USER MOD reduce.3.24.130724 H: found=0, std=0, add=981, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 982 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 116 GLN : amide:sc= 0.419 K(o=0.8,f=-5.7!) USER MOD Set 1.2: A 120 THR OG1 : rot 180:sc= 0.378 USER MOD Set 2.1: A 77 LYS NZ :NH3+ -178:sc= 2.86 (180deg=1.87) USER MOD Set 2.2: A 111 ASN : amide:sc= 0.862 K(o=5.9,f=4.6) USER MOD Set 2.3: A 112 SER OG : rot 112:sc= 2.15 USER MOD Set 3.1: A 70 TYR OH : rot 30:sc= 0.352 USER MOD Set 3.2: A 104 LYS NZ :NH3+ 138:sc= 0.352 (180deg=0) USER MOD Set 4.1: A 37 HIS : no HE2:sc= 1.22 K(o=0.84,f=-5.2!) USER MOD Set 4.2: A 65 ASN : amide:sc= -0.379 K(o=0.84,f=-0.31) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0.00428 USER MOD Single : A 10 SER OG : rot -48:sc= 1.45 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 HIS : no HD1:sc= -0.666 K(o=-0.67,f=-1.6) USER MOD Single : A 25 LYS NZ :NH3+ -154:sc= 1.24 (180deg=1.22) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0.0397 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= -0.0307 USER MOD Single : A 54 SER OG : rot -30:sc=-0.00574 USER MOD Single : A 55 SER OG : rot -170:sc= -0.0748 USER MOD Single : A 56 THR OG1 : rot -117:sc= 0.682 USER MOD Single : A 57 HIS : no HE2:sc= 0.601 K(o=0.6,f=-2.1!) USER MOD Single : A 67 SER OG : rot 180:sc= -0.356 USER MOD Single : A 74 GLN : amide:sc= 1.75 K(o=1.8,f=0) USER MOD Single : A 76 GLN : amide:sc= 0.87 K(o=0.87,f=-0.042) USER MOD Single : A 81 SER OG : rot 105:sc= 1.24 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot -170:sc=-0.00703 USER MOD Single : A 110 LYS NZ :NH3+ -173:sc= 1.23 (180deg=1.11) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 82:sc= 1.51 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 ASN : amide:sc= 1.18 K(o=1.2,f=-9.6!) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 LYS NZ :NH3+ 173:sc= 1.21 (180deg=1.06) USER MOD ----------------------------------------------------------------- ATOM 20 N ALA A 2 5.470 0.091 1.287 1.00 0.00 N ATOM 21 CA ALA A 2 6.905 0.237 1.082 1.00 0.00 C ATOM 22 C ALA A 2 7.264 -0.389 -0.266 1.00 0.00 C ATOM 23 O ALA A 2 6.576 -1.297 -0.737 1.00 0.00 O ATOM 24 CB ALA A 2 7.672 -0.444 2.220 1.00 0.00 C ATOM 0 HA ALA A 2 7.181 1.292 1.080 1.00 0.00 H new ATOM 0 HB1 ALA A 2 8.744 -0.329 2.057 1.00 0.00 H new ATOM 0 HB2 ALA A 2 7.398 0.016 3.170 1.00 0.00 H new ATOM 0 HB3 ALA A 2 7.421 -1.504 2.245 1.00 0.00 H new ATOM 30 N ASP A 3 8.356 0.084 -0.862 1.00 0.00 N ATOM 31 CA ASP A 3 8.865 -0.364 -2.161 1.00 0.00 C ATOM 32 C ASP A 3 10.381 -0.562 -2.118 1.00 0.00 C ATOM 33 O ASP A 3 10.910 -1.407 -2.841 1.00 0.00 O ATOM 34 CB ASP A 3 8.497 0.650 -3.248 1.00 0.00 C ATOM 35 CG ASP A 3 9.013 0.206 -4.626 1.00 0.00 C ATOM 36 OD1 ASP A 3 8.480 -0.779 -5.187 1.00 0.00 O ATOM 37 OD2 ASP A 3 9.914 0.872 -5.182 1.00 0.00 O ATOM 0 H ASP A 3 8.932 0.814 -0.442 1.00 0.00 H new ATOM 0 HA ASP A 3 8.403 -1.323 -2.395 1.00 0.00 H new ATOM 0 HB2 ASP A 3 7.414 0.770 -3.284 1.00 0.00 H new ATOM 0 HB3 ASP A 3 8.917 1.624 -2.997 1.00 0.00 H new ATOM 42 N ILE A 4 11.070 0.135 -1.207 1.00 0.00 N ATOM 43 CA ILE A 4 12.467 -0.071 -0.875 1.00 0.00 C ATOM 44 C ILE A 4 12.476 -0.288 0.634 1.00 0.00 C ATOM 45 O ILE A 4 12.657 0.634 1.429 1.00 0.00 O ATOM 46 CB ILE A 4 13.360 1.102 -1.331 1.00 0.00 C ATOM 47 CG1 ILE A 4 13.146 1.460 -2.821 1.00 0.00 C ATOM 48 CG2 ILE A 4 14.827 0.696 -1.082 1.00 0.00 C ATOM 49 CD1 ILE A 4 14.020 2.620 -3.309 1.00 0.00 C ATOM 0 H ILE A 4 10.644 0.886 -0.664 1.00 0.00 H new ATOM 0 HA ILE A 4 12.893 -0.927 -1.399 1.00 0.00 H new ATOM 0 HB ILE A 4 13.097 1.993 -0.762 1.00 0.00 H new ATOM 0 HG12 ILE A 4 13.353 0.580 -3.430 1.00 0.00 H new ATOM 0 HG13 ILE A 4 12.098 1.716 -2.977 1.00 0.00 H new ATOM 0 HG21 ILE A 4 15.487 1.506 -1.395 1.00 0.00 H new ATOM 0 HG22 ILE A 4 14.974 0.497 -0.020 1.00 0.00 H new ATOM 0 HG23 ILE A 4 15.058 -0.202 -1.655 1.00 0.00 H new ATOM 0 HD11 ILE A 4 13.814 2.813 -4.362 1.00 0.00 H new ATOM 0 HD12 ILE A 4 13.797 3.514 -2.726 1.00 0.00 H new ATOM 0 HD13 ILE A 4 15.071 2.360 -3.187 1.00 0.00 H new ATOM 61 N THR A 5 12.160 -1.507 1.038 1.00 0.00 N ATOM 62 CA THR A 5 12.120 -1.871 2.440 1.00 0.00 C ATOM 63 C THR A 5 13.573 -2.042 2.901 1.00 0.00 C ATOM 64 O THR A 5 14.298 -2.913 2.411 1.00 0.00 O ATOM 65 CB THR A 5 11.269 -3.132 2.590 1.00 0.00 C ATOM 66 OG1 THR A 5 9.966 -2.868 2.100 1.00 0.00 O ATOM 67 CG2 THR A 5 11.186 -3.609 4.038 1.00 0.00 C ATOM 0 H THR A 5 11.925 -2.269 0.403 1.00 0.00 H new ATOM 0 HA THR A 5 11.657 -1.112 3.070 1.00 0.00 H new ATOM 0 HB THR A 5 11.744 -3.927 2.016 1.00 0.00 H new ATOM 0 HG1 THR A 5 9.413 -3.672 2.191 1.00 0.00 H new ATOM 0 HG21 THR A 5 10.571 -4.507 4.091 1.00 0.00 H new ATOM 0 HG22 THR A 5 12.187 -3.833 4.405 1.00 0.00 H new ATOM 0 HG23 THR A 5 10.741 -2.827 4.654 1.00 0.00 H new ATOM 75 N LEU A 6 14.017 -1.169 3.801 1.00 0.00 N ATOM 76 CA LEU A 6 15.328 -1.236 4.435 1.00 0.00 C ATOM 77 C LEU A 6 15.293 -2.275 5.555 1.00 0.00 C ATOM 78 O LEU A 6 14.248 -2.552 6.148 1.00 0.00 O ATOM 79 CB LEU A 6 15.729 0.144 4.994 1.00 0.00 C ATOM 80 CG LEU A 6 16.467 1.033 3.979 1.00 0.00 C ATOM 81 CD1 LEU A 6 15.683 1.287 2.686 1.00 0.00 C ATOM 82 CD2 LEU A 6 16.801 2.382 4.610 1.00 0.00 C ATOM 0 H LEU A 6 13.460 -0.375 4.117 1.00 0.00 H new ATOM 0 HA LEU A 6 16.071 -1.529 3.694 1.00 0.00 H new ATOM 0 HB2 LEU A 6 14.832 0.663 5.333 1.00 0.00 H new ATOM 0 HB3 LEU A 6 16.365 0.001 5.868 1.00 0.00 H new ATOM 0 HG LEU A 6 17.369 0.483 3.710 1.00 0.00 H new ATOM 0 HD11 LEU A 6 16.271 1.922 2.023 1.00 0.00 H new ATOM 0 HD12 LEU A 6 15.478 0.337 2.192 1.00 0.00 H new ATOM 0 HD13 LEU A 6 14.742 1.783 2.923 1.00 0.00 H new ATOM 0 HD21 LEU A 6 17.323 3.004 3.883 1.00 0.00 H new ATOM 0 HD22 LEU A 6 15.880 2.878 4.917 1.00 0.00 H new ATOM 0 HD23 LEU A 6 17.438 2.229 5.481 1.00 0.00 H new ATOM 94 N ILE A 7 16.466 -2.814 5.870 1.00 0.00 N ATOM 95 CA ILE A 7 16.672 -3.895 6.822 1.00 0.00 C ATOM 96 C ILE A 7 17.740 -3.401 7.803 1.00 0.00 C ATOM 97 O ILE A 7 18.939 -3.485 7.528 1.00 0.00 O ATOM 98 CB ILE A 7 17.022 -5.188 6.040 1.00 0.00 C ATOM 99 CG1 ILE A 7 15.798 -5.616 5.192 1.00 0.00 C ATOM 100 CG2 ILE A 7 17.478 -6.332 6.959 1.00 0.00 C ATOM 101 CD1 ILE A 7 15.966 -6.929 4.425 1.00 0.00 C ATOM 0 H ILE A 7 17.338 -2.493 5.448 1.00 0.00 H new ATOM 0 HA ILE A 7 15.790 -4.157 7.407 1.00 0.00 H new ATOM 0 HB ILE A 7 17.867 -4.968 5.388 1.00 0.00 H new ATOM 0 HG12 ILE A 7 14.934 -5.706 5.850 1.00 0.00 H new ATOM 0 HG13 ILE A 7 15.575 -4.823 4.479 1.00 0.00 H new ATOM 0 HG21 ILE A 7 17.710 -7.211 6.358 1.00 0.00 H new ATOM 0 HG22 ILE A 7 18.367 -6.024 7.509 1.00 0.00 H new ATOM 0 HG23 ILE A 7 16.681 -6.573 7.663 1.00 0.00 H new ATOM 0 HD11 ILE A 7 15.056 -7.141 3.863 1.00 0.00 H new ATOM 0 HD12 ILE A 7 16.806 -6.843 3.736 1.00 0.00 H new ATOM 0 HD13 ILE A 7 16.155 -7.740 5.129 1.00 0.00 H new ATOM 113 N SER A 8 17.290 -2.815 8.913 1.00 0.00 N ATOM 114 CA SER A 8 18.125 -2.410 10.038 1.00 0.00 C ATOM 115 C SER A 8 18.710 -3.649 10.737 1.00 0.00 C ATOM 116 O SER A 8 18.184 -4.759 10.580 1.00 0.00 O ATOM 117 CB SER A 8 17.268 -1.607 11.022 1.00 0.00 C ATOM 118 OG SER A 8 16.396 -0.700 10.359 1.00 0.00 O ATOM 0 H SER A 8 16.302 -2.604 9.056 1.00 0.00 H new ATOM 0 HA SER A 8 18.951 -1.795 9.680 1.00 0.00 H new ATOM 0 HB2 SER A 8 16.680 -2.292 11.633 1.00 0.00 H new ATOM 0 HB3 SER A 8 17.918 -1.054 11.700 1.00 0.00 H new ATOM 0 HG SER A 8 15.867 -0.210 11.023 1.00 0.00 H new ATOM 124 N GLY A 9 19.760 -3.483 11.548 1.00 0.00 N ATOM 125 CA GLY A 9 20.489 -4.629 12.064 1.00 0.00 C ATOM 126 C GLY A 9 21.664 -4.303 12.970 1.00 0.00 C ATOM 127 O GLY A 9 22.783 -4.726 12.689 1.00 0.00 O ATOM 0 H GLY A 9 20.115 -2.577 11.854 1.00 0.00 H new ATOM 0 HA2 GLY A 9 19.793 -5.262 12.614 1.00 0.00 H new ATOM 0 HA3 GLY A 9 20.855 -5.215 11.221 1.00 0.00 H new ATOM 131 N SER A 10 21.421 -3.594 14.070 1.00 0.00 N ATOM 132 CA SER A 10 22.397 -3.364 15.127 1.00 0.00 C ATOM 133 C SER A 10 21.759 -3.573 16.499 1.00 0.00 C ATOM 134 O SER A 10 20.551 -3.392 16.658 1.00 0.00 O ATOM 135 CB SER A 10 22.982 -1.955 14.977 1.00 0.00 C ATOM 136 OG SER A 10 21.998 -0.933 15.101 1.00 0.00 O ATOM 0 H SER A 10 20.519 -3.154 14.253 1.00 0.00 H new ATOM 0 HA SER A 10 23.211 -4.084 15.041 1.00 0.00 H new ATOM 0 HB2 SER A 10 23.753 -1.804 15.733 1.00 0.00 H new ATOM 0 HB3 SER A 10 23.467 -1.870 14.005 1.00 0.00 H new ATOM 0 HG SER A 10 21.223 -1.156 14.544 1.00 0.00 H new ATOM 182 N GLY A 14 22.909 1.811 15.945 1.00 0.00 N ATOM 183 CA GLY A 14 23.582 2.624 14.934 1.00 0.00 C ATOM 184 C GLY A 14 23.013 2.342 13.549 1.00 0.00 C ATOM 185 O GLY A 14 22.624 3.274 12.846 1.00 0.00 O ATOM 0 HA2 GLY A 14 23.464 3.681 15.173 1.00 0.00 H new ATOM 0 HA3 GLY A 14 24.651 2.413 14.943 1.00 0.00 H new ATOM 189 N ALA A 15 22.855 1.064 13.186 1.00 0.00 N ATOM 190 CA ALA A 15 22.246 0.675 11.919 1.00 0.00 C ATOM 191 C ALA A 15 20.789 1.116 11.863 1.00 0.00 C ATOM 192 O ALA A 15 20.293 1.401 10.778 1.00 0.00 O ATOM 193 CB ALA A 15 22.359 -0.838 11.695 1.00 0.00 C ATOM 0 H ALA A 15 23.146 0.276 13.764 1.00 0.00 H new ATOM 0 HA ALA A 15 22.789 1.177 11.118 1.00 0.00 H new ATOM 0 HB1 ALA A 15 21.897 -1.100 10.743 1.00 0.00 H new ATOM 0 HB2 ALA A 15 23.410 -1.126 11.680 1.00 0.00 H new ATOM 0 HB3 ALA A 15 21.850 -1.364 12.503 1.00 0.00 H new ATOM 199 N GLU A 16 20.115 1.215 13.012 1.00 0.00 N ATOM 200 CA GLU A 16 18.710 1.611 13.056 1.00 0.00 C ATOM 201 C GLU A 16 18.589 3.085 12.655 1.00 0.00 C ATOM 202 O GLU A 16 17.690 3.459 11.901 1.00 0.00 O ATOM 203 CB GLU A 16 18.086 1.376 14.449 1.00 0.00 C ATOM 204 CG GLU A 16 18.531 0.121 15.220 1.00 0.00 C ATOM 205 CD GLU A 16 18.529 -1.168 14.392 1.00 0.00 C ATOM 206 OE1 GLU A 16 17.459 -1.799 14.232 1.00 0.00 O ATOM 207 OE2 GLU A 16 19.629 -1.563 13.942 1.00 0.00 O ATOM 0 H GLU A 16 20.524 1.025 13.927 1.00 0.00 H new ATOM 0 HA GLU A 16 18.157 0.989 12.352 1.00 0.00 H new ATOM 0 HB2 GLU A 16 18.304 2.247 15.067 1.00 0.00 H new ATOM 0 HB3 GLU A 16 17.003 1.333 14.330 1.00 0.00 H new ATOM 0 HG2 GLU A 16 19.536 0.286 15.609 1.00 0.00 H new ATOM 0 HG3 GLU A 16 17.875 -0.013 16.080 1.00 0.00 H new ATOM 214 N TYR A 17 19.520 3.924 13.123 1.00 0.00 N ATOM 215 CA TYR A 17 19.514 5.352 12.828 1.00 0.00 C ATOM 216 C TYR A 17 20.016 5.610 11.410 1.00 0.00 C ATOM 217 O TYR A 17 19.461 6.463 10.721 1.00 0.00 O ATOM 218 CB TYR A 17 20.355 6.117 13.858 1.00 0.00 C ATOM 219 CG TYR A 17 19.821 6.015 15.277 1.00 0.00 C ATOM 220 CD1 TYR A 17 18.575 6.583 15.603 1.00 0.00 C ATOM 221 CD2 TYR A 17 20.562 5.344 16.267 1.00 0.00 C ATOM 222 CE1 TYR A 17 18.064 6.475 16.909 1.00 0.00 C ATOM 223 CE2 TYR A 17 20.060 5.232 17.576 1.00 0.00 C ATOM 224 CZ TYR A 17 18.806 5.795 17.904 1.00 0.00 C ATOM 225 OH TYR A 17 18.329 5.679 19.176 1.00 0.00 O ATOM 0 H TYR A 17 20.296 3.628 13.716 1.00 0.00 H new ATOM 0 HA TYR A 17 18.488 5.715 12.892 1.00 0.00 H new ATOM 0 HB2 TYR A 17 21.376 5.737 13.835 1.00 0.00 H new ATOM 0 HB3 TYR A 17 20.399 7.167 13.570 1.00 0.00 H new ATOM 0 HD1 TYR A 17 18.008 7.105 14.846 1.00 0.00 H new ATOM 0 HD2 TYR A 17 21.521 4.913 16.021 1.00 0.00 H new ATOM 0 HE1 TYR A 17 17.106 6.911 17.152 1.00 0.00 H new ATOM 0 HE2 TYR A 17 20.633 4.715 18.331 1.00 0.00 H new ATOM 0 HH TYR A 17 18.972 5.180 19.722 1.00 0.00 H new ATOM 235 N VAL A 18 21.013 4.854 10.940 1.00 0.00 N ATOM 236 CA VAL A 18 21.443 4.905 9.546 1.00 0.00 C ATOM 237 C VAL A 18 20.274 4.506 8.635 1.00 0.00 C ATOM 238 O VAL A 18 20.029 5.185 7.638 1.00 0.00 O ATOM 239 CB VAL A 18 22.708 4.052 9.360 1.00 0.00 C ATOM 240 CG1 VAL A 18 23.062 3.769 7.893 1.00 0.00 C ATOM 241 CG2 VAL A 18 23.913 4.738 10.027 1.00 0.00 C ATOM 0 H VAL A 18 21.539 4.195 11.513 1.00 0.00 H new ATOM 0 HA VAL A 18 21.721 5.919 9.259 1.00 0.00 H new ATOM 0 HB VAL A 18 22.484 3.094 9.830 1.00 0.00 H new ATOM 0 HG11 VAL A 18 23.966 3.162 7.847 1.00 0.00 H new ATOM 0 HG12 VAL A 18 22.241 3.233 7.417 1.00 0.00 H new ATOM 0 HG13 VAL A 18 23.231 4.711 7.371 1.00 0.00 H new ATOM 0 HG21 VAL A 18 24.803 4.125 9.889 1.00 0.00 H new ATOM 0 HG22 VAL A 18 24.072 5.716 9.573 1.00 0.00 H new ATOM 0 HG23 VAL A 18 23.718 4.860 11.093 1.00 0.00 H new ATOM 251 N ALA A 19 19.516 3.462 8.988 1.00 0.00 N ATOM 252 CA ALA A 19 18.362 3.039 8.214 1.00 0.00 C ATOM 253 C ALA A 19 17.303 4.142 8.190 1.00 0.00 C ATOM 254 O ALA A 19 16.779 4.451 7.124 1.00 0.00 O ATOM 255 CB ALA A 19 17.783 1.742 8.787 1.00 0.00 C ATOM 0 H ALA A 19 19.691 2.894 9.817 1.00 0.00 H new ATOM 0 HA ALA A 19 18.679 2.848 7.189 1.00 0.00 H new ATOM 0 HB1 ALA A 19 16.919 1.437 8.197 1.00 0.00 H new ATOM 0 HB2 ALA A 19 18.540 0.959 8.752 1.00 0.00 H new ATOM 0 HB3 ALA A 19 17.477 1.905 9.820 1.00 0.00 H new ATOM 261 N GLU A 20 17.005 4.763 9.334 1.00 0.00 N ATOM 262 CA GLU A 20 16.029 5.844 9.415 1.00 0.00 C ATOM 263 C GLU A 20 16.471 7.045 8.566 1.00 0.00 C ATOM 264 O GLU A 20 15.659 7.620 7.841 1.00 0.00 O ATOM 265 CB GLU A 20 15.821 6.223 10.890 1.00 0.00 C ATOM 266 CG GLU A 20 14.711 7.265 11.074 1.00 0.00 C ATOM 267 CD GLU A 20 14.446 7.547 12.563 1.00 0.00 C ATOM 268 OE1 GLU A 20 15.117 8.424 13.152 1.00 0.00 O ATOM 269 OE2 GLU A 20 13.545 6.911 13.157 1.00 0.00 O ATOM 0 H GLU A 20 17.436 4.528 10.228 1.00 0.00 H new ATOM 0 HA GLU A 20 15.075 5.510 9.007 1.00 0.00 H new ATOM 0 HB2 GLU A 20 15.574 5.328 11.461 1.00 0.00 H new ATOM 0 HB3 GLU A 20 16.754 6.614 11.297 1.00 0.00 H new ATOM 0 HG2 GLU A 20 14.992 8.191 10.571 1.00 0.00 H new ATOM 0 HG3 GLU A 20 13.795 6.911 10.601 1.00 0.00 H new ATOM 276 N HIS A 21 17.757 7.402 8.614 1.00 0.00 N ATOM 277 CA HIS A 21 18.322 8.496 7.835 1.00 0.00 C ATOM 278 C HIS A 21 18.175 8.209 6.338 1.00 0.00 C ATOM 279 O HIS A 21 17.647 9.037 5.595 1.00 0.00 O ATOM 280 CB HIS A 21 19.792 8.687 8.241 1.00 0.00 C ATOM 281 CG HIS A 21 20.516 9.772 7.485 1.00 0.00 C ATOM 282 ND1 HIS A 21 21.577 9.599 6.622 1.00 0.00 N ATOM 283 CD2 HIS A 21 20.288 11.119 7.578 1.00 0.00 C ATOM 284 CE1 HIS A 21 21.983 10.813 6.213 1.00 0.00 C ATOM 285 NE2 HIS A 21 21.223 11.776 6.769 1.00 0.00 N ATOM 0 H HIS A 21 18.441 6.930 9.205 1.00 0.00 H new ATOM 0 