.00 0.89 C ATOM 1155 CD2 PHE A 73 7.609 5.765 1.604 1.00 0.87 C ATOM 1156 CE1 PHE A 73 5.126 4.784 0.908 1.00 1.12 C ATOM 1157 CE2 PHE A 73 6.934 4.925 2.469 1.00 1.11 C ATOM 1158 CZ PHE A 73 5.692 4.435 2.120 1.00 1.20 C ATOM 0 H PHE A 73 10.074 7.832 -1.429 1.00 0.53 H new ATOM 0 HA PHE A 73 8.924 5.292 -1.138 1.00 0.50 H new ATOM 0 HB2 PHE A 73 8.450 7.706 -0.007 1.00 0.56 H new ATOM 0 HB3 PHE A 73 7.095 7.661 -1.118 1.00 0.56 H new ATOM 0 HD1 PHE A 73 5.348 5.898 -0.896 1.00 0.89 H new ATOM 0 HD2 PHE A 73 8.582 6.143 1.880 1.00 0.87 H new ATOM 0 HE1 PHE A 73 4.156 4.396 0.634 1.00 1.12 H new ATOM 0 HE2 PHE A 73 7.377 4.653 3.416 1.00 1.11 H new ATOM 0 HZ PHE A 73 5.162 3.779 2.794 1.00 1.20 H new ATOM 1168 N ASN A 74 8.103 6.711 -3.977 1.00 0.49 N ATOM 1169 CA ASN A 74 7.453 6.443 -5.280 1.00 0.51 C ATOM 1170 C ASN A 74 8.066 5.171 -5.921 1.00 0.49 C ATOM 1171 O ASN A 74 7.394 4.469 -6.679 1.00 0.53 O ATOM 1172 CB ASN A 74 7.597 7.652 -6.230 1.00 0.57 C ATOM 1173 CG ASN A 74 6.827 7.485 -7.542 1.00 0.65 C ATOM 1174 OD1 ASN A 74 7.376 7.002 -8.534 1.00 0.98 O ATOM 1175 ND2 ASN A 74 5.550 7.875 -7.555 1.00 0.91 N ATOM 0 H ASN A 74 8.730 7.515 -3.979 1.00 0.49 H new ATOM 0 HA ASN A 74 6.389 6.278 -5.110 1.00 0.51 H new ATOM 0 HB2 ASN A 74 7.244 8.549 -5.721 1.00 0.57 H new ATOM 0 HB3 ASN A 74 8.653 7.806 -6.453 1.00 0.57 H new ATOM 0 HD21 ASN A 74 4.996 7.777 -8.406 1.00 0.91 H new ATOM 0 HD22 ASN A 74 5.129 8.271 -6.714 1.00 0.91 H new ATOM 1182 N GLU A 75 9.361 4.913 -5.628 1.00 0.46 N ATOM 1183 CA GLU A 75 10.079 3.713 -6.106 1.00 0.47 C ATOM 1184 C GLU A 75 9.796 2.525 -5.164 1.00 0.43 C ATOM 1185 O GLU A 75 9.671 1.384 -5.618 1.00 0.44 O ATOM 1186 CB GLU A 75 11.603 3.988 -6.196 1.00 0.53 C ATOM 1187 CG GLU A 75 12.062 4.595 -7.523 1.00 0.61 C ATOM 1188 CD GLU A 75 11.501 5.987 -7.784 1.00 0.78 C ATOM 1189 OE1 GLU A 75 10.350 6.081 -8.264 1.00 1.03 O ATOM 1190 OE2 GLU A 75 12.213 6.977 -7.511 1.00 0.98 O ATOM 0 H GLU A 75 9.935 5.531 -5.054 1.00 0.46 H new ATOM 0 HA GLU A 75 9.722 3.463 -7.105 1.00 0.47 H new ATOM 0 HB2 GLU A 75 11.886 4.661 -5.386 1.00 0.53 H new ATOM 0 HB3 GLU A 75 12.138 3.052 -6.035 1.00 0.53 H new ATOM 0 HG2 GLU A 75 13.151 4.644 -7.533 1.00 0.61 H new ATOM 0 HG3 GLU A 75 11.765 3.934 -8.337 1.00 0.61 H new ATOM 1197 N TYR A 76 9.701 2.809 -3.840 1.00 0.42 N ATOM 1198 CA TYR A 76 9.395 1.788 -2.815 1.00 0.41 C ATOM 1199 C TYR A 76 7.910 1.352 -2.899 1.00 0.39 C ATOM 1200 O TYR A 76 7.550 0.267 -2.434 1.00 0.52 O ATOM 1201 CB TYR A 76 9.719 2.331 -1.403 1.00 0.44 C ATOM 1202 CG TYR A 76 9.779 1.268 -0.305 1.00 0.45 C ATOM 1203 CD1 TYR A 76 10.735 0.254 -0.333 1.00 0.52 C ATOM 1204 CD2 TYR A 76 8.883 1.285 0.765 1.00 0.51 C ATOM 1205 CE1 TYR A 76 10.794 -0.704 0.661 1.00 0.59 C ATOM 1206 CE2 TYR A 76 8.942 0.332 1.763 1.00 0.57 C ATOM 1207 CZ TYR A 76 9.897 -0.663 1.706 1.00 0.59 C ATOM 1208 OH TYR A 76 9.962 -1.615 2.702 1.00 0.69 O ATOM 0 H TYR A 76 9.834 3.746 -3.459 1.00 0.42 H new ATOM 0 HA TYR A 76 10.018 0.914 -3.005 1.00 0.41 H new ATOM 0 HB2 TYR A 76 10.677 2.850 -1.440 1.00 0.44 H new ATOM 0 HB3 TYR A 76 8.966 3.071 -1.132 1.00 0.44 H new ATOM 0 HD1 TYR A 76 11.443 0.216 -1.147 1.00 0.52 H new ATOM 0 HD2 TYR A 76 8.130 2.057 0.813 1.00 0.51 H new ATOM 0 HE1 TYR A 76 11.541 -1.483 0.619 1.00 0.59 H new ATOM 0 HE2 TYR A 76 8.243 0.365 2.586 1.00 0.57 H new ATOM 0 HH TYR A 76 9.260 -1.444 3.364 1.00 0.69 H new ATOM 1218 N TRP A 77 7.068 2.223 -3.508 1.00 0.40 N ATOM 1219 CA TRP A 77 5.618 1.995 -3.709 1.00 0.42 C ATOM 1220 C TRP A 77 5.305 0.622 -4.364 1.00 0.37 C ATOM 1221 O TRP A 77 4.296 0.000 -4.017 1.00 0.39 O ATOM 1222 CB TRP A 77 5.063 3.184 -4.542 1.00 0.58 C ATOM 1223 CG TRP A 77 3.723 3.001 -5.209 1.00 0.49 C ATOM 1224 CD1 TRP A 77 2.556 2.577 -4.637 1.00 0.53 C ATOM 1225 CD2 TRP A 77 3.422 3.269 -6.586 1.00 0.78 C ATOM 1226 NE1 TRP A 77 1.554 2.561 -5.574 1.00 0.77 N ATOM 1227 CE2 TRP A 77 2.062 2.980 -6.779 1.00 0.97 C ATOM 1228 CE3 TRP A 77 4.178 3.724 -7.678 1.00 1.04 C ATOM 1229 CZ2 TRP A 77 1.441 3.131 -8.016 1.00 1.40 C ATOM 1230 CZ3 TRP A 77 3.559 3.874 -8.901 1.00 1.45 C ATOM 1231 CH2 TRP A 77 2.202 3.578 -9.062 1.00 1.62 C ATOM 0 H TRP A 77 7.385 3.119 -3.879 1.00 0.40 H new ATOM 0 HA TRP A 77 5.122 1.954 -2.739 1.00 0.42 H new ATOM 0 HB2 TRP A 77 4.997 4.052 -3.886 1.00 0.58 H new ATOM 0 HB3 TRP A 77 5.794 3.423 -5.315 1.00 0.58 H new ATOM 0 HD1 TRP A 77 2.440 2.296 -3.601 1.00 0.53 H new ATOM 0 HE1 TRP A 77 0.588 2.283 -5.403 1.00 0.77 H new ATOM 0 HE3 TRP A 77 5.227 3.953 -7.562 1.00 1.04 H new ATOM 0 HZ2 TRP A 77 0.393 2.903 -8.146 1.00 1.40 H new ATOM 0 HZ3 TRP A 77 4.131 4.225 -9.747 1.00 1.45 H new ATOM 0 HH2 TRP A 77 1.745 3.705 -10.032 1.00 1.62 H new ATOM 1242 N ARG A 78 6.174 0.146 -5.292 1.00 0.39 N ATOM 1243 CA ARG A 78 5.966 -1.159 -5.976 1.00 0.42 C ATOM 1244 C ARG A 78 6.005 -2.349 -4.991 1.00 0.40 C ATOM 1245 O ARG A 78 5.215 -3.287 -5.133 1.00 0.45 O ATOM 1246 CB ARG A 78 7.002 -1.367 -7.114 1.00 0.49 C ATOM 1247 CG ARG A 78 6.523 -0.903 -8.496 1.00 0.64 C ATOM 1248 CD ARG A 78 5.494 -1.859 -9.120 1.00 0.82 C ATOM 1249 NE ARG A 78 6.125 -2.965 -9.867 1.00 1.11 N ATOM 1250 CZ ARG A 78 6.538 -2.903 -11.155 1.00 1.57 C ATOM 1251 NH1 ARG A 78 6.446 -1.774 -11.873 1.00 1.96 N ATOM 1252 NH2 ARG A 78 7.061 -3.990 -11.727 1.00 1.93 N ATOM 0 H ARG A 78 7.018 0.640 -5.583 1.00 0.39 H new ATOM 0 HA ARG A 78 4.968 -1.127 -6.413 1.00 0.42 H new ATOM 0 HB2 ARG A 78 7.916 -0.830 -6.860 1.00 0.49 H new ATOM 0 HB3 ARG A 78 7.258 -2.425 -7.167 1.00 0.49 H new ATOM 0 HG2 ARG A 78 6.083 0.091 -8.409 1.00 0.64 H new ATOM 0 HG3 ARG A 78 7.381 -0.814 -9.162 1.00 0.64 H new ATOM 0 HD2 ARG A 78 4.863 -2.271 -8.333 1.00 0.82 H new ATOM 0 HD3 ARG A 78 4.843 -1.298 -9.790 1.00 0.82 H new ATOM 0 HE ARG A 78 6.261 -3.847 -9.373 1.00 1.11 H new ATOM 0 HH11 ARG A 78 6.056 -0.931 -11.451 1.00 1.96 H new ATOM 0 HH12 ARG A 78 6.766 -1.758 -12.842 1.00 1.96 H new ATOM 0 HH21 ARG A 78 7.146 -4.856 -11.194 1.00 1.93 H new ATOM 0 HH22 ARG A 78 7.375 -3.955 -12.697 1.00 1.93 H new ATOM 1266 N LEU A 79 6.924 -2.307 -3.996 1.00 0.37 N ATOM 1267 CA LEU A 79 7.040 -3.383 -2.986 1.00 0.37 C ATOM 1268 C LEU A 79 5.881 -3.328 -1.965 1.00 0.36 C ATOM 1269 O LEU A 79 5.533 -4.358 -1.385 1.00 0.39 O ATOM 1270 CB LEU A 79 8.417 -3.321 -2.278 1.00 0.40 C ATOM 1271 CG LEU A 79 8.809 -4.535 -1.390 1.00 0.44 C ATOM 1272 CD1 LEU A 79 8.882 -5.828 -2.209 1.00 0.49 C ATOM 1273 CD2 LEU A 79 10.146 -4.282 -0.684 1.00 0.53 C ATOM 0 H LEU A 79 7.590 -1.545 -3.873 1.00 0.37 H new ATOM 0 HA LEU A 79 6.968 -4.339 -3.505 1.00 0.37 H new ATOM 0 HB2 LEU A 79 9.185 -3.198 -3.041 1.00 0.40 H new ATOM 0 HB3 LEU A 79 8.438 -2.426 -1.657 1.00 0.40 H new ATOM 0 HG LEU A 79 8.030 -4.654 -0.637 1.00 0.44 H new ATOM 0 HD11 LEU A 79 9.159 -6.657 -1.557 1.00 0.49 H new ATOM 0 HD12 LEU A 79 7.910 -6.029 -2.659 1.00 0.49 H new ATOM 0 HD13 LEU A 79 9.630 -5.719 -2.995 1.00 0.49 H new ATOM 0 HD21 LEU A 79 10.401 -5.144 -0.068 1.00 0.53 H new ATOM 0 HD22 LEU A 79 10.926 -4.124 -1.428 1.00 0.53 H new ATOM 0 HD23 LEU A 79 10.063 -3.397 -0.053 1.00 0.53 H new ATOM 1285 N ILE A 80 5.286 -2.120 -1.756 1.00 0.38 N ATOM 1286 CA ILE A 80 4.135 -1.948 -0.835 1.00 0.41 C ATOM 1287 C ILE A 80 2.903 -2.714 -1.373 1.00 0.40 C ATOM 1288 O ILE A 80 2.111 -3.240 -0.584 1.00 0.43 O ATOM 1289 CB ILE A 80 3.760 -0.434 -0.603 1.00 0.49 C ATOM 1290 CG1 ILE A 80 4.975 0.393 -0.102 1.00 0.53 C ATOM 1291 CG2 ILE A 80 2.582 -0.285 0.372 1.00 0.59 C ATOM 1292 CD1 ILE A 80 5.622 -0.094 1.192 1.00 0.61 C ATOM 0 H ILE A 80 5.585 -1.258 -2.212 1.00 0.38 H new ATOM 0 HA ILE A 80 4.438 -2.358 0.128 1.00 0.41 H new ATOM 0 HB ILE A 80 3.457 -0.038 -1.572 1.00 0.49 H new ATOM 0 HG12 ILE A 80 5.733 0.400 -0.885 1.00 0.53 H new ATOM 0 HG13 ILE A 80 4.654 1.425 0.040 1.00 0.53 H new ATOM 0 HG21 ILE A 80 2.353 0.772 0.507 1.00 0.59 H new ATOM 0 HG22 ILE A 80 1.709 -0.797 -0.032 1.00 0.59 H new ATOM 0 HG23 ILE A 80 2.848 -0.724 1.334 1.00 0.59 H new ATOM 0 HD11 ILE A 80 6.459 0.556 1.448 1.00 0.61 H new ATOM 0 HD12 ILE A 80 4.887 -0.073 1.997 1.00 0.61 H new ATOM 0 HD13 ILE A 80 5.983 -1.114 1.057 1.00 0.61 H new ATOM 1304 N GLY A 81 2.748 -2.763 -2.721 1.00 0.40 N ATOM 1305 CA GLY A 81 1.639 -3.491 -3.349 1.00 0.44 C ATOM 1306 C GLY A 81 1.668 -4.985 -3.034 1.00 0.41 C ATOM 1307 O GLY A 81 0.643 -5.560 -2.662 1.00 0.47 O ATOM 0 H GLY A 81 3.378 -2.307 -3.381 1.00 0.40 H new ATOM 0 HA2 GLY A 81 0.693 -3.069 -3.009 1.00 0.44 H new ATOM 0 HA3 GLY A 81 1.681 -3.350 -4.429 1.00 0.44 H new ATOM 1311 N GLU A 82 2.859 -5.604 -3.180 1.00 0.38 N ATOM 1312 CA GLU A 82 3.056 -7.041 -2.887 1.00 0.38 C ATOM 1313 C GLU A 82 3.174 -7.309 -1.366 1.00 0.36 C ATOM 1314 O GLU A 82 3.027 -8.456 -0.930 1.00 0.42 O ATOM 1315 CB GLU A 82 4.315 -7.577 -3.607 1.00 0.43 C ATOM 1316 CG GLU A 82 4.267 -7.486 -5.135 1.00 0.51 C ATOM 1317 CD GLU A 82 3.210 -8.388 -5.760 1.00 0.62 C ATOM 1318 OE1 GLU A 82 3.386 -9.624 -5.722 1.00 0.83 O ATOM 1319 OE2 GLU A 82 2.208 -7.854 -6.282 1.00 0.86 O ATOM 0 H GLU A 82 3.703 -5.129 -3.501 1.00 0.38 H new ATOM 0 HA GLU A 82 2.175 -7.566 -3.257 1.00 0.38 H new ATOM 0 HB2 GLU A 82 5.184 -7.023 -3.251 1.00 0.43 H new ATOM 0 HB3 GLU A 82 4.463 -8.619 -3.323 1.00 0.43 H new ATOM 0 HG2 GLU A 82 4.071 -6.454 -5.424 1.00 0.51 H new ATOM 0 HG3 GLU A 82 5.245 -7.750 -5.539 1.00 0.51 H new ATOM 1326 N LEU A 83 3.443 -6.242 -0.572 1.00 0.36 N ATOM 1327 CA LEU A 83 3.585 -6.333 0.899 1.00 0.39 C ATOM 1328 C LEU A 83 2.283 -6.832 1.562 1.00 0.40 C ATOM 1329 O LEU A 83 2.309 -7.777 2.352 1.00 0.49 O ATOM 1330 CB LEU A 83 3.991 -4.944 1.482 1.00 0.44 C ATOM 1331 CG LEU A 83 4.952 -4.943 2.695 1.00 0.49 C ATOM 1332 CD1 LEU A 83 6.312 -5.555 2.330 1.00 0.67 C ATOM 1333 CD2 LEU A 83 5.128 -3.523 3.250 1.00 0.61 C ATOM 0 H LEU A 83 3.567 -5.297 -0.935 1.00 0.36 H new ATOM 0 HA LEU A 83 4.368 -7.058 1.119 1.00 0.39 H new ATOM 0 HB2 LEU A 83 4.453 -4.364 0.683 1.00 0.44 H new ATOM 0 HB3 LEU A 83 3.081 -4.419 1.771 1.00 0.44 H new ATOM 0 HG LEU A 83 4.505 -5.563 3.472 1.00 0.49 H new ATOM 0 HD11 LEU A 83 6.964 -5.540 3.203 1.00 0.67 H new ATOM 0 HD12 LEU A 83 6.171 -6.584 2.001 1.00 0.67 H new ATOM 0 HD13 LEU A 83 6.768 -4.976 1.527 1.00 0.67 H new ATOM 0 HD21 LEU A 83 5.807 -3.547 4.102 1.00 0.61 H new ATOM 0 HD22 LEU A 83 5.541 -2.878 2.475 1.00 0.61 H new ATOM 0 HD23 LEU A 83 4.161 -3.134 3.568 1.00 0.61 H new ATOM 1345 N ALA A 84 1.149 -6.202 1.208 1.00 0.39 N ATOM 1346 CA ALA A 84 -0.169 -6.568 1.758 1.00 0.45 C ATOM 1347 C ALA A 84 -0.862 -7.671 0.927 1.00 0.45 C ATOM 1348 O ALA A 84 -1.808 -8.299 1.412 1.00 0.55 O ATOM 1349 CB ALA A 84 -1.047 -5.321 1.866 1.00 0.54 C ATOM 0 H ALA A 84 1.119 -5.432 0.539 1.00 0.39 H new ATOM 0 HA ALA A 84 -0.016 -6.983 2.754 1.00 0.45 H new ATOM 0 HB1 ALA A 84 -2.020 -5.595 2.273 1.00 0.54 H new ATOM 0 HB2 ALA A 84 -0.570 -4.596 2.525 1.00 0.54 H new ATOM 0 HB3 ALA A 84 -1.178 -4.881 0.877 1.00 0.54 H new ATOM 1355 N LYS A 85 -0.392 -7.903 -0.320 1.00 0.42 N ATOM 1356 CA LYS A 85 -0.960 -8.944 -1.204 1.00 0.46 C ATOM 1357 C LYS A 85 -0.455 -10.354 -0.809 1.00 0.47 C ATOM 1358 O LYS A 85 -1.148 -11.347 -1.057 1.00 0.55 O ATOM 1359 CB LYS A 85 -0.603 -8.642 -2.685 1.00 0.49 C ATOM 1360 CG LYS A 85 -1.444 -9.408 -3.720 1.00 0.59 C ATOM 1361 CD LYS A 85 -0.811 -9.424 -5.126 1.00 0.64 C ATOM 1362 CE LYS A 85 -1.277 -8.268 -6.022 1.00 0.69 C ATOM 1363 NZ LYS A 85 -0.744 -6.939 -5.597 1.00 0.96 N ATOM 0 H LYS A 85 0.380 -7.382 -0.736 1.00 0.42 H new ATOM 0 HA LYS A 85 -2.044 -8.930 -1.088 1.00 0.46 H new ATOM 0 HB2 LYS A 85 -0.721 -7.573 -2.862 1.00 0.49 H new ATOM 0 HB3 LYS A 85 0.449 -8.878 -2.846 1.00 0.49 H new ATOM 0 HG2 LYS A 85 -1.582 -10.434 -3.379 1.00 0.59 H new ATOM 0 HG3 LYS A 85 -2.434 -8.956 -3.780 1.00 0.59 H new ATOM 0 HD2 LYS A 85 0.274 -9.382 -5.028 1.00 0.64 H new ATOM 0 HD3 LYS A 85 -1.051 -10.369 -5.613 1.00 0.64 H new ATOM 0 HE2 LYS A 85 -0.966 -8.465 -7.048 1.00 0.69 H new ATOM 0 HE3 LYS A 85 -2.366 -8.232 -6.020 1.00 0.69 H new ATOM 0 HZ1 LYS A 85 -0.937 -6.235 -6.338 1.00 0.96 H new ATOM 0 HZ2 LYS A 85 -1.206 -6.646 -4.712 1.00 0.96 H new ATOM 0 HZ3 LYS A 85 0.282 -7.009 -5.445 1.00 0.96 H new ATOM 1377 N GLU A 86 0.748 -10.433 -0.191 1.00 0.42 N ATOM 1378 CA GLU A 86 1.353 -11.718 0.220 1.00 0.46 C ATOM 1379 C GLU A 86 1.058 -12.100 1.694 1.00 0.52 C ATOM 1380 O GLU A 86 1.259 -13.258 2.067 1.00 0.92 O ATOM 1381 CB GLU A 86 2.877 -11.679 -0.025 1.00 0.49 C ATOM 1382 CG GLU A 86 3.265 -11.713 -1.506 1.00 0.55 C ATOM 1383 CD GLU A 86 4.762 -11.576 -1.728 1.00 1.03 C ATOM 1384 OE1 GLU A 86 5.244 -10.431 -1.848 1.00 1.52 O ATOM 1385 OE2 GLU A 86 5.451 -12.617 -1.793 1.00 1.65 O ATOM 0 H GLU A 86 1.318 -9.618 0.033 1.00 0.42 H new ATOM 0 HA GLU A 86 0.890 -12.491 -0.393 1.00 0.46 H new ATOM 0 HB2 GLU A 86 3.285 -10.775 0.428 1.00 0.49 H new ATOM 0 HB3 GLU A 86 3.339 -12.526 0.482 1.00 0.49 H new ATOM 0 HG2 GLU A 86 2.922 -12.650 -1.945 1.00 0.55 H new ATOM 0 HG3 GLU A 86 2.750 -10.908 -2.030 1.00 0.55 H new ATOM 1392 N ILE A 87 0.584 -11.149 2.535 1.00 0.44 N ATOM 1393 CA ILE A 87 0.274 -11.444 3.960 1.00 0.47 C ATOM 1394 C ILE A 87 -0.844 -12.518 4.093 1.00 0.51 C ATOM 1395 O ILE A 87 -0.759 -13.395 4.957 1.00 0.61 O ATOM 1396 CB ILE A 87 -0.081 -10.125 4.759 1.00 0.51 C ATOM 1397 CG1 ILE A 87 0.246 -10.250 6.280 1.00 0.59 C ATOM 1398 CG2 ILE A 87 -1.527 -9.651 4.534 1.00 0.55 C ATOM 1399 CD1 ILE A 87 -0.565 -11.269 7.065 1.00 0.66 C ATOM 0 H ILE A 87 0.409 -10.183 2.259 1.00 0.44 H new ATOM 0 HA ILE A 87 1.174 -11.863 4.410 1.00 0.47 H new ATOM 0 HB ILE A 87 0.566 -9.351 4.346 1.00 0.51 H new ATOM 0 HG12 ILE A 87 1.302 -10.501 6.383 1.00 0.59 H new ATOM 0 HG13 ILE A 87 0.105 -9.273 6.741 1.00 0.59 H new ATOM 0 HG21 ILE A 87 -1.706 -8.743 5.110 1.00 0.55 H new ATOM 0 HG22 ILE A 87 -1.682 -9.446 3.475 1.00 0.55 H new ATOM 0 HG23 ILE A 87 -2.219 -10.428 4.858 1.00 0.55 H new ATOM 0 HD11 ILE A 87 -0.246 -11.263 8.107 1.00 0.66 H new ATOM 0 HD12 ILE A 87 -1.623 -11.014 7.007 1.00 0.66 H new ATOM 0 HD13 ILE A 87 -0.408 -12.262 6.644 1.00 0.66 H new ATOM 1411 N ARG A 88 -1.861 -12.458 3.208 1.00 0.54 N ATOM 1412 CA ARG A 88 -2.989 -13.410 3.225 1.00 0.68 C ATOM 1413 C ARG A 88 -2.802 -14.553 2.205 1.00 0.68 C ATOM 1414 O ARG A 88 -3.201 -15.688 2.483 1.00 0.87 O ATOM 1415 CB ARG A 88 -4.326 -12.669 2.979 1.00 0.83 C ATOM 1416 CG ARG A 88 -4.466 -12.028 1.589 1.00 0.91 C ATOM 1417 CD ARG A 88 -5.144 -10.661 1.638 1.00 1.05 C ATOM 1418 NE ARG A 88 -5.293 -10.067 0.300 1.00 1.18 N ATOM 1419 CZ ARG A 88 -5.533 -8.763 0.052 1.00 1.39 C ATOM 1420 NH1 ARG A 88 -5.669 -7.871 1.043 1.00 1.74 N ATOM 1421 NH2 ARG A 88 -5.639 -8.349 -1.208 1.00 1.73 N ATOM 0 H ARG A 88 -1.923 -11.757 2.470 1.00 0.54 H new ATOM 0 HA ARG A 88 -3.015 -13.866 4.215 1.00 0.68 H new ATOM 0 HB2 ARG A 88 -5.146 -13.373 3.123 1.00 0.83 H new ATOM 0 HB3 ARG A 88 -4.438 -11.891 3.734 1.00 0.83 H new ATOM 0 HG2 ARG A 88 -3.478 -11.924 1.140 1.00 0.91 H new ATOM 0 HG3 ARG A 88 -5.041 -12.692 0.943 1.00 0.91 H new ATOM 0 HD2 ARG A 88 -6.126 -10.760 2.101 1.00 1.05 H new ATOM 0 HD3 ARG A 88 -4.561 -9.990 2.269 1.00 1.05 H new ATOM 0 HE ARG A 88 -5.208 -10.690 -0.503 1.00 1.18 H new ATOM 0 HH11 ARG A 88 -5.591 -8.172 2.014 1.00 1.74 H new ATOM 0 HH12 ARG A 88 -5.850 -6.891 0.826 1.00 1.74 H new ATOM 0 HH21 ARG A 88 -5.539 -9.015 -1.974 1.00 1.73 H new ATOM 0 HH22 ARG A 88 -5.820 -7.365 -1.408 1.00 1.73 H new ATOM 1435 N LYS A 89 -2.199 -14.253 1.031 1.00 0.58 N ATOM 1436 CA LYS A 89 -1.982 -15.268 -0.015 1.00 0.64 C ATOM 1437 C LYS A 89 -0.577 -15.156 -0.665 1.00 0.58 C ATOM 1438 O LYS A 89 -0.448 -14.782 -1.837 1.00 0.69 O ATOM 1439 CB LYS A 89 -3.114 -15.192 -1.078 1.00 0.76 C ATOM 1440 CG LYS A 89 -3.251 -13.842 -1.795 1.00 0.77 C ATOM 1441 CD LYS A 89 -4.449 -13.819 -2.747 1.00 1.00 C ATOM 1442 CE LYS A 89 -4.405 -12.624 -3.695 1.00 1.22 C ATOM 1443 NZ LYS A 89 -5.453 -12.712 -4.753 1.00 1.52 N ATOM 0 H LYS A 89 -1.858 -13.322 0.790 1.00 0.58 H new ATOM 0 HA LYS A 89 -2.018 -16.248 0.460 1.00 0.64 H new ATOM 0 HB2 LYS A 89 -2.940 -15.966 -1.826 1.00 0.76 H new ATOM 0 HB3 LYS A 89 -4.062 -15.425 -0.593 1.00 0.76 H new ATOM 0 HG2 LYS A 89 -3.360 -13.048 -1.056 1.00 0.77 H new ATOM 0 HG3 LYS A 89 -2.339 -13.634 -2.354 1.00 0.77 H new ATOM 0 HD2 LYS A 89 -4.468 -14.741 -3.328 1.00 1.00 H new ATOM 0 HD3 LYS A 89 -5.372 -13.788 -2.167 1.00 1.00 H new ATOM 0 HE2 LYS A 89 -4.541 -11.704 -3.126 1.00 1.22 H new ATOM 0 HE3 LYS A 89 -3.422 -12.568 -4.162 1.00 1.22 H new ATOM 0 HZ1 LYS A 89 -5.389 -11.881 -5.375 1.00 1.52 H new ATOM 0 HZ2 LYS A 89 -5.309 -13.576 -5.313 1.00 1.52 H new ATOM 0 HZ3 LYS A 89 -6.393 -12.740 -4.309 1.00 1.52 H new ATOM 1457 N LYS A 90 0.484 -15.485 0.111 1.00 0.56 N ATOM 1458 CA LYS A 90 1.877 -15.454 -0.409 1.00 0.55 C ATOM 1459 C LYS A 90 2.081 -16.547 -1.486 1.00 0.55 C ATOM 1460 O LYS A 90 2.837 -16.348 -2.442 1.00 0.60 O ATOM 1461 CB LYS A 90 2.936 -15.589 0.725 1.00 0.61 C ATOM 1462 CG LYS A 90 2.822 -16.844 1.620 1.00 0.71 C ATOM 1463 CD LYS A 90 2.153 -16.576 2.985 1.00 0.97 C ATOM 1464 CE LYS A 90 3.022 -15.738 3.937 1.00 1.39 C ATOM 1465 NZ LYS A 90 4.278 -16.435 4.351 1.00 1.87 N ATOM 0 H LYS A 90 0.407 -15.772 1.087 1.00 0.56 H new ATOM 0 HA LYS A 90 2.027 -14.477 -0.868 1.00 0.55 H new ATOM 0 HB2 LYS A 90 3.927 -15.581 0.271 1.00 0.61 H new ATOM 0 HB3 LYS A 90 2.870 -14.707 1.362 1.00 0.61 H new ATOM 0 HG2 LYS A 90 2.252 -17.607 1.090 1.00 0.71 H new ATOM 0 HG3 LYS A 90 3.819 -17.251 1.788 1.00 0.71 H new ATOM 0 HD2 LYS A 90 1.206 -16.062 2.822 1.00 0.97 H new ATOM 0 HD3 LYS A 90 1.921 -17.529 3.461 1.00 0.97 H new ATOM 0 HE2 LYS A 90 3.279 -14.797 3.451 1.00 1.39 H new ATOM 0 HE3 LYS A 90 2.442 -15.490 4.826 1.00 1.39 H new ATOM 0 HZ1 LYS A 90 4.813 -15.828 5.005 1.00 1.87 H new ATOM 0 HZ2 LYS A 90 4.039 -17.329 4.826 1.00 1.87 H new ATOM 0 HZ3 LYS A 90 4.858 -16.634 3.511 1.00 1.87 H new ATOM 1479 N LYS A 91 1.401 -17.701 -1.300 1.00 0.57 N ATOM 1480 CA LYS A 91 1.437 -18.826 -2.246 1.00 0.64 C ATOM 1481 C LYS A 91 -0.008 -19.285 -2.521 1.00 0.69 C ATOM 1482 O LYS A 91 -0.517 -20.197 -1.862 1.00 0.71 O ATOM 1483 CB LYS A 91 2.283 -19.996 -1.686 1.00 0.72 C ATOM 1484 CG LYS A 91 3.776 -19.692 -1.541 1.00 0.85 C ATOM 1485 CD LYS A 91 4.536 -20.872 -0.927 1.00 0.97 C ATOM 1486 CE LYS A 91 6.016 -20.557 -0.707 1.00 1.29 C ATOM 1487 NZ LYS A 91 6.801 -20.556 -1.978 1.00 1.53 N ATOM 0 H LYS A 91 0.812 -17.873 -0.485 1.00 0.57 H new ATOM 0 HA LYS A 91 1.905 -18.502 -3.176 1.00 0.64 H new ATOM 0 HB2 LYS A 91 1.887 -20.279 -0.711 1.00 0.72 H new ATOM 0 HB3 LYS A 91 2.164 -20.859 -2.341 1.00 0.72 H new ATOM 0 HG2 LYS A 91 4.196 -19.457 -2.519 1.00 0.85 H new ATOM 0 HG3 LYS A 91 3.909 -18.809 -0.916 1.00 0.85 H new ATOM 0 HD2 LYS A 91 4.078 -21.140 0.025 1.00 0.97 H new ATOM 0 HD3 LYS A 91 4.445 -21.740 -1.580 1.00 0.97 H new ATOM 0 HE2 LYS A 91 6.108 -19.583 -0.227 1.00 1.29 H new ATOM 0 HE3 LYS A 91 6.442 -21.291 -0.023 1.00 1.29 H new ATOM 0 HZ1 LYS A 91 7.796 -20.337 -1.771 1.00 1.53 H new ATOM 0 HZ2 LYS A 91 6.738 -21.493 -2.425 1.00 1.53 H new ATOM 0 HZ3 LYS A 91 6.416 -19.837 -2.624 1.00 1.53 H new ATOM 1501 N ASP A 92 -0.675 -18.616 -3.486 1.00 0.78 N ATOM 1502 CA ASP A 92 -2.078 -18.930 -3.844 1.00 0.87 C ATOM 1503 C ASP A 92 -2.179 -20.180 -4.749 1.00 1.03 C ATOM 1504 O ASP A 92 -2.483 -20.086 -5.946 1.00 1.81 O ATOM 1505 CB ASP A 92 -2.784 -17.697 -4.479 1.00 0.89 C ATOM 1506 CG ASP A 92 -2.060 -17.111 -5.690 1.00 0.98 C ATOM 1507 OD1 ASP A 92 -0.998 -16.480 -5.503 1.00 1.01 O ATOM 1508 OD2 ASP A 92 -2.567 -17.276 -6.821 1.00 1.18 O ATOM 0 H ASP A 92 -0.267 -17.856 -4.031 1.00 0.78 H new ATOM 0 HA ASP A 92 -2.604 -19.171 -2.920 1.00 0.87 H new ATOM 0 HB2 ASP A 92 -3.792 -17.984 -4.777 1.00 0.89 H new ATOM 0 HB3 ASP A 92 -2.885 -16.921 -3.721 1.00 0.89 H new ATOM 1513 N LEU A 93 -1.906 -21.357 -4.147 1.00 0.67 N ATOM 1514 CA LEU A 93 -1.962 -22.666 -4.843 1.00 0.70 C ATOM 1515 C LEU A 93 -1.683 -23.818 -3.855 1.00 0.70 C ATOM 1516 O LEU A 93 -2.409 -24.818 -3.839 1.00 0.79 O ATOM 1517 CB LEU A 93 -0.963 -22.742 -6.034 1.00 0.77 C ATOM 1518 CG LEU A 93 -1.444 -23.578 -7.243 1.00 0.97 C ATOM 1519 CD1 LEU A 93 -2.539 -22.843 -8.025 1.00 1.24 C ATOM 1520 CD2 LEU A 93 -0.271 -23.948 -8.160 1.00 1.15 C ATOM 0 H LEU A 93 -1.640 -21.430 -3.165 1.00 0.67 H new ATOM 0 HA LEU A 93 -2.970 -22.768 -5.246 1.00 0.70 H new ATOM 0 HB2 LEU A 93 -0.750 -21.729 -6.375 1.00 0.77 H new ATOM 0 HB3 LEU A 93 -0.023 -23.161 -5.673 1.00 0.77 H new ATOM 0 HG LEU A 93 -1.873 -24.502 -6.856 1.00 0.97 H new ATOM 0 HD11 LEU A 93 -2.857 -23.455 -8.869 1.00 1.24 H new ATOM 0 HD12 LEU A 93 -3.391 -22.657 -7.371 1.00 1.24 H new ATOM 0 HD13 LEU A 93 -2.149 -21.894 -8.392 1.00 1.24 H new ATOM 0 HD21 LEU A 93 -0.638 -24.535 -9.001 1.00 1.15 H new ATOM 0 HD22 LEU A 93 0.202 -23.039 -8.531 1.00 1.15 H new ATOM 0 HD23 LEU A 93 0.458 -24.533 -7.600 1.00 1.15 H new ATOM 1532 N LYS A 94 -0.622 -23.659 -3.032 1.00 0.70 N ATOM 1533 CA LYS A 94 -0.227 -24.659 -2.026 1.00 0.77 C ATOM 1534 C LYS A 94 -1.022 -24.465 -0.716 1.00 0.71 C ATOM 1535 O LYS A 94 -1.638 -25.412 -0.217 1.00 0.77 O ATOM 1536 CB LYS A 94 1.293 -24.551 -1.753 1.00 0.92 C ATOM 1537 CG LYS A 94 1.890 -25.707 -0.939 1.00 1.09 C ATOM 1538 CD LYS A 94 2.155 -26.947 -1.799 1.00 1.23 C ATOM 1539 CE LYS A 94 2.847 -28.060 -1.012 1.00 1.57 C ATOM 1540 NZ LYS A 94 1.917 -28.764 -0.081 1.00 1.73 N ATOM 0 H LYS A 94 -0.020 -22.836 -3.050 1.00 0.70 H new ATOM 0 HA LYS A 94 -0.453 -25.652 -2.414 1.00 0.77 H new ATOM 0 HB2 LYS A 94 1.815 -24.492 -2.708 1.00 0.92 H new ATOM 0 HB3 LYS A 94 1.487 -23.617 -1.225 1.00 0.92 H new ATOM 0 HG2 LYS A 94 2.823 -25.381 -0.479 1.00 1.09 H new ATOM 0 HG3 LYS A 94 1.209 -25.968 -0.129 1.00 1.09 H new ATOM 0 HD2 LYS A 94 1.211 -27.319 -2.197 1.00 1.23 H new ATOM 0 HD3 LYS A 94 2.774 -26.669 -2.652 1.00 1.23 H new ATOM 0 HE2 LYS A 94 3.274 -28.782 -1.708 1.00 1.57 H new ATOM 0 HE3 LYS A 94 3.675 -27.638 -0.443 1.00 1.57 H new ATOM 0 HZ1 LYS A 94 2.434 -29.509 0.429 1.00 1.73 H new ATOM 0 HZ2 LYS A 94 1.528 -28.083 0.602 1.00 1.73 H new ATOM 0 HZ3 LYS A 94 1.140 -29.192 -0.624 1.00 1.73 H new ATOM 1554 N ILE A 95 -0.994 -23.229 -0.167 1.00 0.68 N ATOM 1555 CA ILE A 95 -1.700 -22.889 1.084 1.00 0.67 C ATOM 1556 C ILE A 95 -2.704 -21.750 0.853 1.00 0.67 C ATOM 1557 O ILE A 95 -2.365 -20.741 0.222 1.00 0.77 O ATOM 1558 CB ILE A 95 -0.708 -22.497 2.234 1.00 0.75 C ATOM 1559 CG1 ILE A 95 0.305 -21.405 1.780 1.00 0.87 C ATOM 1560 CG2 ILE A 95 0.021 -23.744 2.747 1.00 0.85 C ATOM 1561 CD1 ILE A 95 1.083 -20.759 2.914 1.00 1.06 C ATOM 0 H ILE A 95 -0.485 -22.446 -0.577 1.00 0.68 H new ATOM 0 HA ILE A 95 -2.238 -23.785 1.395 1.00 0.67 H new ATOM 0 HB ILE A 95 -1.291 -22.069 3.049 1.00 0.75 H new ATOM 0 HG12 ILE A 95 1.011 -21.851 1.079 1.00 0.87 H new ATOM 0 HG13 ILE A 95 -0.235 -20.629 1.238 1.00 0.87 H new ATOM 0 HG21 ILE A 95 0.707 -23.462 3.545 1.00 0.85 H new ATOM 0 HG22 ILE A 95 -0.707 -24.459 3.130 1.00 0.85 H new ATOM 0 HG23 ILE A 95 0.582 -24.199 1.931 1.00 0.85 H new ATOM 0 HD11 ILE A 95 1.764 -20.011 2.508 1.00 1.06 H new ATOM 0 HD12 ILE A 95 0.389 -20.280 3.605 1.00 1.06 H new ATOM 0 HD13 ILE A 95 1.654 -21.521 3.444 1.00 1.06 H new ATOM 1573 N ARG A 96 -3.945 -21.914 1.357 1.00 0.71 N ATOM 1574 CA ARG A 96 -4.983 -20.878 1.196 1.00 0.77 C ATOM 1575 C ARG A 96 -5.933 -20.786 2.420 1.00 0.77 C ATOM 1576 O ARG A 96 -7.146 -20.600 2.256 1.00 0.93 O ATOM 1577 CB ARG A 96 -5.768 -21.084 -0.126 1.00 0.93 C ATOM 1578 CG ARG A 96 -6.497 -22.426 -0.262 1.00 1.05 C ATOM 1579 CD ARG A 96 -7.312 -22.506 -1.556 1.00 1.26 C ATOM 1580 NE ARG A 96 -8.448 -21.559 -1.582 1.00 1.40 N ATOM 1581 CZ ARG A 96 -9.419 -21.532 -2.517 1.00 1.83 C ATOM 1582 NH1 ARG A 96 -9.437 -22.404 -3.538 1.00 2.26 N ATOM 1583 NH2 ARG A 96 -10.381 -20.614 -2.432 1.00 2.18 N ATOM 0 H ARG A 96 -4.248 -22.741 1.871 1.00 0.71 H new ATOM 0 HA ARG A 96 -4.470 -19.918 1.140 1.00 0.77 H new ATOM 0 HB2 ARG A 96 -6.500 -20.282 -0.222 1.00 0.93 H new ATOM 0 HB3 ARG A 96 -5.073 -20.982 -0.960 1.00 0.93 H new ATOM 0 HG2 ARG A 96 -5.770 -23.238 -0.240 1.00 1.05 H new ATOM 0 HG3 ARG A 96 -7.158 -22.568 0.593 1.00 1.05 H new ATOM 0 HD2 ARG A 96 -6.658 -22.304 -2.404 1.00 1.26 H new ATOM 0 HD3 ARG A 96 -7.689 -23.521 -1.679 1.00 1.26 H new ATOM 0 HE ARG A 96 -8.501 -20.870 -0.831 1.00 1.40 H new ATOM 0 HH11 ARG A 96 -8.704 -23.109 -3.620 1.00 2.26 H new ATOM 0 HH12 ARG A 96 -10.183 -22.362 -4.232 1.00 2.26 H new ATOM 0 HH21 ARG A 96 -10.378 -19.941 -1.665 1.00 2.18 H new ATOM 0 HH22 ARG A 96 -11.121 -20.584 -3.134 1.00 2.18 H new ATOM 1597 N LYS A 97 -5.367 -20.895 3.645 1.00 0.72 N ATOM 1598 CA LYS A 97 -6.147 -20.774 4.901 1.00 0.75 C ATOM 1599 C LYS A 97 -5.217 -20.661 6.133 1.00 0.74 C ATOM 1600 O LYS A 97 -4.754 -21.670 6.677 1.00 0.95 O ATOM 1601 CB LYS A 97 -7.177 -21.925 5.078 1.00 0.87 C ATOM 1602 CG LYS A 97 -6.611 -23.350 4.999 1.00 0.94 C ATOM 1603 CD LYS A 97 -7.684 -24.404 5.300 1.00 1.10 C ATOM 1604 CE LYS A 97 -7.102 -25.818 5.405 1.00 1.36 C ATOM 1605 NZ LYS A 97 -6.337 -26.031 6.673 1.00 1.74 N ATOM 0 H LYS A 97 -4.372 -21.067 3.791 1.00 0.72 H new ATOM 0 HA LYS A 97 -6.720 -19.850 4.823 1.00 0.75 H new ATOM 0 HB2 LYS A 97 -7.667 -21.803 6.044 1.00 0.87 H new ATOM 0 HB3 LYS A 97 -7.947 -21.818 4.314 1.00 0.87 H new ATOM 0 HG2 LYS A 97 -6.199 -23.523 4.005 1.00 0.94 H new ATOM 0 HG3 LYS A 97 -5.789 -23.455 5.707 1.00 0.94 H new ATOM 0 HD2 LYS A 97 -8.186 -24.151 6.234 1.00 1.10 H new ATOM 0 HD3 LYS A 97 -8.440 -24.383 4.515 1.00 1.10 H new ATOM 0 HE2 LYS A 97 -7.911 -26.546 5.346 1.00 1.36 H new ATOM 0 HE3 LYS A 97 -6.446 -26.001 4.554 1.00 1.36 H new ATOM 0 HZ1 LYS A 97 -5.965 -27.002 6.695 1.00 1.74 H new ATOM 0 HZ2 LYS A 97 -5.547 -25.356 6.719 1.00 1.74 H new ATOM 0 HZ3 LYS A 97 -6.967 -25.883 7.487 1.00 1.74 H new ATOM 1619 N LYS A 98 -4.929 -19.410 6.553 1.00 0.69 N ATOM 1620 CA LYS A 98 -4.066 -19.142 7.717 1.00 0.72 C ATOM 1621 C LYS A 98 -4.622 -17.969 8.533 1.00 0.76 C ATOM 1622 O LYS A 98 -5.225 -18.162 9.588 1.00 0.98 O ATOM 1623 CB LYS A 98 -2.620 -18.852 7.255 1.00 0.88 C ATOM 1624 CG LYS A 98 -1.560 -19.004 8.352 1.00 1.04 C ATOM 1625 CD LYS A 98 -0.144 -18.785 7.811 1.00 1.35 C ATOM 1626 CE LYS A 98 0.931 -19.021 8.877 1.00 1.61 C ATOM 1627 NZ LYS A 98 1.083 -20.464 9.236 1.00 1.71 N ATOM 0 H LYS A 98 -5.285 -18.569 6.099 1.00 0.69 H new ATOM 0 HA LYS A 98 -4.052 -20.026 8.355 1.00 0.72 H new ATOM 0 HB2 LYS A 98 -2.373 -19.524 6.433 1.00 0.88 H new ATOM 0 HB3 LYS A 98 -2.574 -17.837 6.861 1.00 0.88 H new ATOM 0 HG2 LYS A 98 -1.758 -18.289 9.150 1.00 1.04 H new ATOM 0 HG3 LYS A 98 -1.631 -19.999 8.791 1.00 1.04 H new ATOM 0 HD2 LYS A 98 0.029 -19.456 6.970 1.00 1.35 H new ATOM 0 HD3 LYS A 98 -0.057 -17.768 7.430 1.00 1.35 H new ATOM 0 HE2 LYS A 98 1.885 -18.639 8.515 1.00 1.61 H new ATOM 0 HE3 LYS A 98 0.679 -18.453 9.773 1.00 1.61 H new ATOM 0 HZ1 LYS A 98 1.834 -20.567 9.948 1.00 1.71 H new ATOM 0 HZ2 LYS A 98 0.187 -20.822 9.624 1.00 1.71 H new ATOM 0 HZ3 LYS A 98 1.334 -21.009 8.386 1.00 1.71 H new TER 1641 LYS A 98 ATOM 1642 N MET B 1 -5.564 -17.586 3.158 1.00 0.85 N ATOM 1643 CA MET B 1 -6.299 -16.464 2.569 1.00 0.86 C ATOM 1644 C MET B 1 -6.795 -15.455 3.636 1.00 0.76 C ATOM 1645 O MET B 1 -7.664 -14.625 3.345 1.00 0.93 O ATOM 1646 CB MET B 1 -7.473 -16.990 1.707 1.00 1.04 C ATOM 1647 CG MET B 1 -8.547 -17.775 2.470 1.00 1.09 C ATOM 1648 SD MET B 1 -9.767 -18.535 1.375 1.00 1.44 S ATOM 1649 CE MET B 1 -10.828 -19.372 2.551 1.00 1.75 C ATOM 0 H1 MET B 1 -5.283 -18.249 2.408 1.00 0.85 H new ATOM 0 H2 MET B 1 -4.715 -17.229 3.641 1.00 0.85 H new ATOM 0 H3 MET B 1 -6.172 -18.077 3.844 1.00 0.85 H new ATOM 0 HA MET B 1 -5.607 -15.918 1.928 1.00 0.86 H new ATOM 0 HB2 MET B 1 -7.948 -16.142 1.214 1.00 1.04 H new ATOM 0 HB3 MET B 1 -7.068 -17.629 0.922 1.00 1.04 H new ATOM 0 HG2 MET B 1 -8.068 -18.551 3.067 1.00 1.09 H new ATOM 0 HG3 MET B 1 -9.055 -17.106 3.164 1.00 1.09 H new ATOM 0 HE1 MET B 1 -11.628 -19.886 2.018 1.00 1.75 H new ATOM 0 HE2 MET B 1 -10.243 -20.098 3.116 1.00 1.75 H new ATOM 0 HE3 MET B 1 -11.259 -18.642 3.236 1.00 1.75 H new ATOM 1659 N ALA B 2 -6.222 -15.510 4.863 1.00 0.73 N ATOM 1660 CA ALA B 2 -6.601 -14.602 5.959 1.00 0.67 C ATOM 1661 C ALA B 2 -5.361 -13.970 6.606 1.00 0.60 C ATOM 1662 O ALA B 2 -4.419 -14.679 6.974 1.00 0.68 O ATOM 1663 CB ALA B 2 -7.433 -15.348 6.999 1.00 0.78 C ATOM 0 H ALA B 2 -5.493 -16.179 5.113 1.00 0.73 H new ATOM 0 HA ALA B 2 -7.205 -13.796 5.542 1.00 0.67 H new ATOM 0 HB1 ALA B 2 -7.707 -14.666 7.804 1.00 0.78 H new ATOM 0 HB2 ALA B 2 -8.337 -15.738 6.531 1.00 0.78 H new ATOM 0 HB3 ALA B 2 -6.850 -16.174 7.406 1.00 0.78 H new ATOM 1669 N ALA B 3 -5.370 -12.629 6.747 1.00 0.57 N ATOM 1670 CA ALA B 3 -4.238 -11.894 7.339 1.00 0.57 C ATOM 1671 C ALA B 3 -4.140 -12.135 8.863 1.00 0.58 C ATOM 1672 O ALA B 3 -4.973 -11.641 9.633 1.00 0.69 O ATOM 1673 CB ALA B 3 -4.336 -10.403 7.003 1.00 0.64 C ATOM 0 H ALA B 3 -6.148 -12.035 6.459 1.00 0.57 H new ATOM 0 HA ALA B 3 -3.316 -12.277 6.902 1.00 0.57 H new ATOM 0 HB1 ALA B 3 -3.493 -9.874 7.447 1.00 0.64 H new ATOM 0 HB2 ALA B 3 -4.317 -10.272 5.921 1.00 0.64 H new ATOM 0 HB3 ALA B 3 -5.267 -10.001 7.401 1.00 0.64 H new ATOM 1679 N GLU B 4 -3.108 -12.906 9.278 1.00 0.56 N ATOM 1680 CA GLU B 4 -2.877 -13.255 10.696 1.00 0.59 C ATOM 1681 C GLU B 4 -1.809 -12.327 11.329 1.00 0.56 C ATOM 1682 O GLU B 4 -0.846 -11.964 10.648 1.00 0.54 O ATOM 1683 CB GLU B 4 -2.437 -14.737 10.793 1.00 0.66 C ATOM 1684 CG GLU B 4 -2.461 -15.329 12.206 1.00 0.79 C ATOM 1685 CD GLU B 4 -2.145 -16.817 12.229 1.00 0.91 C ATOM 1686 OE1 GLU B 4 -0.946 -17.169 12.271 1.00 1.00 O ATOM 1687 OE2 GLU B 4 -3.097 -17.630 12.197 1.00 1.10 O ATOM 0 H GLU B 4 -2.416 -13.301 8.641 1.00 0.56 H new ATOM 0 HA GLU B 4 -3.805 -13.116 11.251 1.00 0.59 H new ATOM 0 HB2 GLU B 4 -3.086 -15.335 10.154 1.00 0.66 H new ATOM 0 HB3 GLU B 4 -1.426 -14.827 10.395 1.00 0.66 H new ATOM 0 HG2 GLU B 4 -1.740 -14.800 12.829 1.00 0.79 H new ATOM 0 HG3 GLU B 4 -3.444 -15.164 12.647 1.00 0.79 H new ATOM 1694 N PRO B 5 -1.953 -11.928 12.642 1.00 0.62 N ATOM 1695 CA PRO B 5 -0.975 -11.040 13.330 1.00 0.65 C ATOM 1696 C PRO B 5 0.464 -11.615 13.377 1.00 0.59 C ATOM 1697 O PRO B 5 0.656 -12.764 13.782 1.00 0.68 O ATOM 1698 CB PRO B 5 -1.552 -10.905 14.757 1.00 0.83 C ATOM 1699 CG PRO B 5 -2.998 -11.223 14.618 1.00 0.80 C ATOM 1700 CD PRO B 5 -3.083 -12.269 13.547 1.00 0.73 C ATOM 0 HA PRO B 5 -0.865 -10.093 12.801 1.00 0.65 H new ATOM 0 HB2 PRO B 5 -1.062 -11.591 15.448 1.00 0.83 H new ATOM 0 HB3 PRO B 5 -1.405 -9.899 15.149 1.00 0.83 H new ATOM 0 HG2 PRO B 5 -3.410 -11.591 15.558 1.00 0.80 H new ATOM 0 