USER MOD reduce.3.24.130724 H: found=0, std=0, add=921, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 0 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 110 THR OG1 : rot 178:sc= 1.09 USER MOD Set 1.2: A 139 TYR OH : rot 177:sc= 1.11 USER MOD Set 2.1: A 138 HIS : no HE2:sc= 0.305 K(o=-0.23,f=-2) USER MOD Set 2.2: A 141 GLN : amide:sc= -0.536 K(o=-0.23,f=-7.3!) USER MOD Set 3.1: A 126 LYS NZ :NH3+ -121:sc= -0.186 (180deg=0) USER MOD Set 3.2: A 128 ASN : amide:sc= 0.326 X(o=0.14,f=-0.31) USER MOD Set 4.1: A 113 SER OG : rot -153:sc= 0.671 USER MOD Set 4.2: A 116 HIS : no HD1:sc= -3.78 K(o=-4.4,f=-3.4) USER MOD Set 4.3: A 119 LYS NZ :NH3+ -171:sc= -1.3! (180deg=0) USER MOD Set 5.1: A 109 ASN : amide:sc= -1.23! C(o=-1.7!,f=-6.2!) USER MOD Set 5.2: A 111 TYR OH : rot -15:sc= -0.427 USER MOD Set 6.1: A 90 SER OG : rot -93:sc= 0.934 USER MOD Set 6.2: A 97 CYS SG : rot 179:sc=-0.00465 USER MOD Set 7.1: A 77 GLN : amide:sc= 0.0302 K(o=0.23,f=-4.2!) USER MOD Set 7.2: A 91 GLN : amide:sc= 0.205 K(o=0.23,f=-2.9!) USER MOD Set 8.1: A 72 SER OG : rot -100:sc= 1.06 USER MOD Set 8.2: A 75 THR OG1 : rot 155:sc= -0.829 USER MOD Set 9.1: A 61 SER OG : rot -160:sc= 0 USER MOD Set 9.2: A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 CYS SG : rot 30:sc= -1.92! USER MOD Single : A 31 SER OG : rot 120:sc= -0.0456 USER MOD Single : A 32 ASN : amide:sc= -6.98! C(o=-7!,f=-10!) USER MOD Single : A 35 HIS : no HE2:sc= -0.0995 K(o=0.52,f=-4.7!) USER MOD Single : A 44 THR OG1 : rot -120:sc= 0.108 USER MOD Single : A 48 THR OG1 : rot 170:sc= -0.121 USER MOD Single : A 52 SER OG : rot 180:sc= 0.042 USER MOD Single : A 54 GLN : amide:sc= 1.03 K(o=1,f=-0.067) USER MOD Single : A 55 HIS : no HD1:sc= -3.74! C(o=-3.7!,f=-4.8!) USER MOD Single : A 57 GLN : amide:sc= -2.56! C(o=-2.6!,f=-8.3!) USER MOD Single : A 59 GLN : amide:sc= 0.196 K(o=0.2,f=-5!) USER MOD Single : A 64 SER OG : rot -105:sc= 0.775 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot -71:sc= 1.12 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl -107:sc= -2.01! (180deg=-4.09!) USER MOD Single : A 83 THR OG1 : rot -39:sc= 0.225 USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.117 USER MOD Single : A 94 ASN : amide:sc= -0.28 K(o=-0.28,f=-3.5!) USER MOD Single : A 106 ASN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 107 HIS : no HD1:sc= -0.222 K(o=-0.22,f=-0.85) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 LYS NZ :NH3+ -171:sc= -1.28 (180deg=-1.59) USER MOD Single : A 130 SER OG : rot -150:sc= -1.22 USER MOD Single : A 131 CYS SG : rot 0:sc= -2.93 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot 134:sc= 0.361 USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 21 N CYS A 30 -9.204 4.756 2.454 1.00 0.00 N ATOM 22 CA CYS A 30 -9.650 3.400 2.098 1.00 0.00 C ATOM 23 C CYS A 30 -11.132 3.230 2.442 1.00 0.00 C ATOM 24 O CYS A 30 -11.601 3.762 3.449 1.00 0.00 O ATOM 25 CB CYS A 30 -8.846 2.345 2.861 1.00 0.00 C ATOM 26 SG CYS A 30 -8.900 2.539 4.678 1.00 0.00 S ATOM 0 HA CYS A 30 -9.495 3.266 1.027 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -9.224 1.356 2.600 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -7.808 2.386 2.532 1.00 0.00 H new ATOM 0 HG CYS A 30 -10.029 3.084 5.023 1.00 0.00 H new ATOM 27 N SER A 31 -11.809 2.389 1.668 1.00 0.00 N ATOM 28 CA SER A 31 -13.167 1.933 2.008 1.00 0.00 C ATOM 29 C SER A 31 -13.097 0.664 2.883 1.00 0.00 C ATOM 30 O SER A 31 -13.605 -0.410 2.549 1.00 0.00 O ATOM 31 CB SER A 31 -13.994 1.715 0.732 1.00 0.00 C ATOM 32 OG SER A 31 -13.315 0.758 -0.072 1.00 0.00 O ATOM 0 H SER A 31 -11.445 2.004 0.797 1.00 0.00 H new ATOM 0 HA SER A 31 -13.672 2.704 2.590 1.00 0.00 H new ATOM 0 HB2 SER A 31 -14.995 1.362 0.982 1.00 0.00 H new ATOM 0 HB3 SER A 31 -14.113 2.653 0.190 1.00 0.00 H new ATOM 0 HG SER A 31 -13.893 -0.020 -0.213 1.00 0.00 H new ATOM 33 N ASN A 32 -12.254 0.798 3.909 1.00 0.00 N ATOM 34 CA ASN A 32 -11.920 -0.210 4.934 1.00 0.00 C ATOM 35 C ASN A 32 -11.921 0.521 6.302 1.00 0.00 C ATOM 36 O ASN A 32 -12.471 1.614 6.430 1.00 0.00 O ATOM 37 CB ASN A 32 -10.521 -0.691 4.545 1.00 0.00 C ATOM 38 CG ASN A 32 -9.982 -1.823 5.418 1.00 0.00 C ATOM 39 OD1 ASN A 32 -10.547 -2.904 5.478 1.00 0.00 O ATOM 40 ND2 ASN A 32 -9.007 -1.499 6.234 1.00 0.00 N ATOM 0 H ASN A 32 -11.749 1.671 4.062 1.00 0.00 H new ATOM 0 HA ASN A 32 -12.609 -1.052 5.001 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -10.539 -1.025 3.508 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -9.832 0.152 4.597 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -8.698 -2.159 6.947 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -8.558 -0.587 6.155 1.00 0.00 H new ATOM 41 N GLY A 33 -11.345 -0.121 7.312 1.00 0.00 N ATOM 42 CA GLY A 33 -10.909 0.523 8.556 1.00 0.00 C ATOM 43 C GLY A 33 -9.918 1.641 8.190 1.00 0.00 C ATOM 44 O GLY A 33 -8.923 1.376 7.513 1.00 0.00 O ATOM 0 H GLY A 33 -11.162 -1.124 7.293 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -11.764 0.933 9.093 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -10.436 -0.204 9.216 1.00 0.00 H new ATOM 45 N GLY A 34 -10.508 2.824 8.230 1.00 0.00 N ATOM 46 CA GLY A 34 -9.892 4.131 7.924 1.00 0.00 C ATOM 47 C GLY A 34 -8.530 4.388 8.583 1.00 0.00 C ATOM 48 O GLY A 34 -8.435 4.687 9.763 1.00 0.00 O ATOM 0 H GLY A 34 -11.490 2.917 8.491 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.775 4.214 6.843 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -10.580 4.919 8.232 1.00 0.00 H new ATOM 49 N HIS A 35 -7.503 4.206 7.762 1.00 0.00 N ATOM 50 CA HIS A 35 -6.104 4.527 8.121 1.00 0.00 C ATOM 51 C HIS A 35 -5.427 5.138 6.868 1.00 0.00 C ATOM 52 O HIS A 35 -6.086 5.704 5.995 1.00 0.00 O ATOM 53 CB HIS A 35 -5.355 3.271 8.591 1.00 0.00 C ATOM 54 CG HIS A 35 -6.055 2.423 9.662 1.00 0.00 C ATOM 55 ND1 HIS A 35 -6.935 1.452 9.420 1.00 0.00 N ATOM 56 CD2 HIS A 35 -5.851 2.478 10.974 1.00 0.00 C ATOM 57 CE1 HIS A 35 -7.277 0.904 10.576 1.00 0.00 C ATOM 58 NE2 HIS A 35 -6.607 1.540 11.534 1.00 0.00 N ATOM 0 H HIS A 35 -7.605 3.830 6.819 1.00 0.00 H new ATOM 0 HA HIS A 35 -6.081 5.237 8.947 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -5.168 2.639 7.723 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -4.383 3.577 8.978 1.00 0.00 H new ATOM 0 HD1 HIS A 35 -7.285 1.178 8.502 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -5.192 3.160 11.490 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -7.973 0.090 10.716 1.00 0.00 H new ATOM 59 N PHE A 36 -4.108 4.938 6.771 1.00 0.00 N ATOM 60 CA PHE A 36 -3.283 5.320 5.610 1.00 0.00 C ATOM 61 C PHE A 36 -2.244 4.219 5.397 1.00 0.00 C ATOM 62 O PHE A 36 -1.820 3.557 6.351 1.00 0.00 O ATOM 63 CB PHE A 36 -2.511 6.608 5.903 1.00 0.00 C ATOM 64 CG PHE A 36 -3.304 7.881 5.601 1.00 0.00 C ATOM 65 CD1 PHE A 36 -4.226 8.370 6.557 1.00 0.00 C ATOM 66 CD2 PHE A 36 -3.076 8.554 4.380 1.00 0.00 C ATOM 67 CE1 PHE A 36 -4.947 9.544 6.279 1.00 0.00 C ATOM 68 CE2 PHE A 36 -3.792 9.737 4.110 1.00 0.00 C ATOM 69 CZ PHE A 36 -4.728 10.226 5.062 1.00 0.00 C ATOM 0 H PHE A 36 -3.567 4.495 7.514 1.00 0.00 H new ATOM 0 HA PHE A 36 -3.928 5.462 4.743 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -2.216 6.614 6.952 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -1.594 6.613 5.314 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -4.374 7.847 7.490 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -2.364 8.168 3.665 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -5.664 9.922 6.992 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -3.631 10.270 3.184 1.00 0.00 H new ATOM 0 HZ PHE A 36 -5.279 11.131 4.852 1.00 0.00 H new ATOM 70 N LEU A 37 -1.794 4.103 4.164 1.00 