HA HIS A 21 17.784 9.422 8.038 1.00 0.00 H new ATOM 0 HB2 HIS A 21 19.834 8.914 9.306 1.00 0.00 H new ATOM 0 HB3 HIS A 21 20.321 7.745 8.095 1.00 0.00 H new ATOM 0 HD2 HIS A 21 19.520 11.592 8.172 1.00 0.00 H new ATOM 0 HE1 HIS A 21 22.804 10.991 5.534 1.00 0.00 H new ATOM 0 HE2 HIS A 21 21.311 12.782 6.629 1.00 0.00 H new ATOM 293 N LEU A 22 18.589 7.018 5.894 1.00 0.00 N ATOM 294 CA LEU A 22 18.494 6.604 4.497 1.00 0.00 C ATOM 295 C LEU A 22 17.032 6.557 4.046 1.00 0.00 C ATOM 296 O LEU A 22 16.728 6.981 2.930 1.00 0.00 O ATOM 297 CB LEU A 22 19.157 5.228 4.323 1.00 0.00 C ATOM 298 CG LEU A 22 20.698 5.264 4.368 1.00 0.00 C ATOM 299 CD1 LEU A 22 21.235 3.858 4.633 1.00 0.00 C ATOM 300 CD2 LEU A 22 21.281 5.785 3.046 1.00 0.00 C ATOM 0 H LEU A 22 19.002 6.311 6.502 1.00 0.00 H new ATOM 0 HA LEU A 22 19.014 7.332 3.875 1.00 0.00 H new ATOM 0 HB2 LEU A 22 18.796 4.561 5.106 1.00 0.00 H new ATOM 0 HB3 LEU A 22 18.841 4.802 3.371 1.00 0.00 H new ATOM 0 HG LEU A 22 20.998 5.940 5.169 1.00 0.00 H new ATOM 0 HD11 LEU A 22 22.324 3.884 4.665 1.00 0.00 H new ATOM 0 HD12 LEU A 22 20.853 3.497 5.588 1.00 0.00 H new ATOM 0 HD13 LEU A 22 20.911 3.189 3.836 1.00 0.00 H new ATOM 0 HD21 LEU A 22 22.369 5.799 3.109 1.00 0.00 H new ATOM 0 HD22 LEU A 22 20.973 5.132 2.230 1.00 0.00 H new ATOM 0 HD23 LEU A 22 20.915 6.795 2.860 1.00 0.00 H new ATOM 312 N ALA A 23 16.121 6.082 4.900 1.00 0.00 N ATOM 313 CA ALA A 23 14.698 6.055 4.604 1.00 0.00 C ATOM 314 C ALA A 23 14.161 7.474 4.414 1.00 0.00 C ATOM 315 O ALA A 23 13.394 7.702 3.483 1.00 0.00 O ATOM 316 CB ALA A 23 13.931 5.333 5.717 1.00 0.00 C ATOM 0 H ALA A 23 16.357 5.705 5.818 1.00 0.00 H new ATOM 0 HA ALA A 23 14.551 5.506 3.674 1.00 0.00 H new ATOM 0 HB1 ALA A 23 12.868 5.323 5.478 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.294 4.309 5.803 1.00 0.00 H new ATOM 0 HB3 ALA A 23 14.086 5.853 6.662 1.00 0.00 H new ATOM 322 N GLU A 24 14.572 8.432 5.249 1.00 0.00 N ATOM 323 CA GLU A 24 14.134 9.817 5.131 1.00 0.00 C ATOM 324 C GLU A 24 14.626 10.420 3.809 1.00 0.00 C ATOM 325 O GLU A 24 13.846 11.057 3.098 1.00 0.00 O ATOM 326 CB GLU A 24 14.613 10.617 6.352 1.00 0.00 C ATOM 327 CG GLU A 24 14.065 12.050 6.354 1.00 0.00 C ATOM 328 CD GLU A 24 14.447 12.797 7.644 1.00 0.00 C ATOM 329 OE1 GLU A 24 15.560 13.363 7.722 1.00 0.00 O ATOM 330 OE2 GLU A 24 13.627 12.846 8.589 1.00 0.00 O ATOM 0 H GLU A 24 15.216 8.266 6.022 1.00 0.00 H new ATOM 0 HA GLU A 24 13.045 9.860 5.115 1.00 0.00 H new ATOM 0 HB2 GLU A 24 14.300 10.108 7.264 1.00 0.00 H new ATOM 0 HB3 GLU A 24 15.703 10.646 6.361 1.00 0.00 H new ATOM 0 HG2 GLU A 24 14.453 12.590 5.491 1.00 0.00 H new ATOM 0 HG3 GLU A 24 12.980 12.026 6.254 1.00 0.00 H new ATOM 337 N LYS A 25 15.889 10.174 3.432 1.00 0.00 N ATOM 338 CA LYS A 25 16.422 10.620 2.144 1.00 0.00 C ATOM 339 C LYS A 25 15.586 10.038 0.999 1.00 0.00 C ATOM 340 O LYS A 25 15.220 10.765 0.077 1.00 0.00 O ATOM 341 CB LYS A 25 17.888 10.189 1.983 1.00 0.00 C ATOM 342 CG LYS A 25 18.904 10.766 2.978 1.00 0.00 C ATOM 343 CD LYS A 25 19.337 12.208 2.687 1.00 0.00 C ATOM 344 CE LYS A 25 20.528 12.510 3.605 1.00 0.00 C ATOM 345 NZ LYS A 25 21.128 13.840 3.378 1.00 0.00 N ATOM 0 H LYS A 25 16.561 9.665 4.007 1.00 0.00 H new ATOM 0 HA LYS A 25 16.372 11.708 2.112 1.00 0.00 H new ATOM 0 HB2 LYS A 25 17.929 9.102 2.051 1.00 0.00 H new ATOM 0 HB3 LYS A 25 18.210 10.458 0.977 1.00 0.00 H new ATOM 0 HG2 LYS A 25 18.475 10.725 3.979 1.00 0.00 H new ATOM 0 HG3 LYS A 25 19.789 10.129 2.984 1.00 0.00 H new ATOM 0 HD2 LYS A 25 19.618 12.323 1.640 1.00 0.00 H new ATOM 0 HD3 LYS A 25 18.518 12.902 2.876 1.00 0.00 H new ATOM 0 HE2 LYS A 25 20.203 12.440 4.643 1.00 0.00 H new ATOM 0 HE3 LYS A 25 21.292 11.746 3.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 22.126 13.825 3.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 21.065 14.081 2.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 20.616 14.552 3.937 1.00 0.00 H new ATOM 359 N LEU A 26 15.269 8.739 1.048 1.00 0.00 N ATOM 360 CA LEU A 26 14.445 8.080 0.042 1.00 0.00 C ATOM 361 C LEU A 26 13.036 8.663 -0.014 1.00 0.00 C ATOM 362 O LEU A 26 12.506 8.815 -1.113 1.00 0.00 O ATOM 363 CB LEU A 26 14.373 6.572 0.322 1.00 0.00 C ATOM 364 CG LEU A 26 15.619 5.799 -0.130 1.00 0.00 C ATOM 365 CD1 LEU A 26 15.556 4.348 0.358 1.00 0.00 C ATOM 366 CD2 LEU A 26 15.768 5.808 -1.660 1.00 0.00 C ATOM 0 H LEU A 26 15.581 8.117 1.793 1.00 0.00 H new ATOM 0 HA LEU A 26 14.914 8.252 -0.927 1.00 0.00 H new ATOM 0 HB2 LEU A 26 14.228 6.417 1.391 1.00 0.00 H new ATOM 0 HB3 LEU A 26 13.498 6.160 -0.181 1.00 0.00 H new ATOM 0 HG LEU A 26 16.483 6.299 0.307 1.00 0.00 H new ATOM 0 HD11 LEU A 26 16.447 3.814 0.029 1.00 0.00 H new ATOM 0 HD12 LEU A 26 15.505 4.332 1.447 1.00 0.00 H new ATOM 0 HD13 LEU A 26 14.670 3.864 -0.054 1.00 0.00 H new ATOM 0 HD21 LEU A 26 16.661 5.251 -1.942 1.00 0.00 H new ATOM 0 HD22 LEU A 26 14.892 5.343 -2.114 1.00 0.00 H new ATOM 0 HD23 LEU A 26 15.856 6.836 -2.011 1.00 0.00 H new ATOM 378 N GLU A 27 12.428 9.009 1.123 1.00 0.00 N ATOM 379 CA GLU A 27 11.100 9.614 1.142 1.00 0.00 C ATOM 380 C GLU A 27 11.134 10.991 0.476 1.00 0.00 C ATOM 381 O GLU A 27 10.210 11.324 -0.266 1.00 0.00 O ATOM 382 CB GLU A 27 10.551 9.719 2.573 1.00 0.00 C ATOM 383 CG GLU A 27 10.042 8.370 3.095 1.00 0.00 C ATOM 384 CD GLU A 27 9.422 8.504 4.497 1.00 0.00 C ATOM 385 OE1 GLU A 27 10.162 8.565 5.505 1.00 0.00 O ATOM 386 OE2 GLU A 27 8.175 8.553 4.609 1.00 0.00 O ATOM 0 H GLU A 27 12.840 8.878 2.047 1.00 0.00 H new ATOM 0 HA GLU A 27 10.428 8.967 0.578 1.00 0.00 H new ATOM 0 HB2 GLU A 27 11.333 10.092 3.235 1.00 0.00 H new ATOM 0 HB3 GLU A 27 9.740 10.446 2.597 1.00 0.00 H new ATOM 0 HG2 GLU A 27 9.300 7.969 2.405 1.00 0.00 H new ATOM 0 HG3 GLU A 27 10.866 7.657 3.127 1.00 0.00 H new ATOM 393 N GLU A 28 12.198 11.775 0.683 1.00 0.00 N ATOM 394 CA GLU A 28 12.364 13.059 0.005 1.00 0.00 C ATOM 395 C GLU A 28 12.577 12.855 -1.503 1.00 0.00 C ATOM 396 O GLU A 28 12.055 13.635 -2.304 1.00 0.00 O ATOM 397 CB GLU A 28 13.525 13.863 0.614 1.00 0.00 C ATOM 398 CG GLU A 28 13.195 14.399 2.015 1.00 0.00 C ATOM 399 CD GLU A 28 14.303 15.333 2.534 1.00 0.00 C ATOM 400 OE1 GLU A 28 15.371 14.849 2.973 1.00 0.00 O ATOM 401 OE2 GLU A 28 14.110 16.571 2.519 1.00 0.00 O ATOM 0 H GLU A 28 12.959 11.538 1.319 1.00 0.00 H new ATOM 0 HA GLU A 28 11.448 13.633 0.148 1.00 0.00 H new ATOM 0 HB2 GLU A 28 14.411 13.231 0.669 1.00 0.00 H new ATOM 0 HB3 GLU A 28 13.769 14.698 -0.043 1.00 0.00 H new ATOM 0 HG2 GLU A 28 12.247 14.937 1.987 1.00 0.00 H new ATOM 0 HG3 GLU A 28 13.068 13.565 2.705 1.00 0.00 H new ATOM 408 N ALA A 29 13.297 11.799 -1.901 1.00 0.00 N ATOM 409 CA ALA A 29 13.457 11.424 -3.304 1.00 0.00 C ATOM 410 C ALA A 29 12.138 10.922 -3.918 1.00 0.00 C ATOM 411 O ALA A 29 11.955 11.033 -5.132 1.00 0.00 O ATOM 412 CB ALA A 29 14.567 10.376 -3.439 1.00 0.00 C ATOM 0 H ALA A 29 13.785 11.181 -1.253 1.00 0.00 H new ATOM 0 HA ALA A 29 13.743 12.315 -3.863 1.00 0.00 H new ATOM 0 HB1 ALA A 29 14.682 10.100 -4.487 1.00 0.00 H new ATOM 0 HB2 ALA A 29 15.505 10.789 -3.068 1.00 0.00 H new ATOM 0 HB3 ALA A 29 14.305 9.492 -2.858 1.00 0.00 H new ATOM 418 N GLY A 30 11.216 10.400 -3.100 1.00 0.00 N ATOM 419 CA GLY A 30 9.845 10.065 -3.475 1.00 0.00 C ATOM 420 C GLY A 30 9.509 8.576 -3.343 1.00 0.00 C ATOM 421 O GLY A 30 8.388 8.184 -3.673 1.00 0.00 O ATOM 0 H GLY A 30 11.417 10.193 -2.122 1.00 0.00 H new ATOM 0 HA2 GLY A 30 9.158 10.638 -2.852 1.00 0.00 H new ATOM 0 HA3 GLY A 30 9.675 10.375 -4.506 1.00 0.00 H new ATOM 425 N PHE A 31 10.450 7.735 -2.902 1.00 0.00 N ATOM 426 CA PHE A 31 10.237 6.293 -2.768 1.00 0.00 C ATOM 427 C PHE A 31 9.554 5.989 -1.433 1.00 0.00 C ATOM 428 O PHE A 31 9.786 6.688 -0.442 1.00 0.00 O ATOM 429 CB PHE A 31 11.580 5.554 -2.850 1.00 0.00 C ATOM 430 CG PHE A 31 12.332 5.752 -4.154 1.00 0.00 C ATOM 431 CD1 PHE A 31 12.048 4.940 -5.268 1.00 0.00 C ATOM 432 CD2 PHE A 31 13.327 6.745 -4.254 1.00 0.00 C ATOM 433 CE1 PHE A 31 12.761 5.111 -6.468 1.00 0.00 C ATOM 434 CE2 PHE A 31 14.034 6.922 -5.455 1.00 0.00 C ATOM 435 CZ PHE A 31 13.755 6.102 -6.563 1.00 0.00 C ATOM 0 H PHE A 31 11.384 8.038 -2.627 1.00 0.00 H new ATOM 0 HA PHE A 31 9.596 5.952 -3.581 1.00 0.00 H new ATOM 0 HB2 PHE A 31 12.213 5.886 -2.027 1.00 0.00 H new ATOM 0 HB3 PHE A 31 11.403 4.488 -2.706 1.00 0.00 H new ATOM 0 HD1 PHE A 31 11.280 4.183 -5.201 1.00 0.00 H new ATOM 0 HD2 PHE A 31 13.547 7.373 -3.403 1.00 0.00 H new ATOM 0 HE1 PHE A 31 12.545 4.481 -7.318 1.00 0.00 H new ATOM 0 HE2 PHE A 31 14.792 7.688 -5.527 1.00 0.00 H new ATOM 0 HZ PHE A 31 14.303 6.233 -7.485 1.00 0.00 H new ATOM 445 N THR A 32 8.750 4.927 -1.379 1.00 0.00 N ATOM 446 CA THR A 32 8.168 4.426 -0.141 1.00 0.00 C ATOM 447 C THR A 32 9.140 3.435 0.503 1.00 0.00 C ATOM 448 O THR A 32 9.752 2.598 -0.174 1.00 0.00 O ATOM 449 CB THR A 32 6.802 3.786 -0.438 1.00 0.00 C ATOM 450 OG1 THR A 32 6.851 3.019 -1.628 1.00 0.00 O ATOM 451 CG2 THR A 32 5.720 4.857 -0.608 1.00 0.00 C ATOM 0 H THR A 32 8.484 4.388 -2.203 1.00 0.00 H new ATOM 0 HA THR A 32 8.002 5.241 0.563 1.00 0.00 H new ATOM 0 HB THR A 32 6.560 3.144 0.409 1.00 0.00 H new ATOM 0 HG1 THR A 32 5.972 2.620 -1.796 1.00 0.00 H new ATOM 0 HG21 THR A 32 4.764 4.378 -0.817 1.00 0.00 H new ATOM 0 HG22 THR A 32 5.640 5.442 0.308 1.00 0.00 H new ATOM 0 HG23 THR A 32 5.985 5.514 -1.436 1.00 0.00 H new ATOM 459 N THR A 33 9.259 3.491 1.824 1.00 0.00 N ATOM 460 CA THR A 33 10.277 2.785 2.586 1.00 0.00 C ATOM 461 C THR A 33 9.662 2.210 3.866 1.00 0.00 C ATOM 462 O THR A 33 8.559 2.589 4.274 1.00 0.00 O ATOM 463 CB THR A 33 11.406 3.778 2.928 1.00 0.00 C ATOM 464 OG1 THR A 33 10.867 5.002 3.399 1.00 0.00 O ATOM 465 CG2 THR A 33 12.272 4.083 1.712 1.00 0.00 C ATOM 0 H THR A 33 8.632 4.044 2.409 1.00 0.00 H new ATOM 0 HA THR A 33 10.682 1.959 2.002 1.00 0.00 H new ATOM 0 HB THR A 33 12.016 3.308 3.699 1.00 0.00 H new ATOM 0 HG1 THR A 33 11.597 5.620 3.613 1.00 0.00 H new ATOM 0 HG21 THR A 33 13.057 4.786 1.991 1.00 0.00 H new ATOM 0 HG22 THR A 33 12.724 3.161 1.347 1.00 0.00 H new ATOM 0 HG23 THR A 33 11.655 4.521 0.927 1.00 0.00 H new ATOM 473 N GLU A 34 10.388 1.304 4.515 1.00 0.00 N ATOM 474 CA GLU A 34 10.108 0.784 5.849 1.00 0.00 C ATOM 475 C GLU A 34 11.471 0.335 6.382 1.00 0.00 C ATOM 476 O GLU A 34 12.357 0.061 5.577 1.00 0.00 O ATOM 477 CB GLU A 34 9.081 -0.361 5.749 1.00 0.00 C ATOM 478 CG GLU A 34 8.842 -1.103 7.073 1.00 0.00 C ATOM 479 CD GLU A 34 7.577 -1.979 7.013 1.00 0.00 C ATOM 480 OE1 GLU A 34 7.563 -3.002 6.293 1.00 0.00 O ATOM 481 OE2 GLU A 34 6.582 -1.656 7.703 1.00 0.00 O ATOM 0 H GLU A 34 11.227 0.893 4.105 1.00 0.00 H new ATOM 0 HA GLU A 34 9.662 1.513 6.526 1.00 0.00 H new ATOM 0 HB2 GLU A 34 8.133 0.045 5.395 1.00 0.00 H new ATOM 0 HB3 GLU A 34 9.421 -1.076 5.000 1.00 0.00 H new ATOM 0 HG2 GLU A 34 9.706 -1.727 7.302 1.00 0.00 H new ATOM 0 HG3 GLU A 34 8.746 -0.380 7.883 1.00 0.00 H new ATOM 488 N THR A 35 11.674 0.274 7.694 1.00 0.00 N ATOM 489 CA THR A 35 12.970 0.033 8.309 1.00 0.00 C ATOM 490 C THR A 35 12.805 -1.152 9.261 1.00 0.00 C ATOM 491 O THR A 35 12.482 -0.982 10.439 1.00 0.00 O ATOM 492 CB THR A 35 13.441 1.335 8.986 1.00 0.00 C ATOM 493 OG1 THR A 35 12.386 1.999 9.668 1.00 0.00 O ATOM 494 CG2 THR A 35 14.000 2.325 7.958 1.00 0.00 C ATOM 0 H THR A 35 10.923 0.394 8.373 1.00 0.00 H new ATOM 0 HA THR A 35 13.748 -0.231 7.592 1.00 0.00 H new ATOM 0 HB THR A 35 14.211 1.033 9.696 1.00 0.00 H new ATOM 0 HG1 THR A 35 12.729 2.818 10.083 1.00 0.00 H new ATOM 0 HG21 THR A 35 14.324 3.233 8.466 1.00 0.00 H new ATOM 0 HG22 THR A 35 14.849 1.875 7.443 1.00 0.00 H new ATOM 0 HG23 THR A 35 13.225 2.572 7.232 1.00 0.00 H new ATOM 502 N LEU A 36 12.907 -2.366 8.713 1.00 0.00 N ATOM 503 CA LEU A 36 12.651 -3.593 9.456 1.00 0.00 C ATOM 504 C LEU A 36 13.747 -3.763 10.500 1.00 0.00 C ATOM 505 O LEU A 36 14.923 -3.858 10.156 1.00 0.00 O ATOM 506 CB LEU A 36 12.606 -4.812 8.521 1.00 0.00 C ATOM 507 CG LEU A 36 11.396 -4.842 7.574 1.00 0.00 C ATOM 508 CD1 LEU A 36 11.547 -6.015 6.596 1.00 0.00 C ATOM 509 CD2 LEU A 36 10.065 -4.983 8.325 1.00 0.00 C ATOM 0 H LEU A 36 13.170 -2.521 7.740 1.00 0.00 H new ATOM 0 HA LEU A 36 11.678 -3.523 9.942 1.00 0.00 H new ATOM 0 HB2 LEU A 36 13.519 -4.831 7.925 1.00 0.00 H new ATOM 0 HB3 LEU A 36 12.601 -5.719 9.126 1.00 0.00 H new ATOM 0 HG LEU A 36 11.375 -3.891 7.042 1.00 0.00 H new ATOM 0 HD11 LEU A 36 10.690 -6.040 5.922 1.00 0.00 H new ATOM 0 HD12 LEU A 36 12.461 -5.890 6.016 1.00 0.00 H new ATOM 0 HD13 LEU A 36 11.597 -6.950 7.154 1.00 0.00 H new ATOM 0 HD21 LEU A 36 9.243 -4.999 7.609 1.00 0.00 H new ATOM 0 HD22 LEU A 36 10.066 -5.911 8.897 1.00 0.00 H new ATOM 0 HD23 LEU A 36 9.939 -4.139 9.003 1.00 0.00 H new ATOM 521 N HIS A 37 13.352 -3.805 11.770 1.00 0.00 N ATOM 522 CA HIS A 37 14.249 -3.993 12.899 1.00 0.00 C ATOM 523 C HIS A 37 14.663 -5.470 12.950 1.00 0.00 C ATOM 524 O HIS A 37 13.955 -6.288 13.543 1.00 0.00 O ATOM 525 CB HIS A 37 13.533 -3.516 14.174 1.00 0.00 C ATOM 526 CG HIS A 37 14.336 -3.643 15.446 1.00 0.00 C ATOM 527 ND1 HIS A 37 15.520 -3.006 15.743 1.00 0.00 N ATOM 528 CD2 HIS A 37 13.982 -4.364 16.557 1.00 0.00 C ATOM 529 CE1 HIS A 37 15.872 -3.340 16.995 1.00 0.00 C ATOM 530 NE2 HIS A 37 14.961 -4.166 17.541 1.00 0.00 N ATOM 0 H HIS A 37 12.375 -3.707 12.045 1.00 0.00 H new ATOM 0 HA HIS A 37 15.162 -3.405 12.803 1.00 0.00 H new ATOM 0 HB2 HIS A 37 13.251 -2.471 14.044 1.00 0.00 H new ATOM 0 HB3 HIS A 37 12.610 -4.084 14.287 1.00 0.00 H new ATOM 0 HD1 HIS A 37 16.040 -2.388 15.120 1.00 0.00 H new ATOM 0 HD2 HIS A 37 13.100 -4.979 16.657 1.00 0.00 H new ATOM 0 HE1 HIS A 37 16.764 -2.993 17.495 1.00 0.00 H new ATOM 538 N GLY A 38 15.788 -5.810 12.308 1.00 0.00 N ATOM 539 CA GLY A 38 16.386 -7.141 12.331 1.00 0.00 C ATOM 540 C GLY A 38 15.397 -8.277 11.999 1.00 0.00 C ATOM 541 O GLY A 38 15.128 -9.118 12.861 1.00 0.00 O ATOM 0 H GLY A 38 16.318 -5.145 11.744 1.00 0.00 H new ATOM 0 HA2 GLY A 38 17.210 -7.170 11.618 1.00 0.00 H new ATOM 0 HA3 GLY A 38 16.812 -7.320 13.318 1.00 0.00 H new ATOM 545 N PRO A 