HG3 PRO B 5 -3.569 -10.336 14.345 1.00 0.80 H new ATOM 0 HD2 PRO B 5 -2.980 -13.274 13.957 1.00 0.73 H new ATOM 0 HD3 PRO B 5 -4.040 -12.234 13.026 1.00 0.73 H new ATOM 1708 N LEU B 6 1.465 -10.799 12.958 1.00 0.61 N ATOM 1709 CA LEU B 6 2.893 -11.207 12.954 1.00 0.70 C ATOM 1710 C LEU B 6 3.787 -10.083 13.573 1.00 0.73 C ATOM 1711 O LEU B 6 3.436 -9.556 14.635 1.00 1.24 O ATOM 1712 CB LEU B 6 3.326 -11.581 11.510 1.00 0.87 C ATOM 1713 CG LEU B 6 2.532 -12.715 10.819 1.00 0.95 C ATOM 1714 CD1 LEU B 6 2.904 -12.804 9.336 1.00 1.18 C ATOM 1715 CD2 LEU B 6 2.766 -14.062 11.516 1.00 1.08 C ATOM 0 H LEU B 6 1.308 -9.851 12.617 1.00 0.61 H new ATOM 0 HA LEU B 6 3.024 -12.091 13.578 1.00 0.70 H new ATOM 0 HB2 LEU B 6 3.252 -10.687 10.890 1.00 0.87 H new ATOM 0 HB3 LEU B 6 4.378 -11.867 11.533 1.00 0.87 H new ATOM 0 HG LEU B 6 1.471 -12.478 10.898 1.00 0.95 H new ATOM 0 HD11 LEU B 6 2.336 -13.607 8.866 1.00 1.18 H new ATOM 0 HD12 LEU B 6 2.671 -11.859 8.845 1.00 1.18 H new ATOM 0 HD13 LEU B 6 3.970 -13.009 9.240 1.00 1.18 H new ATOM 0 HD21 LEU B 6 2.195 -14.839 11.008 1.00 1.08 H new ATOM 0 HD22 LEU B 6 3.827 -14.310 11.481 1.00 1.08 H new ATOM 0 HD23 LEU B 6 2.443 -13.995 12.555 1.00 1.08 H new ATOM 1727 N THR B 7 4.940 -9.720 12.933 1.00 0.52 N ATOM 1728 CA THR B 7 5.852 -8.660 13.437 1.00 0.50 C ATOM 1729 C THR B 7 5.185 -7.269 13.342 1.00 0.48 C ATOM 1730 O THR B 7 4.202 -7.118 12.630 1.00 0.53 O ATOM 1731 CB THR B 7 7.199 -8.655 12.638 1.00 0.53 C ATOM 1732 OG1 THR B 7 7.623 -10.002 12.386 1.00 0.92 O ATOM 1733 CG2 THR B 7 8.317 -7.924 13.383 1.00 1.06 C ATOM 0 H THR B 7 5.255 -10.152 12.064 1.00 0.52 H new ATOM 0 HA THR B 7 6.065 -8.878 14.484 1.00 0.50 H new ATOM 0 HB THR B 7 7.010 -8.127 11.703 1.00 0.53 H new ATOM 0 HG1 THR B 7 7.531 -10.201 11.431 1.00 0.92 H new ATOM 0 HG21 THR B 7 9.229 -7.949 12.786 1.00 1.06 H new ATOM 0 HG22 THR B 7 8.024 -6.888 13.554 1.00 1.06 H new ATOM 0 HG23 THR B 7 8.496 -8.413 14.341 1.00 1.06 H new ATOM 1741 N GLU B 8 5.727 -6.260 14.063 1.00 0.49 N ATOM 1742 CA GLU B 8 5.178 -4.875 14.062 1.00 0.49 C ATOM 1743 C GLU B 8 4.950 -4.313 12.633 1.00 0.44 C ATOM 1744 O GLU B 8 3.912 -3.692 12.380 1.00 0.47 O ATOM 1745 CB GLU B 8 6.104 -3.933 14.867 1.00 0.54 C ATOM 1746 CG GLU B 8 5.483 -2.581 15.228 1.00 0.95 C ATOM 1747 CD GLU B 8 6.448 -1.671 15.970 1.00 1.01 C ATOM 1748 OE1 GLU B 8 7.222 -0.952 15.300 1.00 1.29 O ATOM 1749 OE2 GLU B 8 6.428 -1.675 17.221 1.00 1.51 O ATOM 0 H GLU B 8 6.548 -6.376 14.657 1.00 0.49 H new ATOM 0 HA GLU B 8 4.199 -4.924 14.539 1.00 0.49 H new ATOM 0 HB2 GLU B 8 6.403 -4.437 15.786 1.00 0.54 H new ATOM 0 HB3 GLU B 8 7.012 -3.758 14.290 1.00 0.54 H new ATOM 0 HG2 GLU B 8 5.150 -2.084 14.317 1.00 0.95 H new ATOM 0 HG3 GLU B 8 4.599 -2.745 15.844 1.00 0.95 H new ATOM 1756 N LEU B 9 5.914 -4.533 11.709 1.00 0.42 N ATOM 1757 CA LEU B 9 5.793 -4.047 10.310 1.00 0.39 C ATOM 1758 C LEU B 9 4.795 -4.908 9.512 1.00 0.38 C ATOM 1759 O LEU B 9 3.996 -4.375 8.736 1.00 0.39 O ATOM 1760 CB LEU B 9 7.162 -4.038 9.592 1.00 0.41 C ATOM 1761 CG LEU B 9 8.290 -3.229 10.273 1.00 0.50 C ATOM 1762 CD1 LEU B 9 9.617 -3.452 9.551 1.00 0.63 C ATOM 1763 CD2 LEU B 9 7.958 -1.734 10.337 1.00 0.65 C ATOM 0 H LEU B 9 6.778 -5.039 11.902 1.00 0.42 H new ATOM 0 HA LEU B 9 5.422 -3.023 10.358 1.00 0.39 H new ATOM 0 HB2 LEU B 9 7.498 -5.069 9.485 1.00 0.41 H new ATOM 0 HB3 LEU B 9 7.018 -3.643 8.586 1.00 0.41 H new ATOM 0 HG LEU B 9 8.381 -3.589 11.298 1.00 0.50 H new ATOM 0 HD11 LEU B 9 10.400 -2.875 10.043 1.00 0.63 H new ATOM 0 HD12 LEU B 9 9.873 -4.511 9.580 1.00 0.63 H new ATOM 0 HD13 LEU B 9 9.526 -3.129 8.514 1.00 0.63 H new ATOM 0 HD21 LEU B 9 8.775 -1.200 10.822 1.00 0.65 H new ATOM 0 HD22 LEU B 9 7.822 -1.348 9.327 1.00 0.65 H new ATOM 0 HD23 LEU B 9 7.041 -1.589 10.907 1.00 0.65 H new ATOM 1775 N GLU B 10 4.861 -6.245 9.705 1.00 0.39 N ATOM 1776 CA GLU B 10 3.954 -7.199 9.024 1.00 0.41 C ATOM 1777 C GLU B 10 2.509 -7.068 9.560 1.00 0.42 C ATOM 1778 O GLU B 10 1.547 -7.303 8.821 1.00 0.47 O ATOM 1779 CB GLU B 10 4.447 -8.651 9.212 1.00 0.46 C ATOM 1780 CG GLU B 10 5.885 -8.894 8.749 1.00 0.50 C ATOM 1781 CD GLU B 10 6.331 -10.338 8.919 1.00 0.56 C ATOM 1782 OE1 GLU B 10 5.615 -11.244 8.439 1.00 0.95 O ATOM 1783 OE2 GLU B 10 7.393 -10.562 9.536 1.00 0.95 O ATOM 0 H GLU B 10 5.535 -6.689 10.329 1.00 0.39 H new ATOM 0 HA GLU B 10 3.958 -6.957 7.961 1.00 0.41 H new ATOM 0 HB2 GLU B 10 4.368 -8.915 10.267 1.00 0.46 H new ATOM 0 HB3 GLU B 10 3.784 -9.321 8.665 1.00 0.46 H new ATOM 0 HG2 GLU B 10 5.975 -8.614 7.700 1.00 0.50 H new ATOM 0 HG3 GLU B 10 6.556 -8.244 9.311 1.00 0.50 H new ATOM 1790 N GLU B 11 2.378 -6.689 10.853 1.00 0.42 N ATOM 1791 CA GLU B 11 1.076 -6.510 11.522 1.00 0.45 C ATOM 1792 C GLU B 11 0.376 -5.219 11.052 1.00 0.43 C ATOM 1793 O GLU B 11 -0.852 -5.175 11.018 1.00 0.45 O ATOM 1794 CB GLU B 11 1.255 -6.495 13.058 1.00 0.51 C ATOM 1795 CG GLU B 11 -0.047 -6.634 13.848 1.00 0.62 C ATOM 1796 CD GLU B 11 0.173 -6.687 15.349 1.00 0.70 C ATOM 1797 OE1 GLU B 11 0.356 -7.801 15.885 1.00 0.82 O ATOM 1798 OE2 GLU B 11 0.160 -5.615 15.988 1.00 0.85 O ATOM 0 H GLU B 11 3.176 -6.499 11.459 1.00 0.42 H new ATOM 0 HA GLU B 11 0.443 -7.354 11.249 1.00 0.45 H new ATOM 0 HB2 GLU B 11 1.926 -7.306 13.341 1.00 0.51 H new ATOM 0 HB3 GLU B 11 1.742 -5.563 13.346 1.00 0.51 H new ATOM 0 HG2 GLU B 11 -0.700 -5.794 13.612 1.00 0.62 H new ATOM 0 HG3 GLU B 11 -0.564 -7.539 13.530 1.00 0.62 H new ATOM 1805 N SER B 12 1.162 -4.171 10.699 1.00 0.43 N ATOM 1806 CA SER B 12 0.606 -2.885 10.217 1.00 0.44 C ATOM 1807 C SER B 12 -0.192 -3.080 8.917 1.00 0.42 C ATOM 1808 O SER B 12 -1.359 -2.682 8.838 1.00 0.47 O ATOM 1809 CB SER B 12 1.731 -1.859 9.999 1.00 0.48 C ATOM 1810 OG SER B 12 2.259 -1.405 11.235 1.00 0.56 O ATOM 0 H SER B 12 2.181 -4.193 10.740 1.00 0.43 H new ATOM 0 HA SER B 12 -0.073 -2.507 10.981 1.00 0.44 H new ATOM 0 HB2 SER B 12 2.526 -2.308 9.404 1.00 0.48 H new ATOM 0 HB3 SER B 12 1.348 -1.011 9.431 1.00 0.48 H new ATOM 0 HG SER B 12 2.799 -2.115 11.640 1.00 0.56 H new ATOM 1816 N ILE B 13 0.446 -3.706 7.903 1.00 0.40 N ATOM 1817 CA ILE B 13 -0.211 -3.994 6.610 1.00 0.41 C ATOM 1818 C ILE B 13 -1.307 -5.082 6.760 1.00 0.41 C ATOM 1819 O ILE B 13 -2.202 -5.180 5.917 1.00 0.48 O ATOM 1820 CB ILE B 13 0.808 -4.388 5.475 1.00 0.46 C ATOM 1821 CG1 ILE B 13 1.753 -5.564 5.876 1.00 0.45 C ATOM 1822 CG2 ILE B 13 1.632 -3.166 5.059 1.00 0.53 C ATOM 1823 CD1 ILE B 13 1.174 -6.949 5.653 1.00 0.45 C ATOM 0 H ILE B 13 1.415 -4.021 7.956 1.00 0.40 H new ATOM 0 HA ILE B 13 -0.685 -3.062 6.301 1.00 0.41 H new ATOM 0 HB ILE B 13 0.214 -4.740 4.631 1.00 0.46 H new ATOM 0 HG12 ILE B 13 2.679 -5.477 5.308 1.00 0.45 H new ATOM 0 HG13 ILE B 13 2.013 -5.459 6.929 1.00 0.45 H new ATOM 0 HG21 ILE B 13 2.333 -3.450 4.274 1.00 0.53 H new ATOM 0 HG22 ILE B 13 0.966 -2.388 4.687 1.00 0.53 H new ATOM 0 HG23 ILE B 13 2.184 -2.789 5.920 1.00 0.53 H new ATOM 0 HD11 ILE B 13 1.901 -7.701 5.960 1.00 0.45 H new ATOM 0 HD12 ILE B 13 0.264 -7.062 6.242 1.00 0.45 H new ATOM 0 HD13 ILE B 13 0.941 -7.080 4.596 1.00 0.45 H new ATOM 1835 N GLU B 14 -1.217 -5.895 7.842 1.00 0.40 N ATOM 1836 CA GLU B 14 -2.201 -6.952 8.148 1.00 0.43 C ATOM 1837 C GLU B 14 -3.473 -6.350 8.784 1.00 0.45 C ATOM 1838 O GLU B 14 -4.579 -6.822 8.511 1.00 0.48 O ATOM 1839 CB GLU B 14 -1.557 -8.005 9.088 1.00 0.46 C ATOM 1840 CG GLU B 14 -2.525 -8.999 9.754 1.00 0.57 C ATOM 1841 CD GLU B 14 -3.054 -8.532 11.106 1.00 0.64 C ATOM 1842 OE1 GLU B 14 -2.268 -7.969 11.898 1.00 0.92 O ATOM 1843 OE2 GLU B 14 -4.259 -8.732 11.371 1.00 1.00 O ATOM 0 H GLU B 14 -0.460 -5.833 8.523 1.00 0.40 H new ATOM 0 HA GLU B 14 -2.496 -7.441 7.220 1.00 0.43 H new ATOM 0 HB2 GLU B 14 -0.823 -8.572 8.516 1.00 0.46 H new ATOM 0 HB3 GLU B 14 -1.013 -7.478 9.872 1.00 0.46 H new ATOM 0 HG2 GLU B 14 -3.368 -9.174 9.085 1.00 0.57 H new ATOM 0 HG3 GLU B 14 -2.017 -9.955 9.884 1.00 0.57 H new ATOM 1850 N THR B 15 -3.298 -5.318 9.646 1.00 0.45 N ATOM 1851 CA THR B 15 -4.425 -4.634 10.327 1.00 0.49 C ATOM 1852 C THR B 15 -5.436 -4.057 9.311 1.00 0.47 C ATOM 1853 O THR B 15 -6.646 -4.144 9.532 1.00 0.50 O ATOM 1854 CB THR B 15 -3.913 -3.503 11.272 1.00 0.54 C ATOM 1855 OG1 THR B 15 -2.907 -4.024 12.149 1.00 0.75 O ATOM 1856 CG2 THR B 15 -5.039 -2.896 12.117 1.00 0.88 C ATOM 0 H THR B 15 -2.382 -4.940 9.887 1.00 0.45 H new ATOM 0 HA THR B 15 -4.936 -5.385 10.929 1.00 0.49 H new ATOM 0 HB THR B 15 -3.504 -2.716 10.639 1.00 0.54 H new ATOM 0 HG1 THR B 15 -2.053 -4.077 11.672 1.00 0.75 H new ATOM 0 HG21 THR B 15 -4.632 -2.114 12.758 1.00 0.88 H new ATOM 0 HG22 THR B 15 -5.797 -2.469 11.460 1.00 0.88 H new ATOM 0 HG23 THR B 15 -5.490 -3.673 12.735 1.00 0.88 H new ATOM 1864 N VAL B 16 -4.929 -3.492 8.194 1.00 0.45 N ATOM 1865 CA VAL B 16 -5.788 -2.914 7.134 1.00 0.47 C ATOM 1866 C VAL B 16 -6.652 -4.012 6.455 1.00 0.47 C ATOM 1867 O VAL B 16 -7.757 -3.724 5.986 1.00 0.52 O ATOM 1868 CB VAL B 16 -4.936 -2.140 6.060 1.00 0.49 C ATOM 1869 CG1 VAL B 16 -5.799 -1.590 4.913 1.00 0.56 C ATOM 1870 CG2 VAL B 16 -4.145 -0.999 6.711 1.00 0.53 C ATOM 0 H VAL B 16 -3.930 -3.423 8.002 1.00 0.45 H new ATOM 0 HA VAL B 16 -6.456 -2.198 7.612 1.00 0.47 H new ATOM 0 HB VAL B 16 -4.241 -2.863 5.633 1.00 0.49 H new ATOM 0 HG11 VAL B 16 -5.164 -1.065 4.199 1.00 0.56 H new ATOM 0 HG12 VAL B 16 -6.305 -2.415 4.411 1.00 0.56 H new ATOM 0 HG13 VAL B 16 -6.541 -0.900 5.315 1.00 0.56 H new ATOM 0 HG21 VAL B 16 -3.564 -0.479 5.950 1.00 0.53 H new ATOM 0 HG22 VAL B 16 -4.836 -0.299 7.181 1.00 0.53 H new ATOM 0 HG23 VAL B 16 -3.472 -1.407 7.465 1.00 0.53 H new ATOM 1880 N VAL B 17 -6.142 -5.268 6.421 1.00 0.46 N ATOM 1881 CA VAL B 17 -6.860 -6.414 5.814 1.00 0.50 C ATOM 1882 C VAL B 17 -7.899 -7.029 6.793 1.00 0.57 C ATOM 1883 O VAL B 17 -8.849 -7.681 6.352 1.00 0.97 O ATOM 1884 CB VAL B 17 -5.857 -7.524 5.326 1.00 0.53 C ATOM 1885 CG1 VAL B 17 -6.571 -8.661 4.580 1.00 0.63 C ATOM 1886 CG2 VAL B 17 -4.748 -6.929 4.443 1.00 0.55 C ATOM 0 H VAL B 17 -5.231 -5.513 6.809 1.00 0.46 H new ATOM 0 HA VAL B 17 -7.398 -6.025 4.949 1.00 0.50 H new ATOM 0 HB VAL B 17 -5.402 -7.945 6.222 1.00 0.53 H new ATOM 0 HG11 VAL B 17 -5.839 -9.404 4.262 1.00 0.63 H new ATOM 0 HG12 VAL B 17 -7.299 -9.130 5.242 1.00 0.63 H new ATOM 0 HG13 VAL B 17 -7.082 -8.258 3.706 1.00 0.63 H new ATOM 0 HG21 VAL B 17 -4.073 -7.722 4.123 1.00 0.55 H new ATOM 0 HG22 VAL B 17 -5.194 -6.457 3.567 1.00 0.55 H new ATOM 0 HG23 VAL B 17 -4.190 -6.185 5.012 1.00 0.55 H new ATOM 1896 N THR B 18 -7.720 -6.824 8.115 1.00 0.50 N ATOM 1897 CA THR B 18 -8.654 -7.363 9.130 1.00 0.52 C ATOM 1898 C THR B 18 -9.695 -6.324 9.599 1.00 0.54 C ATOM 1899 O THR B 18 -10.665 -6.693 10.269 1.00 0.67 O ATOM 1900 CB THR B 18 -7.887 -7.899 10.370 1.00 0.56 C ATOM 1901 OG1 THR B 18 -6.971 -6.903 10.856 1.00 0.58 O ATOM 1902 CG2 THR B 18 -7.121 -9.179 10.039 1.00 0.62 C ATOM 0 H THR B 18 -6.942 -6.292 8.505 1.00 0.50 H new ATOM 0 HA THR B 18 -9.185 -8.179 8.639 1.00 0.52 H new ATOM 0 HB THR B 18 -8.622 -8.127 11.142 1.00 0.56 H new ATOM 0 HG1 THR B 18 -6.112 -7.324 11.068 1.00 0.58 H new ATOM 0 HG21 THR B 18 -6.595 -9.528 10.928 1.00 0.62 H new ATOM 0 HG22 THR B 18 -7.820 -9.946 9.706 1.00 0.62 H new ATOM 0 HG23 THR B 18 -6.400 -8.977 9.247 1.00 0.62 H new ATOM 1910 N THR B 19 -9.502 -5.032 9.245 1.00 0.53 N ATOM 1911 CA THR B 19 -10.418 -3.956 9.656 1.00 0.57 C ATOM 1912 C THR B 19 -11.432 -3.596 8.545 1.00 0.57 C ATOM 1913 O THR B 19 -12.640 -3.662 8.788 1.00 0.66 O ATOM 1914 CB THR B 19 -9.618 -2.688 10.089 1.00 0.60 C ATOM 1915 OG1 THR B 19 -8.598 -3.057 11.030 1.00 0.61 O ATOM 1916 CG2 THR B 19 -10.508 -1.628 10.741 1.00 0.69 C ATOM 0 H THR B 19 -8.718 -4.715 8.675 1.00 0.53 H new ATOM 0 HA THR B 19 -10.986 -4.328 10.509 1.00 0.57 H new ATOM 0 HB THR B 19 -9.185 -2.264 9.183 1.00 0.60 H new ATOM 0 HG1 THR B 19 -7.751 -3.193 10.557 1.00 0.61 H new ATOM 0 HG21 THR B 19 -9.902 -0.767 11.023 1.00 0.69 H new ATOM 0 HG22 THR B 19 -11.277 -1.314 10.035 1.00 0.69 H new ATOM 0 HG23 THR B 19 -10.980 -2.046 11.630 1.00 0.69 H new ATOM 1924 N PHE B 20 -10.949 -3.222 7.335 1.00 0.56 N ATOM 1925 CA PHE B 20 -11.853 -2.827 6.227 1.00 0.60 C ATOM 1926 C PHE B 20 -12.193 -3.981 5.258 1.00 0.60 C ATOM 1927 O PHE B 20 -13.350 -4.092 4.838 1.00 0.94 O ATOM 1928 CB PHE B 20 -11.284 -1.631 5.433 1.00 0.68 C ATOM 1929 CG PHE B 20 -12.246 -1.108 4.378 1.00 0.75 C ATOM 1930 CD1 PHE B 20 -13.408 -0.438 4.746 1.00 0.91 C ATOM 1931 CD2 PHE B 20 -12.004 -1.315 3.025 1.00 0.80 C ATOM 1932 CE1 PHE B 20 -14.297 0.017 3.792 1.00 1.02 C ATOM 1933 CE2 PHE B 20 -12.897 -0.864 2.070 1.00 0.90 C ATOM 1934 CZ PHE B 20 -14.041 -0.196 2.454 1.00 0.97 C ATOM 0 H PHE B 20 -9.956 -3.186 7.104 1.00 0.56 H new ATOM 0 HA PHE B 20 -12.784 -2.534 6.712 1.00 0.60 H new ATOM 0 HB2 PHE B 20 -11.039 -0.825 6.125 1.00 0.68 H new ATOM 0 HB3 PHE B 20 -10.353 -1.931 4.952 1.00 0.68 H new ATOM 0 HD1 PHE B 20 -13.618 -0.271 5.792 1.00 0.91 H new ATOM 0 HD2 PHE B 20 -11.109 -1.834 2.716 1.00 0.80 H new ATOM 0 HE1 PHE B 20 -15.193 0.540 4.094 1.00 1.02 H new ATOM 0 HE2 PHE B 20 -12.698 -1.035 1.022 1.00 0.90 H new ATOM 0 HZ PHE B 20 -14.736 0.160 1.707 1.00 0.97 H new ATOM 1944 N PHE B 21 -11.203 -4.827 4.889 1.00 0.71 N ATOM 1945 CA PHE B 21 -11.447 -5.953 3.945 1.00 0.72 C ATOM 1946 C PHE B 21 -12.526 -6.950 4.450 1.00 0.68 C ATOM 1947 O PHE B 21 -13.039 -7.746 3.656 1.00 0.71 O ATOM 1948 CB PHE B 21 -10.130 -6.686 3.590 1.00 1.01 C ATOM 1949 CG PHE B 21 -9.318 -6.006 2.500 1.00 1.63 C ATOM 1950 CD1 PHE B 21 -8.556 -4.877 2.778 1.00 1.93 C ATOM 1951 CD2 PHE B 21 -9.321 -6.497 1.198 1.00 2.26 C ATOM 1952 CE1 PHE B 21 -7.818 -4.258 1.788 1.00 2.67 C ATOM 1953 CE2 PHE B 21 -8.585 -5.876 0.207 1.00 2.92 C ATOM 1954 CZ PHE B 21 -7.833 -4.757 0.503 1.00 3.08 C ATOM 0 H PHE B 21 -10.241 -4.757 5.222 1.00 0.71 H new ATOM 0 HA PHE B 21 -11.846 -5.505 3.035 1.00 0.72 H new ATOM 0 HB2 PHE B 21 -9.518 -6.767 4.488 1.00 1.01 H new ATOM 0 HB3 PHE B 21 -10.366 -7.702 3.273 1.00 1.01 H new ATOM 0 HD1 PHE B 21 -8.541 -4.478 3.782 1.00 1.93 H new ATOM 0 HD2 PHE B 21 -9.905 -7.373 0.959 1.00 2.26 H new ATOM 0 HE1 PHE B 21 -7.229 -3.383 2.021 1.00 2.67 H new ATOM 0 HE2 PHE B 21 -8.598 -6.266 -0.800 1.00 2.92 H new ATOM 0 HZ PHE B 21 -7.257 -4.273 -0.272 1.00 3.08 H new ATOM 1964 N THR B 22 -12.859 -6.913 5.765 1.00 0.76 N ATOM 1965 CA THR B 22 -13.927 -7.762 6.338 1.00 0.91 C ATOM 1966 C THR B 22 -15.308 -7.294 5.809 1.00 0.84 C ATOM 1967 O THR B 22 -16.179 -8.119 5.513 1.00 1.01 O ATOM 1968 CB THR B 22 -13.929 -7.717 7.903 1.00 1.10 C ATOM 1969 OG1 THR B 22 -12.585 -7.831 8.409 1.00 1.23 O ATOM 1970 CG2 THR B 22 -14.792 -8.825 8.513 1.00 1.37 C ATOM 0 H THR B 22 -12.403 -6.305 6.445 1.00 0.76 H new ATOM 0 HA THR B 22 -13.734 -8.790 6.030 1.00 0.91 H new ATOM 0 HB THR B 22 -14.357 -6.757 8.192 1.00 1.10 H new ATOM 0 HG1 THR B 22 -12.408 -7.099 9.036 1.00 1.23 H new ATOM 0 HG21 THR B 22 -14.762 -8.753 9.600 1.00 1.37 H new ATOM 0 HG22 THR B 22 -15.821 -8.715 8.170 1.00 1.37 H new ATOM 0 HG23 THR B 22 -14.408 -9.797 8.203 1.00 1.37 H new ATOM 1978 N PHE B 23 -15.484 -5.955 5.701 1.00 0.69 N ATOM 1979 CA PHE B 23 -16.730 -5.337 5.185 1.00 0.75 C ATOM 1980 C PHE B 23 -16.750 -5.287 3.637 1.00 0.70 C ATOM 1981 O PHE B 23 -17.816 -5.101 3.041 1.00 0.83 O ATOM 1982 CB PHE B 23 -16.883 -3.897 5.725 1.00 0.84 C ATOM 1983 