0.00 N ATOM 71 CA LEU A 37 -0.661 3.212 3.833 1.00 0.00 C ATOM 72 C LEU A 37 0.683 3.923 4.077 1.00 0.00 C ATOM 73 O LEU A 37 1.463 4.216 3.167 1.00 0.00 O ATOM 74 CB LEU A 37 -0.810 2.574 2.434 1.00 0.00 C ATOM 75 CG LEU A 37 -1.288 3.522 1.326 1.00 0.00 C ATOM 76 CD1 LEU A 37 -0.761 3.057 -0.032 1.00 0.00 C ATOM 77 CD2 LEU A 37 -2.817 3.637 1.287 1.00 0.00 C ATOM 0 H LEU A 37 -2.183 4.605 3.366 1.00 0.00 H new ATOM 0 HA LEU A 37 -0.674 2.362 4.516 1.00 0.00 H new ATOM 0 HB2 LEU A 37 0.152 2.155 2.140 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -1.511 1.743 2.505 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.890 4.512 1.550 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -1.107 3.738 -0.809 1.00 0.00 H new ATOM 0 HD12 LEU A 37 0.329 3.049 -0.016 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.128 2.052 -0.240 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -3.110 4.318 0.488 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -3.251 2.654 1.104 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -3.177 4.021 2.241 1.00 0.00 H new ATOM 78 N ARG A 38 0.884 4.237 5.357 1.00 0.00 N ATOM 79 CA ARG A 38 2.065 4.939 5.868 1.00 0.00 C ATOM 80 C ARG A 38 3.314 4.062 5.739 1.00 0.00 C ATOM 81 O ARG A 38 3.359 2.927 6.227 1.00 0.00 O ATOM 82 CB ARG A 38 1.815 5.374 7.323 1.00 0.00 C ATOM 83 CG ARG A 38 2.989 6.084 8.005 1.00 0.00 C ATOM 84 CD ARG A 38 2.714 6.571 9.434 1.00 0.00 C ATOM 85 NE ARG A 38 2.373 5.387 10.242 1.00 0.00 N ATOM 86 CZ ARG A 38 2.047 5.339 11.536 1.00 0.00 C ATOM 87 NH1 ARG A 38 2.004 6.417 12.313 1.00 0.00 N ATOM 88 NH2 ARG A 38 1.751 4.187 12.103 1.00 0.00 N ATOM 0 H ARG A 38 0.212 4.004 6.088 1.00 0.00 H new ATOM 0 HA ARG A 38 2.243 5.834 5.271 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.950 6.037 7.343 1.00 0.00 H new ATOM 0 HB3 ARG A 38 1.555 4.492 7.909 1.00 0.00 H new ATOM 0 HG2 ARG A 38 3.841 5.405 8.027 1.00 0.00 H new ATOM 0 HG3 ARG A 38 3.279 6.940 7.396 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.589 7.076 9.843 1.00 0.00 H new ATOM 0 HD3 ARG A 38 1.896 7.292 9.444 1.00 0.00 H new ATOM 0 HE ARG A 38 2.388 4.493 9.752 1.00 0.00 H new ATOM 0 HH11 ARG A 38 2.226 7.334 11.926 1.00 0.00 H new ATOM 0 HH12 ARG A 38 1.749 6.327 13.296 1.00 0.00 H new ATOM 0 HH21 ARG A 38 1.770 3.328 11.553 1.00 0.00 H new ATOM 0 HH22 ARG A 38 1.502 4.154 13.092 1.00 0.00 H new ATOM 89 N ILE A 39 4.300 4.672 5.110 1.00 0.00 N ATOM 90 CA ILE A 39 5.611 4.036 4.864 1.00 0.00 C ATOM 91 C ILE A 39 6.588 4.715 5.812 1.00 0.00 C ATOM 92 O ILE A 39 7.043 5.840 5.629 1.00 0.00 O ATOM 93 CB ILE A 39 5.970 4.176 3.369 1.00 0.00 C ATOM 94 CG1 ILE A 39 4.842 3.684 2.464 1.00 0.00 C ATOM 95 CG2 ILE A 39 7.206 3.353 3.052 1.00 0.00 C ATOM 96 CD1 ILE A 39 4.374 4.748 1.470 1.00 0.00 C ATOM 0 H ILE A 39 4.230 5.623 4.749 1.00 0.00 H new ATOM 0 HA ILE A 39 5.625 2.964 5.062 1.00 0.00 H new ATOM 0 HB ILE A 39 6.144 5.236 3.183 1.00 0.00 H new ATOM 0 HG12 ILE A 39 5.179 2.804 1.916 1.00 0.00 H new ATOM 0 HG13 ILE A 39 3.998 3.372 3.079 1.00 0.00 H new ATOM 0 HG21 ILE A 39 7.452 3.458 1.995 1.00 0.00 H new ATOM 0 HG22 ILE A 39 8.042 3.705 3.656 1.00 0.00 H new ATOM 0 HG23 ILE A 39 7.012 2.304 3.277 1.00 0.00 H new ATOM 0 HD11 ILE A 39 3.572 4.342 0.854 1.00 0.00 H new ATOM 0 HD12 ILE A 39 4.008 5.619 2.014 1.00 0.00 H new ATOM 0 HD13 ILE A 39 5.208 5.042 0.833 1.00 0.00 H new ATOM 97 N LEU A 40 6.615 4.033 6.953 1.00 0.00 N ATOM 98 CA LEU A 40 7.276 4.473 8.179 1.00 0.00 C ATOM 99 C LEU A 40 8.785 4.717 8.002 1.00 0.00 C ATOM 100 O LEU A 40 9.458 3.860 7.435 1.00 0.00 O ATOM 101 CB LEU A 40 7.108 3.445 9.318 1.00 0.00 C ATOM 102 CG LEU A 40 5.779 3.413 10.070 1.00 0.00 C ATOM 103 CD1 LEU A 40 5.576 4.723 10.806 1.00 0.00 C ATOM 104 CD2 LEU A 40 4.595 3.092 9.153 1.00 0.00 C ATOM 0 H LEU A 40 6.161 3.125 7.054 1.00 0.00 H new ATOM 0 HA LEU A 40 6.788 5.414 8.431 1.00 0.00 H new ATOM 0 HB2 LEU A 40 7.278 2.453 8.899 1.00 0.00 H new ATOM 0 HB3 LEU A 40 7.899 3.623 10.047 1.00 0.00 H new ATOM 0 HG LEU A 40 5.823 2.602 10.797 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.627 4.696 11.341 1.00 0.00 H new ATOM 0 HD12 LEU A 40 6.389 4.871 11.517 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.566 5.545 10.090 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.675 3.082 9.737 1.00 0.00 H new ATOM 0 HD22 LEU A 40 4.522 3.851 8.374 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.745 2.115 8.694 1.00 0.00 H new ATOM 105 N PRO A 41 9.324 5.673 8.785 1.00 0.00 N ATOM 106 CA PRO A 41 10.784 5.853 8.926 1.00 0.00 C ATOM 107 C PRO A 41 11.458 4.599 9.518 1.00 0.00 C ATOM 108 O PRO A 41 12.494 4.165 9.025 1.00 0.00 O ATOM 109 CB PRO A 41 10.932 7.090 9.817 1.00 0.00 C ATOM 110 CG PRO A 41 9.647 7.122 10.646 1.00 0.00 C ATOM 111 CD PRO A 41 8.575 6.555 9.707 1.00 0.00 C ATOM 0 HA PRO A 41 11.284 5.993 7.968 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.813 7.017 10.454 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.043 7.997 9.222 1.00 0.00 H new ATOM 0 HG2 PRO A 41 9.742 6.521 11.550 1.00 0.00 H new ATOM 0 HG3 PRO A 41 9.403 8.136 10.962 1.00 0.00 H new ATOM 0 HD2 PRO A 41 7.816 6.000 10.259 1.00 0.00 H new ATOM 0 HD3 PRO A 41 8.060 7.349 9.167 1.00 0.00 H new ATOM 112 N ASP A 42 10.656 3.856 10.281 1.00 0.00 N ATOM 113 CA ASP A 42 11.008 2.579 10.937 1.00 0.00 C ATOM 114 C ASP A 42 10.924 1.344 9.997 1.00 0.00 C ATOM 115 O ASP A 42 10.605 0.232 10.421 1.00 0.00 O ATOM 116 CB ASP A 42 10.062 2.427 12.135 1.00 0.00 C ATOM 117 CG ASP A 42 10.334 3.469 13.231 1.00 0.00 C ATOM 118 OD1 ASP A 42 9.789 4.588 13.075 1.00 0.00 O ATOM 119 OD2 ASP A 42 11.050 3.109 14.185 1.00 0.00 O ATOM 0 H ASP A 42 9.694 4.135 10.473 1.00 0.00 H new ATOM 0 HA ASP A 42 12.053 2.613 11.245 1.00 0.00 H new ATOM 0 HB2 ASP A 42 9.031 2.522 11.795 1.00 0.00 H new ATOM 0 HB3 ASP A 42 10.168 1.426 12.554 1.00 0.00 H new ATOM 120 N GLY A 43 11.136 1.611 8.712 1.00 0.00 N ATOM 121 CA GLY A 43 11.192 0.632 7.604 1.00 0.00 C ATOM 122 C GLY A 43 9.982 -0.309 7.449 1.00 0.00 C ATOM 123 O GLY A 43 10.092 -1.306 6.737 1.00 0.00 O ATOM 0 H GLY A 43 11.283 2.566 8.386 1.00 0.00 H new ATOM 0 HA2 GLY A 43 11.317 1.181 6.671 1.00 0.00 H new ATOM 0 HA3 GLY A 43 12.084 0.020 7.736 1.00 0.00 H new ATOM 124 N THR A 44 8.790 0.160 7.832 1.00 0.00 N ATOM 125 CA THR A 44 7.590 -0.722 7.801 1.00 0.00 C ATOM 126 C THR A 44 6.383 0.003 7.217 1.00 0.00 C ATOM 127 O THR A 44 6.340 1.235 7.189 1.00 0.00 O ATOM 128 CB THR A 44 7.266 -1.339 9.185 1.00 0.00 C ATOM 129 OG1 THR A 44 6.148 -2.216 9.031 1.00 0.00 O ATOM 130 CG2 THR A 44 6.999 -0.316 10.285 1.00 0.00 C ATOM 0 H THR A 44 8.619 1.111 8.159 1.00 0.00 H new ATOM 0 HA THR A 44 7.833 -1.555 7.141 1.00 0.00 H new ATOM 0 HB THR A 44 8.153 -1.879 9.517 1.00 0.00 H new ATOM 0 HG1 THR A 44 5.411 -1.909 9.599 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.781 -0.834 11.219 1.00 0.00 H new ATOM 0 HG22 THR A 44 7.878 0.315 10.417 1.00 0.00 H new ATOM 0 HG23 THR A 44 6.147 0.304 10.006 1.00 0.00 H new ATOM 131 N VAL A 45 5.479 -0.761 6.628 1.00 0.00 N ATOM 132 CA VAL A 45 4.239 -0.185 6.089 1.00 0.00 C ATOM 133 C VAL A 45 3.073 -0.541 7.005 1.00 0.00 C ATOM 134 O VAL A 45 2.613 -1.683 7.095 1.00 0.00 O ATOM 135 CB VAL A 45 4.054 -0.535 4.606 1.00 0.00 C ATOM 136 CG1 VAL A 45 2.711 -0.099 4.037 1.00 0.00 C ATOM 137 CG2 VAL A 45 5.163 0.117 3.774 1.00 0.00 C ATOM 0 H VAL A 45 5.569 -1.770 6.507 1.00 0.00 H new ATOM 0 HA VAL A 45 4.292 0.904 6.087 1.00 0.00 H new ATOM 0 HB VAL A 45 4.098 -1.623 4.549 1.00 0.00 H new ATOM 0 HG11 VAL A 45 2.653 -0.380 2.985 1.00 0.00 H new ATOM 0 HG12 VAL A 45 1.907 -0.587 4.588 1.00 0.00 H new ATOM 0 HG13 VAL A 