39 14.805 -8.297 10.788 1.00 0.00 N ATOM 546 CA PRO A 39 13.869 -9.331 10.354 1.00 0.00 C ATOM 547 C PRO A 39 14.566 -10.685 10.150 1.00 0.00 C ATOM 548 O PRO A 39 15.790 -10.807 10.245 1.00 0.00 O ATOM 549 CB PRO A 39 13.282 -8.800 9.038 1.00 0.00 C ATOM 550 CG PRO A 39 14.450 -8.014 8.450 1.00 0.00 C ATOM 551 CD PRO A 39 15.083 -7.386 9.694 1.00 0.00 C ATOM 0 HA PRO A 39 13.099 -9.517 11.103 1.00 0.00 H new ATOM 0 HB2 PRO A 39 12.964 -9.609 8.380 1.00 0.00 H new ATOM 0 HB3 PRO A 39 12.411 -8.167 9.208 1.00 0.00 H new ATOM 0 HG2 PRO A 39 15.150 -8.661 7.921 1.00 0.00 H new ATOM 0 HG3 PRO A 39 14.115 -7.259 7.739 1.00 0.00 H new ATOM 0 HD2 PRO A 39 16.157 -7.253 9.560 1.00 0.00 H new ATOM 0 HD3 PRO A 39 14.662 -6.400 9.891 1.00 0.00 H new ATOM 559 N LEU A 40 13.767 -11.698 9.803 1.00 0.00 N ATOM 560 CA LEU A 40 14.229 -13.009 9.355 1.00 0.00 C ATOM 561 C LEU A 40 13.965 -13.114 7.856 1.00 0.00 C ATOM 562 O LEU A 40 13.039 -12.484 7.344 1.00 0.00 O ATOM 563 CB LEU A 40 13.460 -14.119 10.096 1.00 0.00 C ATOM 564 CG LEU A 40 13.907 -14.320 11.555 1.00 0.00 C ATOM 565 CD1 LEU A 40 12.838 -15.101 12.328 1.00 0.00 C ATOM 566 CD2 LEU A 40 15.231 -15.089 11.629 1.00 0.00 C ATOM 0 H LEU A 40 12.750 -11.623 9.828 1.00 0.00 H new ATOM 0 HA LEU A 40 15.292 -13.125 9.564 1.00 0.00 H new ATOM 0 HB2 LEU A 40 12.396 -13.882 10.082 1.00 0.00 H new ATOM 0 HB3 LEU A 40 13.585 -15.057 9.555 1.00 0.00 H new ATOM 0 HG LEU A 40 14.046 -13.334 11.998 1.00 0.00 H new ATOM 0 HD11 LEU A 40 13.163 -15.239 13.359 1.00 0.00 H new ATOM 0 HD12 LEU A 40 11.900 -14.546 12.314 1.00 0.00 H new ATOM 0 HD13 LEU A 40 12.690 -16.075 11.861 1.00 0.00 H new ATOM 0 HD21 LEU A 40 15.521 -15.215 12.672 1.00 0.00 H new ATOM 0 HD22 LEU A 40 15.110 -16.068 11.165 1.00 0.00 H new ATOM 0 HD23 LEU A 40 16.006 -14.531 11.102 1.00 0.00 H new ATOM 578 N LEU A 41 14.743 -13.944 7.156 1.00 0.00 N ATOM 579 CA LEU A 41 14.649 -14.124 5.711 1.00 0.00 C ATOM 580 C LEU A 41 13.241 -14.542 5.288 1.00 0.00 C ATOM 581 O LEU A 41 12.731 -14.052 4.284 1.00 0.00 O ATOM 582 CB LEU A 41 15.713 -15.162 5.320 1.00 0.00 C ATOM 583 CG LEU A 41 15.932 -15.438 3.825 1.00 0.00 C ATOM 584 CD1 LEU A 41 14.927 -16.409 3.196 1.00 0.00 C ATOM 585 CD2 LEU A 41 16.051 -14.164 2.981 1.00 0.00 C ATOM 0 H LEU A 41 15.467 -14.518 7.588 1.00 0.00 H new ATOM 0 HA LEU A 41 14.836 -13.186 5.189 1.00 0.00 H new ATOM 0 HB2 LEU A 41 16.665 -14.841 5.744 1.00 0.00 H new ATOM 0 HB3 LEU A 41 15.452 -16.105 5.800 1.00 0.00 H new ATOM 0 HG LEU A 41 16.898 -15.943 3.809 1.00 0.00 H new ATOM 0 HD11 LEU A 41 15.161 -16.542 2.140 1.00 0.00 H new ATOM 0 HD12 LEU A 41 14.984 -17.372 3.704 1.00 0.00 H new ATOM 0 HD13 LEU A 41 13.919 -16.005 3.296 1.00 0.00 H new ATOM 0 HD21 LEU A 41 16.204 -14.433 1.936 1.00 0.00 H new ATOM 0 HD22 LEU A 41 15.136 -13.579 3.075 1.00 0.00 H new ATOM 0 HD23 LEU A 41 16.897 -13.573 3.332 1.00 0.00 H new ATOM 597 N GLU A 42 12.593 -15.403 6.079 1.00 0.00 N ATOM 598 CA GLU A 42 11.262 -15.930 5.781 1.00 0.00 C ATOM 599 C GLU A 42 10.177 -14.840 5.740 1.00 0.00 C ATOM 600 O GLU A 42 9.104 -15.071 5.182 1.00 0.00 O ATOM 601 CB GLU A 42 10.902 -17.045 6.780 1.00 0.00 C ATOM 602 CG GLU A 42 10.786 -16.568 8.238 1.00 0.00 C ATOM 603 CD GLU A 42 10.392 -17.723 9.176 1.00 0.00 C ATOM 604 OE1 GLU A 42 11.288 -18.420 9.706 1.00 0.00 O ATOM 605 OE2 GLU A 42 9.180 -17.938 9.407 1.00 0.00 O ATOM 0 H GLU A 42 12.984 -15.756 6.953 1.00 0.00 H new ATOM 0 HA GLU A 42 11.297 -16.350 4.776 1.00 0.00 H new ATOM 0 HB2 GLU A 42 9.956 -17.495 6.480 1.00 0.00 H new ATOM 0 HB3 GLU A 42 11.659 -17.827 6.724 1.00 0.00 H new ATOM 0 HG2 GLU A 42 11.737 -16.143 8.560 1.00 0.00 H new ATOM 0 HG3 GLU A 42 10.043 -15.773 8.305 1.00 0.00 H new ATOM 612 N ASP A 43 10.434 -13.657 6.315 1.00 0.00 N ATOM 613 CA ASP A 43 9.492 -12.538 6.285 1.00 0.00 C ATOM 614 C ASP A 43 9.459 -11.855 4.910 1.00 0.00 C ATOM 615 O ASP A 43 8.495 -11.157 4.590 1.00 0.00 O ATOM 616 CB ASP A 43 9.863 -11.511 7.362 1.00 0.00 C ATOM 617 CG ASP A 43 8.806 -10.400 7.470 1.00 0.00 C ATOM 618 OD1 ASP A 43 7.661 -10.689 7.891 1.00 0.00 O ATOM 619 OD2 ASP A 43 9.124 -9.224 7.187 1.00 0.00 O ATOM 0 H ASP A 43 11.301 -13.453 6.813 1.00 0.00 H new ATOM 0 HA ASP A 43 8.498 -12.940 6.484 1.00 0.00 H new ATOM 0 HB2 ASP A 43 9.965 -12.012 8.324 1.00 0.00 H new ATOM 0 HB3 ASP A 43 10.832 -11.071 7.128 1.00 0.00 H new ATOM 624 N LEU A 44 10.495 -12.051 4.086 1.00 0.00 N ATOM 625 CA LEU A 44 10.668 -11.357 2.813 1.00 0.00 C ATOM 626 C LEU A 44 10.225 -12.252 1.648 1.00 0.00 C ATOM 627 O LEU A 44 10.485 -13.460 1.682 1.00 0.00 O ATOM 628 CB LEU A 44 12.151 -11.015 2.584 1.00 0.00 C ATOM 629 CG LEU A 44 12.817 -10.133 3.652 1.00 0.00 C ATOM 630 CD1 LEU A 44 14.296 -9.979 3.290 1.00 0.00 C ATOM 631 CD2 LEU A 44 12.166 -8.749 3.767 1.00 0.00 C ATOM 0 H LEU A 44 11.247 -12.708 4.292 1.00 0.00 H new ATOM 0 HA LEU A 44 10.065 -10.450 2.852 1.00 0.00 H new ATOM 0 HB2 LEU A 44 12.711 -11.948 2.512 1.00 0.00 H new ATOM 0 HB3 LEU A 44 12.242 -10.514 1.620 1.00 0.00 H new ATOM 0 HG LEU A 44 12.694 -10.618 4.620 1.00 0.00 H new ATOM 0 HD11 LEU A 44 14.790 -9.356 4.035 1.00 0.00 H new ATOM 0 HD12 LEU A 44 14.769 -10.961 3.267 1.00 0.00 H new ATOM 0 HD13 LEU A 44 14.384 -9.511 2.310 1.00 0.00 H new ATOM 0 HD21 LEU A 44 12.677 -8.169 4.536 1.00 0.00 H new ATOM 0 HD22 LEU A 44 12.242 -8.230 2.811 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.116 -8.862 4.036 1.00 0.00 H new ATOM 643 N PRO A 45 9.602 -11.691 0.597 1.00 0.00 N ATOM 644 CA PRO A 45 9.358 -12.416 -0.643 1.00 0.00 C ATOM 645 C PRO A 45 10.685 -12.575 -1.408 1.00 0.00 C ATOM 646 O PRO A 45 11.657 -11.851 -1.169 1.00 0.00 O ATOM 647 CB PRO A 45 8.337 -11.569 -1.410 1.00 0.00 C ATOM 648 CG PRO A 45 8.656 -10.149 -0.952 1.00 0.00 C ATOM 649 CD PRO A 45 9.108 -10.326 0.497 1.00 0.00 C ATOM 0 HA PRO A 45 8.972 -13.423 -0.487 1.00 0.00 H new ATOM 0 HB2 PRO A 45 8.449 -11.680 -2.488 1.00 0.00 H new ATOM 0 HB3 PRO A 45 7.313 -11.852 -1.165 1.00 0.00 H new ATOM 0 HG2 PRO A 45 9.438 -9.698 -1.563 1.00 0.00 H new ATOM 0 HG3 PRO A 45 7.783 -9.500 -1.022 1.00 0.00 H new ATOM 0 HD2 PRO A 45 9.888 -9.609 0.753 1.00 0.00 H new ATOM 0 HD3 PRO A 45 8.281 -10.158 1.187 1.00 0.00 H new ATOM 657 N ALA A 46 10.718 -13.495 -2.375 1.00 0.00 N ATOM 658 CA ALA A 46 11.909 -13.835 -3.157 1.00 0.00 C ATOM 659 C ALA A 46 12.113 -12.873 -4.339 1.00 0.00 C ATOM 660 O ALA A 46 12.687 -13.248 -5.363 1.00 0.00 O ATOM 661 CB ALA A 46 11.803 -15.293 -3.620 1.00 0.00 C ATOM 0 H ALA A 46 9.897 -14.038 -2.642 1.00 0.00 H new ATOM 0 HA ALA A 46 12.791 -13.726 -2.526 1.00 0.00 H new ATOM 0 HB1 ALA A 46 12.686 -15.555 -4.203 1.00 0.00 H new ATOM 0 HB2 ALA A 46 11.736 -15.947 -2.751 1.00 0.00 H new ATOM 0 HB3 ALA A 46 10.912 -15.415 -4.236 1.00 0.00 H new ATOM 667 N SER A 47 11.607 -11.644 -4.247 1.00 0.00 N ATOM 668 CA SER A 47 11.759 -10.596 -5.251 1.00 0.00 C ATOM 669 C SER A 47 11.591 -9.246 -4.551 1.00 0.00 C ATOM 670 O SER A 47 10.754 -9.133 -3.655 1.00 0.00 O ATOM 671 CB SER A 47 10.693 -10.753 -6.348 1.00 0.00 C ATOM 672 OG SER A 47 10.713 -12.050 -6.921 1.00 0.00 O ATOM 0 H SER A 47 11.060 -11.341 -3.441 1.00 0.00 H new ATOM 0 HA SER A 47 12.741 -10.663 -5.719 1.00 0.00 H new ATOM 0 HB2 SER A 47 9.707 -10.557 -5.927 1.00 0.00 H new ATOM 0 HB3 SER A 47 10.861 -10.009 -7.127 1.00 0.00 H new ATOM 0 HG SER A 47 10.021 -12.113 -7.612 1.00 0.00 H new ATOM 678 N GLY A 48 12.365 -8.232 -4.942 1.00 0.00 N ATOM 679 CA GLY A 48 12.279 -6.891 -4.370 1.00 0.00 C ATOM 680 C GLY A 48 13.625 -6.180 -4.420 1.00 0.00 C ATOM 681 O GLY A 48 14.597 -6.727 -4.949 1.00 0.00 O ATOM 0 H GLY A 48 13.074 -8.321 -5.670 1.00 0.00 H new ATOM 0 HA2 GLY A 48 11.537 -6.308 -4.915 1.00 0.00 H new ATOM 0 HA3 GLY A 48 11.938 -6.955 -3.337 1.00 0.00 H new ATOM 685 N ILE A 49 13.689 -4.974 -3.853 1.00 0.00 N ATOM 686 CA ILE A 49 14.898 -4.167 -3.768 1.00 0.00 C ATOM 687 C ILE A 49 15.023 -3.762 -2.302 1.00 0.00 C ATOM 688 O ILE A 49 14.309 -2.876 -1.827 1.00 0.00 O ATOM 689 CB ILE A 49 14.892 -2.946 -4.723 1.00 0.00 C ATOM 690 CG1 ILE A 49 14.518 -3.274 -6.188 1.00 0.00 C ATOM 691 CG2 ILE A 49 16.298 -2.318 -4.708 1.00 0.00 C ATOM 692 CD1 ILE A 49 13.011 -3.174 -6.464 1.00 0.00 C ATOM 0 H ILE A 49 12.877 -4.524 -3.430 1.00 0.00 H new ATOM 0 HA ILE A 49 15.764 -4.741 -4.097 1.00 0.00 H new ATOM 0 HB ILE A 49 14.120 -2.269 -4.356 1.00 0.00 H new ATOM 0 HG12 ILE A 49 15.049 -2.593 -6.853 1.00 0.00 H new ATOM 0 HG13 ILE A 49 14.858 -4.282 -6.426 1.00 0.00 H new ATOM 0 HG21 ILE A 49 16.318 -1.455 -5.374 1.00 0.00 H new ATOM 0 HG22 ILE A 49 16.544 -2.000 -3.695 1.00 0.00 H new ATOM 0 HG23 ILE A 49 17.029 -3.053 -5.045 1.00 0.00 H new ATOM 0 HD11 ILE A 49 12.816 -3.416 -7.509 1.00 0.00 H new ATOM 0 HD12 ILE A 49 12.476 -3.875 -5.823 1.00 0.00 H new ATOM 0 HD13 ILE A 49 12.670 -2.160 -6.256 1.00 0.00 H new ATOM 704 N TRP A 50 15.894 -4.453 -1.575 1.00 0.00 N ATOM 705 CA TRP A 50 16.115 -4.249 -0.151 1.00 0.00 C ATOM 706 C TRP A 50 17.417 -3.465 0.044 1.00 0.00 C ATOM 707 O TRP A 50 18.164 -3.239 -0.910 1.00 0.00 O ATOM 708 CB TRP A 50 16.097 -5.615 0.561 1.00 0.00 C ATOM 709 CG TRP A 50 14.959 -6.543 0.199 1.00 0.00 C ATOM 710 CD1 TRP A 50 15.068 -7.882 0.031 1.00 0.00 C ATOM 711 CD2 TRP A 50 13.552 -6.236 -0.081 1.00 0.00 C ATOM 712 NE1 TRP A 50 13.852 -8.419 -0.349 1.00 0.00 N ATOM 713 CE2 TRP A 50 12.883 -7.448 -0.429 1.00 0.00 C ATOM 714 CE3 TRP A 50 12.766 -5.063 -0.098 1.00 0.00 C ATOM 715 CZ2 TRP A 50 11.526 -7.490 -0.770 1.00 0.00 C ATOM 716 CZ3 TRP A 50 11.403 -5.089 -0.456 1.00 0.00 C ATOM 717 CH2 TRP A 50 10.779 -6.302 -0.787 1.00 0.00 C ATOM 0 H TRP A 50 16.480 -5.188 -1.971 1.00 0.00 H new ATOM 0 HA TRP A 50 15.321 -3.653 0.299 1.00 0.00 H new ATOM 0 HB2 TRP A 50 17.036 -6.125 0.347 1.00 0.00 H new ATOM 0 HB3 TRP A 50 16.067 -5.440 1.636 1.00 0.00 H new ATOM 0 HD1 TRP A 50 15.976 -8.450 0.174 1.00 0.00 H new ATOM 0 HE1 TRP A 50 13.695 -9.408 -0.545 1.00 0.00 H new ATOM 0 HE3 TRP A 50 13.221 -4.121 0.170 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 11.057 -8.431 -1.018 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 10.835 -4.170 -0.476 1.00 0.00 H new ATOM 0 HH2 TRP A 50 9.732 -6.321 -1.053 1.00 0.00 H new ATOM 728 N LEU A 51 17.715 -3.031 1.268 1.00 0.00 N ATOM 729 CA LEU A 51 18.960 -2.342 1.589 1.00 0.00 C ATOM 730 C LEU A 51 19.262 -2.743 3.019 1.00 0.00 C ATOM 731 O LEU A 51 18.439 -2.497 3.897 1.00 0.00 O ATOM 732 CB LEU A 51 18.775 -0.826 1.389 1.00 0.00 C ATOM 733 CG LEU A 51 19.924 0.066 1.902 1.00 0.00 C ATOM 734 CD1 LEU A 51 21.275 -0.314 1.289 1.00 0.00 C ATOM 735 CD2 LEU A 51 19.630 1.528 1.545 1.00 0.00 C ATOM 0 H LEU A 51 17.094 -3.149 2.069 1.00 0.00 H new ATOM 0 HA LEU A 51 19.799 -2.610 0.946 1.00 0.00 H new ATOM 0 HB2 LEU A 51 18.639 -0.633 0.325 1.00 0.00 H new ATOM 0 HB3 LEU A 51 17.855 -0.523 1.888 1.00 0.00 H new ATOM 0 HG LEU A 51 19.985 -0.076 2.981 1.00 0.00 H new ATOM 0 HD11 LEU A 51 22.051 0.343 1.682 1.00 0.00 H new ATOM 0 HD12 LEU A 51 21.512 -1.347 1.543 1.00 0.00 H new ATOM 0 HD13 LEU A 51 21.225 -0.209 0.205 1.00 0.00 H new ATOM 0 HD21 LEU A 51 20.441 2.161 1.906 1.00 0.00 H new ATOM 0 HD22 LEU A 51 19.546 1.628 0.463 1.00 0.00 H new ATOM 0 HD23 LEU A 51 18.694 1.835 2.012 1.00 0.00 H new ATOM 747 N VAL A 52 20.379 -3.430 3.235 1.00 0.00 N ATOM 748 CA VAL A 52 20.705 -4.073 4.501 1.00 0.00 C ATOM 749 C VAL A 52 21.762 -3.233 5.209 1.00 0.00 C ATOM 750 O VAL A 52 22.739 -2.808 4.586 1.00 0.00 O ATOM 751 CB VAL A 52 21.164 -5.521 4.250 1.00 0.00 C ATOM 752 CG1 VAL A 52 21.329 -6.296 5.564 1.00 0.00 C ATOM 753 CG2 VAL A 52 20.194 -6.309 3.350 1.00 0.00 C ATOM 0 H VAL A 52 21.096 -3.557 2.521 1.00 0.00 H new ATOM 0 HA VAL A 52 19.830 -4.132 5.148 1.00 0.00 H new ATOM 0 HB VAL A 52 22.124 -5.432 3.741 1.00 0.00 H new ATOM 0 HG11 VAL A 52 21.654 -7.314 5.348 1.00 0.00 H new ATOM 0 HG12 VAL A 52 22.075 -5.802 6.187 1.00 0.00 H new ATOM 0 HG13 VAL A 52 20.376 -6.324 6.092 1.00 0.00 H new ATOM 0 HG21 VAL A 52 20.570 -7.322 3.209 1.00 0.00 H new ATOM 0 HG22 VAL A 52 19.212 -6.349 3.821 1.00 0.00 H new ATOM 0 HG23 VAL A 52 20.112 -5.814 2.382 1.00 0.00 H new ATOM 763 N ILE A 53 21.578 -3.014 6.511 1.00 0.00 N ATOM 764 CA ILE A 53 22.467 -2.241 7.347 1.00 0.00 C ATOM 765 C ILE A 53 22.735 -3.134 8.557 1.00 0.00 C ATOM 766 O ILE A 53 21.807 -3.533 9.262 1.00 0.00 O ATOM 767 CB ILE A 53 21.851 -0.869 7.729 1.00 0.00 C ATOM 768 CG1 ILE A 53 21.206 -0.073 6.564 1.00 0.00 C ATOM 769 CG2 ILE A 53 22.957 0.017 8.331 1.00 0.00 C ATOM 770 CD1 ILE A 53 19.741 -0.425 6.274 1.00 0.00 C ATOM 0 H ILE A 53 20.776 -3.387 7.020 1.00 0.00 H new ATOM 0 HA ILE A 53 23.395 -1.980 6.838 1.00 0.00 H new ATOM 0 HB ILE A 53 21.047 -1.104 8.426 1.00 0.00 H new ATOM 0 HG12 ILE A 53 21.271 0.991 6.791 1.00 0.00 H new ATOM 0 HG13 ILE A 53 21.791 -0.242 5.660 1.00 0.00 H new ATOM 0 HG21 ILE A 53 22.539 0.986 8.605 1.00 0.00 H new ATOM 0 HG22 ILE A 53 23.367 -0.465 9.219 1.00 0.00 H new ATOM 0 HG23 ILE A 53 23.750 0.159 7.597 1.00 0.00 H new ATOM 0 HD11 ILE A 53 19.378 0.182 5.445 1.00 0.00 H new ATOM 0 HD12 ILE A 53 19.665 -1.480 6.011 1.00 0.00 H new ATOM 0 HD13 ILE A 53 19.137 -0.227 7.160 1.00 0.00 H new ATOM 782 N SER A 54 24.003 -3.467 8.766 1.00 0.00 N ATOM 783 CA SER A 54 24.484 -4.401 9.777 1.00 0.00 C ATOM 784 C SER A 54 25.495 -3.660 10.655 1.00 0.00 C ATOM 785 O SER A 54 25.722 -2.456 10.497 1.00 0.00 O ATOM 786 CB SER A 54 25.145 -5.595 9.072 1.00 0.00 C ATOM 787 OG SER A 54 24.353 -6.057 7.994 1.00 0.00 O ATOM 0 H SER A 54 24.761 -3.074 8.208 1.00 0.00 H new ATOM 0 HA SER A 54 23.669 -4.773 10.397 1.00 0.00 H new ATOM 0 HB2 SER A 54 26.129 -5.304 8.705 1.00 0.00 H new ATOM 0 HB3 SER A 54 25.298 -6.404 9.787 1.00 0.00 H new ATOM 0 HG SER A 54 23.407 -5.889 8.188 1.00 0.00 H new ATOM 793 N SER A 55 26.144 -4.362 11.575 1.00 0.00 N ATOM 794 CA SER A 55 27.288 -3.852 12.314 1.00 0.00 C ATOM 795 C SER A 55 28.246 -5.024 12.536 1.00 0.00 C ATOM 796 O SER A 55 27.879 -6.172 12.273 1.00 0.00 O ATOM 797 CB SER A 55 26.856 -3.176 13.624 1.00 0.00 C ATOM 798 OG SER A 55 25.839 -2.221 13.382 1.00 0.00 O ATOM 0 H SER A 55 25.886 -5.315 11.831 1.00 0.00 H new ATOM 0 HA SER A 55 27.798 -3.071 11.749 1.00 0.00 H new ATOM 0 HB2 SER A 55 26.496 -3.928 14.326 1.00 0.00 H new ATOM 0 HB3 SER A 55 27.714 -2.691 14.089 1.00 0.00 H new ATOM 0 HG SER A 55 25.688 -1.692 14.193 1.00 0.00 H new ATOM 804 N THR A 56 29.454 -4.753 13.019 1.00 0.00 N ATOM 805 CA THR A 56 30.432 -5.775 13.364 1.00 0.00 C ATOM 806 C THR A 56 30.860 -5.515 14.807 1.00 0.00 C ATOM 807 O THR A 56 31.209 -4.383 15.145 1.00 0.00 O ATOM 808 CB THR A 56 31.617 -5.706 12.382 1.00 0.00 C ATOM 809 OG1 THR A 56 31.167 -5.711 11.036 1.00 0.00 O ATOM 810 CG2 THR A 56 32.576 -6.883 12.592 1.00 0.00 C ATOM 0 H THR A 56 29.785 -3.802 13.184 1.00 0.00 H new ATOM 0 HA THR A 56 30.018 -6.780 13.287 1.00 0.00 H new ATOM 0 HB THR A 56 32.144 -4.773 12.581 1.00 0.00 H new ATOM 0 HG1 THR A 56 31.501 -6.513 10.582 1.00 0.00 H new ATOM 0 HG21 THR A 56 33.403 -6.809 11.886 1.00 0.00 H new ATOM 0 HG22 THR A 56 32.965 -6.858 13.610 1.00 0.00 H new ATOM 0 HG23 THR A 56 32.043 -7.820 12.430 1.00 0.00 H new ATOM 818 N HIS A 57 30.824 -6.541 15.666 1.00 0.00 N ATOM 819 CA HIS A 57 31.219 -6.399 17.068 1.00 0.00 C ATOM 820 C HIS A 57 32.728 -6.117 17.201 1.00 0.00 C ATOM 821 O HIS A 57 33.149 -5.455 18.152 1.00 0.00 O ATOM 822 CB HIS A 57 30.815 -7.664 17.845 1.00 0.00 C ATOM 823 CG HIS A 57 30.745 -7.500 19.348 1.00 0.00 C ATOM 824 ND1 HIS A 57 31.543 -6.699 20.136 1.00 0.00 N ATOM 825 CD2 HIS A 57 29.876 -8.144 20.189 1.00 0.00 C ATOM 826 CE1 HIS A 57 31.162 -6.851 21.415 1.00 0.00 C ATOM 827 NE2 HIS A 57 30.144 -7.727 21.501 1.00 0.00 N ATOM 0 H HIS A 57 30.524 -7.482 15.411 1.00 0.00 H new ATOM 0 HA HIS A 57 30.699 -5.542 17.495 1.00 0.00 H new ATOM 0 HB2 HIS A 57 29.841 -7.997 17.486 1.00 0.00 H new ATOM 0 HB3 HIS A 57 31.527 -8.456 17.614 1.00 0.00 H new ATOM 0 HD1 HIS A 57 32.294 -6.094 19.805 1.00 0.00 H new ATOM 0 HD2 HIS A 57 29.115 -8.851 19.893 1.00 0.00 H new ATOM 0 HE1 HIS A 57 31.610 -6.342 22.256 1.00 0.00 H new ATOM 835 N GLY A 58 33.541 -6.614 16.260 1.00 0.00 N ATOM 836 CA GLY A 58 34.975 -6.339 16.200 1.00 0.00 C ATOM 837 C GLY A 58 35.727 -7.312 15.294 1.00 0.00 C ATOM 838 O GLY A 58 36.599 -6.888 14.535 1.00 0.00 O ATOM 0 H GLY A 58 33.214 -7.225 15.512 1.00 0.00 H new ATOM 0 HA2 GLY A 58 35.130 -5.322 15.841 1.00 0.00 H new ATOM 0 HA3 GLY A 58 35.392 -6.390 17.206 1.00 0.00 H new ATOM 842 N ALA A 59 35.349 -8.597 15.321 1.00 0.00 N ATOM 843 CA ALA A 59 36.093 -9.685 14.680 1.00 0.00 C ATOM 844 C ALA A 59 35.223 -10.515 13.719 1.00 0.00 C ATOM 845 O ALA A 59 35.560 -11.660 13.407 1.00 0.00 O ATOM 846 CB ALA A 59 36.735 -10.550 15.774 1.00 0.00 C ATOM 0 H ALA A 59 34.504 -8.913 15.797 1.00 0.00 H new ATOM 0 HA ALA A 59 36.874 -9.255 14.053 1.00 0.00 H new ATOM 0 HB1 ALA A 59 37.293 -11.365 15.313 1.00 0.00 H new ATOM 0 HB2 ALA A 59 37.412 -9.939 16.371 1.00 0.00 H new ATOM 0 HB3 ALA A 59 35.956 -10.961 16.416 1.00 0.00 H new ATOM 852 N GLY A 60 34.085 -9.964 13.276 1.00 0.00 N ATOM 853 CA GLY A 60 33.207 -10.576 12.275 1.00 0.00 C ATOM 854 C GLY A 60 31.864 -11.026 12.848 1.00 0.00 C ATOM 855 O GLY A 60 30.983 -11.415 12.083 1.00 0.00 O ATOM 0 H GLY A 60 33.744 -9.063 13.611 1.00 0.00 H new ATOM 0 HA2 GLY A 60 33.031 -9.862 11.470 1.00 0.00 H new ATOM 0 HA3 GLY A 60 33.713 -11.435 11.834 1.00 0.00 H new ATOM 859 N ASP A 61 31.688 -10.980 14.173 1.00 0.00 N ATOM 860 CA ASP A 61 30.422 -11.318 14.819 1.00 0.00 C ATOM 861 C ASP A 61 29.359 -10.280 14.453 1.00 0.00 C ATOM 862 O ASP A 61 29.546 -9.082 14.693 1.00 0.00 O ATOM 863 CB ASP A 61 30.602 -11.406 16.336 1.00 0.00 C ATOM 864 CG ASP A 61 29.272 -11.738 17.031 1.00 0.00 C ATOM 865 OD1 ASP A 61 28.700 -12.815 16.750 1.00 0.00 O ATOM 866 OD2 ASP A 61 28.825 -10.954 17.896 1.00 0.00 O ATOM 0 H ASP A 61 32.423 -10.707 14.826 1.00 0.00 H new ATOM 0 HA ASP A 61 30.091 -12.294 14.464 1.00 0.00 H new ATOM 0 HB2 ASP A 61 31.341 -12.171 16.574 1.00 0.00 H new ATOM 0 HB3 ASP A 61 30.988 -10.460 16.715 1.00 0.00 H new ATOM 871 N ILE A 62 28.266 -10.744 13.844 1.00 0.00 N ATOM 872 CA ILE A 62 27.109 -9.932 13.475 1.00 0.00 C ATOM 873 C ILE A 62 26.282 -9.704 14.763 1.00 0.00 C ATOM 874 O ILE A 62 26.147 -10.638 15.560 1.00 0.00 O ATOM 875 CB ILE A 62 26.275 -10.680 12.399 1.00 0.00 C ATOM 876 CG1 ILE A 62 27.079 -11.086 11.142 1.00 0.00 C ATOM 877 CG2 ILE A 62 25.062 -9.846 11.932 1.00 0.00 C ATOM 878 CD1 ILE A 62 26.431 -12.229 10.354 1.00 0.00 C ATOM 0 H ILE A 62 28.160 -11.725 13.587 1.00 0.00 H new ATOM 0 HA ILE A 62 27.410 -8.973 13.053 1.00 0.00 H new ATOM 0 HB ILE A 62 25.950 -11.589 12.905 1.00 0.00 H new ATOM 0 HG12 ILE A 62 27.185 -10.219 10.491 1.00 0.00 H new ATOM 0 HG13 ILE A 62 28.084 -11.384 11.442 1.00 0.00 H new ATOM 0 HG21 ILE A 62 24.505 -10.404 11.180 1.00 0.00 H new ATOM 0 HG22 ILE A 62 24.414 -9.638 12.783 1.00 0.00 H new ATOM 0 HG23 ILE A 62 25.410 -8.906 11.503 1.00 0.00 H new ATOM 0 HD11 ILE A 62 27.045 -12.465 9.485 1.00 0.00 H new ATOM 0 HD12 ILE A 62 26.350 -13.110 10.991 1.00 0.00 H new ATOM 0 HD13 ILE A 62 25.437 -11.926 10.025 1.00 0.00 H new ATOM 890 N PRO A 63 25.689 -8.515 14.977 1.00 0.00 N ATOM 891 CA PRO A 63 24.832 -8.235 16.124 1.00 0.00 C ATOM 892 C PRO A 63 23.553 -9.081 16.107 1.00 0.00 C ATOM 893 O PRO A 63 22.948 -9.305 15.055 1.00 0.00 O ATOM 894 CB PRO A 63 24.510 -6.738 16.039 1.00 0.00 C ATOM 895 CG PRO A 63 24.658 -6.436 14.555 1.00 0.00 C ATOM 896 CD PRO A 63 25.828 -7.323 14.164 1.00 0.00 C ATOM 0 HA PRO A 63 25.332 -8.490 17.058 1.00 0.00 H new ATOM 0 HB2 PRO A 63 23.503 -6.522 16.396 1.00 0.00 H new ATOM 0 HB3 PRO A 63 25.196 -6.143 16.642 1.00 0.00 H new ATOM 0 HG2 PRO A 63 23.755 -6.683 13.997 1.00 0.00 H new ATOM 0 HG3 PRO A 63 24.867 -5.382 14.373 1.00 0.00 H new ATOM 0 HD2 PRO A 63 25.801 -7.565 13.102 1.00 0.00 H new ATOM 0 HD3 PRO A 63 26.779 -6.826 14.353 1.00 0.00 H new ATOM 904 N ASP A 64 23.097 -9.464 17.302 1.00 0.00 N ATOM 905 CA ASP A 64 21.973 -10.379 17.544 1.00 0.00 C ATOM 906 C ASP A 64 20.635 -9.905 16.957 1.00 0.00 C ATOM 907 O ASP A 64 19.718 -10.707 16.783 1.00 0.00 O ATOM 908 CB ASP A 64 21.834 -10.593 19.058 1.00 0.00 C ATOM 909 CG ASP A 64 20.718 -11.591 19.413 1.00 0.00 C ATOM 910 OD1 ASP A 64 20.887 -12.807 19.170 1.00 0.00 O ATOM 911 OD2 ASP A 64 19.695 -11.175 20.003 1.00 0.00 O ATOM 0 H ASP A 64 23.519 -9.131 18.169 1.00 0.00 H new ATOM 0 HA ASP A 64 22.204 -11.310 17.027 1.00 0.00 H new ATOM 0 HB2 ASP A 64 22.781 -10.954 19.459 1.00 0.00 H new ATOM 0 HB3 ASP A 64 21.628 -9.637 19.539 1.00 0.00 H new ATOM 916 N ASN A 65 20.520 -8.612 16.628 1.00 0.00 N ATOM 917 CA ASN A 65 19.318 -8.036 16.026 1.00 0.00 C ATOM 918 C ASN A 65 19.066 -8.691 14.665 1.00 0.00 C ATOM 919 O ASN A 65 17.943 -9.094 14.374 1.00 0.00 O ATOM 920 CB ASN A 65 19.492 -6.513 15.868 1.00 0.00 C ATOM 921 CG ASN A 65 18.231 -5.753 15.453 1.00 0.00 C ATOM 922 OD1 ASN A 65 17.123 -6.273 15.445 1.00 0.00 O ATOM 923 ND2 ASN A 65 18.398 -4.486 15.110 1.00 0.00 N ATOM 0 H ASN A 65 21.267 -7.933 16.775 1.00 0.00 H new ATOM 0 HA ASN A 65 18.460 -8.222 16.672 1.00 0.00 H new ATOM 0 HB2 ASN A 65 19.849 -6.104 16.813 1.00 0.00 H new ATOM 0 HB3 ASN A 65 20.269 -6.327 15.127 1.00 0.00 H new ATOM 0 HD21 ASN A 65 17.594 -3.923 14.832 1.00 0.00 H new ATOM 0 HD22 ASN A 65 19.330 -4.073 15.124 1.00 0.00 H new ATOM 930 N LEU A 66 20.121 -8.844 13.853 1.00 0.00 N ATOM 931 CA LEU A 66 20.005 -9.255 12.448 1.00 0.00 C ATOM 932 C LEU A 66 20.750 -10.555 12.161 1.00 0.00 C ATOM 933 O LEU A 66 20.444 -11.203 11.164 1.00 0.00 O ATOM 934 CB LEU A 66 20.476 -8.105 11.533 1.00 0.00 C ATOM 935 CG LEU A 66 20.402 -8.367 10.010 1.00 0.00 C ATOM 936 CD1 LEU A 66 18.962 -8.573 9.523 1.00 0.00 C ATOM 937 CD2 LEU A 66 20.999 -7.191 9.231 1.00 0.00 C ATOM 0 H LEU A 66 21.083 -8.685 14.154 1.00 0.00 H new ATOM 0 HA LEU A 66 18.956 -9.463 12.237 1.00 0.00 H new ATOM 0 HB2 LEU A 66 19.878 -7.222 11.758 1.00 0.00 H new ATOM 0 HB3 LEU A 66 21.508 -7.865 11.789 1.00 0.00 H new ATOM 0 HG LEU A 66 20.971 -9.279 9.830 1.00 0.00 H new ATOM 0 HD11 LEU A 66 18.964 -8.753 8.448 1.00 0.00 H new ATOM 0 HD12 LEU A 66 18.524 -9.431 10.034 1.00 0.00 H new ATOM 0 HD13 LEU A 66 18.373 -7.682 9.740 1.00 0.00 H new ATOM 0 HD21 LEU A 66 20.938 -7.394 8.162 1.00 0.00 H new ATOM 0 HD22 LEU A 66 20.442 -6.283 9.460 1.00 0.00 H new ATOM 0 HD23 LEU A 66 22.043 -7.058 9.516 1.00 0.00 H new ATOM 949 N SER A 67 21.678 -10.995 13.011 1.00 0.00 N ATOM 950 CA SER A 67 22.436 -12.214 12.762 1.00 0.00 C ATOM 951 C SER A 67 21.585 -13.477 12.490 1.00 0.00 C ATOM 952 O SER A 67 22.006 -14.264 11.636 1.00 0.00 O ATOM 953 CB SER A 67 23.493 -12.376 13.854 1.00 0.00 C ATOM 954 OG SER A 67 22.948 -12.667 15.122 1.00 0.00 O ATOM 0 H SER A 67 21.921 -10.521 13.881 1.00 0.00 H new ATOM 0 HA SER A 67 22.946 -12.099 11.806 1.00 0.00 H new ATOM 0 HB2 SER A 67 24.179 -13.174 13.570 1.00 0.00 H new ATOM 0 HB3 SER A 67 24.080 -11.460 13.920 1.00 0.00 H new ATOM 0 HG SER A 67 23.672 -12.760 15.776 1.00 0.00 H new ATOM 960 N PRO A 68 20.378 -13.678 13.072 1.00 0.00 N ATOM 961 CA PRO A 68 19.486 -14.769 12.677 1.00 0.00 C ATOM 962 C PRO A 68 19.145 -14.814 11.181 1.00 0.00 C ATOM 963 O PRO A 68 18.812 -15.881 10.671 1.00 0.00 O ATOM 964 CB PRO A 68 18.218 -14.594 13.518 1.00 0.00 C ATOM 965 CG PRO A 68 18.722 -13.889 14.772 1.00 0.00 C ATOM 966 CD PRO A 68 19.790 -12.964 14.201 1.00 0.00 C ATOM 0 HA PRO A 68 19.990 -15.719 12.855 1.00 0.00 H new ATOM 0 HB2 PRO A 68 17.468 -13.999 12.996 1.00 0.00 H new ATOM 0 HB3 PRO A 68 17.756 -15.553 13.754 1.00 0.00 H new ATOM 0 HG2 PRO A 68 17.930 -13.336 15.277 1.00 0.00 H new ATOM 0 HG3 PRO A 68 19.134 -14.590 15.498 1.00 0.00 H new ATOM 0 HD2 PRO A 68 19.355 -12.017 13.880 1.00 0.00 H new ATOM 0 HD3 PRO A 68 20.545 -12.730 14.951 1.00 0.00 H new ATOM 974 N PHE A 69 19.230 -13.694 10.456 1.00 0.00 N ATOM 975 CA PHE A 69 18.978 -13.635 9.020 1.00 0.00 C ATOM 976 C PHE A 69 19.965 -14.526 8.258 1.00 0.00 C ATOM 977 O PHE A 69 19.564 -15.209 7.317 1.00 0.00 O ATOM 978 CB PHE A 69 19.077 -12.170 8.574 1.00 0.00 C ATOM 979 CG PHE A 69 18.557 -11.841 7.188 1.00 0.00 C ATOM 980 CD1 PHE A 69 17.191 -11.546 7.023 1.00 0.00 C ATOM 981 CD2 PHE A 69 19.430 -11.731 6.086 1.00 0.00 C ATOM 982 CE1 PHE A 69 16.696 -11.150 5.771 1.00 0.00 C ATOM 983 CE2 PHE A 69 18.932 -11.327 4.834 1.00 0.00 C ATOM 984 CZ PHE A 69 17.567 -11.037 4.674 1.00 0.00 C ATOM 0 H PHE A 69 19.480 -12.791 10.860 1.00 0.00 H new ATOM 0 HA PHE A 69 17.980 -14.012 8.798 1.00 0.00 H new ATOM 0 HB2 PHE A 69 18.534 -11.558 9.295 1.00 0.00 H new ATOM 0 HB3 PHE A 69 20.124 -11.869 8.625 1.00 0.00 H new ATOM 0 HD1 PHE A 69 16.519 -11.625 7.865 1.00 0.00 H new ATOM 0 HD2 PHE A 69 20.480 -11.957 6.203 1.00 0.00 H new ATOM 0 HE1 PHE A 69 15.645 -10.932 5.650 1.00 0.00 H new ATOM 0 HE2 PHE A 69 19.602 -11.239 3.992 1.00 0.00 H new ATOM 0 HZ PHE A 69 17.188 -10.728 3.711 1.00 0.00 H new ATOM 994 N TYR A 70 21.235 -14.572 8.682 1.00 0.00 N ATOM 995 CA TYR A 70 22.242 -15.429 8.060 1.00 0.00 C ATOM 996 C TYR A 70 21.913 -16.906 8.303 1.00 0.00 C ATOM 997 O TYR A 70 22.103 -17.738 7.414 1.00 0.00 O ATOM 998 CB TYR A 70 23.641 -15.075 8.597 1.00 0.00 C ATOM 999 CG TYR A 70 24.781 -15.901 8.023 1.00 0.00 C ATOM 1000 CD1 TYR A 70 24.954 -16.009 6.628 1.00 0.00 C ATOM 1001 CD2 TYR A 70 25.676 -16.562 8.888 1.00 0.00 C ATOM 1002 CE1 TYR A 70 25.988 -16.803 6.100 1.00 0.00 C ATOM 1003 CE2 TYR A 70 26.723 -17.344 8.367 1.00 0.00 C ATOM 1004 CZ TYR A 70 26.874 -17.481 6.969 1.00 0.00 C ATOM 1005 OH TYR A 70 27.875 -18.264 6.475 1.00 0.00 O ATOM 0 H TYR A 70 21.588 -14.018 9.462 1.00 0.00 H new ATOM 0 HA TYR A 70 22.236 -15.259 6.983 1.00 0.00 H new ATOM 0 HB2 TYR A 70 23.836 -14.023 8.391 1.00 0.00 H new ATOM 0 HB3 TYR A 70 23.638 -15.193 9.681 1.00 0.00 H new ATOM 0 HD1 TYR A 70 24.289 -15.479 5.962 1.00 0.00 H new ATOM 0 HD2 TYR A 70 25.557 -16.468 9.957 1.00 0.00 H new ATOM 0 HE1 TYR A 70 26.105 -16.895 5.030 1.00 0.00 H new ATOM 0 HE2 TYR A 70 27.411 -17.840 9.036 1.00 0.00 H new ATOM 0 HH TYR A 70 28.165 -17.915 5.606 1.00 0.00 H new ATOM 1015 N GLU A 71 21.394 -17.242 9.488 1.00 0.00 N ATOM 1016 CA GLU A 71 20.992 -18.607 9.807 1.00 0.00 C ATOM 1017 C GLU A 71 19.764 -18.990 8.976 1.00 0.00 C ATOM 1018 O GLU A 71 19.746 -20.050 8.356 1.00 0.00 O ATOM 1019 CB GLU A 71 20.718 -18.761 11.311 1.00 0.00 C ATOM 1020 CG GLU A 71 21.972 -18.502 12.159 1.00 0.00 C ATOM 1021 CD GLU A 71 21.729 -18.834 13.642 1.00 0.00 C ATOM 1022 OE1 GLU A 71 21.298 -17.946 14.410 1.00 0.00 O ATOM 1023 OE2 GLU A 71 21.988 -19.985 14.062 1.00 0.00 O ATOM 0 H GLU A 71 21.243 -16.577 10.246 1.00 0.00 H new ATOM 0 HA GLU A 71 21.808 -19.285 9.555 1.00 0.00 H new ATOM 0 HB2 GLU A 71 19.931 -18.068 11.608 1.00 0.00 H new ATOM 0 HB3 GLU A 71 20.348 -19.767 11.510 1.00 0.00 H new ATOM 0 HG2 GLU A 71 22.799 -19.104 11.781 1.00 0.00 H new ATOM 0 HG3 GLU A 71 22.268 -17.457 12.063 1.00 0.00 H new ATOM 1030 N ALA A 72 18.759 -18.113 8.899 1.00 0.00 N ATOM 1031 CA ALA A 72 17.538 -18.372 8.147 1.00 0.00 C ATOM 1032 C ALA A 72 17.799 -18.474 6.643 1.00 0.00 C ATOM 1033 O ALA A 72 17.093 -19.218 5.959 1.00 0.00 O ATOM 1034 CB ALA A 72 16.516 -17.271 8.448 1.00 0.00 C ATOM 0 H ALA A 72 18.774 -17.203 9.359 1.00 0.00 H new ATOM 0 HA ALA A 72 17.141 -19.337 8.462 1.00 0.00 H new ATOM 0 HB1 ALA A 72 15.601 -17.461 7.887 1.00 0.00 H new ATOM 0 HB2 ALA A 72 16.293 -17.263 9.515 1.00 0.00 H new ATOM 0 HB3 ALA A 72 16.926 -16.304 8.156 1.00 0.00 H new ATOM 1040 N LEU A 73 18.797 -17.748 6.127 1.00 0.00 N ATOM 1041 CA LEU A 73 19.259 -17.881 4.752 1.00 0.00 C ATOM 1042 C LEU A 73 19.783 -19.292 4.529 1.00 0.00 C ATOM 1043 O LEU A 73 19.243 -20.010 3.692 1.00 0.00 O ATOM 1044 CB LEU A 73 20.361 -16.846 4.443 1.00 0.00 C ATOM 1045 CG LEU A 73 19.809 -15.500 3.954 1.00 0.00 C ATOM 1046 CD1 LEU A 73 20.850 -14.387 4.103 1.00 0.00 C ATOM 1047 CD2 LEU A 73 19.390 -15.595 2.482 1.00 0.00 C ATOM 0 H LEU A 73 19.308 -17.046 6.662 1.00 0.00 H new ATOM 0 HA LEU A 73 18.423 -17.695 4.078 1.00 0.00 H new ATOM 0 HB2 LEU A 73 