CG PHE B 23 -17.013 -3.790 7.232 1.00 1.00 C ATOM 1984 CD1 PHE B 23 -18.256 -3.878 7.850 1.00 1.32 C ATOM 1985 CD2 PHE B 23 -15.889 -3.595 8.027 1.00 1.03 C ATOM 1986 CE1 PHE B 23 -18.371 -3.775 9.223 1.00 1.54 C ATOM 1987 CE2 PHE B 23 -16.002 -3.491 9.399 1.00 1.27 C ATOM 1988 CZ PHE B 23 -17.243 -3.580 9.997 1.00 1.48 C ATOM 0 H PHE B 23 -14.771 -5.276 5.967 1.00 0.69 H new ATOM 0 HA PHE B 23 -17.557 -5.959 5.528 1.00 0.75 H new ATOM 0 HB2 PHE B 23 -16.020 -3.312 5.407 1.00 0.84 H new ATOM 0 HB3 PHE B 23 -17.762 -3.444 5.266 1.00 0.84 H new ATOM 0 HD1 PHE B 23 -19.141 -4.029 7.250 1.00 1.32 H new ATOM 0 HD2 PHE B 23 -14.915 -3.524 7.565 1.00 1.03 H new ATOM 0 HE1 PHE B 23 -19.342 -3.847 9.691 1.00 1.54 H new ATOM 0 HE2 PHE B 23 -15.120 -3.340 10.004 1.00 1.27 H new ATOM 0 HZ PHE B 23 -17.332 -3.497 11.070 1.00 1.48 H new ATOM 1998 N ALA B 24 -15.571 -5.473 2.994 1.00 0.61 N ATOM 1999 CA ALA B 24 -15.438 -5.417 1.523 1.00 0.67 C ATOM 2000 C ALA B 24 -15.830 -6.733 0.800 1.00 0.65 C ATOM 2001 O ALA B 24 -15.671 -6.830 -0.421 1.00 0.85 O ATOM 2002 CB ALA B 24 -14.012 -5.008 1.158 1.00 0.77 C ATOM 0 H ALA B 24 -14.694 -5.664 3.479 1.00 0.61 H new ATOM 0 HA ALA B 24 -16.151 -4.671 1.172 1.00 0.67 H new ATOM 0 HB1 ALA B 24 -13.912 -4.966 0.073 1.00 0.77 H new ATOM 0 HB2 ALA B 24 -13.795 -4.027 1.581 1.00 0.77 H new ATOM 0 HB3 ALA B 24 -13.310 -5.739 1.559 1.00 0.77 H new ATOM 2008 N ARG B 25 -16.346 -7.736 1.546 1.00 0.62 N ATOM 2009 CA ARG B 25 -16.777 -9.030 0.963 1.00 0.68 C ATOM 2010 C ARG B 25 -18.200 -8.958 0.347 1.00 0.70 C ATOM 2011 O ARG B 25 -18.681 -9.955 -0.199 1.00 0.87 O ATOM 2012 CB ARG B 25 -16.726 -10.148 2.039 1.00 0.77 C ATOM 2013 CG ARG B 25 -17.688 -9.951 3.223 1.00 0.80 C ATOM 2014 CD ARG B 25 -17.454 -10.963 4.345 1.00 1.01 C ATOM 2015 NE ARG B 25 -18.228 -10.650 5.565 1.00 1.10 N ATOM 2016 CZ ARG B 25 -18.403 -11.492 6.606 1.00 1.38 C ATOM 2017 NH1 ARG B 25 -17.881 -12.725 6.606 1.00 1.73 N ATOM 2018 NH2 ARG B 25 -19.106 -11.088 7.667 1.00 1.48 N ATOM 0 H ARG B 25 -16.475 -7.675 2.556 1.00 0.62 H new ATOM 0 HA ARG B 25 -16.082 -9.263 0.156 1.00 0.68 H new ATOM 0 HB2 ARG B 25 -16.951 -11.102 1.562 1.00 0.77 H new ATOM 0 HB3 ARG B 25 -15.708 -10.216 2.424 1.00 0.77 H new ATOM 0 HG2 ARG B 25 -17.570 -8.942 3.618 1.00 0.80 H new ATOM 0 HG3 ARG B 25 -18.716 -10.037 2.870 1.00 0.80 H new ATOM 0 HD2 ARG B 25 -17.725 -11.959 3.993 1.00 1.01 H new ATOM 0 HD3 ARG B 25 -16.392 -10.989 4.590 1.00 1.01 H new ATOM 0 HE ARG B 25 -18.662 -9.729 5.625 1.00 1.10 H new ATOM 0 HH11 ARG B 25 -17.336 -13.048 5.807 1.00 1.73 H new ATOM 0 HH12 ARG B 25 -18.028 -13.341 7.405 1.00 1.73 H new ATOM 0 HH21 ARG B 25 -19.506 -10.150 7.687 1.00 1.48 H new ATOM 0 HH22 ARG B 25 -19.243 -11.718 8.458 1.00 1.48 H new ATOM 2032 N GLN B 26 -18.864 -7.779 0.431 1.00 0.71 N ATOM 2033 CA GLN B 26 -20.230 -7.593 -0.098 1.00 0.79 C ATOM 2034 C GLN B 26 -20.286 -7.759 -1.633 1.00 0.73 C ATOM 2035 O GLN B 26 -21.116 -8.525 -2.135 1.00 0.84 O ATOM 2036 CB GLN B 26 -20.783 -6.218 0.340 1.00 0.90 C ATOM 2037 CG GLN B 26 -22.293 -6.048 0.144 1.00 1.09 C ATOM 2038 CD GLN B 26 -22.872 -4.841 0.883 1.00 1.31 C ATOM 2039 OE1 GLN B 26 -22.206 -3.814 1.044 1.00 1.46 O ATOM 2040 NE2 GLN B 26 -24.122 -4.957 1.345 1.00 1.68 N ATOM 0 H GLN B 26 -18.471 -6.943 0.862 1.00 0.71 H new ATOM 0 HA GLN B 26 -20.863 -8.375 0.321 1.00 0.79 H new ATOM 0 HB2 GLN B 26 -20.547 -6.064 1.393 1.00 0.90 H new ATOM 0 HB3 GLN B 26 -20.267 -5.438 -0.220 1.00 0.90 H new ATOM 0 HG2 GLN B 26 -22.504 -5.948 -0.921 1.00 1.09 H new ATOM 0 HG3 GLN B 26 -22.800 -6.951 0.486 1.00 1.09 H new ATOM 0 HE21 GLN B 26 -24.643 -5.820 1.194 1.00 1.68 H new ATOM 0 HE22 GLN B 26 -24.554 -4.182 1.848 1.00 1.68 H new ATOM 2049 N GLU B 27 -19.399 -7.054 -2.366 1.00 0.66 N ATOM 2050 CA GLU B 27 -19.349 -7.142 -3.841 1.00 0.71 C ATOM 2051 C GLU B 27 -18.460 -8.330 -4.279 1.00 0.88 C ATOM 2052 O GLU B 27 -17.940 -9.058 -3.423 1.00 1.45 O ATOM 2053 CB GLU B 27 -18.850 -5.806 -4.446 1.00 0.83 C ATOM 2054 CG GLU B 27 -19.849 -4.647 -4.339 1.00 0.93 C ATOM 2055 CD GLU B 27 -21.054 -4.796 -5.259 1.00 1.04 C ATOM 2056 OE1 GLU B 27 -22.061 -5.395 -4.828 1.00 1.16 O ATOM 2057 OE2 GLU B 27 -20.985 -4.310 -6.408 1.00 1.23 O ATOM 0 H GLU B 27 -18.710 -6.420 -1.962 1.00 0.66 H new ATOM 0 HA GLU B 27 -20.355 -7.322 -4.219 1.00 0.71 H new ATOM 0 HB2 GLU B 27 -17.925 -5.519 -3.947 1.00 0.83 H new ATOM 0 HB3 GLU B 27 -18.609 -5.965 -5.497 1.00 0.83 H new ATOM 0 HG2 GLU B 27 -20.196 -4.571 -3.308 1.00 0.93 H new ATOM 0 HG3 GLU B 27 -19.337 -3.714 -4.573 1.00 0.93 H new ATOM 2064 N GLY B 28 -18.295 -8.533 -5.609 1.00 0.73 N ATOM 2065 CA GLY B 28 -17.481 -9.641 -6.137 1.00 0.86 C ATOM 2066 C GLY B 28 -16.067 -9.735 -5.548 1.00 0.69 C ATOM 2067 O GLY B 28 -15.437 -8.706 -5.288 1.00 0.66 O ATOM 0 H GLY B 28 -18.715 -7.944 -6.328 1.00 0.73 H new ATOM 0 HA2 GLY B 28 -18.002 -10.579 -5.947 1.00 0.86 H new ATOM 0 HA3 GLY B 28 -17.403 -9.533 -7.219 1.00 0.86 H new ATOM 2071 N ARG B 29 -15.573 -10.985 -5.350 1.00 0.68 N ATOM 2072 CA ARG B 29 -14.230 -11.269 -4.785 1.00 0.65 C ATOM 2073 C ARG B 29 -14.101 -10.844 -3.309 1.00 0.62 C ATOM 2074 O ARG B 29 -14.723 -9.870 -2.872 1.00 0.69 O ATOM 2075 CB ARG B 29 -13.091 -10.618 -5.624 1.00 0.66 C ATOM 2076 CG ARG B 29 -12.317 -11.594 -6.514 1.00 0.84 C ATOM 2077 CD ARG B 29 -13.079 -11.952 -7.790 1.00 1.28 C ATOM 2078 NE ARG B 29 -12.255 -12.702 -8.754 1.00 1.44 N ATOM 2079 CZ ARG B 29 -12.713 -13.226 -9.912 1.00 1.93 C ATOM 2080 NH1 ARG B 29 -13.986 -13.052 -10.297 1.00 2.62 N ATOM 2081 NH2 ARG B 29 -11.885 -13.916 -10.696 1.00 2.09 N ATOM 0 H ARG B 29 -16.099 -11.828 -5.580 1.00 0.68 H new ATOM 0 HA ARG B 29 -14.120 -12.352 -4.832 1.00 0.65 H new ATOM 0 HB2 ARG B 29 -13.521 -9.837 -6.252 1.00 0.66 H new ATOM 0 HB3 ARG B 29 -12.390 -10.132 -4.945 1.00 0.66 H new ATOM 0 HG2 ARG B 29 -11.356 -11.154 -6.780 1.00 0.84 H new ATOM 0 HG3 ARG B 29 -12.107 -12.504 -5.953 1.00 0.84 H new ATOM 0 HD2 ARG B 29 -13.956 -12.545 -7.530 1.00 1.28 H new ATOM 0 HD3 ARG B 29 -13.440 -11.038 -8.261 1.00 1.28 H new ATOM 0 HE ARG B 29 -11.269 -12.835 -8.531 1.00 1.44 H new ATOM 0 HH11 ARG B 29 -14.627 -12.516 -9.712 1.00 2.62 H new ATOM 0 HH12 ARG B 29 -14.313 -13.455 -11.175 1.00 2.62 H new ATOM 0 HH21 ARG B 29 -10.912 -14.046 -10.420 1.00 2.09 H new ATOM 0 HH22 ARG B 29 -12.225 -14.314 -11.571 1.00 2.09 H new ATOM 2095 N LYS B 30 -13.269 -11.592 -2.552 1.00 0.64 N ATOM 2096 CA LYS B 30 -13.006 -11.313 -1.126 1.00 0.65 C ATOM 2097 C LYS B 30 -11.780 -10.397 -0.984 1.00 0.63 C ATOM 2098 O LYS B 30 -11.763 -9.517 -0.119 1.00 0.67 O ATOM 2099 CB LYS B 30 -12.776 -12.619 -0.335 1.00 0.73 C ATOM 2100 CG LYS B 30 -13.952 -13.603 -0.359 1.00 0.79 C ATOM 2101 CD LYS B 30 -15.135 -13.135 0.499 1.00 0.87 C ATOM 2102 CE LYS B 30 -16.321 -14.105 0.431 1.00 1.01 C ATOM 2103 NZ LYS B 30 -17.102 -13.974 -0.836 1.00 1.11 N ATOM 0 H LYS B 30 -12.764 -12.402 -2.911 1.00 0.64 H new ATOM 0 HA LYS B 30 -13.882 -10.813 -0.714 1.00 0.65 H new ATOM 0 HB2 LYS B 30 -11.894 -13.119 -0.736 1.00 0.73 H new ATOM 0 HB3 LYS B 30 -12.555 -12.365 0.702 1.00 0.73 H new ATOM 0 HG2 LYS B 30 -14.286 -13.738 -1.388 1.00 0.79 H new ATOM 0 HG3 LYS B 30 -13.613 -14.576 -0.003 1.00 0.79 H new ATOM 0 HD2 LYS B 30 -14.812 -13.032 1.535 1.00 0.87 H new ATOM 0 HD3 LYS B 30 -15.456 -12.148 0.165 1.00 0.87 H new ATOM 0 HE2 LYS B 30 -15.954 -15.127 0.523 1.00 1.01 H new ATOM 0 HE3 LYS B 30 -16.981 -13.926 1.280 1.00 1.01 H new ATOM 0 HZ1 LYS B 30 -17.891 -14.652 -0.829 1.00 1.11 H new ATOM 0 HZ2 LYS B 30 -17.477 -13.007 -0.914 1.00 1.11 H new ATOM 0 HZ3 LYS B 30 -16.483 -14.172 -1.648 1.00 1.11 H new ATOM 2117 N ASP B 31 -10.755 -10.610 -1.845 1.00 0.65 N ATOM 2118 CA ASP B 31 -9.526 -9.792 -1.839 1.00 0.69 C ATOM 2119 C ASP B 31 -9.682 -8.577 -2.784 1.00 0.64 C ATOM 2120 O ASP B 31 -8.848 -8.334 -3.666 1.00 0.88 O ATOM 2121 CB ASP B 31 -8.305 -10.654 -2.237 1.00 0.83 C ATOM 2122 CG ASP B 31 -8.019 -11.769 -1.239 1.00 0.94 C ATOM 2123 OD1 ASP B 31 -7.808 -11.462 -0.046 1.00 1.36 O ATOM 2124 OD2 ASP B 31 -8.011 -12.950 -1.652 1.00 1.24 O ATOM 0 H ASP B 31 -10.759 -11.345 -2.553 1.00 0.65 H new ATOM 0 HA ASP B 31 -9.360 -9.415 -0.830 1.00 0.69 H new ATOM 0 HB2 ASP B 31 -8.479 -11.089 -3.221 1.00 0.83 H new ATOM 0 HB3 ASP B 31 -7.427 -10.014 -2.322 1.00 0.83 H new ATOM 2129 N SER B 32 -10.777 -7.813 -2.576 1.00 0.65 N ATOM 2130 CA SER B 32 -11.093 -6.619 -3.374 1.00 0.59 C ATOM 2131 C SER B 32 -11.924 -5.624 -2.551 1.00 0.57 C ATOM 2132 O SER B 32 -12.593 -6.013 -1.587 1.00 0.64 O ATOM 2133 CB SER B 32 -11.853 -7.008 -4.657 1.00 0.59 C ATOM 2134 OG SER B 32 -13.089 -7.640 -4.363 1.00 1.13 O ATOM 0 H SER B 32 -11.464 -8.011 -1.848 1.00 0.65 H new ATOM 0 HA SER B 32 -10.154 -6.142 -3.656 1.00 0.59 H new ATOM 0 HB2 SER B 32 -12.034 -6.116 -5.257 1.00 0.59 H new ATOM 0 HB3 SER B 32 -11.236 -7.677 -5.257 1.00 0.59 H new ATOM 0 HG SER B 32 -13.572 -7.817 -5.197 1.00 1.13 H new ATOM 2140 N LEU B 33 -11.879 -4.342 -2.946 1.00 0.55 N ATOM 2141 CA LEU B 33 -12.611 -3.272 -2.260 1.00 0.56 C ATOM 2142 C LEU B 33 -13.751 -2.767 -3.158 1.00 0.55 C ATOM 2143 O LEU B 33 -13.536 -2.510 -4.347 1.00 0.72 O ATOM 2144 CB LEU B 33 -11.656 -2.117 -1.881 1.00 0.59 C ATOM 2145 CG LEU B 33 -10.355 -2.527 -1.125 1.00 0.69 C ATOM 2146 CD1 LEU B 33 -9.237 -2.934 -2.096 1.00 0.79 C ATOM 2147 CD2 LEU B 33 -9.874 -1.404 -0.208 1.00 0.75 C ATOM 0 H LEU B 33 -11.335 -4.021 -3.747 1.00 0.55 H new ATOM 0 HA LEU B 33 -13.039 -3.667 -1.339 1.00 0.56 H new ATOM 0 HB2 LEU B 33 -11.373 -1.592 -2.793 1.00 0.59 H new ATOM 0 HB3 LEU B 33 -12.204 -1.407 -1.262 1.00 0.59 H new ATOM 0 HG LEU B 33 -10.602 -3.395 -0.513 1.00 0.69 H new ATOM 0 HD11 LEU B 33 -8.348 -3.213 -1.531 1.00 0.79 H new ATOM 0 HD12 LEU B 33 -9.567 -3.783 -2.695 1.00 0.79 H new ATOM 0 HD13 LEU B 33 -9.002 -2.096 -2.752 1.00 0.79 H new ATOM 0 HD21 LEU B 33 -8.966 -1.718 0.306 1.00 0.75 H new ATOM 0 HD22 LEU B 33 -9.666 -0.514 -0.801 1.00 0.75 H new ATOM 0 HD23 LEU B 33 -10.647 -1.178 0.527 1.00 0.75 H new ATOM 2159 N SER B 34 -14.963 -2.631 -2.583 1.00 0.52 N ATOM 2160 CA SER B 34 -16.154 -2.175 -3.337 1.00 0.53 C ATOM 2161 C SER B 34 -15.989 -0.730 -3.848 1.00 0.50 C ATOM 2162 O SER B 34 -15.405 0.111 -3.160 1.00 0.52 O ATOM 2163 CB SER B 34 -17.411 -2.302 -2.459 1.00 0.62 C ATOM 2164 OG SER B 34 -18.584 -1.910 -3.152 1.00 0.69 O ATOM 0 H SER B 34 -15.145 -2.830 -1.599 1.00 0.52 H new ATOM 0 HA SER B 34 -16.264 -2.815 -4.212 1.00 0.53 H new ATOM 0 HB2 SER B 34 -17.516 -3.334 -2.123 1.00 0.62 H new ATOM 0 HB3 SER B 34 -17.294 -1.687 -1.567 1.00 0.62 H new ATOM 0 HG SER B 34 -19.360 -2.007 -2.562 1.00 0.69 H new ATOM 2170 N VAL B 35 -16.527 -0.453 -5.061 1.00 0.52 N ATOM 2171 CA VAL B 35 -16.427 0.883 -5.694 1.00 0.53 C ATOM 2172 C VAL B 35 -17.234 1.980 -4.941 1.00 0.48 C ATOM 2173 O VAL B 35 -16.938 3.172 -5.089 1.00 0.52 O ATOM 2174 CB VAL B 35 -16.837 0.831 -7.209 1.00 0.64 C ATOM 2175 CG1 VAL B 35 -18.347 0.623 -7.407 1.00 0.67 C ATOM 2176 CG2 VAL B 35 -16.340 2.073 -7.967 1.00 0.71 C ATOM 0 H VAL B 35 -17.035 -1.139 -5.620 1.00 0.52 H new ATOM 0 HA VAL B 35 -15.377 1.168 -5.627 1.00 0.53 H new ATOM 0 HB VAL B 35 -16.344 -0.043 -7.634 1.00 0.64 H new ATOM 0 HG11 VAL B 35 -18.574 0.595 -8.473 1.00 0.67 H new ATOM 0 HG12 VAL B 35 -18.648 -0.318 -6.947 1.00 0.67 H new ATOM 0 HG13 VAL B 35 -18.892 1.445 -6.942 1.00 0.67 H new ATOM 0 HG21 VAL B 35 -16.640 2.006 -9.013 1.00 0.71 H new ATOM 0 HG22 VAL B 35 -16.774 2.969 -7.522 1.00 0.71 H new ATOM 0 HG23 VAL B 35 -15.253 2.127 -7.905 1.00 0.71 H new ATOM 2186 N ASN B 36 -18.241 1.573 -4.141 1.00 0.47 N ATOM 2187 CA ASN B 36 -19.078 2.516 -3.374 1.00 0.48 C ATOM 2188 C ASN B 36 -18.589 2.655 -1.914 1.00 0.46 C ATOM 2189 O ASN B 36 -18.709 3.736 -1.328 1.00 0.66 O ATOM 2190 CB ASN B 36 -20.550 2.051 -3.408 1.00 0.55 C ATOM 2191 CG ASN B 36 -21.544 3.167 -3.094 1.00 0.64 C ATOM 2192 OD1 ASN B 36 -22.010 3.862 -3.999 1.00 0.83 O ATOM 2193 ND2 ASN B 36 -21.875 3.347 -1.814 1.00 0.79 N ATOM 0 H ASN B 36 -18.494 0.594 -4.010 1.00 0.47 H new ATOM 0 HA ASN B 36 -18.997 3.498 -3.839 1.00 0.48 H new ATOM 0 HB2 ASN B 36 -20.772 1.643 -4.394 1.00 0.55 H new ATOM 0 HB3 ASN B 36 -20.685 1.242 -2.690 1.00 0.55 H new ATOM 0 HD21 ASN B 36 -22.535 4.080 -1.556 1.00 0.79 H new ATOM 0 HD22 ASN B 36 -21.468 2.751 -1.093 1.00 0.79 H new ATOM 2200 N GLU B 37 -18.037 1.562 -1.334 1.00 0.46 N ATOM 2201 CA GLU B 37 -17.553 1.563 0.067 1.00 0.50 C ATOM 2202 C GLU B 37 -16.173 2.240 0.233 1.00 0.45 C ATOM 2203 O GLU B 37 -15.922 2.849 1.276 1.00 0.46 O ATOM 2204 CB GLU B 37 -17.500 0.128 0.638 1.00 0.62 C ATOM 2205 CG GLU B 37 -18.867 -0.558 0.735 1.00 0.69 C ATOM 2206 CD GLU B 37 -18.796 -1.945 1.356 1.00 0.88 C ATOM 2207 OE1 GLU B 37 -18.625 -2.036 2.591 1.00 1.61 O ATOM 2208 OE2 GLU B 37 -18.913 -2.940 0.608 1.00 1.28 O ATOM 0 H GLU B 37 -17.916 0.670 -1.814 1.00 0.46 H new ATOM 0 HA GLU B 37 -18.275 2.154 0.630 1.00 0.50 H new ATOM 0 HB2 GLU B 37 -16.846 -0.477 0.011 1.00 0.62 H new ATOM 0 HB3 GLU B 37 -17.050 0.160 1.630 1.00 0.62 H new ATOM 0 HG2 GLU B 37 -19.538 0.065 1.327 1.00 0.69 H new ATOM 0 HG3 GLU B 37 -19.300 -0.635 -0.262 1.00 0.69 H new ATOM 2215 N PHE B 38 -15.273 2.137 -0.783 1.00 0.43 N ATOM 2216 CA PHE B 38 -13.926 2.761 -0.692 1.00 0.43 C ATOM 2217 C PHE B 38 -14.015 4.304 -0.644 1.00 0.39 C ATOM 2218 O PHE B 38 -13.187 4.949 0.005 1.00 0.42 O ATOM 2219 CB PHE B 38 -12.974 2.266 -1.827 1.00 0.48 C ATOM 2220 CG PHE B 38 -12.890 3.136 -3.079 1.00 0.46 C ATOM 2221 CD1 PHE B 38 -13.816 3.002 -4.103 1.00 0.52 C ATOM 2222 CD2 PHE B 38 -11.873 4.080 -3.228 1.00 0.55 C ATOM 2223 CE1 PHE B 38 -13.736 3.780 -5.240 1.00 0.61 C ATOM 2224 CE2 PHE B 38 -11.794 4.860 -4.366 1.00 0.65 C ATOM 2225 CZ PHE B 38 -12.725 4.710 -5.373 1.00 0.66 C ATOM 0 H PHE B 38 -15.451 1.639 -1.655 1.00 0.43 H new ATOM 0 HA PHE B 38 -13.486 2.436 0.250 1.00 0.43 H new ATOM 0 HB2 PHE B 38 -11.971 2.169 -1.412 1.00 0.48 H new ATOM 0 HB3 PHE B 38 -13.292 1.268 -2.127 1.00 0.48 H new ATOM 0 HD1 PHE B 38 -14.612 2.278 -4.009 1.00 0.52 H new ATOM 0 HD2 PHE B 38 -11.139 4.202 -2.445 1.00 0.55 H new ATOM 0 HE1 PHE B 38 -14.466 3.661 -6.027 1.00 0.61 H new ATOM 0 HE2 PHE B 38 -11.003 5.588 -4.467 1.00 0.65 H new ATOM 0 HZ PHE B 38 -12.663 5.319 -6.263 1.00 0.66 H new ATOM 2235 N LYS B 39 -15.021 4.885 -1.334 1.00 0.37 N ATOM 2236 CA LYS B 39 -15.234 6.348 -1.349 1.00 0.38 C ATOM 2237 C LYS B 39 -15.740 6.848 0.022 1.00 0.36 C ATOM 2238 O LYS B 39 -15.344 7.927 0.474 1.00 0.39 O ATOM 2239 CB LYS B 39 -16.234 6.733 -2.460 1.00 0.43 C ATOM 2240 CG LYS B 39 -16.344 8.238 -2.730 1.00 0.50 C ATOM 2241 CD LYS B 39 -17.359 8.547 -3.833 1.00 0.60 C ATOM 2242 CE LYS B 39 -17.657 10.046 -3.958 1.00 0.70 C ATOM 2243 NZ LYS B 39 -16.471 10.847 -4.392 1.00 0.81 N ATOM 0 H LYS B 39 -15.699 4.362 -1.888 1.00 0.37 H new ATOM 0 HA LYS B 39 -14.277 6.827 -1.554 1.00 0.38 H new ATOM 0 HB2 LYS B 39 -15.941 6.233 -3.383 1.00 0.43 H new ATOM 0 HB3 LYS B 39 -17.219 6.353 -2.190 1.00 0.43 H new ATOM 0 HG2 LYS B 39 -16.636 8.751 -1.814 1.00 0.50 H new ATOM 0 HG3 LYS B 39 -15.367 8.628 -3.016 1.00 0.50 H new ATOM 0 HD2 LYS B 39 -16.980 8.175 -4.785 1.00 0.60 H new ATOM 0 HD3 LYS B 39 -18.286 8.012 -3.628 1.00 0.60 H new ATOM 0 HE2 LYS B 39 -18.467 10.191 -4.673 1.00 0.70 H new ATOM 0 HE3 LYS B 39 -18.009 