45 2.610 0.982 4.130 1.00 0.00 H new ATOM 0 HG21 VAL A 45 5.025 -0.136 2.723 1.00 0.00 H new ATOM 0 HG22 VAL A 45 5.121 1.199 3.896 1.00 0.00 H new ATOM 0 HG23 VAL A 45 6.133 -0.248 4.111 1.00 0.00 H new ATOM 138 N ASP A 46 2.637 0.502 7.700 1.00 0.00 N ATOM 139 CA ASP A 46 1.599 0.414 8.728 1.00 0.00 C ATOM 140 C ASP A 46 0.559 1.534 8.681 1.00 0.00 C ATOM 141 O ASP A 46 0.898 2.682 8.402 1.00 0.00 O ATOM 142 CB ASP A 46 2.182 0.363 10.148 1.00 0.00 C ATOM 143 CG ASP A 46 2.879 -0.972 10.436 1.00 0.00 C ATOM 144 OD1 ASP A 46 2.254 -2.010 10.123 1.00 0.00 O ATOM 145 OD2 ASP A 46 4.003 -0.926 10.976 1.00 0.00 O ATOM 0 H ASP A 46 2.997 1.447 7.566 1.00 0.00 H new ATOM 0 HA ASP A 46 1.095 -0.523 8.492 1.00 0.00 H new ATOM 0 HB2 ASP A 46 2.894 1.179 10.277 1.00 0.00 H new ATOM 0 HB3 ASP A 46 1.383 0.519 10.873 1.00 0.00 H new ATOM 146 N GLY A 47 -0.689 1.098 8.757 1.00 0.00 N ATOM 147 CA GLY A 47 -1.867 1.957 9.011 1.00 0.00 C ATOM 148 C GLY A 47 -1.794 2.488 10.440 1.00 0.00 C ATOM 149 O GLY A 47 -1.104 1.946 11.301 1.00 0.00 O ATOM 0 H GLY A 47 -0.932 0.114 8.643 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.890 2.785 8.302 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.786 1.389 8.867 1.00 0.00 H new ATOM 150 N THR A 48 -2.706 3.404 10.701 1.00 0.00 N ATOM 151 CA THR A 48 -2.503 4.360 11.799 1.00 0.00 C ATOM 152 C THR A 48 -3.802 4.980 12.318 1.00 0.00 C ATOM 153 O THR A 48 -4.623 5.478 11.548 1.00 0.00 O ATOM 154 CB THR A 48 -1.530 5.459 11.337 1.00 0.00 C ATOM 155 OG1 THR A 48 -1.338 6.407 12.391 1.00 0.00 O ATOM 156 CG2 THR A 48 -1.947 6.122 10.010 1.00 0.00 C ATOM 0 H THR A 48 -3.580 3.515 10.187 1.00 0.00 H new ATOM 0 HA THR A 48 -2.083 3.805 12.637 1.00 0.00 H new ATOM 0 HB THR A 48 -0.572 4.987 11.118 1.00 0.00 H new ATOM 0 HG1 THR A 48 -0.602 7.011 12.158 1.00 0.00 H new ATOM 0 HG21 THR A 48 -1.219 6.887 9.741 1.00 0.00 H new ATOM 0 HG22 THR A 48 -1.988 5.368 9.224 1.00 0.00 H new ATOM 0 HG23 THR A 48 -2.929 6.580 10.125 1.00 0.00 H new ATOM 157 N ARG A 49 -4.044 4.715 13.605 1.00 0.00 N ATOM 158 CA ARG A 49 -5.117 5.425 14.338 1.00 0.00 C ATOM 159 C ARG A 49 -4.702 6.834 14.776 1.00 0.00 C ATOM 160 O ARG A 49 -5.537 7.677 15.096 1.00 0.00 O ATOM 161 CB ARG A 49 -5.561 4.600 15.547 1.00 0.00 C ATOM 162 CG ARG A 49 -6.115 3.232 15.101 1.00 0.00 C ATOM 163 CD ARG A 49 -6.573 2.376 16.284 1.00 0.00 C ATOM 164 NE ARG A 49 -5.469 2.224 17.256 1.00 0.00 N ATOM 165 CZ ARG A 49 -4.575 1.241 17.334 1.00 0.00 C ATOM 166 NH1 ARG A 49 -4.603 0.177 16.543 1.00 0.00 N ATOM 167 NH2 ARG A 49 -3.513 1.414 18.097 1.00 0.00 N ATOM 0 H ARG A 49 -3.529 4.031 14.159 1.00 0.00 H new ATOM 0 HA ARG A 49 -5.953 5.543 13.649 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -4.718 4.454 16.223 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -6.325 5.143 16.103 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -6.953 3.386 14.421 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -5.347 2.696 14.544 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -7.433 2.840 16.768 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -6.895 1.396 15.931 1.00 0.00 H new ATOM 0 HE ARG A 49 -5.382 2.964 17.953 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -5.333 0.086 15.836 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -3.895 -0.551 16.642 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -3.391 2.287 18.611 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -2.814 0.675 18.173 1.00 0.00 H new ATOM 168 N ASP A 50 -3.393 7.086 14.784 1.00 0.00 N ATOM 169 CA ASP A 50 -2.827 8.403 15.132 1.00 0.00 C ATOM 170 C ASP A 50 -1.903 8.872 13.998 1.00 0.00 C ATOM 171 O ASP A 50 -0.669 8.836 14.093 1.00 0.00 O ATOM 172 CB ASP A 50 -2.123 8.310 16.491 1.00 0.00 C ATOM 173 CG ASP A 50 -1.729 9.692 17.020 1.00 0.00 C ATOM 174 OD1 ASP A 50 -2.530 10.640 16.837 1.00 0.00 O ATOM 175 OD2 ASP A 50 -0.611 9.787 17.574 1.00 0.00 O ATOM 0 H ASP A 50 -2.689 6.386 14.550 1.00 0.00 H new ATOM 0 HA ASP A 50 -3.611 9.154 15.234 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -2.781 7.819 17.209 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -1.232 7.688 16.398 1.00 0.00 H new ATOM 176 N ARG A 51 -2.558 9.303 12.935 1.00 0.00 N ATOM 177 CA ARG A 51 -1.942 9.730 11.667 1.00 0.00 C ATOM 178 C ARG A 51 -0.851 10.780 11.838 1.00 0.00 C ATOM 179 O ARG A 51 -1.060 11.935 12.222 1.00 0.00 O ATOM 180 CB ARG A 51 -3.004 10.225 10.668 1.00 0.00 C ATOM 181 CG ARG A 51 -4.066 9.174 10.351 1.00 0.00 C ATOM 182 CD ARG A 51 -5.385 9.555 11.019 1.00 0.00 C ATOM 183 NE ARG A 51 -6.326 8.434 10.960 1.00 0.00 N ATOM 184 CZ ARG A 51 -7.527 8.398 11.528 1.00 0.00 C ATOM 185 NH1 ARG A 51 -7.972 9.385 12.296 1.00 0.00 N ATOM 186 NH2 ARG A 51 -8.283 7.310 11.396 1.00 0.00 N ATOM 0 H ARG A 51 -3.576 9.372 12.919 1.00 0.00 H new ATOM 0 HA ARG A 51 -1.458 8.840 11.266 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -3.490 11.112 11.074 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -2.512 10.526 9.743 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -4.203 9.096 9.272 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -3.739 8.195 10.703 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -5.207 9.835 12.057 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -5.814 10.426 10.523 1.00 0.00 H new ATOM 0 HE ARG A 51 -6.034 7.608 10.437 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -7.387 10.203 12.465 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -8.899 9.325 12.717 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -7.939 6.512 10.862 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -9.206 7.275 11.829 1.00 0.00 H new ATOM 187 N SER A 52 0.361 10.268 11.673 1.00 0.00 N ATOM 188 CA SER A 52 1.621 11.007 11.752 1.00 0.00 C ATOM 189 C SER A 52 1.920 11.563 10.362 1.00 0.00 C ATOM 190 O SER A 52 2.270 10.830 9.430 1.00 0.00 O ATOM 191 CB SER A 52 2.732 10.062 12.150 1.00 0.00 C ATOM 192 OG SER A 52 2.314 9.213 13.232 1.00 0.00 O ATOM 0 H SER A 52 0.503 9.278 11.470 1.00 0.00 H new ATOM 0 HA SER A 52 1.548 11.809 12.486 1.00 0.00 H new ATOM 0 HB2 SER A 52 3.022 9.452 11.294 1.00 0.00 H new ATOM 0 HB3 SER A 52 3.612 10.632 12.448 1.00 0.00 H new ATOM 0 HG SER A 52 3.046 8.608 13.474 1.00 0.00 H new ATOM 193 N ASP A 53 1.250 12.697 10.233 1.00 0.00 N ATOM 194 CA ASP A 53 1.253 13.651 9.099 1.00 0.00 C ATOM 195 C ASP A 53 2.608 14.026 8.469 1.00 0.00 C ATOM 196 O ASP A 53 2.901 15.171 8.113 1.00 0.00 O ATOM 197 CB ASP A 53 0.428 14.889 9.451 1.00 0.00 C ATOM 198 CG ASP A 53 -1.063 14.575 9.395 1.00 0.00 C ATOM 199 OD1 ASP A 53 -1.553 14.371 8.259 1.00 0.00 O ATOM 200 OD2 ASP A 53 -1.648 14.473 10.484 1.00 0.00 O ATOM 0 H ASP A 53 0.630 13.016 10.978 1.00 0.00 H new ATOM 0 HA ASP A 53 0.788 13.087 8.291 1.00 0.00 H new ATOM 0 HB2 ASP A 53 0.694 15.238 10.449 1.00 0.00 H new ATOM 0 HB3 ASP A 53 0.661 15.697 8.758 1.00 0.00 H new ATOM 201 N GLN A 54 3.312 12.956 8.132 1.00 0.00 N ATOM 202 CA GLN A 54 4.593 12.957 7.434 1.00 0.00 C ATOM 203 C GLN A 54 4.655 11.692 6.555 1.00 0.00 C ATOM 204 O GLN A 54 4.197 11.712 5.422 1.00 0.00 O ATOM 205 CB GLN A 54 5.749 13.041 8.442 1.00 0.00 C ATOM 206 CG GLN A 54 7.042 13.458 7.735 1.00 0.00 C ATOM 207 CD GLN A 54 8.329 13.201 8.520 1.00 0.00 C ATOM 208 OE1 GLN A 54 8.370 13.070 9.735 1.00 0.00 O ATOM 209 NE2 GLN A 54 9.407 13.032 7.786 1.00 0.00 N ATOM 0 H GLN A 54 2.990 12.013 8.349 1.00 0.00 H new ATOM 0 HA GLN A 54 4.690 13.831 6.790 1.00 0.00 H new ATOM 0 HB2 GLN A 54 5.506 13.760 9.225 1.00 0.00 H new ATOM 0 HB3 GLN A 54 5.888 12.075 8.928 1.00 0.00 H new ATOM 0 HG2 GLN A 54 7.104 12.928 6.784 1.00 0.00 H new ATOM 0 HG3 GLN A 54 6.983 14.522 