20.958 -16.682 5.340 1.00 0.00 H new ATOM 0 HB3 LEU A 73 21.030 -17.253 3.685 1.00 0.00 H new ATOM 0 HG LEU A 73 18.942 -15.260 4.570 1.00 0.00 H new ATOM 0 HD11 LEU A 73 20.430 -13.446 3.748 1.00 0.00 H new ATOM 0 HD12 LEU A 73 21.129 -14.288 5.152 1.00 0.00 H new ATOM 0 HD13 LEU A 73 21.734 -14.634 3.515 1.00 0.00 H new ATOM 0 HD21 LEU A 73 19.001 -14.632 2.152 1.00 0.00 H new ATOM 0 HD22 LEU A 73 20.254 -15.865 1.875 1.00 0.00 H new ATOM 0 HD23 LEU A 73 18.617 -16.356 2.372 1.00 0.00 H new ATOM 1059 N GLN A 74 20.815 -19.706 5.269 1.00 0.00 N ATOM 1060 CA GLN A 74 21.490 -20.971 4.982 1.00 0.00 C ATOM 1061 C GLN A 74 20.624 -22.188 5.341 1.00 0.00 C ATOM 1062 O GLN A 74 20.785 -23.244 4.728 1.00 0.00 O ATOM 1063 CB GLN A 74 22.876 -21.003 5.647 1.00 0.00 C ATOM 1064 CG GLN A 74 22.842 -21.120 7.177 1.00 0.00 C ATOM 1065 CD GLN A 74 24.173 -20.704 7.798 1.00 0.00 C ATOM 1066 OE1 GLN A 74 25.033 -21.527 8.105 1.00 0.00 O ATOM 1067 NE2 GLN A 74 24.366 -19.411 7.989 1.00 0.00 N ATOM 0 H GLN A 74 21.197 -19.190 6.062 1.00 0.00 H new ATOM 0 HA GLN A 74 21.645 -21.036 3.905 1.00 0.00 H new ATOM 0 HB2 GLN A 74 23.440 -21.843 5.243 1.00 0.00 H new ATOM 0 HB3 GLN A 74 23.417 -20.096 5.376 1.00 0.00 H new ATOM 0 HG2 GLN A 74 22.043 -20.494 7.573 1.00 0.00 H new ATOM 0 HG3 GLN A 74 22.612 -22.147 7.460 1.00 0.00 H new ATOM 0 HE21 GLN A 74 23.641 -18.743 7.728 1.00 0.00 H new ATOM 0 HE22 GLN A 74 25.240 -19.081 8.398 1.00 0.00 H new ATOM 1076 N GLU A 75 19.701 -22.059 6.303 1.00 0.00 N ATOM 1077 CA GLU A 75 18.822 -23.149 6.715 1.00 0.00 C ATOM 1078 C GLU A 75 17.833 -23.510 5.597 1.00 0.00 C ATOM 1079 O GLU A 75 17.533 -24.689 5.401 1.00 0.00 O ATOM 1080 CB GLU A 75 18.092 -22.738 8.006 1.00 0.00 C ATOM 1081 CG GLU A 75 17.168 -23.835 8.556 1.00 0.00 C ATOM 1082 CD GLU A 75 16.584 -23.447 9.925 1.00 0.00 C ATOM 1083 OE1 GLU A 75 15.541 -22.755 9.976 1.00 0.00 O ATOM 1084 OE2 GLU A 75 17.145 -23.854 10.969 1.00 0.00 O ATOM 0 H GLU A 75 19.546 -21.191 6.816 1.00 0.00 H new ATOM 0 HA GLU A 75 19.414 -24.043 6.912 1.00 0.00 H new ATOM 0 HB2 GLU A 75 18.830 -22.479 8.766 1.00 0.00 H new ATOM 0 HB3 GLU A 75 17.504 -21.840 7.813 1.00 0.00 H new ATOM 0 HG2 GLU A 75 16.356 -24.016 7.851 1.00 0.00 H new ATOM 0 HG3 GLU A 75 17.724 -24.768 8.648 1.00 0.00 H new ATOM 1091 N GLN A 76 17.341 -22.509 4.856 1.00 0.00 N ATOM 1092 CA GLN A 76 16.243 -22.688 3.903 1.00 0.00 C ATOM 1093 C GLN A 76 16.743 -22.664 2.455 1.00 0.00 C ATOM 1094 O GLN A 76 16.203 -23.381 1.611 1.00 0.00 O ATOM 1095 CB GLN A 76 15.206 -21.574 4.120 1.00 0.00 C ATOM 1096 CG GLN A 76 14.561 -21.609 5.514 1.00 0.00 C ATOM 1097 CD GLN A 76 13.633 -20.413 5.712 1.00 0.00 C ATOM 1098 OE1 GLN A 76 12.410 -20.534 5.690 1.00 0.00 O ATOM 1099 NE2 GLN A 76 14.195 -19.227 5.890 1.00 0.00 N ATOM 0 H GLN A 76 17.694 -21.553 4.902 1.00 0.00 H new ATOM 0 HA GLN A 76 15.789 -23.664 4.077 1.00 0.00 H new ATOM 0 HB2 GLN A 76 15.686 -20.606 3.973 1.00 0.00 H new ATOM 0 HB3 GLN A 76 14.426 -21.661 3.364 1.00 0.00 H new ATOM 0 HG2 GLN A 76 13.999 -22.535 5.637 1.00 0.00 H new ATOM 0 HG3 GLN A 76 15.337 -21.603 6.279 1.00 0.00 H new ATOM 0 HE21 GLN A 76 15.211 -19.141 5.906 1.00 0.00 H new ATOM 0 HE22 GLN A 76 13.612 -18.399 6.011 1.00 0.00 H new ATOM 1108 N LYS A 77 17.771 -21.852 2.181 1.00 0.00 N ATOM 1109 CA LYS A 77 18.357 -21.558 0.872 1.00 0.00 C ATOM 1110 C LYS A 77 17.332 -21.577 -0.282 1.00 0.00 C ATOM 1111 O LYS A 77 17.467 -22.386 -1.205 1.00 0.00 O ATOM 1112 CB LYS A 77 19.594 -22.452 0.666 1.00 0.00 C ATOM 1113 CG LYS A 77 20.509 -21.882 -0.425 1.00 0.00 C ATOM 1114 CD LYS A 77 21.827 -22.663 -0.520 1.00 0.00 C ATOM 1115 CE LYS A 77 22.669 -22.200 -1.716 1.00 0.00 C ATOM 1116 NZ LYS A 77 22.982 -20.754 -1.664 1.00 0.00 N ATOM 0 H LYS A 77 18.249 -21.346 2.926 1.00 0.00 H new ATOM 0 HA LYS A 77 18.698 -20.523 0.855 1.00 0.00 H new ATOM 0 HB2 LYS A 77 20.147 -22.536 1.602 1.00 0.00 H new ATOM 0 HB3 LYS A 77 19.278 -23.458 0.391 1.00 0.00 H new ATOM 0 HG2 LYS A 77 19.995 -21.915 -1.386 1.00 0.00 H new ATOM 0 HG3 LYS A 77 20.721 -20.834 -0.213 1.00 0.00 H new ATOM 0 HD2 LYS A 77 22.396 -22.531 0.400 1.00 0.00 H new ATOM 0 HD3 LYS A 77 21.614 -23.728 -0.614 1.00 0.00 H new ATOM 0 HE2 LYS A 77 23.598 -22.769 -1.744 1.00 0.00 H new ATOM 0 HE3 LYS A 77 22.134 -22.419 -2.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 23.523 -20.485 -2.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 22.097 -20.208 -1.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 23.546 -20.551 -0.814 1.00 0.00 H new ATOM 1130 N PRO A 78 16.282 -20.734 -0.239 1.00 0.00 N ATOM 1131 CA PRO A 78 15.342 -20.625 -1.345 1.00 0.00 C ATOM 1132 C PRO A 78 16.020 -19.950 -2.546 1.00 0.00 C ATOM 1133 O PRO A 78 17.014 -19.236 -2.395 1.00 0.00 O ATOM 1134 CB PRO A 78 14.187 -19.778 -0.805 1.00 0.00 C ATOM 1135 CG PRO A 78 14.874 -18.856 0.200 1.00 0.00 C ATOM 1136 CD PRO A 78 15.987 -19.730 0.777 1.00 0.00 C ATOM 0 HA PRO A 78 14.990 -21.596 -1.694 1.00 0.00 H new ATOM 0 HB2 PRO A 78 13.695 -19.215 -1.598 1.00 0.00 H new ATOM 0 HB3 PRO A 78 13.423 -20.394 -0.330 1.00 0.00 H new ATOM 0 HG2 PRO A 78 15.273 -17.963 -0.281 1.00 0.00 H new ATOM 0 HG3 PRO A 78 14.184 -18.520 0.974 1.00 0.00 H new ATOM 0 HD2 PRO A 78 16.871 -19.135 1.005 1.00 0.00 H new ATOM 0 HD3 PRO A 78 15.670 -20.200 1.708 1.00 0.00 H new ATOM 1144 N ASP A 79 15.467 -20.152 -3.742 1.00 0.00 N ATOM 1145 CA ASP A 79 15.862 -19.398 -4.929 1.00 0.00 C ATOM 1146 C ASP A 79 15.325 -17.978 -4.765 1.00 0.00 C ATOM 1147 O ASP A 79 14.131 -17.796 -4.509 1.00 0.00 O ATOM 1148 CB ASP A 79 15.276 -20.030 -6.201 1.00 0.00 C ATOM 1149 CG ASP A 79 15.330 -19.072 -7.407 1.00 0.00 C ATOM 1150 OD1 ASP A 79 16.323 -18.323 -7.554 1.00 0.00 O ATOM 1151 OD2 ASP A 79 14.376 -19.074 -8.217 1.00 0.00 O ATOM 0 H ASP A 79 14.735 -20.841 -3.914 1.00 0.00 H new ATOM 0 HA ASP A 79 16.947 -19.401 -5.029 1.00 0.00 H new ATOM 0 HB2 ASP A 79 15.826 -20.941 -6.438 1.00 0.00 H new ATOM 0 HB3 ASP A 79 14.242 -20.321 -6.017 1.00 0.00 H new ATOM 1156 N LEU A 80 16.195 -16.981 -4.915 1.00 0.00 N ATOM 1157 CA LEU A 80 15.859 -15.563 -4.843 1.00 0.00 C ATOM 1158 C LEU A 80 16.636 -14.783 -5.906 1.00 0.00 C ATOM 1159 O LEU A 80 17.047 -13.642 -5.690 1.00 0.00 O ATOM 1160 CB LEU A 80 15.957 -15.026 -3.398 1.00 0.00 C ATOM 1161 CG LEU A 80 17.138 -15.499 -2.534 1.00 0.00 C ATOM 1162 CD1 LEU A 80 18.416 -14.752 -2.900 1.00 0.00 C ATOM 1163 CD2 LEU A 80 16.833 -15.250 -1.052 1.00 0.00 C ATOM 0 H LEU A 80 17.185 -17.145 -5.096 1.00 0.00 H new ATOM 0 HA LEU A 80 14.809 -15.413 -5.094 1.00 0.00 H new ATOM 0 HB2 LEU A 80 15.993 -13.938 -3.447 1.00 0.00 H new ATOM 0 HB3 LEU A 80 15.036 -15.291 -2.879 1.00 0.00 H new ATOM 0 HG LEU A 80 17.281 -16.564 -2.717 1.00 0.00 H new ATOM 0 HD11 LEU A 80 19.236 -15.105 -2.274 1.00 0.00 H new ATOM 0 HD12 LEU A 80 18.655 -14.932 -3.948 1.00 0.00 H new ATOM 0 HD13 LEU A 80 18.272 -13.684 -2.740 1.00 0.00 H new ATOM 0 HD21 LEU A 80 17.674 -15.587 -0.446 1.00 0.00 H new ATOM 0 HD22 LEU A 80 16.672 -14.185 -0.888 1.00 0.00 H new ATOM 0 HD23 LEU A 80 15.936 -15.801 -0.768 1.00 0.00 H new ATOM 1175 N SER A 81 16.784 -15.390 -7.087 1.00 0.00 N ATOM 1176 CA SER A 81 17.301 -14.816 -8.338 1.00 0.00 C ATOM 1177 C SER A 81 16.516 -13.603 -8.888 1.00 0.00 C ATOM 1178 O SER A 81 16.548 -13.338 -10.092 1.00 0.00 O ATOM 1179 CB SER A 81 17.413 -15.933 -9.389 1.00 0.00 C ATOM 1180 OG SER A 81 18.106 -17.059 -8.884 1.00 0.00 O ATOM 0 H SER A 81 16.527 -16.370 -7.205 1.00 0.00 H new ATOM 0 HA SER A 81 18.282 -14.402 -8.103 1.00 0.00 H new ATOM 0 HB2 SER A 81 16.415 -16.233 -9.709 1.00 0.00 H new ATOM 0 HB3 SER A 81 17.929 -15.553 -10.270 1.00 0.00 H new ATOM 0 HG SER A 81 17.468 -17.778 -8.696 1.00 0.00 H new ATOM 1186 N ALA A 82 15.803 -12.869 -8.031 1.00 0.00 N ATOM 1187 CA ALA A 82 15.035 -11.676 -8.377 1.00 0.00 C ATOM 1188 C ALA A 82 15.041 -10.633 -7.246 1.00 0.00 C ATOM 1189 O ALA A 82 14.368 -9.605 -7.359 1.00 0.00 O ATOM 1190 CB ALA A 82 13.608 -12.093 -8.750 1.00 0.00 C ATOM 0 H ALA A 82 15.744 -13.100 -7.039 1.00 0.00 H new ATOM 0 HA ALA A 82 15.506 -11.193 -9.233 1.00 0.00 H new ATOM 0 HB1 ALA A 82 13.027 -11.208 -9.010 1.00 0.00 H new ATOM 0 HB2 ALA A 82 13.638 -12.771 -9.603 1.00 0.00 H new ATOM 0 HB3 ALA A 82 13.143 -12.597 -7.903 1.00 0.00 H new ATOM 1196 N VAL A 83 15.767 -10.871 -6.149 1.00 0.00 N ATOM 1197 CA VAL A 83 16.007 -9.864 -5.128 1.00 0.00 C ATOM 1198 C VAL A 83 17.251 -9.070 -5.540 1.00 0.00 C ATOM 1199 O VAL A 83 18.198 -9.615 -6.112 1.00 0.00 O ATOM 1200 CB VAL A 83 16.202 -10.555 -3.756 1.00 0.00 C ATOM 1201 CG1 VAL A 83 16.597 -9.584 -2.634 1.00 0.00 C ATOM 1202 CG2 VAL A 83 14.923 -11.279 -3.318 1.00 0.00 C ATOM 0 H VAL A 83 16.203 -11.772 -5.950 1.00 0.00 H new ATOM 0 HA VAL A 83 15.160 -9.184 -5.035 1.00 0.00 H new ATOM 0 HB VAL A 83 17.019 -11.260 -3.908 1.00 0.00 H new ATOM 0 HG11 VAL A 83 16.717 -10.135 -1.701 1.00 0.00 H new ATOM 0 HG12 VAL A 83 17.537 -9.095 -2.890 1.00 0.00 H new ATOM 0 HG13 VAL A 83 15.818 -8.831 -2.513 1.00 0.00 H new ATOM 0 HG21 VAL A 83 15.087 -11.756 -2.352 1.00 0.00 H new ATOM 0 HG22 VAL A 83 14.108 -10.560 -3.234 1.00 0.00 H new ATOM 0 HG23 VAL A 83 14.663 -12.037 -4.057 1.00 0.00 H new ATOM 1212 N ARG A 84 17.259 -7.784 -5.217 1.00 0.00 N ATOM 1213 CA ARG A 84 18.425 -6.917 -5.290 1.00 0.00 C ATOM 1214 C ARG A 84 18.586 -6.394 -3.877 1.00 0.00 C ATOM 1215 O ARG A 84 17.586 -6.184 -3.182 1.00 0.00 O ATOM 1216 CB ARG A 84 18.236 -5.753 -6.270 1.00 0.00 C ATOM 1217 CG ARG A 84 18.346 -6.187 -7.738 1.00 0.00 C ATOM 1218 CD ARG A 84 18.754 -5.014 -8.641 1.00 0.00 C ATOM 1219 NE ARG A 84 20.179 -4.663 -8.457 1.00 0.00 N ATOM 1220 CZ ARG A 84 21.061 -4.398 -9.429 1.00 0.00 C ATOM 1221 NH1 ARG A 84 20.659 -4.198 -10.682 1.00 0.00 N ATOM 1222 NH2 ARG A 84 22.355 -4.337 -9.136 1.00 0.00 N ATOM 0 H ARG A 84 16.425 -7.300 -4.886 1.00 0.00 H new ATOM 0 HA ARG A 84 19.297 -7.459 -5.656 1.00 0.00 H new ATOM 0 HB2 ARG A 84 17.260 -5.298 -6.103 1.00 0.00 H new ATOM 0 HB3 ARG A 84 18.984 -4.987 -6.065 1.00 0.00 H new ATOM 0 HG2 ARG A 84 19.079 -6.989 -7.828 1.00 0.00 H new ATOM 0 HG3 ARG A 84 17.390 -6.590 -8.072 1.00 0.00 H new ATOM 0 HD2 ARG A 84 18.574 -5.275 -9.684 1.00 0.00 H new ATOM 0 HD3 ARG A 84 18.132 -4.147 -8.418 1.00 0.00 H new ATOM 0 HE ARG A 84 20.523 -4.619 -7.498 1.00 0.00 H new ATOM 0 HH11 ARG A 84 19.667 -4.246 -10.913 1.00 0.00 H new ATOM 0 HH12 ARG A 84 21.343 -3.997 -11.411 1.00 0.00 H new ATOM 0 HH21 ARG A 84 22.669 -4.491 -8.178 1.00 0.00 H new ATOM 0 HH22 ARG A 84 23.035 -4.136 -9.869 1.00 0.00 H new ATOM 1236 N PHE A 85 19.818 -6.171 -3.446 1.00 0.00 N ATOM 1237 CA PHE A 85 20.075 -5.611 -2.134 1.00 0.00 C ATOM 1238 C PHE A 85 21.177 -4.569 -2.243 1.00 0.00 C ATOM 1239 O PHE A 85 21.846 -4.466 -3.273 1.00 0.00 O ATOM 1240 CB PHE A 85 20.400 -6.729 -1.130 1.00 0.00 C ATOM 1241 CG PHE A 85 21.653 -7.524 -1.449 1.00 0.00 C ATOM 1242 CD1 PHE A 85 22.913 -7.017 -1.088 1.00 0.00 C ATOM 1243 CD2 PHE A 85 21.562 -8.765 -2.109 1.00 0.00 C ATOM 1244 CE1 PHE A 85 24.075 -7.733 -1.404 1.00 0.00 C ATOM 1245 CE2 PHE A 85 22.729 -9.491 -2.412 1.00 0.00 C ATOM 1246 CZ PHE A 85 23.986 -8.972 -2.061 1.00 0.00 C ATOM 0 H PHE A 85 20.657 -6.371 -3.991 1.00 0.00 H new ATOM 0 HA PHE A 85 19.185 -5.109 -1.754 1.00 0.00 H new ATOM 0 HB2 PHE A 85 20.508 -6.288 -0.139 1.00 0.00 H new ATOM 0 HB3 PHE A 85 19.554 -7.414 -1.083 1.00 0.00 H new ATOM 0 HD1 PHE A 85 22.986 -6.074 -0.566 1.00 0.00 H new ATOM 0 HD2 PHE A 85 20.595 -9.160 -2.383 1.00 0.00 H new ATOM 0 HE1 PHE A 85 25.043 -7.331 -1.142 1.00 0.00 H new ATOM 0 HE2 PHE A 85 22.658 -10.445 -2.913 1.00 0.00 H new ATOM 0 HZ PHE A 85 24.884 -9.525 -2.296 1.00 0.00 H new ATOM 1256 N GLY A 86 21.360 -3.814 -1.168 1.00 0.00 N ATOM 1257 CA GLY A 86 22.477 -2.918 -0.943 1.00 0.00 C ATOM 1258 C GLY A 86 23.060 -3.351 0.400 1.00 0.00 C ATOM 1259 O GLY A 86 22.340 -3.959 1.201 1.00 0.00 O ATOM 0 H GLY A 86 20.697 -3.813 -0.392 1.00 0.00 H new ATOM 0 HA2 GLY A 86 23.216 -3.000 -1.740 1.00 0.00 H new ATOM 0 HA3 GLY A 86 22.151 -1.878 -0.916 1.00 0.00 H new ATOM 1263 N ALA A 87 24.333 -3.061 0.661 1.00 0.00 N ATOM 1264 CA ALA A 87 25.045 -3.619 1.802 1.00 0.00 C ATOM 1265 C ALA A 87 25.818 -2.521 2.521 1.00 0.00 C ATOM 1266 O ALA A 87 26.655 -1.846 1.914 1.00 0.00 O ATOM 1267 CB ALA A 87 25.984 -4.719 1.294 1.00 0.00 C ATOM 0 H ALA A 87 24.896 -2.434 0.087 1.00 0.00 H new ATOM 0 HA ALA A 87 24.343 -4.049 2.517 1.00 0.00 H new ATOM 0 HB1 ALA A 87 26.527 -5.150 2.135 1.00 0.00 H new ATOM 0 HB2 ALA A 87 25.400 -5.497 0.802 1.00 0.00 H new ATOM 0 HB3 ALA A 87 26.693 -4.293 0.584 1.00 0.00 H new ATOM 1273 N ILE A 88 25.553 -2.367 3.819 1.00 0.00 N ATOM 1274 CA ILE A 88 26.192 -1.388 4.679 1.00 0.00 C ATOM 1275 C ILE A 88 26.613 -2.126 5.948 1.00 0.00 C ATOM 1276 O ILE A 88 25.828 -2.891 6.518 1.00 0.00 O ATOM 1277 CB ILE A 88 25.228 -0.215 4.997 1.00 0.00 C ATOM 1278 CG1 ILE A 88 24.570 0.355 3.720 1.00 0.00 C ATOM 1279 CG2 ILE A 88 25.967 0.876 5.798 1.00 0.00 C ATOM 1280 CD1 ILE A 88 23.716 1.609 3.936 1.00 0.00 C ATOM 0 H ILE A 88 24.866 -2.940 4.309 1.00 0.00 H new ATOM 0 HA ILE A 88 27.059 -0.945 4.190 1.00 0.00 H new ATOM 0 HB ILE A 88 24.416 -0.600 5.613 1.00 0.00 H new ATOM 0 HG12 ILE A 88 25.353 0.587 2.998 1.00 0.00 H new ATOM 0 HG13 ILE A 88 23.945 -0.419 3.275 1.00 0.00 H new ATOM 0 HG21 ILE A 88 25.281 1.695 6.016 1.00 0.00 H new ATOM 0 HG22 ILE A 88 26.337 0.454 6.732 1.00 0.00 H new ATOM 0 HG23 ILE A 88 26.806 1.252 5.213 1.00 0.00 H new ATOM 0 HD11 ILE A 88 23.298 1.933 2.983 1.00 0.00 H new ATOM 0 HD12 ILE A 88 22.906 1.383 4.630 1.00 0.00 H new ATOM 0 HD13 ILE A 88 24.336 2.405 4.349 1.00 0.00 H new ATOM 1292 N GLY A 89 27.835 -1.865 6.403 1.00 0.00 N ATOM 1293 CA GLY A 89 28.331 -2.297 7.697 1.00 0.00 C ATOM 1294 C GLY A 89 28.695 -1.067 8.520 1.00 0.00 C ATOM 1295 O GLY A 89 28.862 0.031 7.979 1.00 0.00 O ATOM 0 H GLY A 89 28.521 -1.334 5.866 1.00 0.00 H new ATOM 0 HA2 GLY A 89 27.573 -2.886 8.214 1.00 0.00 H new ATOM 0 HA3 GLY A 89 29.203 -2.939 7.572 1.00 0.00 H new ATOM 1299 N