10.421 -2.997 1.00 0.70 H new ATOM 0 HZ1 LYS B 39 -16.756 11.836 -4.540 1.00 0.81 H new ATOM 0 HZ2 LYS B 39 -15.736 10.804 -3.658 1.00 0.81 H new ATOM 0 HZ3 LYS B 39 -16.096 10.458 -5.281 1.00 0.81 H new ATOM 2257 N GLU B 40 -16.624 6.055 0.669 1.00 0.35 N ATOM 2258 CA GLU B 40 -17.177 6.402 1.994 1.00 0.38 C ATOM 2259 C GLU B 40 -16.134 6.194 3.112 1.00 0.38 C ATOM 2260 O GLU B 40 -16.181 6.889 4.131 1.00 0.41 O ATOM 2261 CB GLU B 40 -18.450 5.583 2.283 1.00 0.43 C ATOM 2262 CG GLU B 40 -19.616 5.923 1.354 1.00 0.47 C ATOM 2263 CD GLU B 40 -20.901 5.204 1.726 1.00 0.56 C ATOM 2264 OE1 GLU B 40 -21.075 4.040 1.305 1.00 0.63 O ATOM 2265 OE2 GLU B 40 -21.737 5.809 2.430 1.00 0.69 O ATOM 0 H GLU B 40 -16.968 5.171 0.294 1.00 0.35 H new ATOM 0 HA GLU B 40 -17.440 7.460 1.976 1.00 0.38 H new ATOM 0 HB2 GLU B 40 -18.219 4.522 2.190 1.00 0.43 H new ATOM 0 HB3 GLU B 40 -18.756 5.754 3.315 1.00 0.43 H new ATOM 0 HG2 GLU B 40 -19.789 6.999 1.376 1.00 0.47 H new ATOM 0 HG3 GLU B 40 -19.345 5.665 0.330 1.00 0.47 H new ATOM 2272 N LEU B 41 -15.199 5.232 2.918 1.00 0.37 N ATOM 2273 CA LEU B 41 -14.125 4.956 3.897 1.00 0.40 C ATOM 2274 C LEU B 41 -13.192 6.178 4.057 1.00 0.38 C ATOM 2275 O LEU B 41 -12.841 6.548 5.180 1.00 0.40 O ATOM 2276 CB LEU B 41 -13.308 3.716 3.461 1.00 0.44 C ATOM 2277 CG LEU B 41 -12.123 3.309 4.375 1.00 0.55 C ATOM 2278 CD1 LEU B 41 -12.617 2.788 5.731 1.00 0.68 C ATOM 2279 CD2 LEU B 41 -11.236 2.279 3.674 1.00 0.64 C ATOM 0 H LEU B 41 -15.169 4.635 2.091 1.00 0.37 H new ATOM 0 HA LEU B 41 -14.591 4.754 4.862 1.00 0.40 H new ATOM 0 HB2 LEU B 41 -13.989 2.868 3.388 1.00 0.44 H new ATOM 0 HB3 LEU B 41 -12.919 3.899 2.460 1.00 0.44 H new ATOM 0 HG LEU B 41 -11.523 4.198 4.569 1.00 0.55 H new ATOM 0 HD11 LEU B 41 -11.762 2.511 6.348 1.00 0.68 H new ATOM 0 HD12 LEU B 41 -13.190 3.567 6.233 1.00 0.68 H new ATOM 0 HD13 LEU B 41 -13.251 1.915 5.576 1.00 0.68 H new ATOM 0 HD21 LEU B 41 -10.409 2.004 4.329 1.00 0.64 H new ATOM 0 HD22 LEU B 41 -11.824 1.391 3.440 1.00 0.64 H new ATOM 0 HD23 LEU B 41 -10.842 2.706 2.752 1.00 0.64 H new ATOM 2291 N VAL B 42 -12.803 6.795 2.921 1.00 0.37 N ATOM 2292 CA VAL B 42 -11.916 7.977 2.914 1.00 0.38 C ATOM 2293 C VAL B 42 -12.636 9.242 3.452 1.00 0.39 C ATOM 2294 O VAL B 42 -11.975 10.192 3.871 1.00 0.43 O ATOM 2295 CB VAL B 42 -11.327 8.243 1.481 1.00 0.43 C ATOM 2296 CG1 VAL B 42 -10.369 9.441 1.454 1.00 0.48 C ATOM 2297 CG2 VAL B 42 -10.615 6.994 0.940 1.00 0.47 C ATOM 0 H VAL B 42 -13.092 6.491 1.991 1.00 0.37 H new ATOM 0 HA VAL B 42 -11.088 7.755 3.587 1.00 0.38 H new ATOM 0 HB VAL B 42 -12.174 8.482 0.838 1.00 0.43 H new ATOM 0 HG11 VAL B 42 -9.991 9.581 0.442 1.00 0.48 H new ATOM 0 HG12 VAL B 42 -10.900 10.339 1.771 1.00 0.48 H new ATOM 0 HG13 VAL B 42 -9.535 9.255 2.131 1.00 0.48 H new ATOM 0 HG21 VAL B 42 -10.216 7.204 -0.053 1.00 0.47 H new ATOM 0 HG22 VAL B 42 -9.799 6.722 1.609 1.00 0.47 H new ATOM 0 HG23 VAL B 42 -11.324 6.169 0.879 1.00 0.47 H new ATOM 2307 N THR B 43 -13.985 9.249 3.451 1.00 0.38 N ATOM 2308 CA THR B 43 -14.760 10.398 3.949 1.00 0.42 C ATOM 2309 C THR B 43 -15.060 10.304 5.468 1.00 0.48 C ATOM 2310 O THR B 43 -15.364 11.331 6.086 1.00 0.83 O ATOM 2311 CB THR B 43 -16.097 10.549 3.156 1.00 0.44 C ATOM 2312 OG1 THR B 43 -15.833 10.563 1.741 1.00 0.46 O ATOM 2313 CG2 THR B 43 -16.858 11.822 3.540 1.00 0.49 C ATOM 0 H THR B 43 -14.556 8.474 3.112 1.00 0.38 H new ATOM 0 HA THR B 43 -14.140 11.280 3.791 1.00 0.42 H new ATOM 0 HB THR B 43 -16.721 9.693 3.414 1.00 0.44 H new ATOM 0 HG1 THR B 43 -15.685 9.647 1.427 1.00 0.46 H new ATOM 0 HG21 THR B 43 -17.780 11.883 2.962 1.00 0.49 H new ATOM 0 HG22 THR B 43 -17.097 11.796 4.603 1.00 0.49 H new ATOM 0 HG23 THR B 43 -16.239 12.694 3.328 1.00 0.49 H new ATOM 2321 N GLN B 44 -14.963 9.092 6.072 1.00 0.42 N ATOM 2322 CA GLN B 44 -15.266 8.904 7.508 1.00 0.44 C ATOM 2323 C GLN B 44 -14.023 8.511 8.341 1.00 0.44 C ATOM 2324 O GLN B 44 -13.682 9.214 9.298 1.00 0.50 O ATOM 2325 CB GLN B 44 -16.381 7.844 7.674 1.00 0.47 C ATOM 2326 CG GLN B 44 -16.958 7.744 9.091 1.00 0.58 C ATOM 2327 CD GLN B 44 -18.133 6.773 9.200 1.00 0.67 C ATOM 2328 OE1 GLN B 44 -18.894 6.588 8.248 1.00 0.91 O ATOM 2329 NE2 GLN B 44 -18.298 6.146 10.370 1.00 0.98 N ATOM 0 H GLN B 44 -14.680 8.239 5.589 1.00 0.42 H new ATOM 0 HA GLN B 44 -15.607 9.865 7.893 1.00 0.44 H new ATOM 0 HB2 GLN B 44 -17.190 8.075 6.981 1.00 0.47 H new ATOM 0 HB3 GLN B 44 -15.984 6.870 7.387 1.00 0.47 H new ATOM 0 HG2 GLN B 44 -16.170 7.428 9.775 1.00 0.58 H new ATOM 0 HG3 GLN B 44 -17.282 8.733 9.414 1.00 0.58 H new ATOM 0 HE21 GLN B 44 -17.650 6.321 11.138 1.00 0.98 H new ATOM 0 HE22 GLN B 44 -19.071 5.493 10.494 1.00 0.98 H new ATOM 2338 N GLN B 45 -13.354 7.395 7.976 1.00 0.42 N ATOM 2339 CA GLN B 45 -12.186 6.891 8.737 1.00 0.43 C ATOM 2340 C GLN B 45 -10.816 7.329 8.159 1.00 0.41 C ATOM 2341 O GLN B 45 -9.797 7.143 8.834 1.00 0.46 O ATOM 2342 CB GLN B 45 -12.265 5.347 8.847 1.00 0.47 C ATOM 2343 CG GLN B 45 -11.450 4.754 10.004 1.00 0.57 C ATOM 2344 CD GLN B 45 -11.782 3.291 10.305 1.00 0.62 C ATOM 2345 OE1 GLN B 45 -12.096 2.511 9.404 1.00 0.70 O ATOM 2346 NE2 GLN B 45 -11.721 2.908 11.583 1.00 0.73 N ATOM 0 H GLN B 45 -13.600 6.828 7.164 1.00 0.42 H new ATOM 0 HA GLN B 45 -12.241 7.345 9.727 1.00 0.43 H new ATOM 0 HB2 GLN B 45 -13.309 5.056 8.966 1.00 0.47 H new ATOM 0 HB3 GLN B 45 -11.917 4.909 7.911 1.00 0.47 H new ATOM 0 HG2 GLN B 45 -10.389 4.835 9.768 1.00 0.57 H new ATOM 0 HG3 GLN B 45 -11.624 5.349 10.901 1.00 0.57 H new ATOM 0 HE21 GLN B 45 -11.458 3.579 12.305 1.00 0.73 H new ATOM 0 HE22 GLN B 45 -11.938 1.944 11.838 1.00 0.73 H new ATOM 2355 N LEU B 46 -10.773 7.911 6.934 1.00 0.39 N ATOM 2356 CA LEU B 46 -9.495 8.353 6.329 1.00 0.38 C ATOM 2357 C LEU B 46 -9.599 9.757 5.644 1.00 0.38 C ATOM 2358 O LEU B 46 -9.038 9.949 4.557 1.00 0.41 O ATOM 2359 CB LEU B 46 -9.007 7.272 5.320 1.00 0.40 C ATOM 2360 CG LEU B 46 -7.498 6.935 5.360 1.00 0.41 C ATOM 2361 CD1 LEU B 46 -7.142 6.123 6.608 1.00 0.58 C ATOM 2362 CD2 LEU B 46 -7.079 6.184 4.093 1.00 0.62 C ATOM 0 H LEU B 46 -11.595 8.082 6.355 1.00 0.39 H new ATOM 0 HA LEU B 46 -8.766 8.466 7.131 1.00 0.38 H new ATOM 0 HB2 LEU B 46 -9.568 6.355 5.501 1.00 0.40 H new ATOM 0 HB3 LEU B 46 -9.258 7.605 4.313 1.00 0.40 H new ATOM 0 HG LEU B 46 -6.948 7.875 5.405 1.00 0.41 H new ATOM 0 HD11 LEU B 46 -6.075 5.902 6.606 1.00 0.58 H new ATOM 0 HD12 LEU B 46 -7.392 6.698 7.500 1.00 0.58 H new ATOM 0 HD13 LEU B 46 -7.705 5.190 6.608 1.00 0.58 H new ATOM 0 HD21 LEU B 46 -6.014 5.956 4.140 1.00 0.62 H new ATOM 0 HD22 LEU B 46 -7.646 5.256 4.016 1.00 0.62 H new ATOM 0 HD23 LEU B 46 -7.279 6.805 3.219 1.00 0.62 H new ATOM 2374 N PRO B 47 -10.290 10.780 6.267 1.00 0.40 N ATOM 2375 CA PRO B 47 -10.421 12.126 5.665 1.00 0.42 C ATOM 2376 C PRO B 47 -9.203 13.053 5.901 1.00 0.42 C ATOM 2377 O PRO B 47 -8.837 13.820 5.005 1.00 0.46 O ATOM 2378 CB PRO B 47 -11.675 12.682 6.351 1.00 0.48 C ATOM 2379 CG PRO B 47 -11.691 12.049 7.702 1.00 0.48 C ATOM 2380 CD PRO B 47 -11.011 10.711 7.567 1.00 0.44 C ATOM 0 HA PRO B 47 -10.483 12.070 4.578 1.00 0.42 H new ATOM 0 HB2 PRO B 47 -11.635 13.769 6.425 1.00 0.48 H new ATOM 0 HB3 PRO B 47 -12.575 12.434 5.789 1.00 0.48 H new ATOM 0 HG2 PRO B 47 -11.171 12.675 8.428 1.00 0.48 H new ATOM 0 HG3 PRO B 47 -12.714 11.928 8.060 1.00 0.48 H new ATOM 0 HD2 PRO B 47 -10.322 10.533 8.392 1.00 0.44 H new ATOM 0 HD3 PRO B 47 -11.735 9.897 7.575 1.00 0.44 H new ATOM 2388 N HIS B 48 -8.581 12.979 7.100 1.00 0.42 N ATOM 2389 CA HIS B 48 -7.417 13.829 7.447 1.00 0.44 C ATOM 2390 C HIS B 48 -6.159 13.468 6.623 1.00 0.43 C ATOM 2391 O HIS B 48 -5.373 14.357 6.284 1.00 0.49 O ATOM 2392 CB HIS B 48 -7.084 13.741 8.953 1.00 0.49 C ATOM 2393 CG HIS B 48 -8.186 14.203 9.873 1.00 0.56 C ATOM 2394 ND1 HIS B 48 -9.147 13.354 10.383 1.00 0.67 N ATOM 2395 CD2 HIS B 48 -8.461 15.428 10.390 1.00 0.70 C ATOM 2396 CE1 HIS B 48 -9.962 14.035 11.171 1.00 0.79 C ATOM 2397 NE2 HIS B 48 -9.566 15.294 11.194 1.00 0.81 N ATOM 0 H HIS B 48 -8.865 12.340 7.843 1.00 0.42 H new ATOM 0 HA HIS B 48 -7.705 14.851 7.201 1.00 0.44 H new ATOM 0 HB2 HIS B 48 -6.836 12.708 9.196 1.00 0.49 H new ATOM 0 HB3 HIS B 48 -6.193 14.337 9.149 1.00 0.49 H new ATOM 0 HD2 HIS B 48 -7.912 16.339 10.203 1.00 0.70 H new ATOM 0 HE1 HIS B 48 -10.808 13.630 11.705 1.00 0.79 H new ATOM 0 HE2 HIS B 48 -10.009 16.045 11.723 1.00 0.81 H new ATOM 2406 N LEU B 49 -5.979 12.166 6.296 1.00 0.41 N ATOM 2407 CA LEU B 49 -4.809 11.686 5.527 1.00 0.42 C ATOM 2408 C LEU B 49 -4.853 12.192 4.075 1.00 0.40 C ATOM 2409 O LEU B 49 -3.976 12.958 3.660 1.00 0.48 O ATOM 2410 CB LEU B 49 -4.740 10.141 5.576 1.00 0.43 C ATOM 2411 CG LEU B 49 -3.466 9.475 5.011 1.00 0.52 C ATOM 2412 CD1 LEU B 49 -2.208 9.929 5.760 1.00 0.88 C ATOM 2413 CD2 LEU B 49 -3.612 7.954 5.070 1.00 0.62 C ATOM 0 H LEU B 49 -6.633 11.428 6.555 1.00 0.41 H new ATOM 0 HA LEU B 49 -3.906 12.089 5.985 1.00 0.42 H new ATOM 0 HB2 LEU B 49 -4.852 9.830 6.615 1.00 0.43 H new ATOM 0 HB3 LEU B 49 -5.598 9.747 5.031 1.00 0.43 H new ATOM 0 HG LEU B 49 -3.350 9.786 3.973 1.00 0.52 H new ATOM 0 HD11 LEU B 49 -1.333 9.438 5.333 1.00 0.88 H new ATOM 0 HD12 LEU B 49 -2.099 11.010 5.667 1.00 0.88 H new ATOM 0 HD13 LEU B 49 -2.295 9.662 6.813 1.00 0.88 H new ATOM 0 HD21 LEU B 49 -2.712 7.486 4.671 1.00 0.62 H new ATOM 0 HD22 LEU B 49 -3.755 7.642 6.105 1.00 0.62 H new ATOM 0 HD23 LEU B 49 -4.474 7.648 4.477 1.00 0.62 H new ATOM 2425 N LEU B 50 -5.881 11.767 3.314 1.00 0.38 N ATOM 2426 CA LEU B 50 -6.044 12.192 1.920 1.00 0.41 C ATOM 2427 C LEU B 50 -6.823 13.519 1.880 1.00 0.45 C ATOM 2428 O LEU B 50 -8.022 13.545 2.186 1.00 0.52 O ATOM 2429 CB LEU B 50 -6.769 11.102 1.088 1.00 0.44 C ATOM 2430 CG LEU B 50 -6.078 9.713 0.986 1.00 0.51 C ATOM 2431 CD1 LEU B 50 -6.872 8.782 0.064 1.00 0.57 C ATOM 2432 CD2 LEU B 50 -4.627 9.819 0.500 1.00 0.70 C ATOM 0 H LEU B 50 -6.607 11.131 3.645 1.00 0.38 H new ATOM 0 HA LEU B 50 -5.059 12.341 1.477 1.00 0.41 H new ATOM 0 HB2 LEU B 50 -7.762 10.956 1.514 1.00 0.44 H new ATOM 0 HB3 LEU B 50 -6.909 11.485 0.077 1.00 0.44 H new ATOM 0 HG LEU B 50 -6.058 9.294 1.992 1.00 0.51 H new ATOM 0 HD11 LEU B 50 -6.372 7.815 0.006 1.00 0.57 H new ATOM 0 HD12 LEU B 50 -7.878 8.647 0.462 1.00 0.57 H new ATOM 0 HD13 LEU B 50 -6.931 9.220 -0.932 1.00 0.57 H new ATOM 0 HD21 LEU B 50 -4.188 8.823 0.445 1.00 0.70 H new ATOM 0 HD22 LEU B 50 -4.607 10.279 -0.488 1.00 0.70 H new ATOM 0 HD23 LEU B 50 -4.054 10.431 1.197 1.00 0.70 H new ATOM 2444 N LYS B 51 -6.127 14.625 1.520 1.00 0.50 N ATOM 2445 CA LYS B 51 -6.744 15.976 1.440 1.00 0.58 C ATOM 2446 C LYS B 51 -7.947 16.010 0.473 1.00 0.53 C ATOM 2447 O LYS B 51 -8.903 16.759 0.697 1.00 0.61 O ATOM 2448 CB LYS B 51 -5.697 17.045 1.028 1.00 0.68 C ATOM 2449 CG LYS B 51 -5.146 16.912 -0.407 1.00 0.72 C ATOM 2450 CD LYS B 51 -3.649 17.229 -0.495 1.00 1.06 C ATOM 2451 CE LYS B 51 -3.103 17.057 -1.918 1.00 1.03 C ATOM 2452 NZ LYS B 51 -3.382 18.240 -2.788 1.00 1.23 N ATOM 0 H LYS B 51 -5.136 14.610 1.280 1.00 0.50 H new ATOM 0 HA LYS B 51 -7.113 16.211 2.438 1.00 0.58 H new ATOM 0 HB2 LYS B 51 -6.148 18.031 1.136 1.00 0.68 H new ATOM 0 HB3 LYS B 51 -4.861 16.998 1.726 1.00 0.68 H new ATOM 0 HG2 LYS B 51 -5.321 15.898 -0.767 1.00 0.72 H new ATOM 0 HG3 LYS B 51 -5.695 17.584 -1.067 1.00 0.72 H new ATOM 0 HD2 LYS B 51 -3.476 18.253 -0.163 1.00 1.06 H new ATOM 0 HD3 LYS B 51 -3.101 16.576 0.184 1.00 1.06 H new ATOM 0 HE2 LYS B 51 -2.027 16.890 -1.872 1.00 1.03 H new ATOM 0 HE3 LYS B 51 -3.545 16.168 -2.368 1.00 1.03 H new ATOM 0 HZ1 LYS B 51 -2.992 18.072 -3.738 1.00 1.23 H new ATOM 0 HZ2 LYS B 51 -4.409 18.386 -2.856 1.00 1.23 H new ATOM 0 HZ3 LYS B 51 -2.939 19.086 -2.376 1.00 1.23 H new ATOM 2466 N ASP B 52 -7.879 15.195 -0.599 1.00 0.48 N ATOM 2467 CA ASP B 52 -8.946 15.110 -1.602 1.00 0.54 C ATOM 2468 C ASP B 52 -10.035 14.118 -1.125 1.00 0.48 C ATOM 2469 O ASP B 52 -10.016 12.933 -1.478 1.00 0.60 O ATOM 2470 CB ASP B 52 -8.336 14.694 -2.969 1.00 0.69 C ATOM 2471 CG ASP B 52 -9.076 15.246 -4.179 1.00 1.20 C ATOM 2472 OD1 ASP B 52 -10.196 15.774 -4.017 1.00 1.78 O ATOM 2473 OD2 ASP B 52 -8.523 15.148 -5.297 1.00 1.94 O ATOM 0 H ASP B 52 -7.085 14.583 -0.788 1.00 0.48 H new ATOM 0 HA ASP B 52 -9.422 16.082 -1.730 1.00 0.54 H new ATOM 0 HB2 ASP B 52 -7.299 15.029 -3.008 1.00 0.69 H new ATOM 0 HB3 ASP B 52 -8.322 13.606 -3.031 1.00 0.69 H new ATOM 2478 N VAL B 53 -10.970 14.627 -0.296 1.00 0.44 N ATOM 2479 CA VAL B 53 -12.067 13.812 0.282 1.00 0.45 C ATOM 2480 C VAL B 53 -13.369 13.890 -0.543 1.00 0.46 C ATOM 2481 O VAL B 53 -14.137 12.922 -0.568 1.00 0.57 O ATOM 2482 CB VAL B 53 -12.370 14.213 1.771 1.00 0.53 C ATOM 2483 CG1 VAL B 53 -11.164 13.931 2.669 1.00 0.60 C ATOM 2484 CG2 VAL B 53 -12.805 15.683 1.903 1.00 0.58 C ATOM 0 H VAL B 53 -10.989 15.605 -0.008 1.00 0.44 H new ATOM 0 HA VAL B 53 -11.709 12.783 0.254 1.00 0.45 H new ATOM 0 HB VAL B 53 -13.206 13.596 2.100 1.00 0.53 H new ATOM 0 HG11 VAL B 53 -11.399 14.217 3.694 1.00 0.60 H new ATOM 0 HG12 VAL B 53 -10.925 12.868 2.634 1.00 0.60 H new ATOM 0 HG13 VAL B 53 -10.307 14.507 2.319 1.00 0.60 H new ATOM 0 HG21 VAL B 53 -13.003 15.911 2.950 1.00 0.58 H new ATOM 0 HG22 VAL B 53 -12.011 16.332 1.534 1.00 0.58 H new ATOM 0 HG23 VAL B 53 -13.710 15.849 1.318 1.00 0.58 H new ATOM 2494 N GLY B 54 -13.618 15.039 -1.204 1.00 0.44 N ATOM 2495 CA GLY B 54 -14.835 15.222 -2.002 1.00 0.51 C ATOM 2496 C GLY B 54 -14.682 14.800 -3.461 1.00 0.51 C ATOM 2497 O GLY B 54 -15.589 14.176 -4.023 1.00 0.67 O ATOM 0 H GLY B 54 -12.994 15.846 -1.198 1.00 0.44 H new ATOM 0 HA2 GLY B 54 -15.645 14.649 -1.550 1.00 0.51 H new ATOM 0 HA3 GLY B 54 -15.128 16.271 -1.965 1.00 0.51 H new ATOM 2501 N SER B 55 -13.532 15.142 -4.073 1.00 0.51 N ATOM 2502 CA SER B 55 -13.257 14.818 -5.479 1.00 0.57 C ATOM 2503 C SER B 55 -12.333 13.589 -5.591 1.00 0.52 C ATOM 2504 O SER B 55 -11.117 13.726 -5.772 1.00 0.63 O ATOM 2505 CB SER B 55 -12.650 16.050 -6.183 1.00 0.74 C ATOM 2506 OG SER B 55 -12.461 15.824 -7.567 1.00 0.92 O ATOM 0 H SER B 55 -12.776 15.646 -3.609 1.00 0.51 H new ATOM 0 HA SER B 55 -14.192 14.561 -5.976 1.00 0.57 H new ATOM 0 HB2 SER B 55 -13.305 16.909 -6.041 1.00 0.74 H new ATOM 0 HB3 SER B 55 -11.694 16.298 -5.721 1.00 0.74 H new ATOM 0 HG SER B 55 -13.030 15.081 -7.858 1.00 0.92 H new ATOM 2512 N LEU B 56 -12.925 12.380 -5.483 1.00 0.47 N ATOM 2513 CA LEU B 56 -12.167 11.112 -5.575 1.00 0.47 C ATOM 2514 C LEU B 56 -11.970 10.645 -7.041 1.00 0.48 C ATOM 2515 O LEU B 56 -11.369 9.590 -7.260 1.00 0.81 O ATOM 2516 CB LEU B 56 -12.867 9.994 -4.744 1.00 0.58 C ATOM 2517 CG LEU B 56 -12.395 9.801 -3.276 1.00 0.75 C ATOM 2518 CD1 LEU B 56 -10.961 9.264 -3.211 1.00 1.09 C ATOM 2519 CD2 LEU B 56 -12.532 11.095 -2.466 1.00 1.24 C ATOM 0 H LEU B 56 -13.926 12.255 -5.332 1.00 0.47 H new ATOM 0 HA LEU B 56 -11.178 11.304 -5.160 1.00 0.47 H new ATOM 0 HB2 LEU B 56 -13.937 10.202 -4.730 1.00 0.58 H new ATOM 0 HB3 LEU B 56 -12.733 9.048 -5.269 1.00 0.58 H new ATOM 0 HG LEU B 56 -13.050 9.055 -2.825 1.00 0.75 H new ATOM 0 HD11 LEU B 56 -10.665 9.142 -2.169 1.00 1.09 H new ATOM 0 HD12 LEU B 56 -10.910 8.301 -3.718 1.00 1.09 H new ATOM 0 HD13 LEU B 56 -10.287 9.967 -3.699 1.00 1.09 H new ATOM 0 HD21 LEU B 56 -12.193 10.923 -1.445 1.00 1.24 H new ATOM 0 HD22 LEU B 56 -11.925 11.876 -2.923 1.00 1.24 H