7.504 1.00 0.00 H new ATOM 0 HE21 GLN A 54 9.357 13.145 6.773 1.00 0.00 H new ATOM 0 HE22 GLN A 54 10.293 12.788 8.229 1.00 0.00 H new ATOM 210 N HIS A 55 4.883 10.557 7.213 1.00 0.00 N ATOM 211 CA HIS A 55 5.102 9.252 6.557 1.00 0.00 C ATOM 212 C HIS A 55 3.862 8.665 5.855 1.00 0.00 C ATOM 213 O HIS A 55 3.953 7.697 5.094 1.00 0.00 O ATOM 214 CB HIS A 55 5.724 8.262 7.565 1.00 0.00 C ATOM 215 CG HIS A 55 6.172 8.875 8.912 1.00 0.00 C ATOM 216 ND1 HIS A 55 5.512 8.810 10.055 1.00 0.00 N ATOM 217 CD2 HIS A 55 7.222 9.666 9.090 1.00 0.00 C ATOM 218 CE1 HIS A 55 6.155 9.555 10.955 1.00 0.00 C ATOM 219 NE2 HIS A 55 7.219 10.088 10.352 1.00 0.00 N ATOM 0 H HIS A 55 4.923 10.508 8.231 1.00 0.00 H new ATOM 0 HA HIS A 55 5.802 9.428 5.740 1.00 0.00 H new ATOM 0 HB2 HIS A 55 4.999 7.474 7.768 1.00 0.00 H new ATOM 0 HB3 HIS A 55 6.587 7.788 7.097 1.00 0.00 H new ATOM 0 HD2 HIS A 55 7.954 9.923 8.339 1.00 0.00 H new ATOM 0 HE1 HIS A 55 5.867 9.701 11.986 1.00 0.00 H new ATOM 0 HE2 HIS A 55 7.906 10.707 10.781 1.00 0.00 H new ATOM 220 N ILE A 56 2.701 9.189 6.248 1.00 0.00 N ATOM 221 CA ILE A 56 1.383 8.917 5.618 1.00 0.00 C ATOM 222 C ILE A 56 1.202 9.459 4.191 1.00 0.00 C ATOM 223 O ILE A 56 0.348 8.975 3.446 1.00 0.00 O ATOM 224 CB ILE A 56 0.179 9.343 6.488 1.00 0.00 C ATOM 225 CG1 ILE A 56 0.179 10.826 6.851 1.00 0.00 C ATOM 226 CG2 ILE A 56 0.059 8.523 7.771 1.00 0.00 C ATOM 227 CD1 ILE A 56 -1.151 11.512 6.501 1.00 0.00 C ATOM 0 H ILE A 56 2.636 9.835 7.035 1.00 0.00 H new ATOM 0 HA ILE A 56 1.396 7.830 5.539 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.685 9.147 5.853 1.00 0.00 H new ATOM 0 HG12 ILE A 56 0.373 10.937 7.918 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.993 11.326 6.326 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -0.804 8.866 8.342 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -0.067 7.470 7.519 1.00 0.00 H new ATOM 0 HG23 ILE A 56 0.962 8.647 8.368 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -1.101 12.565 6.778 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.333 11.427 5.430 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -1.963 11.031 7.047 1.00 0.00 H new ATOM 228 N GLN A 57 1.979 10.494 3.820 1.00 0.00 N ATOM 229 CA GLN A 57 1.879 11.164 2.510 1.00 0.00 C ATOM 230 C GLN A 57 2.365 10.353 1.292 1.00 0.00 C ATOM 231 O GLN A 57 3.353 10.655 0.623 1.00 0.00 O ATOM 232 CB GLN A 57 2.512 12.560 2.583 1.00 0.00 C ATOM 233 CG GLN A 57 1.557 13.583 3.199 1.00 0.00 C ATOM 234 CD GLN A 57 1.824 13.877 4.681 1.00 0.00 C ATOM 235 OE1 GLN A 57 1.565 13.092 5.584 1.00 0.00 O ATOM 236 NE2 GLN A 57 2.249 15.090 4.974 1.00 0.00 N ATOM 0 H GLN A 57 2.698 10.891 4.425 1.00 0.00 H new ATOM 0 HA GLN A 57 0.811 11.259 2.314 1.00 0.00 H new ATOM 0 HB2 GLN A 57 3.427 12.514 3.174 1.00 0.00 H new ATOM 0 HB3 GLN A 57 2.795 12.884 1.582 1.00 0.00 H new ATOM 0 HG2 GLN A 57 1.627 14.514 2.637 1.00 0.00 H new ATOM 0 HG3 GLN A 57 0.535 13.221 3.090 1.00 0.00 H new ATOM 0 HE21 GLN A 57 2.466 15.749 4.226 1.00 0.00 H new ATOM 0 HE22 GLN A 57 2.360 15.370 5.949 1.00 0.00 H new ATOM 237 N LEU A 58 1.479 9.432 0.920 1.00 0.00 N ATOM 238 CA LEU A 58 1.674 8.483 -0.194 1.00 0.00 C ATOM 239 C LEU A 58 1.526 9.154 -1.572 1.00 0.00 C ATOM 240 O LEU A 58 0.696 10.026 -1.801 1.00 0.00 O ATOM 241 CB LEU A 58 0.716 7.305 0.027 1.00 0.00 C ATOM 242 CG LEU A 58 -0.709 7.553 -0.506 1.00 0.00 C ATOM 243 CD1 LEU A 58 -0.871 6.793 -1.831 1.00 0.00 C ATOM 244 CD2 LEU A 58 -1.786 7.172 0.499 1.00 0.00 C ATOM 0 H LEU A 58 0.582 9.315 1.391 1.00 0.00 H new ATOM 0 HA LEU A 58 2.698 8.110 -0.198 1.00 0.00 H new ATOM 0 HB2 LEU A 58 1.126 6.419 -0.458 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.662 7.088 1.094 1.00 0.00 H new ATOM 0 HG LEU A 58 -0.840 8.622 -0.675 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.874 6.957 -2.224 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.136 7.155 -2.550 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.717 5.727 -1.660 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.769 7.368 0.071 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -1.700 6.113 0.741 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -1.662 7.762 1.407 1.00 0.00 H new ATOM 245 N GLN A 59 2.372 8.702 -2.495 1.00 0.00 N ATOM 246 CA GLN A 59 2.393 9.199 -3.874 1.00 0.00 C ATOM 247 C GLN A 59 2.919 8.166 -4.867 1.00 0.00 C ATOM 248 O GLN A 59 3.912 7.488 -4.599 1.00 0.00 O ATOM 249 CB GLN A 59 3.322 10.426 -3.900 1.00 0.00 C ATOM 250 CG GLN A 59 3.391 11.224 -5.211 1.00 0.00 C ATOM 251 CD GLN A 59 2.036 11.628 -5.784 1.00 0.00 C ATOM 252 OE1 GLN A 59 1.358 10.869 -6.456 1.00 0.00 O ATOM 253 NE2 GLN A 59 1.621 12.862 -5.583 1.00 0.00 N ATOM 0 H GLN A 59 3.066 7.978 -2.309 1.00 0.00 H new ATOM 0 HA GLN A 59 1.372 9.438 -4.173 1.00 0.00 H new ATOM 0 HB2 GLN A 59 3.008 11.105 -3.107 1.00 0.00 H new ATOM 0 HB3 GLN A 59 4.330 10.092 -3.654 1.00 0.00 H new ATOM 0 HG2 GLN A 59 3.982 12.124 -5.042 1.00 0.00 H new ATOM 0 HG3 GLN A 59 3.922 10.630 -5.955 1.00 0.00 H new ATOM 0 HE21 GLN A 59 2.182 13.504 -5.022 1.00 0.00 H new ATOM 0 HE22 GLN A 59 0.739 13.176 -5.988 1.00 0.00 H new ATOM 254 N LEU A 60 2.312 8.163 -6.042 1.00 0.00 N ATOM 255 CA LEU A 60 2.785 7.263 -7.110 1.00 0.00 C ATOM 256 C LEU A 60 3.623 7.879 -8.223 1.00 0.00 C ATOM 257 O LEU A 60 3.132 8.391 -9.227 1.00 0.00 O ATOM 258 CB LEU A 60 1.777 6.287 -7.737 1.00 0.00 C ATOM 259 CG LEU A 60 0.279 6.507 -7.542 1.00 0.00 C ATOM 260 CD1 LEU A 60 -0.079 6.042 -6.135 1.00 0.00 C ATOM 261 CD2 LEU A 60 -0.230 7.915 -7.893 1.00 0.00 C ATOM 0 H LEU A 60 1.514 8.749 -6.288 1.00 0.00 H new ATOM 0 HA LEU A 60 3.444 6.676 -6.470 1.00 0.00 H new ATOM 0 HB2 LEU A 60 1.965 6.272 -8.810 1.00 0.00 H new ATOM 0 HB3 LEU A 60 2.011 5.292 -7.358 1.00 0.00 H new ATOM 0 HG LEU A 60 -0.258 5.904 -8.275 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -1.146 6.187 -5.964 1.00 0.00 H new ATOM 0 HD12 LEU A 60 0.166 4.985 -6.028 1.00 0.00 H new ATOM 0 HD13 LEU A 60 0.487 6.621 -5.405 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -1.305 7.967 -7.720 1.00 0.00 H new ATOM 0 HD22 LEU A 60 0.274 8.651 -7.267 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -0.021 8.127 -8.942 1.00 0.00 H new ATOM 262 N SER A 61 4.861 7.422 -8.125 1.00 0.00 N ATOM 263 CA SER A 61 5.926 7.659 -9.113 1.00 0.00 C ATOM 264 C SER A 61 5.859 6.514 -10.137 1.00 0.00 C ATOM 265 O SER A 61 6.582 5.517 -10.100 1.00 0.00 O ATOM 266 CB SER A 61 7.278 7.600 -8.416 1.00 0.00 C ATOM 267 OG SER A 61 7.351 8.543 -7.349 1.00 0.00 O ATOM 0 H SER A 61 5.172 6.857 -7.335 1.00 0.00 H new ATOM 0 HA SER A 61 5.801 8.631 -9.590 1.00 0.00 H new ATOM 0 HB2 SER A 61 7.447 6.595 -8.029 1.00 0.00 H new ATOM 0 HB3 SER A 61 8.071 7.801 -9.137 1.00 0.00 H new ATOM 0 HG SER A 61 8.290 8.716 -7.129 1.00 0.00 H new ATOM 268 N ALA A 62 4.686 6.512 -10.751 1.00 0.00 N ATOM 269 CA ALA A 62 4.302 5.506 -11.759 1.00 0.00 C ATOM 270 C ALA A 62 5.271 5.380 -12.935 1.00 0.00 C ATOM 271 O ALA A 62 5.512 6.279 -13.731 1.00 0.00 O ATOM 272 CB ALA A 62 2.869 5.769 -12.233 1.00 0.00 C ATOM 0 H ALA A 62 3.962 7.207 -10.571 1.00 0.00 H new ATOM 0 HA ALA A 62 4.354 4.537 -11.263 1.00 0.00 H new ATOM 0 HB1 ALA A 62 2.589 5.024 -12.978 1.00 0.00 H new ATOM 0 HB2 ALA A 62 2.188 5.707 -11.384 1.00 0.00 H new ATOM 0 HB3 ALA A 62 2.809 6.764 -12.675 1.00 0.00 H new ATOM 273 N GLU A 63 5.749 4.151 -12.988 1.00 0.00 N ATOM 274 CA GLU A 63 6.770 3.663 -13.928 1.00 0.00 C ATOM 275 C GLU A 63 6.203 3.538 -15.356 1.00 0.00 C ATOM 276 O GLU A 63 6.916 3.824 -16.314 1.00 0.00 O ATOM 277 CB GLU A 63 7.235 2.320 -13.359 1.00 0.00 C ATOM 278 CG GLU A 63 8.505 1.733 -13.998 1.00 0.00 C ATOM 279 