ILE A 90 28.813 -1.252 9.833 1.00 0.00 N ATOM 1300 CA ILE A 90 29.102 -0.201 10.800 1.00 0.00 C ATOM 1301 C ILE A 90 30.044 -0.830 11.830 1.00 0.00 C ATOM 1302 O ILE A 90 29.909 -2.012 12.161 1.00 0.00 O ATOM 1303 CB ILE A 90 27.787 0.328 11.432 1.00 0.00 C ATOM 1304 CG1 ILE A 90 26.783 0.797 10.349 1.00 0.00 C ATOM 1305 CG2 ILE A 90 28.073 1.464 12.432 1.00 0.00 C ATOM 1306 CD1 ILE A 90 25.493 1.404 10.895 1.00 0.00 C ATOM 0 H ILE A 90 28.706 -2.170 10.265 1.00 0.00 H new ATOM 0 HA ILE A 90 29.575 0.668 10.343 1.00 0.00 H new ATOM 0 HB ILE A 90 27.331 -0.501 11.973 1.00 0.00 H new ATOM 0 HG12 ILE A 90 27.274 1.533 9.712 1.00 0.00 H new ATOM 0 HG13 ILE A 90 26.529 -0.053 9.716 1.00 0.00 H new ATOM 0 HG21 ILE A 90 27.135 1.817 12.860 1.00 0.00 H new ATOM 0 HG22 ILE A 90 28.719 1.094 13.228 1.00 0.00 H new ATOM 0 HG23 ILE A 90 28.568 2.287 11.916 1.00 0.00 H new ATOM 0 HD11 ILE A 90 24.852 1.703 10.066 1.00 0.00 H new ATOM 0 HD12 ILE A 90 24.974 0.666 11.507 1.00 0.00 H new ATOM 0 HD13 ILE A 90 25.731 2.277 11.503 1.00 0.00 H new ATOM 1318 N GLY A 91 30.997 -0.062 12.345 1.00 0.00 N ATOM 1319 CA GLY A 91 31.935 -0.470 13.355 1.00 0.00 C ATOM 1320 C GLY A 91 32.900 0.687 13.549 1.00 0.00 C ATOM 1321 O GLY A 91 32.933 1.642 12.772 1.00 0.00 O ATOM 0 H GLY A 91 31.133 0.904 12.049 1.00 0.00 H new ATOM 0 HA2 GLY A 91 31.422 -0.706 14.287 1.00 0.00 H new ATOM 0 HA3 GLY A 91 32.467 -1.370 13.048 1.00 0.00 H new ATOM 1325 N SER A 92 33.665 0.634 14.616 1.00 0.00 N ATOM 1326 CA SER A 92 34.778 1.541 14.826 1.00 0.00 C ATOM 1327 C SER A 92 35.901 1.118 13.876 1.00 0.00 C ATOM 1328 O SER A 92 36.208 -0.070 13.782 1.00 0.00 O ATOM 1329 CB SER A 92 35.195 1.464 16.296 1.00 0.00 C ATOM 1330 OG SER A 92 34.109 1.854 17.121 1.00 0.00 O ATOM 0 H SER A 92 33.534 -0.042 15.368 1.00 0.00 H new ATOM 0 HA SER A 92 34.517 2.578 14.613 1.00 0.00 H new ATOM 0 HB2 SER A 92 35.506 0.449 16.543 1.00 0.00 H new ATOM 0 HB3 SER A 92 36.052 2.113 16.476 1.00 0.00 H new ATOM 0 HG SER A 92 34.378 1.802 18.062 1.00 0.00 H new ATOM 1336 N ARG A 93 36.540 2.061 13.174 1.00 0.00 N ATOM 1337 CA ARG A 93 37.615 1.739 12.223 1.00 0.00 C ATOM 1338 C ARG A 93 38.832 1.064 12.869 1.00 0.00 C ATOM 1339 O ARG A 93 39.657 0.492 12.161 1.00 0.00 O ATOM 1340 CB ARG A 93 37.988 2.970 11.378 1.00 0.00 C ATOM 1341 CG ARG A 93 38.629 4.108 12.193 1.00 0.00 C ATOM 1342 CD ARG A 93 39.008 5.285 11.285 1.00 0.00 C ATOM 1343 NE ARG A 93 39.593 6.400 12.054 1.00 0.00 N ATOM 1344 CZ ARG A 93 40.861 6.499 12.477 1.00 0.00 C ATOM 1345 NH1 ARG A 93 41.748 5.541 12.210 1.00 0.00 N ATOM 1346 NH2 ARG A 93 41.240 7.565 13.175 1.00 0.00 N ATOM 0 H ARG A 93 36.332 3.057 13.246 1.00 0.00 H new ATOM 0 HA ARG A 93 37.217 0.983 11.546 1.00 0.00 H new ATOM 0 HB2 ARG A 93 38.678 2.664 10.592 1.00 0.00 H new ATOM 0 HB3 ARG A 93 37.091 3.347 10.886 1.00 0.00 H new ATOM 0 HG2 ARG A 93 37.934 4.446 12.962 1.00 0.00 H new ATOM 0 HG3 ARG A 93 39.517 3.738 12.706 1.00 0.00 H new ATOM 0 HD2 ARG A 93 39.721 4.949 10.532 1.00 0.00 H new ATOM 0 HD3 ARG A 93 38.123 5.634 10.753 1.00 0.00 H new ATOM 0 HE ARG A 93 38.970 7.173 12.287 1.00 0.00 H new ATOM 0 HH11 ARG A 93 41.465 4.718 11.677 1.00 0.00 H new ATOM 0 HH12 ARG A 93 42.710 5.630 12.539 1.00 0.00 H new ATOM 0 HH21 ARG A 93 40.567 8.302 13.386 1.00 0.00 H new ATOM 0 HH22 ARG A 93 42.204 7.646 13.500 1.00 0.00 H new ATOM 1360 N GLU A 94 38.948 1.116 14.200 1.00 0.00 N ATOM 1361 CA GLU A 94 39.971 0.406 14.962 1.00 0.00 C ATOM 1362 C GLU A 94 39.762 -1.124 14.909 1.00 0.00 C ATOM 1363 O GLU A 94 40.717 -1.878 15.108 1.00 0.00 O ATOM 1364 CB GLU A 94 39.925 0.933 16.410 1.00 0.00 C ATOM 1365 CG GLU A 94 41.107 0.521 17.301 1.00 0.00 C ATOM 1366 CD GLU A 94 42.445 1.127 16.831 1.00 0.00 C ATOM 1367 OE1 GLU A 94 42.777 2.264 17.239 1.00 0.00 O ATOM 1368 OE2 GLU A 94 43.191 0.468 16.075 1.00 0.00 O ATOM 0 H GLU A 94 38.319 1.665 14.786 1.00 0.00 H new ATOM 0 HA GLU A 94 40.954 0.590 14.527 1.00 0.00 H new ATOM 0 HB2 GLU A 94 39.877 2.022 16.381 1.00 0.00 H new ATOM 0 HB3 GLU A 94 39.003 0.585 16.876 1.00 0.00 H new ATOM 0 HG2 GLU A 94 40.911 0.835 18.326 1.00 0.00 H new ATOM 0 HG3 GLU A 94 41.188 -0.566 17.310 1.00 0.00 H new ATOM 1375 N TYR A 95 38.533 -1.598 14.659 1.00 0.00 N ATOM 1376 CA TYR A 95 38.191 -3.018 14.668 1.00 0.00 C ATOM 1377 C TYR A 95 38.970 -3.781 13.591 1.00 0.00 C ATOM 1378 O TYR A 95 39.165 -3.288 12.478 1.00 0.00 O ATOM 1379 CB TYR A 95 36.679 -3.198 14.449 1.00 0.00 C ATOM 1380 CG TYR A 95 35.726 -2.705 15.534 1.00 0.00 C ATOM 1381 CD1 TYR A 95 36.167 -2.349 16.828 1.00 0.00 C ATOM 1382 CD2 TYR A 95 34.347 -2.659 15.242 1.00 0.00 C ATOM 1383 CE1 TYR A 95 35.244 -1.949 17.811 1.00 0.00 C ATOM 1384 CE2 TYR A 95 33.421 -2.256 16.219 1.00 0.00 C ATOM 1385 CZ TYR A 95 33.864 -1.902 17.512 1.00 0.00 C ATOM 1386 OH TYR A 95 32.954 -1.518 18.452 1.00 0.00 O ATOM 0 H TYR A 95 37.741 -0.993 14.442 1.00 0.00 H new ATOM 0 HA TYR A 95 38.466 -3.426 15.641 1.00 0.00 H new ATOM 0 HB2 TYR A 95 36.415 -2.692 13.520 1.00 0.00 H new ATOM 0 HB3 TYR A 95 36.489 -4.261 14.298 1.00 0.00 H new ATOM 0 HD1 TYR A 95 37.220 -2.384 17.064 1.00 0.00 H new ATOM 0 HD2 TYR A 95 33.999 -2.936 14.258 1.00 0.00 H new ATOM 0 HE1 TYR A 95 35.591 -1.677 18.797 1.00 0.00 H new ATOM 0 HE2 TYR A 95 32.368 -2.217 15.980 1.00 0.00 H new ATOM 0 HH TYR A 95 32.054 -1.545 18.066 1.00 0.00 H new ATOM 1396 N ASP A 96 39.370 -5.017 13.911 1.00 0.00 N ATOM 1397 CA ASP A 96 40.114 -5.886 12.997 1.00 0.00 C ATOM 1398 C ASP A 96 39.274 -6.264 11.772 1.00 0.00 C ATOM 1399 O ASP A 96 39.804 -6.374 10.666 1.00 0.00 O ATOM 1400 CB ASP A 96 40.562 -7.154 13.731 1.00 0.00 C ATOM 1401 CG ASP A 96 41.331 -8.096 12.790 1.00 0.00 C ATOM 1402 OD1 ASP A 96 42.490 -7.784 12.431 1.00 0.00 O ATOM 1403 OD2 ASP A 96 40.797 -9.168 12.432 1.00 0.00 O ATOM 0 H ASP A 96 39.184 -5.444 14.819 1.00 0.00 H new ATOM 0 HA ASP A 96 40.988 -5.336 12.649 1.00 0.00 H new ATOM 0 HB2 ASP A 96 41.194 -6.884 14.577 1.00 0.00 H new ATOM 0 HB3 ASP A 96 39.692 -7.670 14.136 1.00 0.00 H new ATOM 1408 N THR A 97 37.958 -6.397 11.957 1.00 0.00 N ATOM 1409 CA THR A 97 36.984 -6.723 10.925 1.00 0.00 C ATOM 1410 C THR A 97 36.012 -5.537 10.795 1.00 0.00 C ATOM 1411 O THR A 97 34.797 -5.710 10.751 1.00 0.00 O ATOM 1412 CB THR A 97 36.344 -8.077 11.294 1.00 0.00 C ATOM 1413 OG1 THR A 97 37.349 -9.041 11.562 1.00 0.00 O ATOM 1414 CG2 THR A 97 35.456 -8.679 10.206 1.00 0.00 C ATOM 0 H THR A 97 37.528 -6.274 12.874 1.00 0.00 H new ATOM 0 HA THR A 97 37.417 -6.857 9.934 1.00 0.00 H new ATOM 0 HB THR A 97 35.725 -7.854 12.163 1.00 0.00 H new ATOM 0 HG1 THR A 97 36.939 -9.928 11.639 1.00 0.00 H new ATOM 0 HG21 THR A 97 35.049 -9.629 10.553 1.00 0.00 H new ATOM 0 HG22 THR A 97 34.638 -7.994 9.983 1.00 0.00 H new ATOM 0 HG23 THR A 97 36.046 -8.844 9.305 1.00 0.00 H new ATOM 1460 N ALA A 101 31.293 -7.789 8.925 1.00 0.00 N ATOM 1461 CA ALA A 101 30.314 -8.825 9.254 1.00 0.00 C ATOM 1462 C ALA A 101 29.111 -8.870 8.295 1.00 0.00 C ATOM 1463 O ALA A 101 28.470 -9.914 8.161 1.00 0.00 O ATOM 1464 CB ALA A 101 29.864 -8.616 10.697 1.00 0.00 C ATOM 0 HA ALA A 101 30.798 -9.795 9.138 1.00 0.00 H new ATOM 0 HB1 ALA A 101 29.133 -9.379 10.964 1.00 0.00 H new ATOM 0 HB2 ALA A 101 30.725 -8.691 11.361 1.00 0.00 H new ATOM 0 HB3 ALA A 101 29.412 -7.629 10.798 1.00 0.00 H new ATOM 1470 N ILE A 102 28.829 -7.769 7.587 1.00 0.00 N ATOM 1471 CA ILE A 102 27.819 -7.700 6.525 1.00 0.00 C ATOM 1472 C ILE A 102 28.133 -8.727 5.425 1.00 0.00 C ATOM 1473 O ILE A 102 27.220 -9.217 4.763 1.00 0.00 O ATOM 1474 CB ILE A 102 27.691 -6.241 5.994 1.00 0.00 C ATOM 1475 CG1 ILE A 102 26.879 -6.084 4.688 1.00 0.00 C ATOM 1476 CG2 ILE A 102 29.060 -5.567 5.767 1.00 0.00 C ATOM 1477 CD1 ILE A 102 25.411 -6.519 4.751 1.00 0.00 C ATOM 0 H ILE A 102 29.308 -6.882 7.741 1.00 0.00 H new ATOM 0 HA ILE A 102 26.841 -7.967 6.926 1.00 0.00 H new ATOM 0 HB ILE A 102 27.143 -5.750 6.798 1.00 0.00 H new ATOM 0 HG12 ILE A 102 26.914 -5.037 4.386 1.00 0.00 H new ATOM 0 HG13 ILE A 102 27.374 -6.659 3.905 1.00 0.00 H new ATOM 0 HG21 ILE A 102 28.909 -4.553 5.397 1.00 0.00 H new ATOM 0 HG22 ILE A 102 29.609 -5.532 6.708 1.00 0.00 H new ATOM 0 HG23 ILE A 102 29.630 -6.139 5.035 1.00 0.00 H new ATOM 0 HD11 ILE A 102 24.943 -6.363 3.779 1.00 0.00 H new ATOM 0 HD12 ILE A 102 25.355 -7.575 5.015 1.00 0.00 H new ATOM 0 HD13 ILE A 102 24.889 -5.929 5.504 1.00 0.00 H new ATOM 1489 N ASP A 103 29.405 -9.101 5.253 1.00 0.00 N ATOM 1490 CA ASP A 103 29.832 -9.978 4.166 1.00 0.00 C ATOM 1491 C ASP A 103 29.104 -11.322 4.191 1.00 0.00 C ATOM 1492 O ASP A 103 28.716 -11.825 3.142 1.00 0.00 O ATOM 1493 CB ASP A 103 31.344 -10.214 4.215 1.00 0.00 C ATOM 1494 CG ASP A 103 31.796 -11.139 3.072 1.00 0.00 C ATOM 1495 OD1 ASP A 103 31.855 -10.682 1.908 1.00 0.00 O ATOM 1496 OD2 ASP A 103 32.143 -12.310 3.341 1.00 0.00 O ATOM 0 H ASP A 103 30.165 -8.803 5.865 1.00 0.00 H new ATOM 0 HA ASP A 103 29.575 -9.470 3.236 1.00 0.00 H new ATOM 0 HB2 ASP A 103 31.867 -9.260 4.144 1.00 0.00 H new ATOM 0 HB3 ASP A 103 31.616 -10.656 5.174 1.00 0.00 H new ATOM 1501 N LYS A 104 28.860 -11.896 5.376 1.00 0.00 N ATOM 1502 CA LYS A 104 28.193 -13.196 5.473 1.00 0.00 C ATOM 1503 C LYS A 104 26.710 -13.061 5.131 1.00 0.00 C ATOM 1504 O LYS A 104 26.165 -13.908 4.422 1.00 0.00 O ATOM 1505 CB LYS A 104 28.377 -13.789 6.881 1.00 0.00 C ATOM 1506 CG LYS A 104 29.835 -13.889 7.372 1.00 0.00 C ATOM 1507 CD LYS A 104 30.792 -14.651 6.436 1.00 0.00 C ATOM 1508 CE LYS A 104 30.360 -16.097 6.142 1.00 0.00 C ATOM 1509 NZ LYS A 104 30.453 -16.983 7.330 1.00 0.00 N ATOM 0 H LYS A 104 29.113 -11.483 6.273 1.00 0.00 H new ATOM 0 HA LYS A 104 28.648 -13.876 4.753 1.00 0.00 H new ATOM 0 HB2 LYS A 104 27.814 -13.181 7.589 1.00 0.00 H new ATOM 0 HB3 LYS A 104 27.937 -14.786 6.897 1.00 0.00 H new ATOM 0 HG2 LYS A 104 30.222 -12.881 7.518 1.00 0.00 H new ATOM 0 HG3 LYS A 104 29.841 -14.377 8.347 1.00 0.00 H new ATOM 0 HD2 LYS A 104 30.872 -14.108 5.494 1.00 0.00 H new ATOM 0 HD3 LYS A 104 31.787 -14.663 6.882 1.00 0.00 H new ATOM 0 HE2 LYS A 104 29.333 -16.096 5.776 1.00 0.00 H new ATOM 0 HE3 LYS A 104 30.983 -16.501 5.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 29.616 -17.598 7.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 31.310 -17.568 7.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 30.499 -16.404 8.192 1.00 0.00 H new ATOM 1523 N LEU A 105 26.071 -11.989 5.611 1.00 0.00 N ATOM 1524 CA LEU A 105 24.659 -11.716 5.360 1.00 0.00 C ATOM 1525 C LEU A 105 24.431 -11.548 3.863 1.00 0.00 C ATOM 1526 O LEU A 105 23.506 -12.149 3.317 1.00 0.00 O ATOM 1527 CB LEU A 105 24.217 -10.436 6.093 1.00 0.00 C ATOM 1528 CG LEU A 105 24.081 -10.603 7.614 1.00 0.00 C ATOM 1529 CD1 LEU A 105 24.071 -9.232 8.289 1.00 0.00 C ATOM 1530 CD2 LEU A 105 22.786 -11.333 7.983 1.00 0.00 C ATOM 0 H LEU A 105 26.526 -11.283 6.189 1.00 0.00 H new ATOM 0 HA LEU A 105 24.070 -12.554 5.732 1.00 0.00 H new ATOM 0 HB2 LEU A 105 24.938 -9.645 5.888 1.00 0.00 H new ATOM 0 HB3 LEU A 105 23.260 -10.109 5.687 1.00 0.00 H new ATOM 0 HG LEU A 105 24.931 -11.193 7.957 1.00 0.00 H new ATOM 0 HD11 LEU A 105 23.974 -9.358 9.367 1.00 0.00 H new ATOM 0 HD12 LEU A 105 25.002 -8.710 8.067 1.00 0.00 H new ATOM 0 HD13 LEU A 105 23.230 -8.648 7.915 1.00 0.00 H new ATOM 0 HD21 LEU A 105 22.721 -11.434 9.066 1.00 0.00 H new ATOM 0 HD22 LEU A 105 21.931 -10.763 7.620 1.00 0.00 H new ATOM 0 HD23 LEU A 105 22.783 -12.322 7.525 1.00 0.00 H new ATOM 1542 N GLU A 106 25.268 -10.748 3.194 1.00 0.00 N ATOM 1543 CA GLU A 106 25.096 -10.512 1.769 1.00 0.00 C ATOM 1544 C GLU A 106 25.439 -11.770 0.965 1.00 0.00 C ATOM 1545 O GLU A 106 24.785 -12.049 -0.043 1.00 0.00 O ATOM 1546 CB GLU A 106 25.901 -9.284 1.294 1.00 0.00 C ATOM 1547 CG GLU A 106 27.412 -9.476 1.115 1.00 0.00 C ATOM 1548 CD GLU A 106 28.077 -8.278 0.420 1.00 0.00 C ATOM 1549 OE1 GLU A 106 28.158 -8.292 -0.831 1.00 0.00 O ATOM 1550 OE2 GLU A 106 28.559 -7.355 1.114 1.00 0.00 O ATOM 0 H GLU A 106 26.059 -10.262 3.615 1.00 0.00 H new ATOM 0 HA GLU A 106 24.045 -10.284 1.590 1.00 0.00 H new ATOM 0 HB2 GLU A 106 25.485 -8.952 0.342 1.00 0.00 H new ATOM 0 HB3 GLU A 106 25.743 -8.477 2.009 1.00 0.00 H new ATOM 0 HG2 GLU A 106 27.874 -9.629 2.090 1.00 0.00 H new ATOM 0 HG3 GLU A 106 27.594 -10.378 0.531 1.00 0.00 H new ATOM 1557 N ALA A 107 26.453 -12.530 1.403 1.00 0.00 N ATOM 1558 CA ALA A 107 27.002 -13.614 0.612 1.00 0.00 C ATOM 1559 C ALA A 107 25.948 -14.671 0.338 1.00 0.00 C ATOM 1560 O ALA A 107 25.843 -15.118 -0.800 1.00 0.00 O ATOM 1561 CB ALA A 107 28.217 -14.254 1.290 1.00 0.00 C ATOM 0 H ALA A 107 26.905 -12.404 2.309 1.00 0.00 H new ATOM 0 HA ALA A 107 27.330 -13.184 -0.335 1.00 0.00 H new ATOM 0 HB1 ALA A 107 28.599 -15.062 0.665 1.00 0.00 H new ATOM 0 HB2 ALA A 107 28.995 -13.503 1.427 1.00 0.00 H new ATOM 0 HB3 ALA A 107 27.923 -14.654 2.261 1.00 0.00 H new ATOM 1567 N GLU A 108 25.156 -15.074 1.335 1.00 0.00 N ATOM 1568 CA GLU A 108 24.213 -16.162 1.109 1.00 0.00 C ATOM 1569 C GLU A 108 23.015 -15.709 0.259 1.00 0.00 C ATOM 1570 O GLU A 108 22.464 -16.538 -0.462 1.00 0.00 O ATOM 1571 CB GLU A 108 23.825 -16.849 2.428 1.00 0.00 C ATOM 1572 CG GLU A 108 23.296 -18.283 2.224 1.00 0.00 C ATOM 1573 CD GLU A 108 24.357 -19.237 1.637 1.00 0.00 C ATOM 1574 OE1 GLU A 108 25.237 -19.708 2.391 1.00 0.00 O ATOM 1575 OE2 GLU A 108 24.312 -19.524 0.416 1.00 0.00 O ATOM 0 H GLU A 108 25.149 -14.677 2.274 1.00 0.00 H new ATOM 0 HA GLU A 108 24.710 -16.929 0.515 1.00 0.00 H new ATOM 0 HB2 GLU A 108 24.693 -16.878 3.086 1.00 0.00 H new ATOM 0 HB3 GLU A 108 23.063 -16.254 2.931 1.00 0.00 H new ATOM 0 HG2 GLU A 108 22.950 -18.677 3.180 1.00 0.00 H new ATOM 0 HG3 GLU A 108 22.432 -18.255 1.559 1.00 0.00 H new ATOM 1582 N LEU A 109 22.640 -14.417 0.242 1.00 0.00 N ATOM 1583 CA LEU A 109 21.647 -13.936 -0.733 1.00 0.00 C ATOM 1584 C LEU A 109 22.247 -14.044 -2.133 1.00 0.00 C ATOM 1585 O LEU A 109 21.617 -14.562 -3.055 1.00 0.00 O ATOM 1586 CB LEU A 109 21.237 -12.462 -0.532 1.00 0.00 C ATOM 1587 CG LEU A 109 20.387 -12.145 0.707 1.00 0.00 C ATOM 1588 CD1 LEU A 109 20.440 -10.639 0.999 1.00 0.00 C ATOM 1589 CD2 LEU A 109 18.925 -12.546 0.475 1.00 0.00 C ATOM 0 H LEU A 109 23.000 -13.703 0.876 1.00 0.00 H new ATOM 0 HA LEU A 109 20.759 -14.554 -0.595 1.00 0.00 H new ATOM 0 HB2 LEU A 109 22.144 -11.860 -0.485 1.00 0.00 H new ATOM 0 HB3 LEU A 109 20.685 -12.139 -1.415 1.00 0.00 H new ATOM 0 HG LEU A 109 20.788 -12.708 1.550 1.00 0.00 H new ATOM 0 HD11 LEU A 109 19.836 -10.417 1.879 1.00 0.00 H new ATOM 0 HD12 LEU A 109 21.472 -10.340 1.183 1.00 0.00 H new ATOM 0 HD13 LEU A 109 20.050 -10.088 0.143 1.00 0.00 H new ATOM 0 HD21 LEU A 109 18.339 -12.314 1.364 1.00 0.00 H new ATOM 0 HD22 LEU A 109 18.527 -11.994 -0.377 1.00 0.00 H new ATOM 0 HD23 LEU A 109 18.869 -13.616 0.273 1.00 0.00 H new ATOM 1601 N LYS A 110 23.478 -13.552 -2.298 1.00 0.00 N ATOM 1602 CA LYS A 110 24.158 -13.492 -3.587 1.00 0.00 C ATOM 1603 C LYS A 110 24.328 -14.904 -4.143 1.00 0.00 C ATOM 1604 O LYS A 110 24.006 -15.182 -5.296 1.00 0.00 O ATOM 1605 CB LYS A 110 25.494 -12.762 -3.369 1.00 0.00 C ATOM 1606 CG LYS A 110 26.181 -12.278 -4.654 1.00 0.00 C ATOM 1607 CD LYS A 110 27.546 -11.617 -4.368 1.00 0.00 C ATOM 1608 CE LYS A 110 27.443 -10.442 -3.378 1.00 0.00 C ATOM 1609 NZ LYS A 110 28.752 -9.815 -3.071 1.00 0.00 N ATOM 0 H LYS A 110 24.034 -13.180 -1.528 1.00 0.00 H new ATOM 0 HA LYS A 110 23.581 -12.941 -4.329 1.00 0.00 H new ATOM 0 HB2 LYS A 110 25.321 -11.903 -2.721 1.00 0.00 H new ATOM 0 HB3 LYS A 110 26.174 -13.429 -2.839 1.00 0.00 H new ATOM 0 HG2 LYS A 110 26.322 -13.122 -5.329 1.00 0.00 H new ATOM 0 HG3 LYS A 110 25.533 -11.565 -5.165 1.00 0.00 H new ATOM 0 HD2 LYS A 110 28.230 -12.365 -3.967 1.00 0.00 H new ATOM 0 HD3 LYS A 110 27.976 -11.261 -5.304 1.00 0.00 H new ATOM 0 HE2 LYS A 110 26.774 -9.686 -3.790 1.00 0.00 H new ATOM 0 HE3 LYS A 110 26.991 -10.796 -2.