new ATOM 0 HD23 LEU B 56 -13.576 11.408 -2.454 1.00 1.24 H new ATOM 2531 N ASP B 57 -12.459 11.426 -8.043 1.00 0.48 N ATOM 2532 CA ASP B 57 -12.318 11.065 -9.479 1.00 0.49 C ATOM 2533 C ASP B 57 -10.846 10.845 -9.906 1.00 0.44 C ATOM 2534 O ASP B 57 -10.584 10.044 -10.809 1.00 0.46 O ATOM 2535 CB ASP B 57 -12.986 12.115 -10.400 1.00 0.60 C ATOM 2536 CG ASP B 57 -12.488 13.541 -10.192 1.00 0.64 C ATOM 2537 OD1 ASP B 57 -11.391 13.870 -10.694 1.00 0.69 O ATOM 2538 OD2 ASP B 57 -13.194 14.324 -9.527 1.00 0.73 O ATOM 0 H ASP B 57 -12.952 12.305 -7.883 1.00 0.48 H new ATOM 0 HA ASP B 57 -12.837 10.113 -9.595 1.00 0.49 H new ATOM 0 HB2 ASP B 57 -12.815 11.831 -11.438 1.00 0.60 H new ATOM 0 HB3 ASP B 57 -14.063 12.092 -10.236 1.00 0.60 H new ATOM 2543 N GLU B 58 -9.900 11.556 -9.258 1.00 0.45 N ATOM 2544 CA GLU B 58 -8.462 11.422 -9.565 1.00 0.50 C ATOM 2545 C GLU B 58 -7.921 10.054 -9.097 1.00 0.47 C ATOM 2546 O GLU B 58 -7.107 9.443 -9.792 1.00 0.57 O ATOM 2547 CB GLU B 58 -7.664 12.575 -8.926 1.00 0.59 C ATOM 2548 CG GLU B 58 -6.224 12.687 -9.428 1.00 0.73 C ATOM 2549 CD GLU B 58 -5.551 13.985 -9.015 1.00 0.92 C ATOM 2550 OE1 GLU B 58 -4.958 14.026 -7.918 1.00 1.06 O ATOM 2551 OE2 GLU B 58 -5.616 14.961 -9.794 1.00 1.10 O ATOM 0 H GLU B 58 -10.107 12.228 -8.519 1.00 0.45 H new ATOM 0 HA GLU B 58 -8.339 11.477 -10.647 1.00 0.50 H new ATOM 0 HB2 GLU B 58 -8.181 13.514 -9.123 1.00 0.59 H new ATOM 0 HB3 GLU B 58 -7.652 12.439 -7.845 1.00 0.59 H new ATOM 0 HG2 GLU B 58 -5.645 11.846 -9.045 1.00 0.73 H new ATOM 0 HG3 GLU B 58 -6.217 12.610 -10.515 1.00 0.73 H new ATOM 2558 N LYS B 59 -8.374 9.594 -7.910 1.00 0.43 N ATOM 2559 CA LYS B 59 -7.977 8.288 -7.355 1.00 0.48 C ATOM 2560 C LYS B 59 -9.184 7.326 -7.375 1.00 0.54 C ATOM 2561 O LYS B 59 -9.620 6.820 -6.335 1.00 0.91 O ATOM 2562 CB LYS B 59 -7.407 8.438 -5.929 1.00 0.52 C ATOM 2563 CG LYS B 59 -6.097 9.232 -5.855 1.00 0.59 C ATOM 2564 CD LYS B 59 -6.305 10.654 -5.332 1.00 0.79 C ATOM 2565 CE LYS B 59 -5.071 11.527 -5.543 1.00 1.19 C ATOM 2566 NZ LYS B 59 -5.249 12.898 -4.987 1.00 1.47 N ATOM 0 H LYS B 59 -9.020 10.115 -7.317 1.00 0.43 H new ATOM 0 HA LYS B 59 -7.185 7.869 -7.976 1.00 0.48 H new ATOM 0 HB2 LYS B 59 -8.152 8.928 -5.302 1.00 0.52 H new ATOM 0 HB3 LYS B 59 -7.241 7.446 -5.510 1.00 0.52 H new ATOM 0 HG2 LYS B 59 -5.394 8.709 -5.207 1.00 0.59 H new ATOM 0 HG3 LYS B 59 -5.645 9.275 -6.846 1.00 0.59 H new ATOM 0 HD2 LYS B 59 -7.159 11.105 -5.838 1.00 0.79 H new ATOM 0 HD3 LYS B 59 -6.546 10.618 -4.270 1.00 0.79 H new ATOM 0 HE2 LYS B 59 -4.209 11.055 -5.071 1.00 1.19 H new ATOM 0 HE3 LYS B 59 -4.854 11.595 -6.609 1.00 1.19 H new ATOM 0 HZ1 LYS B 59 -5.202 13.594 -5.758 1.00 1.47 H new ATOM 0 HZ2 LYS B 59 -6.174 12.965 -4.517 1.00 1.47 H new ATOM 0 HZ3 LYS B 59 -4.496 13.093 -4.297 1.00 1.47 H new ATOM 2580 N MET B 60 -9.729 7.111 -8.587 1.00 0.40 N ATOM 2581 CA MET B 60 -10.881 6.219 -8.819 1.00 0.43 C ATOM 2582 C MET B 60 -10.683 5.462 -10.145 1.00 0.45 C ATOM 2583 O MET B 60 -10.747 4.229 -10.174 1.00 0.49 O ATOM 2584 CB MET B 60 -12.199 7.032 -8.826 1.00 0.47 C ATOM 2585 CG MET B 60 -13.457 6.213 -9.140 1.00 0.55 C ATOM 2586 SD MET B 60 -14.950 7.218 -9.288 1.00 0.67 S ATOM 2587 CE MET B 60 -16.077 6.030 -10.019 1.00 0.81 C ATOM 0 H MET B 60 -9.381 7.554 -9.437 1.00 0.40 H new ATOM 0 HA MET B 60 -10.948 5.491 -8.010 1.00 0.43 H new ATOM 0 HB2 MET B 60 -12.324 7.504 -7.852 1.00 0.47 H new ATOM 0 HB3 MET B 60 -12.111 7.833 -9.560 1.00 0.47 H new ATOM 0 HG2 MET B 60 -13.303 5.666 -10.070 1.00 0.55 H new ATOM 0 HG3 MET B 60 -13.604 5.471 -8.355 1.00 0.55 H new ATOM 0 HE1 MET B 60 -17.049 6.498 -10.174 1.00 0.81 H new ATOM 0 HE2 MET B 60 -15.679 5.693 -10.976 1.00 0.81 H new ATOM 0 HE3 MET B 60 -16.189 5.176 -9.351 1.00 0.81 H new ATOM 2597 N LYS B 61 -10.442 6.220 -11.240 1.00 0.47 N ATOM 2598 CA LYS B 61 -10.196 5.639 -12.576 1.00 0.53 C ATOM 2599 C LYS B 61 -8.778 5.038 -12.635 1.00 0.48 C ATOM 2600 O LYS B 61 -8.557 4.023 -13.303 1.00 0.52 O ATOM 2601 CB LYS B 61 -10.369 6.700 -13.684 1.00 0.63 C ATOM 2602 CG LYS B 61 -11.723 7.419 -13.663 1.00 0.78 C ATOM 2603 CD LYS B 61 -11.936 8.323 -14.886 1.00 1.13 C ATOM 2604 CE LYS B 61 -11.118 9.620 -14.835 1.00 1.87 C ATOM 2605 NZ LYS B 61 -11.687 10.619 -13.883 1.00 2.39 N ATOM 0 H LYS B 61 -10.413 7.239 -11.221 1.00 0.47 H new ATOM 0 HA LYS B 61 -10.929 4.850 -12.745 1.00 0.53 H new ATOM 0 HB2 LYS B 61 -9.576 7.441 -13.588 1.00 0.63 H new ATOM 0 HB3 LYS B 61 -10.241 6.220 -14.654 1.00 0.63 H new ATOM 0 HG2 LYS B 61 -12.522 6.679 -13.621 1.00 0.78 H new ATOM 0 HG3 LYS B 61 -11.796 8.019 -12.756 1.00 0.78 H new ATOM 0 HD2 LYS B 61 -11.671 7.770 -15.787 1.00 1.13 H new ATOM 0 HD3 LYS B 61 -12.994 8.572 -14.964 1.00 1.13 H new ATOM 0 HE2 LYS B 61 -10.094 9.388 -14.544 1.00 1.87 H new ATOM 0 HE3 LYS B 61 -11.074 10.058 -15.832 1.00 1.87 H new ATOM 0 HZ1 LYS B 61 -11.426 11.578 -14.189 1.00 2.39 H new ATOM 0 HZ2 LYS B 61 -12.723 10.531 -13.866 1.00 2.39 H new ATOM 0 HZ3 LYS B 61 -11.309 10.445 -12.930 1.00 2.39 H new ATOM 2619 N SER B 62 -7.820 5.686 -11.926 1.00 0.46 N ATOM 2620 CA SER B 62 -6.419 5.224 -11.853 1.00 0.47 C ATOM 2621 C SER B 62 -6.313 3.898 -11.074 1.00 0.44 C ATOM 2622 O SER B 62 -5.470 3.057 -11.402 1.00 0.50 O ATOM 2623 CB SER B 62 -5.531 6.293 -11.194 1.00 0.54 C ATOM 2624 OG SER B 62 -5.633 7.536 -11.874 1.00 0.63 O ATOM 0 H SER B 62 -7.999 6.537 -11.394 1.00 0.46 H new ATOM 0 HA SER B 62 -6.071 5.054 -12.872 1.00 0.47 H new ATOM 0 HB2 SER B 62 -5.824 6.421 -10.152 1.00 0.54 H new ATOM 0 HB3 SER B 62 -4.493 5.959 -11.195 1.00 0.54 H new ATOM 0 HG SER B 62 -6.068 8.193 -11.291 1.00 0.63 H new ATOM 2630 N LEU B 63 -7.170 3.727 -10.036 1.00 0.41 N ATOM 2631 CA LEU B 63 -7.191 2.493 -9.231 1.00 0.44 C ATOM 2632 C LEU B 63 -7.707 1.313 -10.070 1.00 0.47 C ATOM 2633 O LEU B 63 -6.931 0.412 -10.399 1.00 0.57 O ATOM 2634 CB LEU B 63 -8.058 2.657 -7.952 1.00 0.45 C ATOM 2635 CG LEU B 63 -7.554 3.687 -6.917 1.00 0.42 C ATOM 2636 CD1 LEU B 63 -8.616 3.950 -5.845 1.00 0.47 C ATOM 2637 CD2 LEU B 63 -6.239 3.235 -6.267 1.00 0.69 C ATOM 0 H LEU B 63 -7.850 4.428 -9.743 1.00 0.41 H new ATOM 0 HA LEU B 63 -6.167 2.289 -8.918 1.00 0.44 H new ATOM 0 HB2 LEU B 63 -9.066 2.940 -8.255 1.00 0.45 H new ATOM 0 HB3 LEU B 63 -8.133 1.686 -7.462 1.00 0.45 H new ATOM 0 HG LEU B 63 -7.362 4.618 -7.451 1.00 0.42 H new ATOM 0 HD11 LEU B 63 -8.237 4.678 -5.128 1.00 0.47 H new ATOM 0 HD12 LEU B 63 -9.519 4.340 -6.315 1.00 0.47 H new ATOM 0 HD13 LEU B 63 -8.849 3.019 -5.328 1.00 0.47 H new ATOM 0 HD21 LEU B 63 -5.914 3.984 -5.545 1.00 0.69 H new ATOM 0 HD22 LEU B 63 -6.393 2.283 -5.759 1.00 0.69 H new ATOM 0 HD23 LEU B 63 -5.475 3.117 -7.035 1.00 0.69 H new ATOM 2649 N ASP B 64 -9.003 1.347 -10.447 1.00 0.47 N ATOM 2650 CA ASP B 64 -9.609 0.276 -11.252 1.00 0.55 C ATOM 2651 C ASP B 64 -9.222 0.447 -12.734 1.00 0.53 C ATOM 2652 O ASP B 64 -9.940 1.088 -13.508 1.00 0.60 O ATOM 2653 CB ASP B 64 -11.146 0.262 -11.055 1.00 0.66 C ATOM 2654 CG ASP B 64 -11.816 -0.993 -11.600 1.00 0.85 C ATOM 2655 OD1 ASP B 64 -11.518 -2.095 -11.089 1.00 1.27 O ATOM 2656 OD2 ASP B 64 -12.643 -0.870 -12.530 1.00 1.32 O ATOM 0 H ASP B 64 -9.644 2.103 -10.206 1.00 0.47 H new ATOM 0 HA ASP B 64 -9.227 -0.689 -10.918 1.00 0.55 H new ATOM 0 HB2 ASP B 64 -11.369 0.351 -9.992 1.00 0.66 H new ATOM 0 HB3 ASP B 64 -11.575 1.136 -11.545 1.00 0.66 H new ATOM 2661 N VAL B 65 -8.054 -0.118 -13.101 1.00 0.53 N ATOM 2662 CA VAL B 65 -7.520 -0.046 -14.477 1.00 0.56 C ATOM 2663 C VAL B 65 -8.074 -1.176 -15.378 1.00 0.56 C ATOM 2664 O VAL B 65 -8.054 -1.050 -16.604 1.00 0.61 O ATOM 2665 CB VAL B 65 -5.946 -0.055 -14.474 1.00 0.64 C ATOM 2666 CG1 VAL B 65 -5.351 -1.428 -14.113 1.00 0.68 C ATOM 2667 CG2 VAL B 65 -5.382 0.459 -15.804 1.00 0.72 C ATOM 0 H VAL B 65 -7.457 -0.635 -12.456 1.00 0.53 H new ATOM 0 HA VAL B 65 -7.858 0.900 -14.900 1.00 0.56 H new ATOM 0 HB VAL B 65 -5.640 0.631 -13.684 1.00 0.64 H new ATOM 0 HG11 VAL B 65 -4.263 -1.368 -14.128 1.00 0.68 H new ATOM 0 HG12 VAL B 65 -5.685 -1.719 -13.117 1.00 0.68 H new ATOM 0 HG13 VAL B 65 -5.684 -2.171 -14.838 1.00 0.68 H new ATOM 0 HG21 VAL B 65 -4.293 0.440 -15.769 1.00 0.72 H new ATOM 0 HG22 VAL B 65 -5.730 -0.178 -16.617 1.00 0.72 H new ATOM 0 HG23 VAL B 65 -5.722 1.481 -15.973 1.00 0.72 H new ATOM 2677 N ASN B 66 -8.571 -2.271 -14.764 1.00 0.56 N ATOM 2678 CA ASN B 66 -9.119 -3.417 -15.512 1.00 0.60 C ATOM 2679 C ASN B 66 -10.585 -3.192 -15.971 1.00 0.61 C ATOM 2680 O ASN B 66 -11.071 -3.934 -16.830 1.00 0.68 O ATOM 2681 CB ASN B 66 -9.027 -4.694 -14.645 1.00 0.65 C ATOM 2682 CG ASN B 66 -9.092 -5.993 -15.452 1.00 0.90 C ATOM 2683 OD1 ASN B 66 -8.499 -6.102 -16.528 1.00 1.38 O ATOM 2684 ND2 ASN B 66 -9.818 -6.990 -14.944 1.00 1.32 N ATOM 0 H ASN B 66 -8.603 -2.383 -13.751 1.00 0.56 H new ATOM 0 HA ASN B 66 -8.519 -3.530 -16.415 1.00 0.60 H new ATOM 0 HB2 ASN B 66 -8.094 -4.673 -14.082 1.00 0.65 H new ATOM 0 HB3 ASN B 66 -9.839 -4.688 -13.918 1.00 0.65 H new ATOM 0 HD21 ASN B 66 -9.894 -7.873 -15.448 1.00 1.32 H new ATOM 0 HD22 ASN B 66 -10.297 -6.869 -14.052 1.00 1.32 H new ATOM 2691 N GLN B 67 -11.287 -2.172 -15.398 1.00 0.59 N ATOM 2692 CA GLN B 67 -12.698 -1.864 -15.740 1.00 0.64 C ATOM 2693 C GLN B 67 -13.619 -3.080 -15.469 1.00 0.64 C ATOM 2694 O GLN B 67 -14.361 -3.527 -16.353 1.00 0.77 O ATOM 2695 CB GLN B 67 -12.836 -1.369 -17.209 1.00 0.75 C ATOM 2696 CG GLN B 67 -12.513 0.113 -17.428 1.00 0.96 C ATOM 2697 CD GLN B 67 -11.025 0.433 -17.367 1.00 1.28 C ATOM 2698 OE1 GLN B 67 -10.310 0.301 -18.362 1.00 2.02 O ATOM 2699 NE2 GLN B 67 -10.550 0.882 -16.207 1.00 1.87 N ATOM 0 H GLN B 67 -10.891 -1.549 -14.694 1.00 0.59 H new ATOM 0 HA GLN B 67 -13.021 -1.051 -15.090 1.00 0.64 H new ATOM 0 HB2 GLN B 67 -12.178 -1.966 -17.841 1.00 0.75 H new ATOM 0 HB3 GLN B 67 -13.856 -1.556 -17.545 1.00 0.75 H new ATOM 0 HG2 GLN B 67 -12.902 0.420 -18.399 1.00 0.96 H new ATOM 0 HG3 GLN B 67 -13.034 0.704 -16.674 1.00 0.96 H new ATOM 0 HE21 GLN B 67 -11.172 0.978 -15.404 1.00 1.87 H new ATOM 0 HE22 GLN B 67 -9.564 1.130 -16.121 1.00 1.87 H new ATOM 2708 N ASP B 68 -13.555 -3.612 -14.233 1.00 0.65 N ATOM 2709 CA ASP B 68 -14.373 -4.772 -13.824 1.00 0.72 C ATOM 2710 C ASP B 68 -15.279 -4.447 -12.607 1.00 0.79 C ATOM 2711 O ASP B 68 -15.933 -5.349 -12.076 1.00 1.30 O ATOM 2712 CB ASP B 68 -13.454 -5.976 -13.499 1.00 0.76 C ATOM 2713 CG ASP B 68 -14.046 -7.309 -13.933 1.00 0.97 C ATOM 2714 OD1 ASP B 68 -13.804 -7.716 -15.090 1.00 1.16 O ATOM 2715 OD2 ASP B 68 -14.751 -7.943 -13.120 1.00 1.25 O ATOM 0 H ASP B 68 -12.944 -3.256 -13.498 1.00 0.65 H new ATOM 0 HA ASP B 68 -15.028 -5.025 -14.658 1.00 0.72 H new ATOM 0 HB2 ASP B 68 -12.492 -5.835 -13.991 1.00 0.76 H new ATOM 0 HB3 ASP B 68 -13.263 -6.001 -12.426 1.00 0.76 H new ATOM 2720 N SER B 69 -15.317 -3.155 -12.172 1.00 0.66 N ATOM 2721 CA SER B 69 -16.129 -2.702 -11.014 1.00 0.71 C ATOM 2722 C SER B 69 -15.706 -3.398 -9.691 1.00 0.71 C ATOM 2723 O SER B 69 -16.498 -3.484 -8.743 1.00 1.26 O ATOM 2724 CB SER B 69 -17.634 -2.903 -11.292 1.00 0.86 C ATOM 2725 OG SER B 69 -18.028 -2.215 -12.469 1.00 1.35 O ATOM 0 H SER B 69 -14.787 -2.405 -12.615 1.00 0.66 H new ATOM 0 HA SER B 69 -15.941 -1.636 -10.883 1.00 0.71 H new ATOM 0 HB2 SER B 69 -17.849 -3.966 -11.398 1.00 0.86 H new ATOM 0 HB3 SER B 69 -18.216 -2.543 -10.444 1.00 0.86 H new ATOM 0 HG SER B 69 -18.985 -2.358 -12.627 1.00 1.35 H new ATOM 2731 N GLU B 70 -14.441 -3.866 -9.636 1.00 0.69 N ATOM 2732 CA GLU B 70 -13.879 -4.554 -8.463 1.00 0.75 C ATOM 2733 C GLU B 70 -12.416 -4.126 -8.280 1.00 0.62 C ATOM 2734 O GLU B 70 -11.546 -4.523 -9.066 1.00 0.78 O ATOM 2735 CB GLU B 70 -13.977 -6.085 -8.635 1.00 1.11 C ATOM 2736 CG GLU B 70 -15.406 -6.637 -8.629 1.00 1.39 C ATOM 2737 CD GLU B 70 -15.472 -8.114 -8.984 1.00 1.87 C ATOM 2738 OE1 GLU B 70 -14.805 -8.921 -8.303 1.00 2.40 O ATOM 2739 OE2 GLU B 70 -16.192 -8.463 -9.946 1.00 2.37 O ATOM 0 H GLU B 70 -13.782 -3.775 -10.409 1.00 0.69 H new ATOM 0 HA GLU B 70 -14.449 -4.278 -7.576 1.00 0.75 H new ATOM 0 HB2 GLU B 70 -13.498 -6.363 -9.574 1.00 1.11 H new ATOM 0 HB3 GLU B 70 -13.413 -6.564 -7.835 1.00 1.11 H new ATOM 0 HG2 GLU B 70 -15.844 -6.486 -7.642 1.00 1.39 H new ATOM 0 HG3 GLU B 70 -16.012 -6.071 -9.337 1.00 1.39 H new ATOM 2746 N LEU B 71 -12.145 -3.304 -7.249 1.00 0.54 N ATOM 2747 CA LEU B 71 -10.787 -2.800 -6.990 1.00 0.51 C ATOM 2748 C LEU B 71 -9.954 -3.805 -6.173 1.00 0.50 C ATOM 2749 O LEU B 71 -9.963 -3.765 -4.939 1.00 0.52 O ATOM 2750 CB LEU B 71 -10.829 -1.428 -6.267 1.00 0.58 C ATOM 2751 CG LEU B 71 -11.250 -0.209 -7.125 1.00 0.78 C ATOM 2752 CD1 LEU B 71 -12.733 -0.268 -7.504 1.00 1.13 C ATOM 2753 CD2 LEU B 71 -10.932 1.101 -6.399 1.00 0.92 C ATOM 0 H LEU B 71 -12.847 -2.977 -6.585 1.00 0.54 H new ATOM 0 HA LEU B 71 -10.304 -2.669 -7.958 1.00 0.51 H new ATOM 0 HB2 LEU B 71 -11.517 -1.507 -5.425 1.00 0.58 H new ATOM 0 HB3 LEU B 71 -9.840 -1.229 -5.854 1.00 0.58 H new ATOM 0 HG LEU B 71 -10.672 -0.245 -8.048 1.00 0.78 H new ATOM 0 HD11 LEU B 71 -12.990 0.604 -8.105 1.00 1.13 H new ATOM 0 HD12 LEU B 71 -12.926 -1.174 -8.078 1.00 1.13 H new ATOM 0 HD13 LEU B 71 -13.340 -0.276 -6.599 1.00 1.13 H new ATOM 0 HD21 LEU B 71 -11.236 1.944 -7.020 1.00 0.92 H new ATOM 0 HD22 LEU B 71 -11.473 1.133 -5.453 1.00 0.92 H new ATOM 0 HD23 LEU B 71 -9.861 1.160 -6.207 1.00 0.92 H new ATOM 2765 N LYS B 72 -9.232 -4.714 -6.870 1.00 0.52 N ATOM 2766 CA LYS B 72 -8.349 -5.705 -6.207 1.00 0.54 C ATOM 2767 C LYS B 72 -7.124 -4.965 -5.633 1.00 0.48 C ATOM 2768 O LYS B 72 -7.043 -3.743 -5.764 1.00 0.46 O ATOM 2769 CB LYS B 72 -7.911 -6.808 -7.211 1.00 0.60 C ATOM 2770 CG LYS B 72 -8.915 -7.952 -7.372 1.00 0.78 C ATOM 2771 CD LYS B 72 -8.527 -8.895 -8.519 1.00 0.91 C ATOM 2772 CE LYS B 72 -9.299 -10.216 -8.491 1.00 1.29 C ATOM 2773 NZ LYS B 72 -8.860 -11.126 -7.386 1.00 1.81 N ATOM 0 H LYS B 72 -9.243 -4.782 -7.888 1.00 0.52 H new ATOM 0 HA LYS B 72 -8.889 -6.197 -5.398 1.00 0.54 H new ATOM 0 HB2 LYS B 72 -7.742 -6.349 -8.185 1.00 0.60 H new ATOM 0 HB3 LYS B 72 -6.957 -7.222 -6.884 1.00 0.60 H new ATOM 0 HG2 LYS B 72 -8.974 -8.517 -6.442 1.00 0.78 H new ATOM 0 HG3 LYS B 72 -9.907 -7.541 -7.559 1.00 0.78 H new ATOM 0 HD2 LYS B 72 -8.707 -8.395 -9.471 1.00 0.91 H new ATOM 0 HD3 LYS B 72 -7.458 -9.103 -8.466 1.00 0.91 H new ATOM 0 HE2 LYS B 72 -10.363 -10.007 -8.381 1.00 1.29 H new ATOM 0 HE3 LYS B 72 -9.172 -10.725 -9.446 1.00 1.29 H new ATOM 0 HZ1 LYS B 72 -9.357 -12.036 -7.468 1.00 1.81 H new ATOM 0 HZ2 LYS B 72 -7.834 -11.284 -7.453 1.00 1.81 H new ATOM 0 HZ3 LYS B 72 -9.084 -10.691 -6.468 1.00 1.81 H new ATOM 2787 N PHE B 73 -6.174 -5.674 -4.990 1.00 0.51 N ATOM 2788 CA PHE B 73 -4.980 -4.998 -4.440 1.00 0.49 C ATOM 2789 C PHE B 73 -4.035 -4.526 -5.560 1.00 0.46 C ATOM 2790 O PHE B 73 -3.303 -3.557 -5.368 1.00 0.46 O ATOM 2791 CB PHE B 73 -4.226 -5.865 -3.410 1.00 0.55 C ATOM 2792 CG PHE B 73 -3.665 -5.043 -2.262 1.00 0.69 C ATOM 2793 CD1 PHE B 73 -4.446 -4.753 -1.146 1.00 0.90 C ATOM 2794 CD2 PHE B 73 -2.375 -4.530 -2.317 1.00 0.89 C ATOM 2795 CE1 PHE B 73 -3.946 -3.977 -0.115 1.00 1.15 C ATOM 2796 CE2 PHE B 73 -1.878 -3.752 -1.292 1.00 1.14 C ATOM 2797 CZ PHE B 73 -2.663 -3.475 -0.192 1.00 1.23 C ATOM 0 H PHE B 73 -6.205 -6.683 -4.841 1.00 0.51 H new ATOM 0 HA PHE B 73 -5.343 -4.119 -3.907 1.00 0.49 H new ATOM 0 HB2 PHE B 73 -4.901 -6.624 -3.014 