CD GLU A 63 8.253 1.062 -15.357 1.00 0.00 C ATOM 280 OE1 GLU A 63 7.333 0.218 -15.437 1.00 0.00 O ATOM 281 OE2 GLU A 63 9.036 1.365 -16.281 1.00 0.00 O ATOM 0 H GLU A 63 5.428 3.422 -12.351 1.00 0.00 H new ATOM 0 HA GLU A 63 7.607 4.355 -14.021 1.00 0.00 H new ATOM 0 HB2 GLU A 63 7.409 2.439 -12.290 1.00 0.00 H new ATOM 0 HB3 GLU A 63 6.426 1.598 -13.471 1.00 0.00 H new ATOM 0 HG2 GLU A 63 9.239 2.528 -14.125 1.00 0.00 H new ATOM 0 HG3 GLU A 63 8.941 1.003 -13.316 1.00 0.00 H new ATOM 282 N SER A 64 4.960 3.067 -15.463 1.00 0.00 N ATOM 283 CA SER A 64 4.286 2.749 -16.749 1.00 0.00 C ATOM 284 C SER A 64 2.798 2.399 -16.549 1.00 0.00 C ATOM 285 O SER A 64 2.219 2.717 -15.504 1.00 0.00 O ATOM 286 CB SER A 64 5.062 1.604 -17.413 1.00 0.00 C ATOM 287 OG SER A 64 4.818 0.349 -16.772 1.00 0.00 O ATOM 0 H SER A 64 4.371 2.888 -14.650 1.00 0.00 H new ATOM 0 HA SER A 64 4.293 3.625 -17.398 1.00 0.00 H new ATOM 0 HB2 SER A 64 4.779 1.536 -18.463 1.00 0.00 H new ATOM 0 HB3 SER A 64 6.129 1.825 -17.384 1.00 0.00 H new ATOM 0 HG SER A 64 5.598 0.100 -16.233 1.00 0.00 H new ATOM 288 N VAL A 65 2.271 1.592 -17.461 1.00 0.00 N ATOM 289 CA VAL A 65 0.875 1.118 -17.575 1.00 0.00 C ATOM 290 C VAL A 65 0.396 0.423 -16.281 1.00 0.00 C ATOM 291 O VAL A 65 0.819 -0.682 -15.933 1.00 0.00 O ATOM 292 CB VAL A 65 0.813 0.219 -18.832 1.00 0.00 C ATOM 293 CG1 VAL A 65 1.700 -1.027 -18.736 1.00 0.00 C ATOM 294 CG2 VAL A 65 -0.629 -0.158 -19.183 1.00 0.00 C ATOM 0 H VAL A 65 2.850 1.213 -18.210 1.00 0.00 H new ATOM 0 HA VAL A 65 0.180 1.949 -17.694 1.00 0.00 H new ATOM 0 HB VAL A 65 1.219 0.821 -19.645 1.00 0.00 H new ATOM 0 HG11 VAL A 65 1.607 -1.611 -19.652 1.00 0.00 H new ATOM 0 HG12 VAL A 65 2.739 -0.725 -18.602 1.00 0.00 H new ATOM 0 HG13 VAL A 65 1.386 -1.633 -17.886 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -0.634 -0.790 -20.071 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -1.077 -0.700 -18.350 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -1.204 0.747 -19.378 1.00 0.00 H new ATOM 295 N GLY A 66 -0.276 1.230 -15.475 1.00 0.00 N ATOM 296 CA GLY A 66 -0.773 0.859 -14.141 1.00 0.00 C ATOM 297 C GLY A 66 0.301 0.573 -13.083 1.00 0.00 C ATOM 298 O GLY A 66 -0.011 0.427 -11.915 1.00 0.00 O ATOM 0 H GLY A 66 -0.502 2.191 -15.730 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -1.411 1.663 -13.775 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.402 -0.026 -14.242 1.00 0.00 H new ATOM 299 N GLU A 67 1.570 0.614 -13.459 1.00 0.00 N ATOM 300 CA GLU A 67 2.678 0.217 -12.604 1.00 0.00 C ATOM 301 C GLU A 67 3.235 1.387 -11.787 1.00 0.00 C ATOM 302 O GLU A 67 3.917 2.262 -12.301 1.00 0.00 O ATOM 303 CB GLU A 67 3.759 -0.372 -13.502 1.00 0.00 C ATOM 304 CG GLU A 67 3.308 -1.691 -14.136 1.00 0.00 C ATOM 305 CD GLU A 67 4.278 -2.223 -15.184 1.00 0.00 C ATOM 306 OE1 GLU A 67 5.493 -2.238 -14.905 1.00 0.00 O ATOM 307 OE2 GLU A 67 3.771 -2.634 -16.248 1.00 0.00 O ATOM 0 H GLU A 67 1.864 0.930 -14.383 1.00 0.00 H new ATOM 0 HA GLU A 67 2.327 -0.516 -11.878 1.00 0.00 H new ATOM 0 HB2 GLU A 67 4.010 0.342 -14.286 1.00 0.00 H new ATOM 0 HB3 GLU A 67 4.665 -0.539 -12.920 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.186 -2.439 -13.352 1.00 0.00 H new ATOM 0 HG3 GLU A 67 2.330 -1.549 -14.596 1.00 0.00 H new ATOM 308 N VAL A 68 2.974 1.315 -10.488 1.00 0.00 N ATOM 309 CA VAL A 68 3.214 2.446 -9.566 1.00 0.00 C ATOM 310 C VAL A 68 4.327 2.218 -8.531 1.00 0.00 C ATOM 311 O VAL A 68 4.364 1.196 -7.856 1.00 0.00 O ATOM 312 CB VAL A 68 1.943 2.901 -8.814 1.00 0.00 C ATOM 313 CG1 VAL A 68 0.618 2.618 -9.497 1.00 0.00 C ATOM 314 CG2 VAL A 68 1.612 2.091 -7.591 1.00 0.00 C ATOM 0 H VAL A 68 2.593 0.484 -10.035 1.00 0.00 H new ATOM 0 HA VAL A 68 3.544 3.231 -10.247 1.00 0.00 H new ATOM 0 HB VAL A 68 2.221 3.947 -8.687 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -0.198 2.983 -8.873 1.00 0.00 H new ATOM 0 HG12 VAL A 68 0.591 3.124 -10.462 1.00 0.00 H new ATOM 0 HG13 VAL A 68 0.508 1.544 -9.647 1.00 0.00 H new ATOM 0 HG21 VAL A 68 0.706 2.483 -7.129 1.00 0.00 H new ATOM 0 HG22 VAL A 68 1.454 1.051 -7.875 1.00 0.00 H new ATOM 0 HG23 VAL A 68 2.436 2.151 -6.880 1.00 0.00 H new ATOM 315 N TYR A 69 5.169 3.221 -8.377 1.00 0.00 N ATOM 316 CA TYR A 69 6.128 3.244 -7.268 1.00 0.00 C ATOM 317 C TYR A 69 5.630 4.174 -6.163 1.00 0.00 C ATOM 318 O TYR A 69 5.573 5.393 -6.333 1.00 0.00 O ATOM 319 CB TYR A 69 7.519 3.717 -7.683 1.00 0.00 C ATOM 320 CG TYR A 69 8.307 2.678 -8.470 1.00 0.00 C ATOM 321 CD1 TYR A 69 8.554 1.415 -7.892 1.00 0.00 C ATOM 322 CD2 TYR A 69 8.877 3.071 -9.694 1.00 0.00 C ATOM 323 CE1 TYR A 69 9.403 0.510 -8.570 1.00 0.00 C ATOM 324 CE2 TYR A 69 9.742 2.180 -10.351 1.00 0.00 C ATOM 325 CZ TYR A 69 9.992 0.914 -9.781 1.00 0.00 C ATOM 326 OH TYR A 69 10.849 0.077 -10.416 1.00 0.00 O ATOM 0 H TYR A 69 5.216 4.030 -8.996 1.00 0.00 H new ATOM 0 HA TYR A 69 6.207 2.214 -6.920 1.00 0.00 H new ATOM 0 HB2 TYR A 69 7.422 4.620 -8.286 1.00 0.00 H new ATOM 0 HB3 TYR A 69 8.083 3.989 -6.790 1.00 0.00 H new ATOM 0 HD1 TYR A 69 8.103 1.144 -6.949 1.00 0.00 H new ATOM 0 HD2 TYR A 69 8.654 4.038 -10.120 1.00 0.00 H new ATOM 0 HE1 TYR A 69 9.595 -0.473 -8.165 1.00 0.00 H new ATOM 0 HE2 TYR A 69 10.211 2.461 -11.283 1.00 0.00 H new ATOM 0 HH TYR A 69 11.170 0.501 -11.239 1.00 0.00 H new ATOM 327 N ILE A 70 5.168 3.557 -5.069 1.00 0.00 N ATOM 328 CA ILE A 70 4.509 4.358 -4.026 1.00 0.00 C ATOM 329 C ILE A 70 5.495 4.866 -2.968 1.00 0.00 C ATOM 330 O ILE A 70 5.675 4.323 -1.882 1.00 0.00 O ATOM 331 CB ILE A 70 3.202 3.771 -3.459 1.00 0.00 C ATOM 332 CG1 ILE A 70 2.407 3.090 -4.577 1.00 0.00 C ATOM 333 CG2 ILE A 70 2.348 4.937 -2.956 1.00 0.00 C ATOM 334 CD1 ILE A 70 1.264 2.164 -4.137 1.00 0.00 C ATOM 0 H ILE A 70 5.231 2.556 -4.885 1.00 0.00 H new ATOM 0 HA ILE A 70 4.146 5.244 -4.547 1.00 0.00 H new ATOM 0 HB ILE A 70 3.437 3.056 -2.671 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.990 3.865 -5.220 1.00 0.00 H new ATOM 0 HG13 ILE A 70 3.101 2.510 -5.185 1.00 0.00 H new ATOM 0 HG21 ILE A 70 1.413 4.554 -2.547 1.00 0.00 H new ATOM 0 HG22 ILE A 70 2.890 5.476 -2.179 1.00 0.00 H new ATOM 0 HG23 ILE A 70 2.132 5.613 -3.783 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.778 1.743 -5.017 1.00 0.00 H new ATOM 0 HD12 ILE A 70 1.665 1.358 -3.523 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.537 2.733 -3.558 1.00 0.00 H new ATOM 335 N LYS A 71 5.771 6.122 -3.248 1.00 0.00 N ATOM 336 CA LYS A 71 6.708 7.006 -2.552 1.00 0.00 C ATOM 337 C LYS A 71 5.949 7.836 -1.525 1.00 0.00 C ATOM 338 O LYS A 71 5.054 8.612 -1.824 1.00 0.00 O ATOM 339 CB LYS A 71 7.320 7.883 -3.657 1.00 0.00 C ATOM 340 CG LYS A 71 8.418 8.814 -3.144 1.00 0.00 C ATOM 341 CD LYS A 71 8.886 9.782 -4.245 1.00 0.00 C ATOM 342 CE LYS A 71 7.868 10.890 -4.491 1.00 0.00 C ATOM 343 NZ LYS A 71 8.230 11.550 -5.749 1.00 0.00 N ATOM 0 H LYS A 71 5.315 6.597 -4.027 1.00 0.00 H new ATOM 0 HA LYS A 71 7.485 6.469 -2.007 1.00 0.00 H new ATOM 0 HB2 LYS A 71 7.731 7.241 -4.436 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.532 8.479 -4.118 1.00 0.00 H new ATOM 0 HG2 LYS A 71 8.048 9.382 -2.290 1.00 0.00 H new ATOM 0 HG3 LYS A 71 9.264 8.224 -2.792 1.00 0.00 H new ATOM 0 HD2 LYS A 71 9.842 10.222 -3.960 1.00 0.00 H new ATOM 0 HD3 LYS A 71 9.053 9.229 -5.169 1.00 0.00 H new ATOM 0 HE2 LYS A 71 6.860 10.479 -4.550 1.00 0.00 H new ATOM 0 HE3 LYS A 71 7.873 11.605 -3.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 7.553 12.314 -5.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 9.188 11.948 -5.