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 28.631 -9.113 -2.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 29.423 -10.547 -2.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 29.120 -9.345 -3.923 1.00 0.00 H new ATOM 1623 N ASN A 111 24.742 -15.820 -3.269 1.00 0.00 N ATOM 1624 CA ASN A 111 24.943 -17.238 -3.543 1.00 0.00 C ATOM 1625 C ASN A 111 23.620 -18.006 -3.700 1.00 0.00 C ATOM 1626 O ASN A 111 23.649 -19.217 -3.921 1.00 0.00 O ATOM 1627 CB ASN A 111 25.791 -17.829 -2.403 1.00 0.00 C ATOM 1628 CG ASN A 111 26.249 -19.263 -2.654 1.00 0.00 C ATOM 1629 OD1 ASN A 111 26.804 -19.580 -3.702 1.00 0.00 O ATOM 1630 ND2 ASN A 111 26.049 -20.150 -1.691 1.00 0.00 N ATOM 0 H ASN A 111 24.957 -15.578 -2.302 1.00 0.00 H new ATOM 0 HA ASN A 111 25.459 -17.341 -4.497 1.00 0.00 H new ATOM 0 HB2 ASN A 111 26.668 -17.199 -2.251 1.00 0.00 H new ATOM 0 HB3 ASN A 111 25.213 -17.799 -1.480 1.00 0.00 H new ATOM 0 HD21 ASN A 111 26.358 -21.114 -1.814 1.00 0.00 H new ATOM 0 HD22 ASN A 111 25.586 -19.869 -0.827 1.00 0.00 H new ATOM 1637 N SER A 112 22.462 -17.345 -3.585 1.00 0.00 N ATOM 1638 CA SER A 112 21.141 -17.943 -3.787 1.00 0.00 C ATOM 1639 C SER A 112 20.342 -17.210 -4.877 1.00 0.00 C ATOM 1640 O SER A 112 19.160 -17.507 -5.073 1.00 0.00 O ATOM 1641 CB SER A 112 20.384 -18.019 -2.455 1.00 0.00 C ATOM 1642 OG SER A 112 21.195 -18.605 -1.455 1.00 0.00 O ATOM 0 H SER A 112 22.419 -16.355 -3.343 1.00 0.00 H new ATOM 0 HA SER A 112 21.276 -18.962 -4.150 1.00 0.00 H new ATOM 0 HB2 SER A 112 20.081 -17.019 -2.145 1.00 0.00 H new ATOM 0 HB3 SER A 112 19.473 -18.604 -2.581 1.00 0.00 H new ATOM 0 HG SER A 112 21.419 -17.931 -0.779 1.00 0.00 H new ATOM 1648 N GLY A 113 20.966 -16.259 -5.587 1.00 0.00 N ATOM 1649 CA GLY A 113 20.406 -15.657 -6.789 1.00 0.00 C ATOM 1650 C GLY A 113 20.472 -14.132 -6.826 1.00 0.00 C ATOM 1651 O GLY A 113 20.612 -13.574 -7.918 1.00 0.00 O ATOM 0 H GLY A 113 21.882 -15.888 -5.334 1.00 0.00 H new ATOM 0 HA2 GLY A 113 20.934 -16.052 -7.657 1.00 0.00 H new ATOM 0 HA3 GLY A 113 19.365 -15.965 -6.882 1.00 0.00 H new ATOM 1655 N ALA A 114 20.343 -13.456 -5.681 1.00 0.00 N ATOM 1656 CA ALA A 114 20.356 -11.994 -5.625 1.00 0.00 C ATOM 1657 C ALA A 114 21.707 -11.408 -6.063 1.00 0.00 C ATOM 1658 O ALA A 114 22.669 -12.140 -6.307 1.00 0.00 O ATOM 1659 CB ALA A 114 20.026 -11.544 -4.202 1.00 0.00 C ATOM 0 H ALA A 114 20.227 -13.905 -4.772 1.00 0.00 H new ATOM 0 HA ALA A 114 19.605 -11.623 -6.322 1.00 0.00 H new ATOM 0 HB1 ALA A 114 20.034 -10.455 -4.154 1.00 0.00 H new ATOM 0 HB2 ALA A 114 19.039 -11.912 -3.924 1.00 0.00 H new ATOM 0 HB3 ALA A 114 20.770 -11.943 -3.512 1.00 0.00 H new ATOM 1665 N LYS A 115 21.820 -10.075 -6.093 1.00 0.00 N ATOM 1666 CA LYS A 115 23.106 -9.407 -6.282 1.00 0.00 C ATOM 1667 C LYS A 115 23.132 -8.056 -5.570 1.00 0.00 C ATOM 1668 O LYS A 115 22.079 -7.503 -5.230 1.00 0.00 O ATOM 1669 CB LYS A 115 23.414 -9.272 -7.790 1.00 0.00 C ATOM 1670 CG LYS A 115 24.870 -9.663 -8.094 1.00 0.00 C ATOM 1671 CD LYS A 115 25.181 -9.517 -9.589 1.00 0.00 C ATOM 1672 CE LYS A 115 26.635 -9.926 -9.868 1.00 0.00 C ATOM 1673 NZ LYS A 115 26.985 -9.809 -11.306 1.00 0.00 N ATOM 0 H LYS A 115 21.030 -9.438 -5.988 1.00 0.00 H new ATOM 0 HA LYS A 115 23.890 -10.016 -5.832 1.00 0.00 H new ATOM 0 HB2 LYS A 115 22.737 -9.907 -8.361 1.00 0.00 H new ATOM 0 HB3 LYS A 115 23.235 -8.246 -8.111 1.00 0.00 H new ATOM 0 HG2 LYS A 115 25.547 -9.034 -7.516 1.00 0.00 H new ATOM 0 HG3 LYS A 115 25.046 -10.692 -7.782 1.00 0.00 H new ATOM 0 HD2 LYS A 115 24.502 -10.139 -10.172 1.00 0.00 H new ATOM 0 HD3 LYS A 115 25.018 -8.486 -9.903 1.00 0.00 H new ATOM 0 HE2 LYS A 115 27.306 -9.299 -9.280 1.00 0.00 H new ATOM 0 HE3 LYS A 115 26.791 -10.954 -9.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 27.975 -10.095 -11.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 26.363 -10.426 -11.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 26.863 -8.823 -11.614 1.00 0.00 H new ATOM 1687 N GLN A 116 24.352 -7.549 -5.368 1.00 0.00 N ATOM 1688 CA GLN A 116 24.629 -6.219 -4.841 1.00 0.00 C ATOM 1689 C GLN A 116 24.029 -5.150 -5.764 1.00 0.00 C ATOM 1690 O GLN A 116 23.735 -5.401 -6.937 1.00 0.00 O ATOM 1691 CB GLN A 116 26.166 -6.016 -4.715 1.00 0.00 C ATOM 1692 CG GLN A 116 26.717 -5.867 -3.285 1.00 0.00 C ATOM 1693 CD GLN A 116 26.270 -4.574 -2.599 1.00 0.00 C ATOM 1694 OE1 GLN A 116 25.091 -4.254 -2.555 1.00 0.00 O ATOM 1695 NE2 GLN A 116 27.180 -3.778 -2.063 1.00 0.00 N ATOM 0 H GLN A 116 25.200 -8.076 -5.576 1.00 0.00 H new ATOM 0 HA GLN A 116 24.174 -6.123 -3.855 1.00 0.00 H new ATOM 0 HB2 GLN A 116 26.663 -6.863 -5.187 1.00 0.00 H new ATOM 0 HB3 GLN A 116 26.442 -5.127 -5.283 1.00 0.00 H new ATOM 0 HG2 GLN A 116 26.393 -6.719 -2.687 1.00 0.00 H new ATOM 0 HG3 GLN A 116 27.806 -5.896 -3.317 1.00 0.00 H new ATOM 0 HE21 GLN A 116 28.166 -4.037 -2.095 1.00 0.00 H new ATOM 0 HE22 GLN A 116 26.896 -2.905 -1.618 1.00 0.00 H new ATOM 1704 N THR A 117 23.944 -3.927 -5.256 1.00 0.00 N ATOM 1705 CA THR A 117 23.526 -2.729 -5.971 1.00 0.00 C ATOM 1706 C THR A 117 24.350 -1.573 -5.391 1.00 0.00 C ATOM 1707 O THR A 117 24.848 -1.676 -4.266 1.00 0.00 O ATOM 1708 CB THR A 117 22.011 -2.507 -5.774 1.00 0.00 C ATOM 1709 OG1 THR A 117 21.303 -3.730 -5.868 1.00 0.00 O ATOM 1710 CG2 THR A 117 21.395 -1.554 -6.808 1.00 0.00 C ATOM 0 H THR A 117 24.177 -3.735 -4.282 1.00 0.00 H new ATOM 0 HA THR A 117 23.695 -2.810 -7.045 1.00 0.00 H new ATOM 0 HB THR A 117 21.919 -2.065 -4.782 1.00 0.00 H new ATOM 0 HG1 THR A 117 21.356 -4.205 -5.013 1.00 0.00 H new ATOM 0 HG21 THR A 117 20.329 -1.443 -6.611 1.00 0.00 H new ATOM 0 HG22 THR A 117 21.880 -0.580 -6.740 1.00 0.00 H new ATOM 0 HG23 THR A 117 21.538 -1.961 -7.809 1.00 0.00 H new ATOM 1718 N GLY A 118 24.471 -0.463 -6.126 1.00 0.00 N ATOM 1719 CA GLY A 118 25.348 0.642 -5.758 1.00 0.00 C ATOM 1720 C GLY A 118 26.764 0.101 -5.557 1.00 0.00 C ATOM 1721 O GLY A 118 27.301 -0.569 -6.442 1.00 0.00 O ATOM 0 H GLY A 118 23.960 -0.310 -6.995 1.00 0.00 H new ATOM 0 HA2 GLY A 118 25.342 1.404 -6.537 1.00 0.00 H new ATOM 0 HA3 GLY A 118 24.992 1.118 -4.844 1.00 0.00 H new ATOM 1725 N GLU A 119 27.338 0.354 -4.383 1.00 0.00 N ATOM 1726 CA GLU A 119 28.579 -0.242 -3.907 1.00 0.00 C ATOM 1727 C GLU A 119 28.378 -0.557 -2.421 1.00 0.00 C ATOM 1728 O GLU A 119 27.452 -0.040 -1.791 1.00 0.00 O ATOM 1729 CB GLU A 119 29.765 0.721 -4.108 1.00 0.00 C ATOM 1730 CG GLU A 119 30.141 0.921 -5.583 1.00 0.00 C ATOM 1731 CD GLU A 119 31.415 1.773 -5.731 1.00 0.00 C ATOM 1732 OE1 GLU A 119 32.535 1.215 -5.691 1.00 0.00 O ATOM 1733 OE2 GLU A 119 31.313 3.007 -5.919 1.00 0.00 O ATOM 0 H GLU A 119 26.933 1.007 -3.712 1.00 0.00 H new ATOM 0 HA GLU A 119 28.812 -1.147 -4.467 1.00 0.00 H new ATOM 0 HB2 GLU A 119 29.518 1.688 -3.669 1.00 0.00 H new ATOM 0 HB3 GLU A 119 30.631 0.338 -3.568 1.00 0.00 H new ATOM 0 HG2 GLU A 119 30.294 -0.049 -6.055 1.00 0.00 H new ATOM 0 HG3 GLU A 119 29.316 1.404 -6.107 1.00 0.00 H new ATOM 1740 N THR A 120 29.230 -1.400 -1.842 1.00 0.00 N ATOM 1741 CA THR A 120 29.236 -1.654 -0.404 1.00 0.00 C ATOM 1742 C THR A 120 29.656 -0.370 0.325 1.00 0.00 C ATOM 1743 O THR A 120 30.445 0.416 -0.212 1.00 0.00 O ATOM 1744 CB THR A 120 30.188 -2.828 -0.118 1.00 0.00 C ATOM 1745 OG1 THR A 120 29.914 -3.883 -1.032 1.00 0.00 O ATOM 1746 CG2 THR A 120 30.061 -3.357 1.314 1.00 0.00 C ATOM 0 H THR A 120 29.936 -1.926 -2.357 1.00 0.00 H new ATOM 0 HA THR A 120 28.245 -1.930 -0.043 1.00 0.00 H new ATOM 0 HB THR A 120 31.207 -2.459 -0.239 1.00 0.00 H new ATOM 0 HG1 THR A 120 30.519 -4.634 -0.856 1.00 0.00 H new ATOM 0 HG21 THR A 120 30.756 -4.184 1.459 1.00 0.00 H new ATOM 0 HG22 THR A 120 30.295 -2.559 2.019 1.00 0.00 H new ATOM 0 HG23 THR A 120 29.042 -3.705 1.484 1.00 0.00 H new ATOM 1754 N LEU A 121 29.163 -0.161 1.549 1.00 0.00 N ATOM 1755 CA LEU A 121 29.471 1.004 2.376 1.00 0.00 C ATOM 1756 C LEU A 121 29.899 0.536 3.767 1.00 0.00 C ATOM 1757 O LEU A 121 29.447 -0.499 4.259 1.00 0.00 O ATOM 1758 CB LEU A 121 28.243 1.934 2.437 1.00 0.00 C ATOM 1759 CG LEU A 121 28.419 3.235 3.255 1.00 0.00 C ATOM 1760 CD1 LEU A 121 29.556 4.130 2.747 1.00 0.00 C ATOM 1761 CD2 LEU A 121 27.120 4.046 3.222 1.00 0.00 C ATOM 0 H LEU A 121 28.523 -0.814 2.001 1.00 0.00 H new ATOM 0 HA LEU A 121 30.295 1.570 1.942 1.00 0.00 H new ATOM 0 HB2 LEU A 121 27.965 2.204 1.418 1.00 0.00 H new ATOM 0 HB3 LEU A 121 27.408 1.374 2.858 1.00 0.00 H new ATOM 0 HG LEU A 121 28.672 2.922 4.268 1.00 0.00 H new ATOM 0 HD11 LEU A 121 29.621 5.024 3.368 1.00 0.00 H new ATOM 0 HD12 LEU A 121 30.498 3.584 2.797 1.00 0.00 H new ATOM 0 HD13 LEU A 121 29.358 4.419 1.715 1.00 0.00 H new ATOM 0 HD21 LEU A 121 27.248 4.962 3.799 1.00 0.00 H new ATOM 0 HD22 LEU A 121 26.875 4.299 2.190 1.00 0.00 H new ATOM 0 HD23 LEU A 121 26.311 3.456 3.653 1.00 0.00 H new ATOM 1773 N LYS A 122 30.751 1.330 4.409 1.00 0.00 N ATOM 1774 CA LYS A 122 31.245 1.140 5.763 1.00 0.00 C ATOM 1775 C LYS A 122 31.141 2.499 6.444 1.00 0.00 C ATOM 1776 O LYS A 122 31.354 3.520 5.786 1.00 0.00 O ATOM 1777 CB LYS A 122 32.684 0.581 5.765 1.00 0.00 C ATOM 1778 CG LYS A 122 33.700 1.221 4.798 1.00 0.00 C ATOM 1779 CD LYS A 122 33.764 0.489 3.441 1.00 0.00 C ATOM 1780 CE LYS A 122 34.669 1.203 2.424 1.00 0.00 C ATOM 1781 NZ LYS A 122 36.107 1.178 2.798 1.00 0.00 N ATOM 0 H LYS A 122 31.134 2.168 3.972 1.00 0.00 H new ATOM 0 HA LYS A 122 30.657 0.399 6.305 1.00 0.00 H new ATOM 0 HB2 LYS A 122 33.079 0.674 6.777 1.00 0.00 H new ATOM 0 HB3 LYS A 122 32.631 -0.484 5.540 1.00 0.00 H new ATOM 0 HG2 LYS A 122 33.432 2.264 4.632 1.00 0.00 H new ATOM 0 HG3 LYS A 122 34.688 1.215 5.258 1.00 0.00 H new ATOM 0 HD2 LYS A 122 34.130 -0.526 3.597 1.00 0.00 H new ATOM 0 HD3 LYS A 122 32.758 0.405 3.030 1.00 0.00 H new ATOM 0 HE2 LYS A 122 34.546 0.735 1.447 1.00 0.00 H new ATOM 0 HE3 LYS A 122 34.345 2.239 2.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 36.663 1.675 2.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 36.235 1.649 3.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 36.431 0.192 2.867 1.00 0.00 H new ATOM 1795 N ILE A 123 30.784 2.530 7.726 1.00 0.00 N ATOM 1796 CA ILE A 123 30.473 3.761 8.446 1.00 0.00 C ATOM 1797 C ILE A 123 31.196 3.661 9.785 1.00 0.00 C ATOM 1798 O ILE A 123 30.851 2.838 10.637 1.00 0.00 O ATOM 1799 CB ILE A 123 28.942 3.975 8.578 1.00 0.00 C ATOM 1800 CG1 ILE A 123 28.225 3.868 7.209 1.00 0.00 C ATOM 1801 CG2 ILE A 123 28.646 5.339 9.232 1.00 0.00 C ATOM 1802 CD1 ILE A 123 26.711 4.095 7.258 1.00 0.00 C ATOM 0 H ILE A 123 30.702 1.691 8.300 1.00 0.00 H new ATOM 0 HA ILE A 123 30.816 4.644 7.908 1.00 0.00 H new ATOM 0 HB ILE A 123 28.553 3.181 9.216 1.00 0.00 H new ATOM 0 HG12 ILE A 123 28.665 4.595 6.526 1.00 0.00 H new ATOM 0 HG13 ILE A 123 28.417 2.880 6.790 1.00 0.00 H new ATOM 0 HG21 ILE A 123 27.568 5.475 9.318 1.00 0.00 H new ATOM 0 HG22 ILE A 123 29.096 5.372 10.224 1.00 0.00 H new ATOM 0 HG23 ILE A 123 29.064 6.136 8.617 1.00 0.00 H new ATOM 0 HD11 ILE A 123 26.296 4.001 6.254 1.00 0.00 H new ATOM 0 HD12 ILE A 123 26.253 3.353 7.911 1.00 0.00 H new ATOM 0 HD13 ILE A 123 26.505 5.094 7.643 1.00 0.00 H new ATOM 1814 N ASN A 124 32.242 4.472 9.933 1.00 0.00 N ATOM 1815 CA ASN A 124 33.040 4.554 11.150 1.00 0.00 C ATOM 1816 C ASN A 124 32.222 5.166 12.290 1.00 0.00 C ATOM 1817 O ASN A 124 31.631 6.231 12.111 1.00 0.00 O ATOM 1818 CB ASN A 124 34.296 5.399 10.892 1.00 0.00 C ATOM 1819 CG ASN A 124 35.111 5.563 12.165 1.00 0.00 C ATOM 1820 OD1 ASN A 124 35.244 4.628 12.948 1.00 0.00 O ATOM 1821 ND2 ASN A 124 35.643 6.743 12.427 1.00 0.00 N ATOM 0 H ASN A 124 32.562 5.101 9.196 1.00 0.00 H new ATOM 0 HA ASN A 124 33.337 3.547 11.441 1.00 0.00 H new ATOM 0 HB2 ASN A 124 34.906 4.925 10.123 1.00 0.00 H new ATOM 0 HB3 ASN A 124 34.008 6.379 10.511 1.00 0.00 H new ATOM 0 HD21 ASN A 124 36.171 6.884 13.288 1.00 0.00 H new ATOM 0 HD22 ASN A 124 35.526 7.513 11.768 1.00 0.00 H new ATOM 1828 N ILE A 125 32.266 4.545 13.472 1.00 0.00 N ATOM 1829 CA ILE A 125 31.661 5.032 14.711 1.00 0.00 C ATOM 1830 C ILE A 125 32.700 5.116 15.853 1.00 0.00 C ATOM 1831 O ILE A 125 32.327 5.229 17.023 1.00 0.00 O ATOM 1832 CB ILE A 125 30.427 4.169 15.067 1.00 0.00 C ATOM 1833 