1.00 0.55 H new ATOM 0 HB3 PHE B 73 -3.412 -6.391 -3.908 1.00 0.55 H new ATOM 0 HD1 PHE B 73 -5.453 -5.138 -1.084 1.00 0.90 H new ATOM 0 HD2 PHE B 73 -1.753 -4.743 -3.174 1.00 0.89 H new ATOM 0 HE1 PHE B 73 -4.559 -3.765 0.748 1.00 1.15 H new ATOM 0 HE2 PHE B 73 -0.874 -3.359 -1.351 1.00 1.14 H new ATOM 0 HZ PHE B 73 -2.273 -2.865 0.609 1.00 1.23 H new ATOM 2807 N ASN B 74 -4.059 -5.211 -6.729 1.00 0.47 N ATOM 2808 CA ASN B 74 -3.242 -4.810 -7.893 1.00 0.50 C ATOM 2809 C ASN B 74 -3.799 -3.496 -8.506 1.00 0.48 C ATOM 2810 O ASN B 74 -3.054 -2.737 -9.133 1.00 0.54 O ATOM 2811 CB ASN B 74 -3.211 -5.945 -8.943 1.00 0.55 C ATOM 2812 CG ASN B 74 -2.209 -5.712 -10.075 1.00 0.63 C ATOM 2813 OD1 ASN B 74 -2.563 -5.176 -11.126 1.00 0.99 O ATOM 2814 ND2 ASN B 74 -0.953 -6.114 -9.870 1.00 0.93 N ATOM 0 H ASN B 74 -4.633 -6.039 -6.887 1.00 0.47 H new ATOM 0 HA ASN B 74 -2.219 -4.627 -7.565 1.00 0.50 H new ATOM 0 HB2 ASN B 74 -2.969 -6.883 -8.443 1.00 0.55 H new ATOM 0 HB3 ASN B 74 -4.207 -6.059 -9.370 1.00 0.55 H new ATOM 0 HD21 ASN B 74 -0.250 -5.981 -10.597 1.00 0.93 H new ATOM 0 HD22 ASN B 74 -0.696 -6.554 -8.986 1.00 0.93 H new ATOM 2821 N GLU B 75 -5.118 -3.250 -8.313 1.00 0.44 N ATOM 2822 CA GLU B 75 -5.799 -2.036 -8.799 1.00 0.47 C ATOM 2823 C GLU B 75 -5.779 -0.933 -7.714 1.00 0.41 C ATOM 2824 O GLU B 75 -5.429 0.213 -8.001 1.00 0.42 O ATOM 2825 CB GLU B 75 -7.258 -2.379 -9.204 1.00 0.54 C ATOM 2826 CG GLU B 75 -7.404 -2.993 -10.601 1.00 0.64 C ATOM 2827 CD GLU B 75 -6.882 -4.420 -10.711 1.00 0.76 C ATOM 2828 OE1 GLU B 75 -5.684 -4.593 -11.022 1.00 0.93 O ATOM 2829 OE2 GLU B 75 -7.674 -5.364 -10.494 1.00 0.91 O ATOM 0 H GLU B 75 -5.735 -3.891 -7.815 1.00 0.44 H new ATOM 0 HA GLU B 75 -5.270 -1.659 -9.675 1.00 0.47 H new ATOM 0 HB2 GLU B 75 -7.671 -3.072 -8.472 1.00 0.54 H new ATOM 0 HB3 GLU B 75 -7.858 -1.470 -9.156 1.00 0.54 H new ATOM 0 HG2 GLU B 75 -8.457 -2.980 -10.884 1.00 0.64 H new ATOM 0 HG3 GLU B 75 -6.873 -2.367 -11.318 1.00 0.64 H new ATOM 2836 N TYR B 76 -6.136 -1.305 -6.459 1.00 0.41 N ATOM 2837 CA TYR B 76 -6.154 -0.371 -5.300 1.00 0.39 C ATOM 2838 C TYR B 76 -4.726 0.069 -4.875 1.00 0.36 C ATOM 2839 O TYR B 76 -4.583 1.028 -4.112 1.00 0.43 O ATOM 2840 CB TYR B 76 -6.884 -1.026 -4.104 1.00 0.43 C ATOM 2841 CG TYR B 76 -7.389 -0.052 -3.036 1.00 0.44 C ATOM 2842 CD1 TYR B 76 -8.521 0.732 -3.256 1.00 0.50 C ATOM 2843 CD2 TYR B 76 -6.750 0.060 -1.802 1.00 0.52 C ATOM 2844 CE1 TYR B 76 -8.991 1.597 -2.287 1.00 0.58 C ATOM 2845 CE2 TYR B 76 -7.218 0.921 -0.827 1.00 0.59 C ATOM 2846 CZ TYR B 76 -8.338 1.686 -1.072 1.00 0.59 C ATOM 2847 OH TYR B 76 -8.810 2.537 -0.094 1.00 0.71 O ATOM 0 H TYR B 76 -6.419 -2.256 -6.221 1.00 0.41 H new ATOM 0 HA TYR B 76 -6.690 0.525 -5.613 1.00 0.39 H new ATOM 0 HB2 TYR B 76 -7.732 -1.595 -4.484 1.00 0.43 H new ATOM 0 HB3 TYR B 76 -6.208 -1.739 -3.632 1.00 0.43 H new ATOM 0 HD1 TYR B 76 -9.039 0.662 -4.201 1.00 0.50 H new ATOM 0 HD2 TYR B 76 -5.872 -0.537 -1.604 1.00 0.52 H new ATOM 0 HE1 TYR B 76 -9.865 2.201 -2.478 1.00 0.58 H new ATOM 0 HE2 TYR B 76 -6.708 0.994 0.122 1.00 0.59 H new ATOM 0 HH TYR B 76 -8.235 2.477 0.697 1.00 0.71 H new ATOM 2857 N TRP B 77 -3.684 -0.653 -5.364 1.00 0.39 N ATOM 2858 CA TRP B 77 -2.254 -0.353 -5.090 1.00 0.40 C ATOM 2859 C TRP B 77 -1.897 1.142 -5.322 1.00 0.35 C ATOM 2860 O TRP B 77 -1.022 1.672 -4.631 1.00 0.37 O ATOM 2861 CB TRP B 77 -1.380 -1.315 -5.952 1.00 0.58 C ATOM 2862 CG TRP B 77 0.032 -0.885 -6.278 1.00 0.48 C ATOM 2863 CD1 TRP B 77 1.076 -0.721 -5.412 1.00 0.56 C ATOM 2864 CD2 TRP B 77 0.552 -0.604 -7.588 1.00 0.74 C ATOM 2865 NE1 TRP B 77 2.205 -0.356 -6.101 1.00 0.79 N ATOM 2866 CE2 TRP B 77 1.910 -0.275 -7.437 1.00 0.94 C ATOM 2867 CE3 TRP B 77 -0.002 -0.597 -8.874 1.00 0.98 C ATOM 2868 CZ2 TRP B 77 2.720 0.056 -8.518 1.00 1.34 C ATOM 2869 CZ3 TRP B 77 0.803 -0.268 -9.946 1.00 1.37 C ATOM 2870 CH2 TRP B 77 2.154 0.055 -9.763 1.00 1.54 C ATOM 0 H TRP B 77 -3.814 -1.467 -5.965 1.00 0.39 H new ATOM 0 HA TRP B 77 -2.049 -0.524 -4.033 1.00 0.40 H new ATOM 0 HB2 TRP B 77 -1.327 -2.273 -5.435 1.00 0.58 H new ATOM 0 HB3 TRP B 77 -1.902 -1.489 -6.893 1.00 0.58 H new ATOM 0 HD1 TRP B 77 1.021 -0.858 -4.342 1.00 0.56 H new ATOM 0 HE1 TRP B 77 3.118 -0.174 -5.685 1.00 0.79 H new ATOM 0 HE3 TRP B 77 -1.042 -0.845 -9.025 1.00 0.98 H new ATOM 0 HZ2 TRP B 77 3.762 0.306 -8.379 1.00 1.34 H new ATOM 0 HZ3 TRP B 77 0.385 -0.259 -10.942 1.00 1.37 H new ATOM 0 HH2 TRP B 77 2.760 0.308 -10.621 1.00 1.54 H new ATOM 2881 N ARG B 78 -2.580 1.814 -6.281 1.00 0.37 N ATOM 2882 CA ARG B 78 -2.334 3.249 -6.568 1.00 0.41 C ATOM 2883 C ARG B 78 -2.686 4.166 -5.366 1.00 0.38 C ATOM 2884 O ARG B 78 -2.093 5.238 -5.232 1.00 0.45 O ATOM 2885 CB ARG B 78 -3.098 3.700 -7.845 1.00 0.49 C ATOM 2886 CG ARG B 78 -2.314 3.502 -9.152 1.00 0.68 C ATOM 2887 CD ARG B 78 -1.328 4.644 -9.429 1.00 0.88 C ATOM 2888 NE ARG B 78 -1.852 5.621 -10.403 1.00 1.17 N ATOM 2889 CZ ARG B 78 -1.743 5.519 -11.748 1.00 1.72 C ATOM 2890 NH1 ARG B 78 -1.171 4.452 -12.328 1.00 2.14 N ATOM 2891 NH2 ARG B 78 -2.231 6.496 -12.521 1.00 2.15 N ATOM 0 H ARG B 78 -3.300 1.389 -6.865 1.00 0.37 H new ATOM 0 HA ARG B 78 -1.264 3.353 -6.745 1.00 0.41 H new ATOM 0 HB2 ARG B 78 -4.035 3.146 -7.909 1.00 0.49 H new ATOM 0 HB3 ARG B 78 -3.357 4.754 -7.746 1.00 0.49 H new ATOM 0 HG2 ARG B 78 -1.768 2.560 -9.104 1.00 0.68 H new ATOM 0 HG3 ARG B 78 -3.015 3.423 -9.983 1.00 0.68 H new ATOM 0 HD2 ARG B 78 -1.098 5.156 -8.494 1.00 0.88 H new ATOM 0 HD3 ARG B 78 -0.392 4.229 -9.804 1.00 0.88 H new ATOM 0 HE ARG B 78 -2.335 6.439 -10.033 1.00 1.17 H new ATOM 0 HH11 ARG B 78 -0.806 3.693 -11.752 1.00 2.14 H new ATOM 0 HH12 ARG B 78 -1.102 4.400 -13.344 1.00 2.14 H new ATOM 0 HH21 ARG B 78 -2.680 7.307 -12.095 1.00 2.15 H new ATOM 0 HH22 ARG B 78 -2.154 6.430 -13.536 1.00 2.15 H new ATOM 2905 N LEU B 79 -3.639 3.740 -4.493 1.00 0.33 N ATOM 2906 CA LEU B 79 -4.039 4.533 -3.305 1.00 0.34 C ATOM 2907 C LEU B 79 -3.222 4.133 -2.062 1.00 0.32 C ATOM 2908 O LEU B 79 -2.952 4.985 -1.217 1.00 0.36 O ATOM 2909 CB LEU B 79 -5.550 4.384 -2.993 1.00 0.36 C ATOM 2910 CG LEU B 79 -6.184 5.515 -2.142 1.00 0.41 C ATOM 2911 CD1 LEU B 79 -6.213 6.842 -2.914 1.00 0.49 C ATOM 2912 CD2 LEU B 79 -7.588 5.121 -1.673 1.00 0.48 C ATOM 0 H LEU B 79 -4.140 2.857 -4.591 1.00 0.33 H new ATOM 0 HA LEU B 79 -3.834 5.576 -3.548 1.00 0.34 H new ATOM 0 HB2 LEU B 79 -6.091 4.320 -3.937 1.00 0.36 H new ATOM 0 HB3 LEU B 79 -5.702 3.438 -2.474 1.00 0.36 H new ATOM 0 HG LEU B 79 -5.561 5.660 -1.260 1.00 0.41 H new ATOM 0 HD11 LEU B 79 -6.663 7.615 -2.291 1.00 0.49 H new ATOM 0 HD12 LEU B 79 -5.196 7.133 -3.176 1.00 0.49 H new ATOM 0 HD13 LEU B 79 -6.801 6.721 -3.824 1.00 0.49 H new ATOM 0 HD21 LEU B 79 -8.013 5.929 -1.078 1.00 0.48 H new ATOM 0 HD22 LEU B 79 -8.223 4.936 -2.540 1.00 0.48 H new ATOM 0 HD23 LEU B 79 -7.529 4.217 -1.067 1.00 0.48 H new ATOM 2924 N ILE B 80 -2.840 2.836 -1.951 1.00 0.34 N ATOM 2925 CA ILE B 80 -2.039 2.336 -0.807 1.00 0.37 C ATOM 2926 C ILE B 80 -0.712 3.120 -0.709 1.00 0.36 C ATOM 2927 O ILE B 80 -0.259 3.437 0.396 1.00 0.39 O ATOM 2928 CB ILE B 80 -1.764 0.792 -0.906 1.00 0.44 C ATOM 2929 CG1 ILE B 80 -3.096 -0.014 -0.941 1.00 0.47 C ATOM 2930 CG2 ILE B 80 -0.856 0.294 0.235 1.00 0.54 C ATOM 2931 CD1 ILE B 80 -3.922 0.018 0.345 1.00 0.56 C ATOM 0 H ILE B 80 -3.074 2.120 -2.638 1.00 0.34 H new ATOM 0 HA ILE B 80 -2.621 2.498 0.100 1.00 0.37 H new ATOM 0 HB ILE B 80 -1.235 0.622 -1.843 1.00 0.44 H new ATOM 0 HG12 ILE B 80 -3.710 0.369 -1.756 1.00 0.47 H new ATOM 0 HG13 ILE B 80 -2.865 -1.053 -1.177 1.00 0.47 H new ATOM 0 HG21 ILE B 80 -0.692 -0.778 0.128 1.00 0.54 H new ATOM 0 HG22 ILE B 80 0.101 0.814 0.192 1.00 0.54 H new ATOM 0 HG23 ILE B 80 -1.334 0.494 1.194 1.00 0.54 H new ATOM 0 HD11 ILE B 80 -4.827 -0.574 0.211 1.00 0.56 H new ATOM 0 HD12 ILE B 80 -3.335 -0.396 1.165 1.00 0.56 H new ATOM 0 HD13 ILE B 80 -4.194 1.048 0.577 1.00 0.56 H new ATOM 2943 N GLY B 81 -0.098 3.416 -1.878 1.00 0.36 N ATOM 2944 CA GLY B 81 1.121 4.218 -1.920 1.00 0.39 C ATOM 2945 C GLY B 81 0.826 5.662 -1.542 1.00 0.37 C ATOM 2946 O GLY B 81 1.593 6.278 -0.803 1.00 0.42 O ATOM 0 H GLY B 81 -0.433 3.109 -2.791 1.00 0.36 H new ATOM 0 HA2 GLY B 81 1.860 3.801 -1.236 1.00 0.39 H new ATOM 0 HA3 GLY B 81 1.554 4.179 -2.920 1.00 0.39 H new ATOM 2950 N GLU B 82 -0.314 6.193 -2.052 1.00 0.34 N ATOM 2951 CA GLU B 82 -0.765 7.565 -1.743 1.00 0.36 C ATOM 2952 C GLU B 82 -1.138 7.709 -0.247 1.00 0.33 C ATOM 2953 O GLU B 82 -1.114 8.818 0.284 1.00 0.40 O ATOM 2954 CB GLU B 82 -1.971 7.968 -2.626 1.00 0.41 C ATOM 2955 CG GLU B 82 -1.659 8.083 -4.124 1.00 0.49 C ATOM 2956 CD GLU B 82 -0.964 9.384 -4.499 1.00 0.61 C ATOM 2957 OE1 GLU B 82 -1.664 10.409 -4.656 1.00 0.91 O ATOM 2958 OE2 GLU B 82 0.278 9.376 -4.635 1.00 0.79 O ATOM 0 H GLU B 82 -0.937 5.686 -2.681 1.00 0.34 H new ATOM 0 HA GLU B 82 0.067 8.235 -1.960 1.00 0.36 H new ATOM 0 HB2 GLU B 82 -2.765 7.234 -2.490 1.00 0.41 H new ATOM 0 HB3 GLU B 82 -2.357 8.925 -2.275 1.00 0.41 H new ATOM 0 HG2 GLU B 82 -1.029 7.245 -4.422 1.00 0.49 H new ATOM 0 HG3 GLU B 82 -2.588 8.000 -4.688 1.00 0.49 H new ATOM 2965 N LEU B 83 -1.499 6.584 0.425 1.00 0.33 N ATOM 2966 CA LEU B 83 -1.840 6.594 1.866 1.00 0.35 C ATOM 2967 C LEU B 83 -0.608 7.003 2.701 1.00 0.37 C ATOM 2968 O LEU B 83 -0.679 7.940 3.497 1.00 0.45 O ATOM 2969 CB LEU B 83 -2.378 5.205 2.328 1.00 0.42 C ATOM 2970 CG LEU B 83 -3.891 5.137 2.642 1.00 0.51 C ATOM 2971 CD1 LEU B 83 -4.735 5.211 1.369 1.00 0.69 C ATOM 2972 CD2 LEU B 83 -4.230 3.874 3.442 1.00 0.63 C ATOM 0 H LEU B 83 -1.560 5.663 -0.010 1.00 0.33 H new ATOM 0 HA LEU B 83 -2.632 7.327 2.023 1.00 0.35 H new ATOM 0 HB2 LEU B 83 -2.155 4.474 1.551 1.00 0.42 H new ATOM 0 HB3 LEU B 83 -1.828 4.902 3.219 1.00 0.42 H new ATOM 0 HG LEU B 83 -4.135 6.006 3.252 1.00 0.51 H new ATOM 0 HD11 LEU B 83 -5.792 5.160 1.630 1.00 0.69 H new ATOM 0 HD12 LEU B 83 -4.533 6.150 0.853 1.00 0.69 H new ATOM 0 HD13 LEU B 83 -4.482 4.376 0.716 1.00 0.69 H new ATOM 0 HD21 LEU B 83 -5.300 3.851 3.649 1.00 0.63 H new ATOM 0 HD22 LEU B 83 -3.953 2.992 2.864 1.00 0.63 H new ATOM 0 HD23 LEU B 83 -3.678 3.880 4.382 1.00 0.63 H new ATOM 2984 N ALA B 84 0.519 6.293 2.496 1.00 0.38 N ATOM 2985 CA ALA B 84 1.777 6.591 3.205 1.00 0.44 C ATOM 2986 C ALA B 84 2.539 7.784 2.582 1.00 0.45 C ATOM 2987 O ALA B 84 3.452 8.318 3.216 1.00 0.55 O ATOM 2988 CB ALA B 84 2.668 5.354 3.246 1.00 0.55 C ATOM 0 H ALA B 84 0.583 5.510 1.846 1.00 0.38 H new ATOM 0 HA ALA B 84 1.511 6.878 4.222 1.00 0.44 H new ATOM 0 HB1 ALA B 84 3.593 5.589 3.772 1.00 0.55 H new ATOM 0 HB2 ALA B 84 2.149 4.549 3.766 1.00 0.55 H new ATOM 0 HB3 ALA B 84 2.900 5.039 2.229 1.00 0.55 H new ATOM 2994 N LYS B 85 2.183 8.190 1.337 1.00 0.41 N ATOM 2995 CA LYS B 85 2.830 9.340 0.667 1.00 0.45 C ATOM 2996 C LYS B 85 2.130 10.662 1.056 1.00 0.47 C ATOM 2997 O LYS B 85 2.796 11.686 1.194 1.00 0.57 O ATOM 2998 CB LYS B 85 2.830 9.145 -0.867 1.00 0.49 C ATOM 2999 CG LYS B 85 3.890 9.964 -1.618 1.00 0.57 C ATOM 3000 CD LYS B 85 3.868 9.723 -3.138 1.00 0.66 C ATOM 3001 CE LYS B 85 4.318 8.307 -3.535 1.00 0.79 C ATOM 3002 NZ LYS B 85 3.162 7.399 -3.816 1.00 1.10 N ATOM 0 H LYS B 85 1.456 7.739 0.782 1.00 0.41 H new ATOM 0 HA LYS B 85 3.866 9.396 1.002 1.00 0.45 H new ATOM 0 HB2 LYS B 85 2.985 8.088 -1.085 1.00 0.49 H new ATOM 0 HB3 LYS B 85 1.846 9.409 -1.253 1.00 0.49 H new ATOM 0 HG2 LYS B 85 3.729 11.024 -1.421 1.00 0.57 H new ATOM 0 HG3 LYS B 85 4.877 9.714 -1.230 1.00 0.57 H new ATOM 0 HD2 LYS B 85 2.858 9.894 -3.512 1.00 0.66 H new ATOM 0 HD3 LYS B 85 4.516 10.452 -3.624 1.00 0.66 H new ATOM 0 HE2 LYS B 85 4.954 8.365 -4.418 1.00 0.79 H new ATOM 0 HE3 LYS B 85 4.923 7.883 -2.734 1.00 0.79 H new ATOM 0 HZ1 LYS B 85 3.484 6.410 -3.795 1.00 1.10 H new ATOM 0 HZ2 LYS B 85 2.427 7.539 -3.094 1.00 1.10 H new ATOM 0 HZ3 LYS B 85 2.771 7.616 -4.755 1.00 1.10 H new ATOM 3016 N GLU B 86 0.787 10.627 1.252 1.00 0.42 N ATOM 3017 CA GLU B 86 0.003 11.826 1.638 1.00 0.46 C ATOM 3018 C GLU B 86 -0.115 11.965 3.182 1.00 0.50 C ATOM 3019 O GLU B 86 -1.112 12.488 3.692 1.00 0.81 O ATOM 3020 CB GLU B 86 -1.410 11.789 0.999 1.00 0.52 C ATOM 3021 CG GLU B 86 -1.432 11.846 -0.533 1.00 0.59 C ATOM 3022 CD GLU B 86 -1.108 13.225 -1.093 1.00 1.01 C ATOM 3023 OE1 GLU B 86 -2.032 14.061 -1.185 1.00 1.48 O ATOM 3024 OE2 GLU B 86 0.067 13.466 -1.449 1.00 1.68 O ATOM 0 H GLU B 86 0.226 9.781 1.149 1.00 0.42 H new ATOM 0 HA GLU B 86 0.540 12.697 1.262 1.00 0.46 H new ATOM 0 HB2 GLU B 86 -1.914 10.877 1.321 1.00 0.52 H new ATOM 0 HB3 GLU B 86 -1.989 12.627 1.387 1.00 0.52 H new ATOM 0 HG2 GLU B 86 -0.715 11.125 -0.926 1.00 0.59 H new ATOM 0 HG3 GLU B 86 -2.417 11.541 -0.886 1.00 0.59 H new ATOM 3031 N ILE B 87 0.915 11.501 3.923 1.00 0.48 N ATOM 3032 CA ILE B 87 0.955 11.588 5.394 1.00 0.51 C ATOM 3033 C ILE B 87 1.932 12.711 5.827 1.00 0.53 C ATOM 3034 O ILE B 87 1.663 13.439 6.786 1.00 0.58 O ATOM 3035 CB ILE B 87 1.341 10.189 6.013 1.00 0.56 C ATOM 3036 CG1 ILE B 87 0.863 10.038 7.489 1.00 0.61 C ATOM 3037 CG2 ILE B 87 2.837 9.863 5.867 1.00 0.62 C ATOM 3038 CD1 ILE B 87 1.603 10.865 8.530 1.00 0.63 C ATOM 0 H ILE B 87 1.739 11.057 3.517 1.00 0.48 H new ATOM 0 HA ILE B 87 -0.033 11.846 5.774 1.00 0.51 H new ATOM 0 HB ILE B 87 0.801 9.448 5.424 1.00 0.56 H new ATOM 0 HG12 ILE B 87 -0.194 10.300 7.534 1.00 0.61 H new ATOM 0 HG13 ILE B 87 0.943 8.987 7.768 1.00 0.61 H new ATOM 0 HG21 ILE B 87 3.042 8.889 6.311 1.00 0.62 H new ATOM 0 HG22 ILE B 87 3.104 9.843 4.810 1.00 0.62 H new ATOM 0 HG23 ILE B 87 3.427 10.625 6.376 1.00 0.62 H new ATOM 0 HD11 ILE B 87 1.179 10.673 9.516 1.00 0.63 H new ATOM 0 HD12 ILE B 87 2.658 10.591 8.529 1.00 0.63 H new ATOM 0 HD13 ILE B 87 1.503 11.924 8.292 1.00 0.63 H new ATOM 3050 N ARG B 88 3.049 12.857 5.078 1.00 0.57 N ATOM 3051 CA ARG B 88 4.086 13.871 5.348 1.00 0.67 C ATOM 3052 C ARG B 88 4.188 14.893 4.198 1.00 0.67 C ATOM 3053 O ARG B 88 4.309 16.095 4.453 1.00 0.84 O ATOM 3054 CB ARG B 88 5.455 13.196 5.598 1.00 0.75 C ATOM 3055 CG ARG B 88 5.841 12.112 4.580 1.00 0.82 C ATOM 3056 CD ARG B 88 7.224 11.539 4.850 1.00 1.05 C ATOM 3057 NE ARG B 88 7.557 10.427 3.935 1.00 1.17 N ATOM 3058 CZ ARG B 88 8.481 9.473 4.178 1.00 1.26 C ATOM 3059 NH1 ARG B 88 9.220 9.475 5.295 1.00 1.64 N ATOM 3060 NH2 ARG B 88 8.670 8.502 3.281 1.00 1.55 N ATOM 0 H ARG B 88 3.254 12.272 4.268 1.00 0.57 H new ATOM 0 HA ARG B 88 3.795 14.412 6.248 1.00 0.67 H new ATOM 0 HB2 ARG B 88 6.228 13.965 5.598 1.00 0.75 H new ATOM 0 HB3 ARG B 88 5.448 12.752 6.593 1.00 0.75 H new ATOM 0 HG2 ARG B 88 5.104 11.309 4.609 1.00 0.82 H new ATOM 0 HG3 ARG B 88 5.814 12.533 3.575 1.00 0.82 H new ATOM 0 HD2 ARG B 88 7.969 12.328 4.746 1.00 1.05 H new ATOM 0 HD3 ARG B 88 7.275 11.187 5.880 1.00 1.05 H new ATOM 0 HE ARG B 88 7.049 10.376 3.052 1.00 1.17 H new ATOM 0 HH11 ARG B 88 9.092 10.211 5.990 1.00 1.64 H new ATOM 0 HH12 ARG B 88 9.911 8.741 5.451 1.00 1.64 H new ATOM 0 HH21 ARG B 88 8.119 8.486 2.423 1.00 1.55 H new ATOM 0 HH22 ARG B 88 9.365 7.776 3.454 1.00 1.55 H new ATOM 3074 N LYS B 89 4.134 14.415 2.932 1.00 0.60 N ATOM 3075 CA LYS B 89 4.216 15.300 1.755 1.00 0.67 C ATOM 3076 C LYS B 89 2.837 15.473 1.075 1.00 0.63 C ATOM 3077 O LYS B 89 2.736 15.456 -0.159 1.00 0.76 O ATOM 3078 CB LYS B 89 5.291 14.804 0.750 1.00 0.76 C ATOM 3079 CG LYS B 89 5.084 13.380 0.207 