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 8.207 10.857 -6.524 1.00 0.00 H new ATOM 344 N SER A 72 6.475 7.709 -0.323 1.00 0.00 N ATOM 345 CA SER A 72 5.936 8.358 0.875 1.00 0.00 C ATOM 346 C SER A 72 6.248 9.849 1.045 1.00 0.00 C ATOM 347 O SER A 72 6.021 10.369 2.133 1.00 0.00 O ATOM 348 CB SER A 72 6.465 7.598 2.092 1.00 0.00 C ATOM 349 OG SER A 72 7.853 7.298 1.974 1.00 0.00 O ATOM 0 H SER A 72 7.304 7.144 -0.139 1.00 0.00 H new ATOM 0 HA SER A 72 4.852 8.319 0.770 1.00 0.00 H new ATOM 0 HB2 SER A 72 6.298 8.192 2.991 1.00 0.00 H new ATOM 0 HB3 SER A 72 5.903 6.672 2.213 1.00 0.00 H new ATOM 0 HG SER A 72 7.963 6.366 1.691 1.00 0.00 H new ATOM 350 N THR A 73 6.423 10.540 -0.088 1.00 0.00 N ATOM 351 CA THR A 73 6.959 11.915 -0.232 1.00 0.00 C ATOM 352 C THR A 73 7.795 12.459 0.949 1.00 0.00 C ATOM 353 O THR A 73 9.011 12.330 0.930 1.00 0.00 O ATOM 354 CB THR A 73 5.885 12.939 -0.616 1.00 0.00 C ATOM 355 OG1 THR A 73 4.788 12.899 0.290 1.00 0.00 O ATOM 356 CG2 THR A 73 5.444 12.782 -2.075 1.00 0.00 C ATOM 0 H THR A 73 6.181 10.135 -0.992 1.00 0.00 H new ATOM 0 HA THR A 73 7.662 11.790 -1.055 1.00 0.00 H new ATOM 0 HB THR A 73 6.330 13.931 -0.535 1.00 0.00 H new ATOM 0 HG1 THR A 73 4.281 12.072 0.153 1.00 0.00 H new ATOM 0 HG21 THR A 73 4.682 13.526 -2.307 1.00 0.00 H new ATOM 0 HG22 THR A 73 6.302 12.924 -2.732 1.00 0.00 H new ATOM 0 HG23 THR A 73 5.033 11.784 -2.226 1.00 0.00 H new ATOM 357 N GLU A 74 7.086 12.825 2.007 1.00 0.00 N ATOM 358 CA GLU A 74 7.598 13.309 3.298 1.00 0.00 C ATOM 359 C GLU A 74 8.598 12.378 4.013 1.00 0.00 C ATOM 360 O GLU A 74 9.241 12.826 4.967 1.00 0.00 O ATOM 361 CB GLU A 74 6.364 13.594 4.167 1.00 0.00 C ATOM 362 CG GLU A 74 6.002 15.087 4.198 1.00 0.00 C ATOM 363 CD GLU A 74 5.624 15.695 2.847 1.00 0.00 C ATOM 364 OE1 GLU A 74 4.408 15.666 2.551 1.00 0.00 O ATOM 365 OE2 GLU A 74 6.514 16.317 2.220 1.00 0.00 O ATOM 0 H GLU A 74 6.067 12.792 1.994 1.00 0.00 H new ATOM 0 HA GLU A 74 8.198 14.201 3.117 1.00 0.00 H new ATOM 0 HB2 GLU A 74 5.516 13.025 3.787 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.551 13.247 5.183 1.00 0.00 H new ATOM 0 HG2 GLU A 74 5.169 15.228 4.887 1.00 0.00 H new ATOM 0 HG3 GLU A 74 6.849 15.641 4.603 1.00 0.00 H new ATOM 366 N THR A 75 8.517 11.086 3.733 1.00 0.00 N ATOM 367 CA THR A 75 9.594 10.129 4.093 1.00 0.00 C ATOM 368 C THR A 75 10.359 9.480 2.923 1.00 0.00 C ATOM 369 O THR A 75 11.363 8.802 3.149 1.00 0.00 O ATOM 370 CB THR A 75 9.124 8.988 5.004 1.00 0.00 C ATOM 371 OG1 THR A 75 7.738 8.709 4.787 1.00 0.00 O ATOM 372 CG2 THR A 75 9.475 9.308 6.466 1.00 0.00 C ATOM 0 H THR A 75 7.722 10.660 3.257 1.00 0.00 H new ATOM 0 HA THR A 75 10.280 10.796 4.615 1.00 0.00 H new ATOM 0 HB THR A 75 9.652 8.068 4.754 1.00 0.00 H new ATOM 0 HG1 THR A 75 7.546 7.784 5.047 1.00 0.00 H new ATOM 0 HG21 THR A 75 9.138 8.494 7.108 1.00 0.00 H new ATOM 0 HG22 THR A 75 10.554 9.425 6.564 1.00 0.00 H new ATOM 0 HG23 THR A 75 8.981 10.233 6.765 1.00 0.00 H new ATOM 373 N GLY A 76 9.800 9.569 1.715 1.00 0.00 N ATOM 374 CA GLY A 76 10.412 9.055 0.465 1.00 0.00 C ATOM 375 C GLY A 76 10.203 7.551 0.206 1.00 0.00 C ATOM 376 O GLY A 76 9.673 7.166 -0.829 1.00 0.00 O ATOM 0 H GLY A 76 8.891 10.007 1.563 1.00 0.00 H new ATOM 0 HA2 GLY A 76 10.004 9.613 -0.377 1.00 0.00 H new ATOM 0 HA3 GLY A 76 11.483 9.258 0.493 1.00 0.00 H new ATOM 377 N GLN A 77 10.621 6.739 1.182 1.00 0.00 N ATOM 378 CA GLN A 77 10.534 5.264 1.187 1.00 0.00 C ATOM 379 C GLN A 77 9.320 4.674 0.439 1.00 0.00 C ATOM 380 O GLN A 77 8.197 5.176 0.543 1.00 0.00 O ATOM 381 CB GLN A 77 10.487 4.786 2.639 1.00 0.00 C ATOM 382 CG GLN A 77 11.745 5.161 3.424 1.00 0.00 C ATOM 383 CD GLN A 77 11.495 4.939 4.913 1.00 0.00 C ATOM 384 OE1 GLN A 77 11.119 5.839 5.655 1.00 0.00 O ATOM 385 NE2 GLN A 77 11.635 3.717 5.360 1.00 0.00 N ATOM 0 H GLN A 77 11.050 7.103 2.033 1.00 0.00 H new ATOM 0 HA GLN A 77 11.415 4.912 0.651 1.00 0.00 H new ATOM 0 HB2 GLN A 77 9.615 5.216 3.131 1.00 0.00 H new ATOM 0 HB3 GLN A 77 10.361 3.703 2.657 1.00 0.00 H new ATOM 0 HG2 GLN A 77 12.589 4.557 3.091 1.00 0.00 H new ATOM 0 HG3 GLN A 77 12.006 6.203 3.239 1.00 0.00 H new ATOM 0 HE21 GLN A 77 11.949 2.977 4.732 1.00 0.00 H new ATOM 0 HE22 GLN A 77 11.430 3.505 6.336 1.00 0.00 H new ATOM 386 N TYR A 78 9.544 3.514 -0.149 1.00 0.00 N ATOM 387 CA TYR A 78 8.589 2.873 -1.072 1.00 0.00 C ATOM 388 C TYR A 78 7.757 1.776 -0.418 1.00 0.00 C ATOM 389 O TYR A 78 8.262 0.924 0.309 1.00 0.00 O ATOM 390 CB TYR A 78 9.370 2.278 -2.258 1.00 0.00 C ATOM 391 CG TYR A 78 9.999 3.376 -3.121 1.00 0.00 C ATOM 392 CD1 TYR A 78 9.203 4.002 -4.097 1.00 0.00 C ATOM 393 CD2 TYR A 78 11.270 3.885 -2.757 1.00 0.00 C ATOM 394 CE1 TYR A 78 9.659 5.186 -4.699 1.00 0.00 C ATOM 395 CE2 TYR A 78 11.717 5.080 -3.353 1.00 0.00 C ATOM 396 CZ TYR A 78 10.905 5.726 -4.297 1.00 0.00 C ATOM 397 OH TYR A 78 11.240 6.965 -4.720 1.00 0.00 O ATOM 0 H TYR A 78 10.398 2.975 -0.007 1.00 0.00 H new ATOM 0 HA TYR A 78 7.890 3.643 -1.399 1.00 0.00 H new ATOM 0 HB2 TYR A 78 10.150 1.614 -1.885 1.00 0.00 H new ATOM 0 HB3 TYR A 78 8.701 1.672 -2.869 1.00 0.00 H new ATOM 0 HD1 TYR A 78 8.252 3.577 -4.380 1.00 0.00 H new ATOM 0 HD2 TYR A 78 11.885 3.366 -2.036 1.00 0.00 H new ATOM 0 HE1 TYR A 78 9.068 5.678 -5.458 1.00 0.00 H new ATOM 0 HE2 TYR A 78 12.677 5.496 -3.085 1.00 0.00 H new ATOM 0 HH TYR A 78 12.121 7.205 -4.365 1.00 0.00 H new ATOM 398 N LEU A 79 6.453 1.901 -0.653 1.00 0.00 N ATOM 399 CA LEU A 79 5.455 0.859 -0.328 1.00 0.00 C ATOM 400 C LEU A 79 5.836 -0.394 -1.114 1.00 0.00 C ATOM 401 O LEU A 79 5.865 -0.394 -2.349 1.00 0.00 O ATOM 402 CB LEU A 79 4.062 1.284 -0.786 1.00 0.00 C ATOM 403 CG LEU A 79 2.952 0.460 -0.121 1.00 0.00 C ATOM 404 CD1 LEU A 79 2.403 1.288 1.030 1.00 0.00 C ATOM 405 CD2 LEU A 79 1.814 0.287 -1.102 1.00 0.00 C ATOM 0 H LEU A 79 6.045 2.733 -1.079 1.00 0.00 H new ATOM 0 HA LEU A 79 5.443 0.690 0.749 1.00 0.00 H new ATOM 0 HB2 LEU A 79 3.914 2.340 -0.558 1.00 0.00 H new ATOM 0 HB3 LEU A 79 3.990 1.179 -1.869 1.00 0.00 H new ATOM 0 HG LEU A 79 3.341 -0.505 0.203 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.608 0.734 1.530 1.00 0.00 H new ATOM 0 HD12 LEU A 79 3.202 1.498 1.741 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.004 2.227 0.645 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.020 -0.298 -0.638 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.426 1.265 -1.386 1.00 0.00 H new ATOM 0 HD23 LEU A 79 2.175 -0.231 -1.990 1.00 0.00 H new ATOM 406 N ALA A 80 6.373 -1.334 -0.356 1.00 0.00 N ATOM 407 CA ALA A 80 6.909 -2.594 -0.888 1.00 0.00 C ATOM 408 C ALA A 80 6.238 -3.815 -0.266 1.00 0.00 C ATOM 409 O ALA A 80 5.737 -3.742 0.859 1.00 0.00 O ATOM 410 CB ALA A 80 8.392 -2.633 -0.538 1.00 0.00 C ATOM 0 H ALA A 80 6.454 -1.252 0.657 1.00 0.00 H new ATOM 0 HA ALA A 80 6.728 -2.628 -1.962 1.00 0.00 H new ATOM 0 HB1 ALA A 80 8.831 -3.556 -0.916 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.895 -1.779 -0.992 1.00 0.00 H new ATOM 0 HB3 ALA A 80 8.512 -2.591 0.545 1.00 0.00 H new ATOM 411 N MET A 81 6.409 -4.942 -0.935 1.00 0.00 N ATOM 412 CA MET A 81 5.956 -6.238 -0.413 1.00 0.00 C ATOM 413 C MET A 81 7.075 -7.293 -0.489 1.00 0.00 C ATOM 414 O MET A 81 7.835 -7.315 -1.463 1.00 0.00 O ATOM 415 CB MET A 81 4.706 -6.758 -1.120 1.00 0.00 C ATOM 416 CG MET A 81 4.077 -7.809 -0.207 1.00 0.00 C ATOM 417 SD MET A 81 2.456 -8.502 -0.687 1.00 0.00 S ATOM 418 CE MET A 81 1.475 -7.096 -1.188 1.00 0.00 C ATOM 0 H MET A 81 6.861 -4.995 -1.848 1.00 0.00 H new ATOM 0 HA MET A 81 5.695 -6.066 0.631 1.00 0.00 H new ATOM 0 HB2 MET A 81 4.005 -5.945 -1.311 1.00 0.00 H new ATOM 0 HB3 MET A 81 4.963 -7.192 -2.087 1.00 0.00 H new ATOM 0 HG2 MET A 81 4.780 -8.637 -0.116 1.00 0.00 H new ATOM 0 HG3 MET A 81 3.972 -7.370 0.785 1.00 0.00 H new ATOM 0 HE1 MET A 81 