CG1 ILE A 125 30.778 2.673 15.201 1.00 0.00 C ATOM 1834 CG2 ILE A 125 29.303 4.390 14.041 1.00 0.00 C ATOM 1835 CD1 ILE A 125 29.791 1.871 16.051 1.00 0.00 C ATOM 0 H ILE A 125 32.744 3.653 13.595 1.00 0.00 H new ATOM 0 HA ILE A 125 31.309 6.053 14.563 1.00 0.00 H new ATOM 0 HB ILE A 125 30.072 4.493 16.045 1.00 0.00 H new ATOM 0 HG12 ILE A 125 30.825 2.232 14.205 1.00 0.00 H new ATOM 0 HG13 ILE A 125 31.773 2.582 15.637 1.00 0.00 H new ATOM 0 HG21 ILE A 125 28.443 3.776 14.306 1.00 0.00 H new ATOM 0 HG22 ILE A 125 29.012 5.441 14.040 1.00 0.00 H new ATOM 0 HG23 ILE A 125 29.656 4.111 13.048 1.00 0.00 H new ATOM 0 HD11 ILE A 125 30.111 0.830 16.094 1.00 0.00 H new ATOM 0 HD12 ILE A 125 29.760 2.284 17.059 1.00 0.00 H new ATOM 0 HD13 ILE A 125 28.798 1.927 15.606 1.00 0.00 H new ATOM 1847 N LEU A 126 34.004 5.084 15.531 1.00 0.00 N ATOM 1848 CA LEU A 126 35.089 5.346 16.488 1.00 0.00 C ATOM 1849 C LEU A 126 34.985 6.770 17.057 1.00 0.00 C ATOM 1850 O LEU A 126 35.453 7.031 18.165 1.00 0.00 O ATOM 1851 CB LEU A 126 36.452 5.135 15.797 1.00 0.00 C ATOM 1852 CG LEU A 126 37.698 5.308 16.693 1.00 0.00 C ATOM 1853 CD1 LEU A 126 37.736 4.318 17.864 1.00 0.00 C ATOM 1854 CD2 LEU A 126 38.960 5.117 15.841 1.00 0.00 C ATOM 0 H LEU A 126 34.336 4.873 14.590 1.00 0.00 H new ATOM 0 HA LEU A 126 35.000 4.648 17.320 1.00 0.00 H new ATOM 0 HB2 LEU A 126 36.470 4.131 15.373 1.00 0.00 H new ATOM 0 HB3 LEU A 126 36.527 5.835 14.965 1.00 0.00 H new ATOM 0 HG LEU A 126 37.652 6.311 17.116 1.00 0.00 H new ATOM 0 HD11 LEU A 126 38.635 4.490 18.456 1.00 0.00 H new ATOM 0 HD12 LEU A 126 36.856 4.461 18.490 1.00 0.00 H new ATOM 0 HD13 LEU A 126 37.745 3.299 17.478 1.00 0.00 H new ATOM 0 HD21 LEU A 126 39.844 5.238 16.468 1.00 0.00 H new ATOM 0 HD22 LEU A 126 38.958 4.118 15.406 1.00 0.00 H new ATOM 0 HD23 LEU A 126 38.976 5.860 15.043 1.00 0.00 H new ATOM 1981 N ALA A 135 26.515 8.456 3.083 1.00 0.00 N ATOM 1982 CA ALA A 135 25.254 7.740 2.983 1.00 0.00 C ATOM 1983 C ALA A 135 24.432 8.297 1.817 1.00 0.00 C ATOM 1984 O ALA A 135 23.949 7.516 1.001 1.00 0.00 O ATOM 1985 CB ALA A 135 24.497 7.829 4.314 1.00 0.00 C ATOM 0 HA ALA A 135 25.442 6.685 2.781 1.00 0.00 H new ATOM 0 HB1 ALA A 135 23.553 7.290 4.232 1.00 0.00 H new ATOM 0 HB2 ALA A 135 25.100 7.386 5.106 1.00 0.00 H new ATOM 0 HB3 ALA A 135 24.299 8.874 4.551 1.00 0.00 H new ATOM 1991 N GLU A 136 24.311 9.624 1.695 1.00 0.00 N ATOM 1992 CA GLU A 136 23.612 10.245 0.574 1.00 0.00 C ATOM 1993 C GLU A 136 24.327 9.950 -0.751 1.00 0.00 C ATOM 1994 O GLU A 136 23.662 9.659 -1.745 1.00 0.00 O ATOM 1995 CB GLU A 136 23.476 11.757 0.810 1.00 0.00 C ATOM 1996 CG GLU A 136 22.683 12.457 -0.304 1.00 0.00 C ATOM 1997 CD GLU A 136 22.536 13.962 -0.038 1.00 0.00 C ATOM 1998 OE1 GLU A 136 21.623 14.353 0.722 1.00 0.00 O ATOM 1999 OE2 GLU A 136 23.314 14.767 -0.601 1.00 0.00 O ATOM 0 H GLU A 136 24.693 10.289 2.367 1.00 0.00 H new ATOM 0 HA GLU A 136 22.612 9.817 0.506 1.00 0.00 H new ATOM 0 HB2 GLU A 136 22.982 11.929 1.766 1.00 0.00 H new ATOM 0 HB3 GLU A 136 24.469 12.201 0.879 1.00 0.00 H new ATOM 0 HG2 GLU A 136 23.185 12.304 -1.259 1.00 0.00 H new ATOM 0 HG3 GLU A 136 21.695 12.004 -0.387 1.00 0.00 H new ATOM 2006 N GLU A 137 25.663 10.000 -0.784 1.00 0.00 N ATOM 2007 CA GLU A 137 26.410 9.773 -2.021 1.00 0.00 C ATOM 2008 C GLU A 137 26.176 8.349 -2.540 1.00 0.00 C ATOM 2009 O GLU A 137 25.871 8.164 -3.720 1.00 0.00 O ATOM 2010 CB GLU A 137 27.910 10.045 -1.823 1.00 0.00 C ATOM 2011 CG GLU A 137 28.211 11.536 -1.622 1.00 0.00 C ATOM 2012 CD GLU A 137 29.726 11.807 -1.614 1.00 0.00 C ATOM 2013 OE1 GLU A 137 30.366 11.715 -0.542 1.00 0.00 O ATOM 2014 OE2 GLU A 137 30.292 12.136 -2.682 1.00 0.00 O ATOM 0 H GLU A 137 26.246 10.195 0.030 1.00 0.00 H new ATOM 0 HA GLU A 137 26.042 10.475 -2.769 1.00 0.00 H new ATOM 0 HB2 GLU A 137 28.267 9.485 -0.959 1.00 0.00 H new ATOM 0 HB3 GLU A 137 28.461 9.679 -2.690 1.00 0.00 H new ATOM 0 HG2 GLU A 137 27.741 12.114 -2.417 1.00 0.00 H new ATOM 0 HG3 GLU A 137 27.775 11.873 -0.682 1.00 0.00 H new ATOM 2021 N TRP A 138 26.258 7.346 -1.659 1.00 0.00 N ATOM 2022 CA TRP A 138 25.969 5.962 -2.013 1.00 0.00 C ATOM 2023 C TRP A 138 24.491 5.782 -2.363 1.00 0.00 C ATOM 2024 O TRP A 138 24.172 5.015 -3.273 1.00 0.00 O ATOM 2025 CB TRP A 138 26.366 5.024 -0.868 1.00 0.00 C ATOM 2026 CG TRP A 138 27.733 4.420 -0.967 1.00 0.00 C ATOM 2027 CD1 TRP A 138 27.964 3.096 -1.091 1.00 0.00 C ATOM 2028 CD2 TRP A 138 29.058 5.047 -0.945 1.00 0.00 C ATOM 2029 NE1 TRP A 138 29.317 2.853 -1.112 1.00 0.00 N ATOM 2030 CE2 TRP A 138 30.045 4.017 -1.027 1.00 0.00 C ATOM 2031 CE3 TRP A 138 29.537 6.371 -0.843 1.00 0.00 C ATOM 2032 CZ2 TRP A 138 31.422 4.285 -0.996 1.00 0.00 C ATOM 2033 CZ3 TRP A 138 30.916 6.655 -0.815 1.00 0.00 C ATOM 2034 CH2 TRP A 138 31.859 5.615 -0.890 1.00 0.00 C ATOM 0 H TRP A 138 26.527 7.476 -0.684 1.00 0.00 H new ATOM 0 HA TRP A 138 26.558 5.708 -2.894 1.00 0.00 H new ATOM 0 HB2 TRP A 138 26.300 5.577 0.069 1.00 0.00 H new ATOM 0 HB3 TRP A 138 25.635 4.217 -0.814 1.00 0.00 H new ATOM 0 HD1 TRP A 138 27.198 2.338 -1.163 1.00 0.00 H new ATOM 0 HE1 TRP A 138 29.730 1.923 -1.182 1.00 0.00 H new ATOM 0 HE3 TRP A 138 28.830 7.185 -0.785 1.00 0.00 H new ATOM 0 HZ2 TRP A 138 32.137 3.478 -1.053 1.00 0.00 H new ATOM 0 HZ3 TRP A 138 31.251 7.679 -0.735 1.00 0.00 H new ATOM 0 HH2 TRP A 138 32.915 5.838 -0.866 1.00 0.00 H new ATOM 2045 N LEU A 139 23.583 6.491 -1.686 1.00 0.00 N ATOM 2046 CA LEU A 139 22.163 6.423 -1.996 1.00 0.00 C ATOM 2047 C LEU A 139 21.882 6.928 -3.405 1.00 0.00 C ATOM 2048 O LEU A 139 21.047 6.340 -4.087 1.00 0.00 O ATOM 2049 CB LEU A 139 21.342 7.177 -0.945 1.00 0.00 C ATOM 2050 CG LEU A 139 19.829 6.944 -1.080 1.00 0.00 C ATOM 2051 CD1 LEU A 139 19.457 5.474 -0.844 1.00 0.00 C ATOM 2052 CD2 LEU A 139 19.116 7.827 -0.057 1.00 0.00 C ATOM 0 H LEU A 139 23.814 7.120 -0.917 1.00 0.00 H new ATOM 0 HA LEU A 139 21.856 5.378 -1.965 1.00 0.00 H new ATOM 0 HB2 LEU A 139 21.664 6.867 0.049 1.00 0.00 H new ATOM 0 HB3 LEU A 139 21.548 8.244 -1.029 1.00 0.00 H new ATOM 0 HG LEU A 139 19.522 7.198 -2.095 1.00 0.00 H new ATOM 0 HD11 LEU A 139 18.379 5.350 -0.948 1.00 0.00 H new ATOM 0 HD12 LEU A 139 19.967 4.848 -1.576 1.00 0.00 H new ATOM 0 HD13 LEU A 139 19.761 5.179 0.160 1.00 0.00 H new ATOM 0 HD21 LEU A 139 18.039 7.678 -0.135 1.00 0.00 H new ATOM 0 HD22 LEU A 139 19.447 7.561 0.947 1.00 0.00 H new ATOM 0 HD23 LEU A 139 19.352 8.873 -0.252 1.00 0.00 H new ATOM 2064 N GLY A 140 22.607 7.952 -3.866 1.00 0.00 N ATOM 2065 CA GLY A 140 22.573 8.403 -5.249 1.00 0.00 C ATOM 2066 C GLY A 140 22.853 7.245 -6.209 1.00 0.00 C ATOM 2067 O GLY A 140 22.098 7.033 -7.159 1.00 0.00 O ATOM 0 H GLY A 140 23.240 8.494 -3.277 1.00 0.00 H new ATOM 0 HA2 GLY A 140 21.598 8.836 -5.470 1.00 0.00 H new ATOM 0 HA3 GLY A 140 23.312 9.190 -5.397 1.00 0.00 H new ATOM 2071 N SER A 141 23.891 6.453 -5.931 1.00 0.00 N ATOM 2072 CA SER A 141 24.227 5.281 -6.727 1.00 0.00 C ATOM 2073 C SER A 141 23.115 4.232 -6.648 1.00 0.00 C ATOM 2074 O SER A 141 22.739 3.675 -7.680 1.00 0.00 O ATOM 2075 CB SER A 141 25.571 4.697 -6.270 1.00 0.00 C ATOM 2076 OG SER A 141 26.560 5.712 -6.183 1.00 0.00 O ATOM 0 H SER A 141 24.521 6.611 -5.144 1.00 0.00 H new ATOM 0 HA SER A 141 24.322 5.584 -7.770 1.00 0.00 H new ATOM 0 HB2 SER A 141 25.452 4.215 -5.299 1.00 0.00 H new ATOM 0 HB3 SER A 141 25.895 3.927 -6.970 1.00 0.00 H new ATOM 0 HG SER A 141 27.408 5.318 -5.889 1.00 0.00 H new ATOM 2082 N TRP A 142 22.550 3.976 -5.460 1.00 0.00 N ATOM 2083 CA TRP A 142 21.467 3.012 -5.317 1.00 0.00 C ATOM 2084 C TRP A 142 20.262 3.421 -6.157 1.00 0.00 C ATOM 2085 O TRP A 142 19.821 2.610 -6.972 1.00 0.00 O ATOM 2086 CB TRP A 142 21.087 2.777 -3.840 1.00 0.00 C ATOM 2087 CG TRP A 142 21.991 1.834 -3.100 1.00 0.00 C ATOM 2088 CD1 TRP A 142 22.350 0.619 -3.560 1.00 0.00 C ATOM 2089 CD2 TRP A 142 22.682 1.979 -1.816 1.00 0.00 C ATOM 2090 NE1 TRP A 142 23.280 0.048 -2.723 1.00 0.00 N ATOM 2091 CE2 TRP A 142 23.569 0.869 -1.655 1.00 0.00 C ATOM 2092 CE3 TRP A 142 22.670 2.929 -0.772 1.00 0.00 C ATOM 2093 CZ2 TRP A 142 24.479 0.780 -0.592 1.00 0.00 C ATOM 2094 CZ3 TRP A 142 23.573 2.851 0.304 1.00 0.00 C ATOM 2095 CH2 TRP A 142 24.502 1.800 0.374 1.00 0.00 C ATOM 0 H TRP A 142 22.830 4.426 -4.589 1.00 0.00 H new ATOM 0 HA TRP A 142 21.828 2.056 -5.696 1.00 0.00 H new ATOM 0 HB2 TRP A 142 21.084 3.737 -3.323 1.00 0.00 H new ATOM 0 HB3 TRP A 142 20.069 2.390 -3.798 1.00 0.00 H new ATOM 0 HD1 TRP A 142 21.963 0.160 -4.457 1.00 0.00 H new ATOM 0 HE1 TRP A 142 23.703 -0.868 -2.874 1.00 0.00 H new ATOM 0 HE3 TRP A 142 21.951 3.734 -0.800 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 25.153 -0.061 -0.517 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 23.552 3.602 1.079 1.00 0.00 H new ATOM 0 HH2 TRP A 142 25.233 1.776 1.169 1.00 0.00 H new ATOM 2106 N VAL A 143 19.746 4.649 -6.031 1.00 0.00 N ATOM 2107 CA VAL A 143 18.567 5.039 -6.784 1.00 0.00 C ATOM 2108 C VAL A 143 18.859 5.059 -8.286 1.00 0.00 C ATOM 2109 O VAL A 143 17.993 4.680 -9.073 1.00 0.00 O ATOM 2110 CB VAL A 143 17.962 6.351 -6.257 1.00 0.00 C ATOM 2111 CG1 VAL A 143 17.542 6.213 -4.784 1.00 0.00 C ATOM 2112 CG2 VAL A 143 18.840 7.596 -6.432 1.00 0.00 C ATOM 0 H VAL A 143 20.125 5.374 -5.422 1.00 0.00 H new ATOM 0 HA VAL A 143 17.797 4.283 -6.632 1.00 0.00 H new ATOM 0 HB VAL A 143 17.089 6.516 -6.888 1.00 0.00 H new ATOM 0 HG11 VAL A 143 17.118 7.155 -4.437 1.00 0.00 H new ATOM 0 HG12 VAL A 143 16.797 5.423 -4.691 1.00 0.00 H new ATOM 0 HG13 VAL A 143 18.414 5.963 -4.179 1.00 0.00 H new ATOM 0 HG21 VAL A 143 18.322 8.466 -6.028 1.00 0.00 H new ATOM 0 HG22 VAL A 143 19.781 7.455 -5.901 1.00 0.00 H new ATOM 0 HG23 VAL A 143 19.042 7.753 -7.492 1.00 0.00 H new ATOM 2122 N ASN A 144 20.082 5.423 -8.696 1.00 0.00 N ATOM 2123 CA ASN A 144 20.468 5.416 -10.102 1.00 0.00 C ATOM 2124 C ASN A 144 20.458 4.001 -10.683 1.00 0.00 C ATOM 2125 O ASN A 144 20.018 3.821 -11.819 1.00 0.00 O ATOM 2126 CB ASN A 144 21.855 6.048 -10.280 1.00 0.00 C ATOM 2127 CG ASN A 144 22.275 6.041 -11.747 1.00 0.00 C ATOM 2128 OD1 ASN A 144 23.067 5.208 -12.174 1.00 0.00 O ATOM 2129 ND2 ASN A 144 21.754 6.956 -12.547 1.00 0.00 N ATOM 0 H ASN A 144 20.822 5.727 -8.063 1.00 0.00 H new ATOM 0 HA ASN A 144 19.732 6.007 -10.647 1.00 0.00 H new ATOM 0 HB2 ASN A 144 21.843 7.072 -9.906 1.00 0.00 H new ATOM 0 HB3 ASN A 144 22.587 5.501 -9.686 1.00 0.00 H new ATOM 0 HD21 ASN A 144 22.010 6.975 -13.534 1.00 0.00 H new ATOM 0 HD22 ASN A 144 21.096 7.642 -12.177 1.00 0.00 H new ATOM 2136 N LEU A 145 20.928 2.997 -9.934 1.00 0.00 N ATOM 2137 CA LEU A 145 21.037 1.634 -10.453 1.00 0.00 C ATOM 2138 C LEU A 145 19.730 0.854 -10.301 1.00 0.00 C ATOM 2139 O LEU A 145 19.406 0.069 -11.193 1.00 0.00 O ATOM 2140 CB LEU A 145 22.213 0.876 -9.805 1.00 0.00 C ATOM 2141 CG LEU A 145 23.615 1.434 -10.144 1.00 0.00 C ATOM 2142 CD1 LEU A 145 24.698 0.475 -9.638 1.00 0.00 C ATOM 2143 CD2 LEU A 145 23.847 1.651 -11.646 1.00 0.00 C ATOM 0 H LEU A 145 21.238 3.105 -8.968 1.00 0.00 H new ATOM 0 HA LEU A 145 21.240 1.719 -11.521 1.00 0.00 H new ATOM 0 HB2 LEU A 145 22.084 0.892 -8.723 1.00 0.00 H new ATOM 0 HB3 LEU A 145 22.169 -0.168 -10.116 1.00 0.00 H new ATOM 0 HG LEU A 145 23.671 2.405 -9.651 1.00 0.00 H new ATOM 0 HD11 LEU A 145 25.682 0.876 -9.881 1.00 0.00 H new ATOM 0 HD12 LEU A 145 24.609 0.363 -8.557 1.00 0.00 H new ATOM 0 HD13 LEU A 145 24.575 -0.497 -10.115 1.00 0.00 H new ATOM 0 HD21 LEU A 145 24.851 2.044 -11.806 1.00 0.00 H new ATOM 0 HD22 LEU A 145 23.740 0.702 -12.171 1.00 0.00 H new ATOM 0 HD23 LEU A 145 23.114 2.362 -12.028 1.00 0.00 H new ATOM 2155 N LEU A 146 18.963 1.059 -9.222 1.00 0.00 N ATOM 2156 CA LEU A 146 17.670 0.383 -9.054 1.00 0.00 C ATOM 2157 C LEU A 146 16.580 1.019 -9.929 1.00 0.00 C ATOM 2158 O LEU A 146 15.685 0.294 -10.363 1.00 0.00 O ATOM 2159 CB LEU A 146 17.274 0.271 -7.566 1.00 0.00 C ATOM 2160 CG LEU A 146 16.718 1.551 -6.904 1.00 0.00 C ATOM 2161 CD1 LEU A 146 15.188 1.640 -6.979 1.00 0.00 C ATOM 2162 CD2 LEU A 146 17.103 1.626 -5.419 1.00 0.00 C ATOM 0 H LEU A 146 19.214 1.684 -8.456 1.00 0.00 H new ATOM 0 HA LEU A 146 17.780 -0.641 -9.411 1.00 0.00 H new ATOM 0 HB2 LEU A 146 16.526 -0.516 -7.470 1.00 0.00 H new ATOM 0 HB3 LEU A 146 18.150 -0.052 -7.003 1.00 0.00 H new ATOM 0 HG LEU A 146 17.160 2.376 -7.463 1.00 0.00 H new ATOM 0 HD11 LEU A 146 14.853 2.559 -6.498 1.00 0.00 H new ATOM 0 HD12 LEU A 146 14.874 1.641 -8.023 1.00 0.00 H new ATOM 0 HD13 LEU A 146 14.748 0.783 -6.469 1.00 0.00 H new ATOM 0 HD21 LEU A 146 16.696 2.539 -4.983 1.00 0.00 H new ATOM 0 HD22 LEU A 146 16.698 0.761 -4.894 1.00 0.00 H new ATOM 0 HD23 LEU A 146 18.189 1.632 -5.324 1.00 0.00 H new ATOM 2174 N LYS A 147 16.696 2.328 -10.211 1.00 0.00 N ATOM 2175 CA LYS A 147 15.815 3.176 -11.023 1.00 0.00 C ATOM 2176 C LYS A 147 14.368 2.668 -11.099 1.00 0.00 C ATOM 2177 O LYS A 147 13.641 2.853 -10.101 1.00 0.00 O ATOM 2178 CB LYS A 147 16.453 3.491 -12.394 1.00 0.00 C ATOM 2179 CG LYS A 147 17.019 2.276 -13.159 1.00 0.00 C ATOM 2180 CD LYS A 147 17.233 2.555 -14.658 1.00 0.00 C ATOM 2181 CE LYS A 147 18.146 3.749 -14.983 1.00 0.00 C ATOM 2182 NZ LYS A 147 19.556 3.536 -14.571 1.00 0.00 N ATOM 2183 OXT LYS A 147 13.922 2.152 -12.147 1.00 0.00 O ATOM 0 H LYS A 147 17.481 2.865 -9.842 1.00 0.00 H new ATOM 0 HA LYS A 147 15.719 4.129 -10.504 1.00 0.00 H new ATOM 0 HB2 LYS A 147 15.704 3.976 -13.021 1.00 0.00 H new ATOM 0 HB3 LYS A 147 17.258 4.211 -12.244 1.00 0.00 H new ATOM 0 HG2 LYS A 147 17.968 1.981 -12.711 1.00 0.00 H new ATOM 0 HG3 LYS A 147 16.338 1.433 -13.046 1.00 0.00 H new ATOM 0 HD2 LYS A 147 17.653 1.662 -15.120 1.00 0.00 H new ATOM 0 HD3 LYS A 147 16.261 2.726 -15.121 1.00 0.00 H new ATOM 0 HE2 LYS A 147 18.113 3.942 -16.055 1.00 0.00 H new ATOM 0 HE3 LYS A 147 17.760 4.639 -14.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 20.142 4.320 -14.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 19.612 3.498 -13.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 19.903 2.640 -14.970 1.00 0.00 H new