1.00 0.78 C ATOM 3080 CD LYS B 89 5.903 13.107 -1.064 1.00 1.06 C ATOM 3081 CE LYS B 89 5.170 13.566 -2.328 1.00 1.32 C ATOM 3082 NZ LYS B 89 5.910 13.220 -3.580 1.00 1.65 N ATOM 0 H LYS B 89 4.034 13.426 2.705 1.00 0.60 H new ATOM 0 HA LYS B 89 4.526 16.284 2.107 1.00 0.67 H new ATOM 0 HB2 LYS B 89 5.321 15.494 -0.093 1.00 0.76 H new ATOM 0 HB3 LYS B 89 6.266 14.851 1.235 1.00 0.76 H new ATOM 0 HG2 LYS B 89 5.361 12.658 0.975 1.00 0.78 H new ATOM 0 HG3 LYS B 89 4.026 13.227 -0.007 1.00 0.78 H new ATOM 0 HD2 LYS B 89 6.862 13.620 -0.995 1.00 1.06 H new ATOM 0 HD3 LYS B 89 6.117 12.041 -1.136 1.00 1.06 H new ATOM 0 HE2 LYS B 89 4.181 13.108 -2.357 1.00 1.32 H new ATOM 0 HE3 LYS B 89 5.020 14.645 -2.285 1.00 1.32 H new ATOM 0 HZ1 LYS B 89 5.371 13.553 -4.405 1.00 1.65 H new ATOM 0 HZ2 LYS B 89 6.844 13.678 -3.569 1.00 1.65 H new ATOM 0 HZ3 LYS B 89 6.031 12.189 -3.638 1.00 1.65 H new ATOM 3096 N LYS B 90 1.767 15.644 1.890 1.00 0.58 N ATOM 3097 CA LYS B 90 0.402 15.867 1.358 1.00 0.56 C ATOM 3098 C LYS B 90 0.294 17.292 0.789 1.00 0.54 C ATOM 3099 O LYS B 90 -0.269 17.493 -0.290 1.00 0.58 O ATOM 3100 CB LYS B 90 -0.695 15.605 2.427 1.00 0.59 C ATOM 3101 CG LYS B 90 -0.596 16.441 3.714 1.00 0.66 C ATOM 3102 CD LYS B 90 -1.505 15.915 4.838 1.00 0.96 C ATOM 3103 CE LYS B 90 -2.977 16.301 4.655 1.00 1.48 C ATOM 3104 NZ LYS B 90 -3.222 17.753 4.914 1.00 2.03 N ATOM 0 H LYS B 90 1.823 15.632 2.908 1.00 0.58 H new ATOM 0 HA LYS B 90 0.230 15.148 0.557 1.00 0.56 H new ATOM 0 HB2 LYS B 90 -1.668 15.788 1.972 1.00 0.59 H new ATOM 0 HB3 LYS B 90 -0.664 14.550 2.699 1.00 0.59 H new ATOM 0 HG2 LYS B 90 0.437 16.445 4.061 1.00 0.66 H new ATOM 0 HG3 LYS B 90 -0.862 17.475 3.492 1.00 0.66 H new ATOM 0 HD2 LYS B 90 -1.424 14.829 4.884 1.00 0.96 H new ATOM 0 HD3 LYS B 90 -1.151 16.302 5.794 1.00 0.96 H new ATOM 0 HE2 LYS B 90 -3.290 16.058 3.640 1.00 1.48 H new ATOM 0 HE3 LYS B 90 -3.592 15.706 5.329 1.00 1.48 H new ATOM 0 HZ1 LYS B 90 -4.242 17.948 4.861 1.00 2.03 H new ATOM 0 HZ2 LYS B 90 -2.871 18.001 5.861 1.00 2.03 H new ATOM 0 HZ3 LYS B 90 -2.723 18.322 4.200 1.00 2.03 H new ATOM 3118 N LYS B 91 0.853 18.270 1.533 1.00 0.55 N ATOM 3119 CA LYS B 91 0.882 19.681 1.124 1.00 0.59 C ATOM 3120 C LYS B 91 2.319 20.229 1.310 1.00 0.62 C ATOM 3121 O LYS B 91 2.546 21.157 2.096 1.00 0.69 O ATOM 3122 CB LYS B 91 -0.137 20.507 1.947 1.00 0.64 C ATOM 3123 CG LYS B 91 -1.606 20.171 1.670 1.00 0.74 C ATOM 3124 CD LYS B 91 -2.548 20.863 2.663 1.00 0.84 C ATOM 3125 CE LYS B 91 -4.022 20.560 2.380 1.00 1.14 C ATOM 3126 NZ LYS B 91 -4.538 21.288 1.181 1.00 1.36 N ATOM 0 H LYS B 91 1.296 18.098 2.435 1.00 0.55 H new ATOM 0 HA LYS B 91 0.600 19.764 0.074 1.00 0.59 H new ATOM 0 HB2 LYS B 91 0.063 20.353 3.007 1.00 0.64 H new ATOM 0 HB3 LYS B 91 0.024 21.565 1.743 1.00 0.64 H new ATOM 0 HG2 LYS B 91 -1.863 20.474 0.655 1.00 0.74 H new ATOM 0 HG3 LYS B 91 -1.748 19.092 1.726 1.00 0.74 H new ATOM 0 HD2 LYS B 91 -2.302 20.543 3.676 1.00 0.84 H new ATOM 0 HD3 LYS B 91 -2.387 21.940 2.621 1.00 0.84 H new ATOM 0 HE2 LYS B 91 -4.147 19.487 2.231 1.00 1.14 H new ATOM 0 HE3 LYS B 91 -4.619 20.832 3.251 1.00 1.14 H new ATOM 0 HZ1 LYS B 91 -5.539 21.048 1.034 1.00 1.36 H new ATOM 0 HZ2 LYS B 91 -4.446 22.313 1.331 1.00 1.36 H new ATOM 0 HZ3 LYS B 91 -3.988 21.010 0.343 1.00 1.36 H new ATOM 3140 N ASP B 92 3.293 19.626 0.582 1.00 0.66 N ATOM 3141 CA ASP B 92 4.723 20.025 0.666 1.00 0.74 C ATOM 3142 C ASP B 92 5.007 21.339 -0.102 1.00 0.92 C ATOM 3143 O ASP B 92 5.660 21.347 -1.151 1.00 1.72 O ATOM 3144 CB ASP B 92 5.655 18.879 0.186 1.00 0.75 C ATOM 3145 CG ASP B 92 5.355 18.387 -1.229 1.00 0.88 C ATOM 3146 OD1 ASP B 92 4.325 17.702 -1.416 1.00 0.93 O ATOM 3147 OD2 ASP B 92 6.155 18.683 -2.141 1.00 1.15 O ATOM 0 H ASP B 92 3.115 18.862 -0.070 1.00 0.66 H new ATOM 0 HA ASP B 92 4.940 20.217 1.717 1.00 0.74 H new ATOM 0 HB2 ASP B 92 6.688 19.223 0.229 1.00 0.75 H new ATOM 0 HB3 ASP B 92 5.569 18.041 0.877 1.00 0.75 H new ATOM 3152 N LEU B 93 4.504 22.451 0.463 1.00 0.63 N ATOM 3153 CA LEU B 93 4.651 23.811 -0.111 1.00 0.66 C ATOM 3154 C LEU B 93 4.057 24.847 0.868 1.00 0.69 C ATOM 3155 O LEU B 93 4.678 25.879 1.146 1.00 0.82 O ATOM 3156 CB LEU B 93 3.952 23.922 -1.494 1.00 0.71 C ATOM 3157 CG LEU B 93 4.389 25.113 -2.381 1.00 0.97 C ATOM 3158 CD1 LEU B 93 5.795 24.898 -2.950 1.00 1.27 C ATOM 3159 CD2 LEU B 93 3.387 25.350 -3.516 1.00 1.18 C ATOM 0 H LEU B 93 3.979 22.437 1.338 1.00 0.63 H new ATOM 0 HA LEU B 93 5.712 24.009 -0.260 1.00 0.66 H new ATOM 0 HB2 LEU B 93 4.132 22.999 -2.045 1.00 0.71 H new ATOM 0 HB3 LEU B 93 2.877 23.991 -1.331 1.00 0.71 H new ATOM 0 HG LEU B 93 4.411 26.000 -1.748 1.00 0.97 H new ATOM 0 HD11 LEU B 93 6.072 25.752 -3.568 1.00 1.27 H new ATOM 0 HD12 LEU B 93 6.507 24.797 -2.131 1.00 1.27 H new ATOM 0 HD13 LEU B 93 5.808 23.992 -3.556 1.00 1.27 H new ATOM 0 HD21 LEU B 93 3.718 26.192 -4.124 1.00 1.18 H new ATOM 0 HD22 LEU B 93 3.323 24.457 -4.138 1.00 1.18 H new ATOM 0 HD23 LEU B 93 2.406 25.570 -3.095 1.00 1.18 H new ATOM 3171 N LYS B 94 2.848 24.537 1.388 1.00 0.66 N ATOM 3172 CA LYS B 94 2.134 25.388 2.354 1.00 0.74 C ATOM 3173 C LYS B 94 2.665 25.136 3.783 1.00 0.70 C ATOM 3174 O LYS B 94 3.001 26.087 4.494 1.00 0.79 O ATOM 3175 CB LYS B 94 0.616 25.099 2.270 1.00 0.84 C ATOM 3176 CG LYS B 94 -0.289 26.075 3.029 1.00 1.00 C ATOM 3177 CD LYS B 94 -0.331 27.464 2.385 1.00 1.15 C ATOM 3178 CE LYS B 94 -1.440 28.337 2.969 1.00 1.45 C ATOM 3179 NZ LYS B 94 -1.213 28.669 4.409 1.00 1.61 N ATOM 0 H LYS B 94 2.342 23.685 1.145 1.00 0.66 H new ATOM 0 HA LYS B 94 2.306 26.437 2.112 1.00 0.74 H new ATOM 0 HB2 LYS B 94 0.322 25.101 1.220 1.00 0.84 H new ATOM 0 HB3 LYS B 94 0.435 24.094 2.650 1.00 0.84 H new ATOM 0 HG2 LYS B 94 -1.299 25.668 3.072 1.00 1.00 H new ATOM 0 HG3 LYS B 94 0.063 26.166 4.057 1.00 1.00 H new ATOM 0 HD2 LYS B 94 0.630 27.958 2.527 1.00 1.15 H new ATOM 0 HD3 LYS B 94 -0.481 27.360 1.310 1.00 1.15 H new ATOM 0 HE2 LYS B 94 -1.511 29.260 2.394 1.00 1.45 H new ATOM 0 HE3 LYS B 94 -2.395 27.822 2.865 1.00 1.45 H new ATOM 0 HZ1 LYS B 94 -1.994 29.262 4.756 1.00 1.61 H new ATOM 0 HZ2 LYS B 94 -1.172 27.791 4.965 1.00 1.61 H new ATOM 0 HZ3 LYS B 94 -0.315 29.185 4.509 1.00 1.61 H new ATOM 3193 N ILE B 95 2.738 23.844 4.187 1.00 0.65 N ATOM 3194 CA ILE B 95 3.241 23.442 5.518 1.00 0.66 C ATOM 3195 C ILE B 95 4.459 22.511 5.379 1.00 0.68 C ATOM 3196 O ILE B 95 4.550 21.749 4.407 1.00 0.78 O ATOM 3197 CB ILE B 95 2.138 22.748 6.393 1.00 0.74 C ATOM 3198 CG1 ILE B 95 1.507 21.526 5.670 1.00 0.83 C ATOM 3199 CG2 ILE B 95 1.063 23.766 6.791 1.00 0.84 C ATOM 3200 CD1 ILE B 95 0.706 20.605 6.578 1.00 1.04 C ATOM 0 H ILE B 95 2.452 23.059 3.602 1.00 0.65 H new ATOM 0 HA ILE B 95 3.538 24.357 6.030 1.00 0.66 H new ATOM 0 HB ILE B 95 2.617 22.370 7.296 1.00 0.74 H new ATOM 0 HG12 ILE B 95 0.857 21.886 4.873 1.00 0.83 H new ATOM 0 HG13 ILE B 95 2.301 20.949 5.197 1.00 0.83 H new ATOM 0 HG21 ILE B 95 0.303 23.274 7.398 1.00 0.84 H new ATOM 0 HG22 ILE B 95 1.520 24.572 7.365 1.00 0.84 H new ATOM 0 HG23 ILE B 95 0.601 24.177 5.893 1.00 0.84 H new ATOM 0 HD11 ILE B 95 0.301 19.779 5.993 1.00 1.04 H new ATOM 0 HD12 ILE B 95 1.355 20.211 7.361 1.00 1.04 H new ATOM 0 HD13 ILE B 95 -0.113 21.164 7.032 1.00 1.04 H new ATOM 3212 N ARG B 96 5.393 22.582 6.348 1.00 0.70 N ATOM 3213 CA ARG B 96 6.616 21.749 6.337 1.00 0.79 C ATOM 3214 C ARG B 96 6.984 21.198 7.742 1.00 0.79 C ATOM 3215 O ARG B 96 8.120 20.750 7.949 1.00 1.02 O ATOM 3216 CB ARG B 96 7.793 22.560 5.744 1.00 0.99 C ATOM 3217 CG ARG B 96 8.100 23.873 6.481 1.00 1.12 C ATOM 3218 CD ARG B 96 9.463 24.454 6.101 1.00 1.41 C ATOM 3219 NE ARG B 96 10.589 23.608 6.549 1.00 1.59 N ATOM 3220 CZ ARG B 96 11.895 23.868 6.322 1.00 2.01 C ATOM 3221 NH1 ARG B 96 12.287 24.949 5.634 1.00 2.42 N ATOM 3222 NH2 ARG B 96 12.821 23.026 6.789 1.00 2.37 N ATOM 0 H ARG B 96 5.325 23.208 7.150 1.00 0.70 H new ATOM 0 HA ARG B 96 6.413 20.881 5.710 1.00 0.79 H new ATOM 0 HB2 ARG B 96 8.687 21.937 5.752 1.00 0.99 H new ATOM 0 HB3 ARG B 96 7.572 22.787 4.701 1.00 0.99 H new ATOM 0 HG2 ARG B 96 7.322 24.603 6.256 1.00 1.12 H new ATOM 0 HG3 ARG B 96 8.071 23.698 7.556 1.00 1.12 H new ATOM 0 HD2 ARG B 96 9.513 24.575 5.019 1.00 1.41 H new ATOM 0 HD3 ARG B 96 9.564 25.448 6.538 1.00 1.41 H new ATOM 0 HE ARG B 96 10.362 22.761 7.071 1.00 1.59 H new ATOM 0 HH11 ARG B 96 11.592 25.600 5.267 1.00 2.42 H new ATOM 0 HH12 ARG B 96 13.280 25.121 5.477 1.00 2.42 H new ATOM 0 HH21 ARG B 96 12.539 22.196 7.311 1.00 2.37 H new ATOM 0 HH22 ARG B 96 13.810 23.213 6.623 1.00 2.37 H new ATOM 3236 N LYS B 97 6.023 21.195 8.698 1.00 0.72 N ATOM 3237 CA LYS B 97 6.282 20.693 10.068 1.00 0.76 C ATOM 3238 C LYS B 97 4.970 20.331 10.799 1.00 0.76 C ATOM 3239 O LYS B 97 4.177 21.216 11.136 1.00 1.04 O ATOM 3240 CB LYS B 97 7.103 21.719 10.900 1.00 0.89 C ATOM 3241 CG LYS B 97 6.555 23.151 10.896 1.00 0.94 C ATOM 3242 CD LYS B 97 7.294 24.052 11.891 1.00 1.16 C ATOM 3243 CE LYS B 97 6.698 25.459 11.953 1.00 1.49 C ATOM 3244 NZ LYS B 97 5.333 25.481 12.564 1.00 1.86 N ATOM 0 H LYS B 97 5.072 21.531 8.547 1.00 0.72 H new ATOM 0 HA LYS B 97 6.873 19.783 9.968 1.00 0.76 H new ATOM 0 HB2 LYS B 97 7.153 21.369 11.931 1.00 0.89 H new ATOM 0 HB3 LYS B 97 8.124 21.737 10.519 1.00 0.89 H new ATOM 0 HG2 LYS B 97 6.643 23.570 9.894 1.00 0.94 H new ATOM 0 HG3 LYS B 97 5.493 23.133 11.142 1.00 0.94 H new ATOM 0 HD2 LYS B 97 7.258 23.601 12.882 1.00 1.16 H new ATOM 0 HD3 LYS B 97 8.345 24.117 11.608 1.00 1.16 H new ATOM 0 HE2 LYS B 97 7.360 26.105 12.530 1.00 1.49 H new ATOM 0 HE3 LYS B 97 6.647 25.873 10.946 1.00 1.49 H new ATOM 0 HZ1 LYS B 97 5.011 26.465 12.659 1.00 1.86 H new ATOM 0 HZ2 LYS B 97 4.672 24.958 11.955 1.00 1.86 H new ATOM 0 HZ3 LYS B 97 5.366 25.035 13.503 1.00 1.86 H new ATOM 3258 N LYS B 98 4.738 19.017 11.025 1.00 0.71 N ATOM 3259 CA LYS B 98 3.526 18.540 11.728 1.00 0.74 C ATOM 3260 C LYS B 98 3.702 17.089 12.208 1.00 0.90 C ATOM 3261 O LYS B 98 3.790 16.882 13.437 1.00 1.07 O ATOM 3262 CB LYS B 98 2.274 18.668 10.822 1.00 0.96 C ATOM 3263 CG LYS B 98 0.957 18.791 11.591 1.00 1.08 C ATOM 3264 CD LYS B 98 -0.232 19.054 10.658 1.00 1.52 C ATOM 3265 CE LYS B 98 -1.544 19.259 11.423 1.00 1.69 C ATOM 3266 NZ LYS B 98 -1.573 20.540 12.196 1.00 1.85 N ATOM 3267 OXT LYS B 98 3.755 16.179 11.353 1.00 1.15 O ATOM 0 H LYS B 98 5.371 18.273 10.732 1.00 0.71 H new ATOM 0 HA LYS B 98 3.378 19.171 12.604 1.00 0.74 H new ATOM 0 HB2 LYS B 98 2.391 19.541 10.180 1.00 0.96 H new ATOM 0 HB3 LYS B 98 2.221 17.797 10.169 1.00 0.96 H new ATOM 0 HG2 LYS B 98 0.780 17.875 12.155 1.00 1.08 H new ATOM 0 HG3 LYS B 98 1.035 19.601 12.316 1.00 1.08 H new ATOM 0 HD2 LYS B 98 -0.026 19.937 10.053 1.00 1.52 H new ATOM 0 HD3 LYS B 98 -0.343 18.215 9.971 1.00 1.52 H new ATOM 0 HE2 LYS B 98 -2.375 19.247 10.718 1.00 1.69 H new ATOM 0 HE3 LYS B 98 -1.694 18.424 12.107 1.00 1.69 H new ATOM 0 HZ1 LYS B 98 -2.507 20.658 12.638 1.00 1.85 H new ATOM 0 HZ2 LYS B 98 -0.841 20.516 12.935 1.00 1.85 H new ATOM 0 HZ3 LYS B 98 -1.391 21.337 11.554 1.00 1.85 H new TER 3281 LYS B 98 HETATM 3282 NAA ANW A 99 10.499 14.411 11.280 1.00 4.56 N HETATM 3283 NAB ANW A 99 10.829 15.948 9.571 1.00 6.22 N HETATM 3284 CAC ANW A 99 12.685 8.052 16.424 1.00 5.26 C HETATM 3285 CAD ANW A 99 12.197 9.450 16.811 1.00 4.51 C HETATM 3286 CAE ANW A 99 11.022 9.329 17.785 1.00 5.16 C HETATM 3287 CAF ANW A 99 11.800 10.147 15.672 1.00 3.64 C HETATM 3288 CAG ANW A 99 12.457 11.323 15.319 1.00 3.13 C HETATM 3289 CAH ANW A 99 12.034 12.055 14.217 1.00 2.76 C HETATM 3290 CAI ANW A 99 10.939 11.625 13.476 1.00 3.04 C HETATM 3291 CAJ ANW A 99 10.285 10.449 13.824 1.00 3.59 C HETATM 3292 CAK ANW A 99 10.715 9.708 14.917 1.00 3.84 C HETATM 3293 CAL ANW A 99 11.019 13.623 12.232 1.00 3.63 C HETATM 3294 CAM ANW A 99 11.217 15.392 10.715 1.00 5.17 C HETATM 3295 CAN ANW A 99 12.528 15.640 11.112 1.00 5.05 C HETATM 3296 CAO ANW A 99 13.089 14.836 12.095 1.00 4.25 C HETATM 3297 CAP ANW A 99 12.326 13.820 12.658 1.00 3.42 C HETATM 3298 CAQ ANW A 99 12.789 13.133 13.772 1.00 3.01 C HETATM 3299 CAR ANW A 99 13.201 16.777 10.680 1.00 6.05 C HETATM 3300 OAS ANW A 99 10.439 12.417 12.485 1.00 3.49 O HETATM 3301 OAT ANW A 99 13.847 13.440 14.319 1.00 3.52 O HETATM 3302 OAU ANW A 99 14.400 16.944 10.993 1.00 6.33 O HETATM 3303 OAV ANW A 99 12.606 17.644 10.004 1.00 6.88 O HETATM 0 HOAV ANW A 99 13.219 18.383 9.808 1.00 6.88 H new HETATM 0 HNAB ANW A 99 9.976 15.629 9.113 1.00 6.22 H new HETATM 0 HNAA ANW A 99 11.385 16.694 9.152 1.00 6.22 H new HETATM 0 HAEB ANW A 99 10.210 8.780 17.309 1.00 5.16 H new HETATM 0 HAEA ANW A 99 11.344 8.796 18.680 1.00 5.16 H new HETATM 0 HACB ANW A 99 13.008 7.519 17.318 1.00 5.26 H new HETATM 0 HACA ANW A 99 11.873 7.502 15.947 1.00 5.26 H new HETATM 0 HAO ANW A 99 14.116 15.000 12.421 1.00 4.25 H new HETATM 0 HAK ANW A 99 10.204 8.783 15.184 1.00 3.84 H new HETATM 0 HAJ ANW A 99 9.432 10.107 13.237 1.00 3.59 H new HETATM 0 HAG ANW A 99 13.305 11.670 15.909 1.00 3.13 H new HETATM 0 HAE ANW A 99 10.674 10.324 18.061 1.00 5.16 H new HETATM 0 HAD ANW A 99 13.009 9.995 17.292 1.00 4.51 H new HETATM 0 HAC ANW A 99 13.522 8.138 15.731 1.00 5.26 H new HETATM 3317 NAA ANW B 99 -13.982 -18.000 3.998 1.00 4.81 N HETATM 3318 NAB ANW B 99 -15.561 -19.508 3.204 1.00 6.57 N HETATM 3319 CAC ANW B 99 -10.834 -10.382 5.615 1.00 5.53 C HETATM 3320 CAD ANW B 99 -11.066 -11.479 6.657 1.00 4.77 C HETATM 3321 CAE ANW B 99 -9.791 -11.683 7.483 1.00 5.55 C HETATM 3322 CAF ANW B 99 -11.420 -12.664 6.023 1.00 3.85 C HETATM 3323 CAG ANW B 99 -12.689 -13.195 6.219 1.00 3.21 C HETATM 3324 CAH ANW B 99 -13.067 -14.363 5.566 1.00 2.83 C HETATM 3325 CAI ANW B 99 -12.167 -15.009 4.725 1.00 3.21 C HETATM 3326 CAJ ANW B 99 -10.900 -14.473 4.518 1.00 3.83 C HETATM 3327 CAK ANW B 99 -10.527 -13.301 5.168 1.00 4.12 C HETATM 3328 CAL ANW B 99 -13.690 -16.788 4.493 1.00 3.82 C HETATM 3329 CAM ANW B 99 -15.245 -18.439 3.931 1.00 5.45 C HETATM 3330 CAN ANW B 99 -16.302 -17.658 4.385 1.00 5.26 C HETATM 3331 CAO ANW B 99 -16.029 -16.396 4.894 1.00 4.33 C HETATM 3332 CAP ANW B 99 -14.710 -15.961 4.950 1.00 3.50 C HETATM 3333 CAQ ANW B 99 -14.380 -14.805 5.644 1.00 3.00 C HETATM 3334 CAR ANW B 99 -17.583 -18.188 4.498 1.00 6.31 C HETATM 3335 OAS ANW B 99 -12.486 -16.221 4.193 1.00 3.68 O HETATM 3336 OAT ANW B 99 -15.214 -14.215 6.330 1.00 3.40 O HETATM 3337 OAU ANW B 99 -18.527 -17.458 4.869 1.00 6.52 O HETATM 3338 OAV ANW B 99 -17.792 -19.394 4.248 1.00 7.25 O HETATM 0 HOAV ANW B 99 -18.739 -19.599 4.394 1.00 7.25 H new HETATM 0 HNAB ANW B 99 -14.836 -20.006 2.687 1.00 6.57 H new HETATM 0 HNAA ANW B 99 -16.528 -19.830 3.164 1.00 6.57 H new HETATM 0 HAEB ANW B 99 -8.974 -11.977 6.824 1.00 5.55 H new HETATM 0 HAEA ANW B 99 -9.532 -10.753 7.989 1.00 5.55 H new HETATM 0 HACB ANW B 99 -10.577 -9.450 6.119 1.00 5.53 H new HETATM 0 HACA ANW B 99 -10.018 -10.675 4.954 1.00 5.53 H new HETATM 0 HAO ANW B 99 -16.838 -15.755 5.245 1.00 4.33 H new HETATM 0 HAK ANW B 99 -9.534 -12.882 5.007 1.00 4.12 H new HETATM 0 HAJ ANW B 99 -10.200 -14.971 3.847 1.00 3.83 H new HETATM 0 HAG ANW B 99 -13.390 -12.694 6.887 1.00 3.21 H new HETATM 0 HAE ANW B 99 -9.959 -12.464 8.224 1.00 5.55 H new HETATM 0 HAD ANW B 99 -11.876 -11.180 7.322 1.00 4.77 H new HETATM 0 HAC ANW B 99 -11.742 -10.239 5.029 1.00 5.53 H new