0.725 -6.885 -0.426 1.00 0.00 H new ATOM 0 HE2 MET A 81 2.121 -6.227 -1.311 1.00 0.00 H new ATOM 0 HE3 MET A 81 0.979 -7.316 -2.133 1.00 0.00 H new ATOM 419 N ASP A 82 7.205 -8.059 0.579 1.00 0.00 N ATOM 420 CA ASP A 82 8.185 -9.157 0.657 1.00 0.00 C ATOM 421 C ASP A 82 7.514 -10.523 0.497 1.00 0.00 C ATOM 422 O ASP A 82 6.371 -10.718 0.920 1.00 0.00 O ATOM 423 CB ASP A 82 8.916 -9.080 1.993 1.00 0.00 C ATOM 424 CG ASP A 82 10.374 -9.524 1.881 1.00 0.00 C ATOM 425 OD1 ASP A 82 10.565 -10.758 1.840 1.00 0.00 O ATOM 426 OD2 ASP A 82 11.247 -8.634 1.788 1.00 0.00 O ATOM 0 H ASP A 82 6.641 -7.948 1.422 1.00 0.00 H new ATOM 0 HA ASP A 82 8.896 -9.046 -0.162 1.00 0.00 H new ATOM 0 HB2 ASP A 82 8.877 -8.057 2.368 1.00 0.00 H new ATOM 0 HB3 ASP A 82 8.403 -9.706 2.723 1.00 0.00 H new ATOM 427 N THR A 83 8.372 -11.502 0.201 1.00 0.00 N ATOM 428 CA THR A 83 7.986 -12.897 -0.069 1.00 0.00 C ATOM 429 C THR A 83 7.379 -13.655 1.137 1.00 0.00 C ATOM 430 O THR A 83 6.951 -14.793 1.013 1.00 0.00 O ATOM 431 CB THR A 83 9.118 -13.664 -0.766 1.00 0.00 C ATOM 432 OG1 THR A 83 8.569 -14.811 -1.414 1.00 0.00 O ATOM 433 CG2 THR A 83 10.289 -14.048 0.156 1.00 0.00 C ATOM 0 H THR A 83 9.378 -11.348 0.140 1.00 0.00 H new ATOM 0 HA THR A 83 7.151 -12.839 -0.767 1.00 0.00 H new ATOM 0 HB THR A 83 9.560 -12.988 -1.498 1.00 0.00 H new ATOM 0 HG1 THR A 83 7.874 -15.206 -0.847 1.00 0.00 H new ATOM 0 HG21 THR A 83 11.043 -14.586 -0.418 1.00 0.00 H new ATOM 0 HG22 THR A 83 10.731 -13.145 0.578 1.00 0.00 H new ATOM 0 HG23 THR A 83 9.924 -14.685 0.962 1.00 0.00 H new ATOM 434 N ASP A 84 7.540 -13.037 2.316 1.00 0.00 N ATOM 435 CA ASP A 84 6.897 -13.393 3.594 1.00 0.00 C ATOM 436 C ASP A 84 5.410 -13.016 3.744 1.00 0.00 C ATOM 437 O ASP A 84 4.812 -13.313 4.771 1.00 0.00 O ATOM 438 CB ASP A 84 7.687 -12.748 4.735 1.00 0.00 C ATOM 439 CG ASP A 84 9.086 -13.338 4.882 1.00 0.00 C ATOM 440 OD1 ASP A 84 9.941 -12.896 4.081 1.00 0.00 O ATOM 441 OD2 ASP A 84 9.262 -14.181 5.781 1.00 0.00 O ATOM 0 H ASP A 84 8.156 -12.230 2.411 1.00 0.00 H new ATOM 0 HA ASP A 84 6.912 -14.483 3.623 1.00 0.00 H new ATOM 0 HB2 ASP A 84 7.765 -11.675 4.558 1.00 0.00 H new ATOM 0 HB3 ASP A 84 7.141 -12.878 5.670 1.00 0.00 H new ATOM 442 N GLY A 85 4.922 -12.169 2.836 1.00 0.00 N ATOM 443 CA GLY A 85 3.511 -11.742 2.824 1.00 0.00 C ATOM 444 C GLY A 85 3.229 -10.654 3.852 1.00 0.00 C ATOM 445 O GLY A 85 2.277 -10.726 4.622 1.00 0.00 O ATOM 0 H GLY A 85 5.485 -11.759 2.091 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.253 -11.376 1.830 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.871 -12.602 3.023 1.00 0.00 H new ATOM 446 N LEU A 86 3.959 -9.555 3.653 1.00 0.00 N ATOM 447 CA LEU A 86 3.918 -8.356 4.519 1.00 0.00 C ATOM 448 C LEU A 86 4.588 -7.187 3.794 1.00 0.00 C ATOM 449 O LEU A 86 5.494 -7.375 2.965 1.00 0.00 O ATOM 450 CB LEU A 86 4.503 -8.685 5.899 1.00 0.00 C ATOM 451 CG LEU A 86 5.981 -9.044 5.838 1.00 0.00 C ATOM 452 CD1 LEU A 86 6.747 -7.771 6.213 1.00 0.00 C ATOM 453 CD2 LEU A 86 6.318 -10.159 6.838 1.00 0.00 C ATOM 0 H LEU A 86 4.610 -9.463 2.873 1.00 0.00 H new ATOM 0 HA LEU A 86 2.893 -8.040 4.713 1.00 0.00 H new ATOM 0 HB2 LEU A 86 4.368 -7.829 6.560 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.949 -9.516 6.336 1.00 0.00 H new ATOM 0 HG LEU A 86 6.248 -9.405 4.845 1.00 0.00 H new ATOM 0 HD11 LEU A 86 7.818 -7.970 6.186 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.507 -6.979 5.503 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.462 -7.457 7.217 1.00 0.00 H new ATOM 0 HD21 LEU A 86 7.380 -10.396 6.774 1.00 0.00 H new ATOM 0 HD22 LEU A 86 6.081 -9.826 7.848 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.733 -11.048 6.603 1.00 0.00 H new ATOM 454 N LEU A 87 4.068 -6.007 4.107 1.00 0.00 N ATOM 455 CA LEU A 87 4.518 -4.746 3.486 1.00 0.00 C ATOM 456 C LEU A 87 5.574 -4.041 4.348 1.00 0.00 C ATOM 457 O LEU A 87 5.382 -3.791 5.546 1.00 0.00 O ATOM 458 CB LEU A 87 3.338 -3.802 3.246 1.00 0.00 C ATOM 459 CG LEU A 87 2.180 -4.436 2.485 1.00 0.00 C ATOM 460 CD1 LEU A 87 0.864 -3.706 2.761 1.00 0.00 C ATOM 461 CD2 LEU A 87 2.455 -4.570 0.992 1.00 0.00 C ATOM 0 H LEU A 87 3.325 -5.886 4.795 1.00 0.00 H new ATOM 0 HA LEU A 87 4.968 -5.004 2.527 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.973 -3.442 4.208 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.690 -2.931 2.692 1.00 0.00 H new ATOM 0 HG LEU A 87 2.079 -5.453 2.864 1.00 0.00 H new ATOM 0 HD11 LEU A 87 0.059 -4.184 2.203 1.00 0.00 H new ATOM 0 HD12 LEU A 87 0.641 -3.748 3.827 1.00 0.00 H new ATOM 0 HD13 LEU A 87 0.953 -2.665 2.450 1.00 0.00 H new ATOM 0 HD21 LEU A 87 1.595 -5.028 0.503 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.632 -3.583 0.565 1.00 0.00 H new ATOM 0 HD23 LEU A 87 3.335 -5.195 0.839 1.00 0.00 H new ATOM 462 N TYR A 88 6.635 -3.643 3.662 1.00 0.00 N ATOM 463 CA TYR A 88 7.786 -2.945 4.266 1.00 0.00 C ATOM 464 C TYR A 88 8.139 -1.636 3.557 1.00 0.00 C ATOM 465 O TYR A 88 7.959 -1.491 2.343 1.00 0.00 O ATOM 466 CB TYR A 88 9.052 -3.830 4.387 1.00 0.00 C ATOM 467 CG TYR A 88 9.647 -4.388 3.093 1.00 0.00 C ATOM 468 CD1 TYR A 88 8.850 -5.172 2.232 1.00 0.00 C ATOM 469 CD2 TYR A 88 10.997 -4.105 2.815 1.00 0.00 C ATOM 470 CE1 TYR A 88 9.417 -5.650 1.034 1.00 0.00 C ATOM 471 CE2 TYR A 88 11.564 -4.596 1.621 1.00 0.00 C ATOM 472 CZ TYR A 88 10.762 -5.347 0.746 1.00 0.00 C ATOM 473 OH TYR A 88 11.222 -5.633 -0.497 1.00 0.00 O ATOM 0 H TYR A 88 6.733 -3.792 2.658 1.00 0.00 H new ATOM 0 HA TYR A 88 7.447 -2.706 5.274 1.00 0.00 H new ATOM 0 HB2 TYR A 88 9.824 -3.247 4.889 1.00 0.00 H new ATOM 0 HB3 TYR A 88 8.814 -4.671 5.038 1.00 0.00 H new ATOM 0 HD1 TYR A 88 7.826 -5.401 2.486 1.00 0.00 H new ATOM 0 HD2 TYR A 88 11.589 -3.522 3.505 1.00 0.00 H new ATOM 0 HE1 TYR A 88 8.829 -6.240 0.347 1.00 0.00 H new ATOM 0 HE2 TYR A 88 12.599 -4.398 1.383 1.00 0.00 H new ATOM 0 HH TYR A 88 12.165 -5.374 -0.565 1.00 0.00 H new ATOM 474 N GLY A 89 8.744 -0.761 4.354 1.00 0.00 N ATOM 475 CA GLY A 89 9.134 0.611 3.951 1.00 0.00 C ATOM 476 C GLY A 89 10.495 0.659 3.268 1.00 0.00 C ATOM 477 O GLY A 89 11.413 1.338 3.728 1.00 0.00 O ATOM 0 H GLY A 89 8.988 -0.978 5.320 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.379 1.015 3.277 1.00 0.00 H new ATOM 0 HA3 GLY A 89 9.151 1.253 4.832 1.00 0.00 H new ATOM 478 N SER A 90 10.569 -0.026 2.123 1.00 0.00 N ATOM 479 CA SER A 90 11.795 -0.153 1.314 1.00 0.00 C ATOM 480 C SER A 90 12.289 1.163 0.685 1.00 0.00 C ATOM 481 O SER A 90 11.681 1.701 -0.240 1.00 0.00 O ATOM 482 CB SER A 90 11.639 -1.253 0.259 1.00 0.00 C ATOM 483 OG SER A 90 12.758 -1.249 -0.638 1.00 0.00 O ATOM 0 H SER A 90 9.770 -0.517 1.722 1.00 0.00 H new ATOM 0 HA SER A 90 12.579 -0.438 2.016 1.00 0.00 H new ATOM 0 HB2 SER A 90 11.559 -2.225 0.747 1.00 0.00 H new ATOM 0 HB3 SER A 90 10.716 -1.101 -0.300 1.00 0.00 H new ATOM 0 HG SER A 90 12.552 -0.690 -1.416 1.00 0.00 H new ATOM 484 N GLN A 91 13.454 1.590 1.139 1.00 0.00 N ATOM 485 CA GLN A 91 14.198 2.775 0.638 1.00 0.00 C ATOM 486 C GLN A 91 14.421 2.822 -0.882 1.00 0.00 C ATOM 487 O GLN A 91 14.549 3.899 -1.466 1.00 0.00 O ATOM 488 CB GLN A 91 15.580 2.796 1.290 1.00 0.00 C ATOM 489 CG GLN A 91 15.606 3.319 2.732 1.00 0.00 C ATOM 490 CD GLN A 91 15.034 2.336 3.756 1.00 0.00 C ATOM 491 OE1 GLN A 91 15.016 1.118 3.586 1.00 0.00 O ATOM 492 NE2 GLN A 91 14.553 2.846 4.867 1.00 0.00 N ATOM 0 H GLN A 91 13.943 1.115 1.897 1.00 0.00 H new ATOM 0 HA GLN A 91 13.574 3.631 0.894 1.00 0.00 H new ATOM 0 HB2 GLN A 91 15.987 1.785 1.278 1.00 0.00 H new ATOM 0 HB3 GLN A 91 16.243 3.413 0.683 1.00 0.00 H new ATOM 0 HG2 GLN A 91 16.635 3.555 3.004 1.00 0.00 H new ATOM 0 HG3 GLN A 91 15.041 4.250 2.781 1.00 0.00 H new ATOM 0 HE21 GLN A 91 14.566 3.856 5.012 1.00 0.00 H new ATOM 0 HE22 GLN A 91 14.167 2.232 5.584 1.00 0.00 H new ATOM 493 N THR A 92 14.588 1.649 -1.469 1.00 0.00 N ATOM 494 CA THR A 92 14.909 1.474 -2.902 1.00 0.00 C ATOM 495 C THR A 92 13.748 0.813 -3.676 1.00 0.00 C ATOM 496 O THR A 92 12.945 0.101 -3.057 1.00 0.00 O ATOM 497 CB THR A 92 16.244 0.711 -3.017 1.00 0.00 C ATOM 498 OG1 THR A 92 16.776 0.935 -4.320 1.00 0.00 O ATOM 499 CG2 THR A 92 16.143 -0.797 -2.749 1.00 0.00 C ATOM 0 H THR A 92 14.506 0.766 -0.965 1.00 0.00 H new ATOM 0 HA THR A 92 15.034 2.447 -3.377 1.00 0.00 H new ATOM 0 HB THR A 92 16.899 1.099 -2.237 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.627 0.458 -4.412 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.128 -1.252 -2.852 1.00 0.00 H new ATOM 0 HG22 THR A 92 15.771 -0.963 -1.738 1.00 0.00 H new ATOM 0 HG23 THR A 92 15.458 -1.249 -3.467 1.00 0.00 H new ATOM 500 N PRO A 93 13.617 1.055 -4.989 1.00 0.00 N ATOM 501 CA PRO A 93 12.571 0.432 -5.790 1.00 0.00 C ATOM 502 C PRO A 93 12.963 -0.831 -6.558 1.00 0.00 C ATOM 503 O PRO A 93 14.034 -0.965 -7.154 1.00 0.00 O ATOM 504 CB PRO A 93 12.103 1.512 -6.757 1.00 0.00 C ATOM 505 CG PRO A 93 13.410 2.254 -7.063 1.00 0.00 C ATOM 506 CD PRO A 93 14.204 2.163 -5.747 1.00 0.00 C ATOM 0 HA PRO A 93 11.799 0.072 -5.110 1.00 0.00 H new ATOM 0 HB2 PRO A 93 11.654 1.089 -7.656 1.00 0.00 H new ATOM 0 HB3 PRO A 93 11.357 2.167 -6.307 1.00 0.00 H new ATOM 0 HG2 PRO A 93 13.950 1.789 -7.888 1.00 0.00 H new ATOM 0 HG3 PRO A 93 13.224 3.290 -7.347 1.00 0.00 H new ATOM 0 HD2 PRO A 93 15.261 1.984 -5.942 1.00 0.00 H new ATOM 0 HD3 PRO A 93 14.137 3.096 -5.187 1.00 0.00 H new ATOM 507 N ASN A 94 12.089 -1.796 -6.361 1.00 0.00 N ATOM 508 CA ASN A 94 12.070 -3.079 -7.090 1.00 0.00 C ATOM 509 C ASN A 94 10.617 -3.363 -7.499 1.00 0.00 C ATOM 510 O ASN A 94 9.706 -2.674 -7.055 1.00 0.00 O ATOM 511 CB ASN A 94 12.613 -4.119 -6.106 1.00 0.00 C ATOM 512 CG ASN A 94 12.981 -5.448 -6.768 1.00 0.00 C ATOM 513 OD1 ASN A 94 12.133 -6.272 -7.077 1.00 0.00 O ATOM 514 ND2 ASN A 94 14.258 -5.684 -6.951 1.00 0.00 N ATOM 0 H ASN A 94 11.342 -1.722 -5.670 1.00 0.00 H new ATOM 0 HA ASN A 94 12.673 -3.085 -7.998 1.00 0.00 H new ATOM 0 HB2 ASN A 94 13.494 -3.713 -5.609 1.00 0.00 H new ATOM 0 HB3 ASN A 94 11.867 -4.301 -5.333 1.00 0.00 H new ATOM 0 HD21 ASN A 94 14.560 -6.569 -7.358 1.00 0.00 H new ATOM 0 HD22 ASN A 94 14.949 -4.982 -6.686 1.00 0.00 H new ATOM 515 N GLU A 95 10.394 -4.451 -8.235 1.00 0.00 N ATOM 516 CA GLU A 95 9.039 -4.961 -8.589 1.00 0.00 C ATOM 517 C GLU A 95 8.133 -5.094 -7.354 1.00 0.00 C ATOM 518 O GLU A 95 6.923 -4.949 -7.417 1.00 0.00 O ATOM 519 CB GLU A 95 9.175 -6.384 -9.125 1.00 0.00 C ATOM 520 CG GLU A 95 10.183 -6.562 -10.271 1.00 0.00 C ATOM 521 CD GLU A 95 10.305 -8.031 -10.662 1.00 0.00 C ATOM 522 OE1 GLU A 95 11.037 -8.743 -9.936 1.00 0.00 O ATOM 523 OE2 GLU A 95 9.674 -8.396 -11.677 1.00 0.00 O ATOM 0 H GLU A 95 11.149 -5.022 -8.615 1.00 0.00 H new ATOM 0 HA GLU A 95 8.614 -4.258 -9.306 1.00 0.00 H new ATOM 0 HB2 GLU A 95 9.466 -7.038 -8.303 1.00 0.00 H new ATOM 0 HB3 GLU A 95 8.197 -6.720 -9.469 1.00 0.00 H new ATOM 0 HG2 GLU A 95 9.866 -5.976 -11.134 1.00 0.00 H new ATOM 0 HG3 GLU A 95 11.157 -6.180 -9.967 1.00 0.00 H new ATOM 524 N GLU A 96 8.757 -5.562 -6.275 1.00 0.00 N ATOM 525 CA GLU A 96 8.199 -5.596 -4.906 1.00 0.00 C ATOM 526 C GLU A 96 7.506 -4.288 -4.511 1.00 0.00 C ATOM 527 O GLU A 96 6.319 -4.303 -4.178 1.00 0.00 O ATOM 528 CB GLU A 96 9.360 -5.836 -3.941 1.00 0.00 C ATOM 529 CG GLU A 96 9.777 -7.308 -4.053 1.00 0.00 C ATOM 530 CD GLU A 96 10.691 -7.766 -2.910 1.00 0.00 C ATOM 531 OE1 GLU A 96 11.869 -7.357 -2.962 1.00 0.00 O ATOM 532 OE2 GLU A 96 10.247 -8.614 -2.100 1.00 0.00 O ATOM 0 H GLU A 96 9.701 -5.945 -6.322 1.00 0.00 H new ATOM 0 HA GLU A 96 7.448 -6.385 -4.866 1.00 0.00 H new ATOM 0 HB2 GLU A 96 10.198 -5.183 -4.185 1.00 0.00 H new ATOM 0 HB3 GLU A 96 9.060 -5.602 -2.919 1.00 0.00 H new ATOM 0 HG2 GLU A 96 8.883 -7.932 -4.067 1.00 0.00 H new ATOM 0 HG3 GLU A 96 10.289 -7.463 -5.003 1.00 0.00 H new ATOM 533 N CYS A 97 8.198 -3.189 -4.819 1.00 0.00 N ATOM 534 CA CYS A 97 7.815 -1.806 -4.511 1.00 0.00 C ATOM 535 C CYS A 97 6.981 -1.170 -5.655 1.00 0.00 C ATOM 536 O CYS A 97 6.622 0.006 -5.605 1.00 0.00 O ATOM 537 CB CYS A 97 9.100 -0.998 -4.341 1.00 0.00 C ATOM 538 SG CYS A 97 10.356 -1.618 -3.166 1.00 0.00 S ATOM 0 H CYS A 97 9.087 -3.241 -5.316 1.00 0.00 H new ATOM 0 HA CYS A 97 7.205 -1.802 -3.608 1.00 0.00 H new ATOM 0 HB2 CYS A 97 9.572 -0.912 -5.320 1.00 0.00 H new ATOM 0 HB3 CYS A 97 8.822 0.010 -4.032 1.00 0.00 H new ATOM 0 HG CYS A 97 11.388 -0.828 -3.177 1.00 0.00 H new ATOM 539 N LEU A 98 6.739 -1.980 -6.685 1.00 0.00 N ATOM 540 CA LEU A 98 5.992 -1.599 -7.898 1.00 0.00 C ATOM 541 C LEU A 98 4.637 -2.290 -7.899 1.00 0.00 C ATOM 542 O LEU A 98 4.508 -3.508 -7.747 1.00 0.00 O ATOM 543 CB LEU A 98 6.782 -1.895 -9.170 1.00 0.00 C ATOM 544 CG LEU A 98 6.154 -1.175 -10.366 1.00 0.00 C ATOM 545 CD1 LEU A 98 6.142 0.319 -10.186 1.00 0.00 C ATOM 546 CD2 LEU A 98 7.034 -1.316 -11.594 1.00 0.00 C ATOM 0 H LEU A 98 7.063 -2.947 -6.706 1.00 0.00 H new ATOM 0 HA LEU A 98 5.833 -0.521 -7.884 1.00 0.00 H new ATOM 0 HB2 LEU A 98 7.816 -1.575 -9.046 1.00 0.00 H new ATOM 0 HB3 LEU A 98 6.801 -2.969 -9.353 1.00 0.00 H new ATOM 0 HG LEU A 98 5.159 -1.610 -10.459 1.00 0.00 H new ATOM 0 HD11 LEU A 98 5.687 0.787 -11.059 1.00 0.00 H new ATOM 0 HD12 LEU A 98 5.566 0.574 -9.296 1.00 0.00 H new ATOM 0 HD13 LEU A 98 7.164 0.680 -10.072 1.00 0.00 H new ATOM 0 HD21 LEU A 98 6.572 -0.798 -12.434 1.00 0.00 H new ATOM 0 HD22 LEU A 98 8.012 -0.880 -11.393 1.00 0.00 H new ATOM 0 HD23 LEU A 98 7.151 -2.372 -11.839 1.00 0.00 H new ATOM 547 N PHE A 99 3.640 -1.441 -8.066 1.00 0.00 N ATOM 548 CA PHE A 99 2.251 -1.858 -7.957 1.00 0.00 C ATOM 549 C PHE A 99 1.303 -1.625 -9.126 1.00 0.00 C ATOM 550 O PHE A 99 1.124 -0.509 -9.599 1.00 0.00 O ATOM 551 CB PHE A 99 1.654 -1.201 -6.701 1.00 0.00 C ATOM 552 CG PHE A 99 2.098 -1.880 -5.394 1.00 0.00 C ATOM 553 CD1 PHE A 99 1.379 -2.991 -4.891 1.00 0.00 C ATOM 554 CD2 PHE A 99 3.216 -1.356 -4.713 1.00 0.00 C ATOM 555 CE1 PHE A 99 1.785 -3.583 -3.681 1.00 0.00 C ATOM 556 CE2 PHE A 99 3.622 -1.961 -3.499 1.00 0.00 C ATOM 557 CZ PHE A 99 2.893 -3.062 -2.991 1.00 0.00 C ATOM 0 H PHE A 99 3.766 -0.452 -8.279 1.00 0.00 H new ATOM 0 HA PHE A 99 2.321 -2.945 -7.925 1.00 0.00 H new ATOM 0 HB2 PHE A 99 1.945 -0.151 -6.675 1.00 0.00 H new ATOM 0 HB3 PHE A 99 0.566 -1.229 -6.766 1.00 0.00 H new ATOM 0 HD1 PHE A 99 0.528 -3.380 -5.430 1.00 0.00 H new ATOM 0 HD2 PHE A 99 3.753 -0.508 -5.111 1.00 0.00 H new ATOM 0 HE1 PHE A 99 1.249 -4.433 -3.285 1.00 0.00 H new ATOM 0 HE2 PHE A 99 4.482 -1.585 -2.965 1.00 0.00 H new ATOM 0 HZ PHE A 99 3.194 -3.510 -2.056 1.00 0.00 H new ATOM 558 N LEU A 100 0.618 -2.707 -9.483 1.00 0.00 N ATOM 559 CA LEU A 100 -0.321 -2.767 -10.606 1.00 0.00 C ATOM 560 C LEU A 100 -1.706 -2.203 -10.255 1.00 0.00 C ATOM 561 O LEU A 100 -2.464 -2.821 -9.516 1.00 0.00 O ATOM 562 CB LEU A 100 -0.446 -4.239 -10.997 1.00 0.00 C ATOM 563 CG LEU A 100 -0.801 -4.356 -12.480 1.00 0.00 C ATOM 564 CD1 LEU A 100 0.457 -4.102 -13.312 1.00 0.00 C ATOM 565 CD2 LEU A 100 -1.336 -5.758 -12.766 1.00 0.00 C ATOM 0 H LEU A 100 0.701 -3.594 -8.986 1.00 0.00 H new ATOM 0 HA LEU A 100 0.058 -2.153 -11.423 1.00 0.00 H new ATOM 0 HB2 LEU A 100 0.491 -4.758 -10.797 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -1.213 -4.721 -10.391 1.00 0.00 H new ATOM 0 HG LEU A 100 -1.565 -3.623 -12.739 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.215 -4.183 -14.372 1.00 0.00 H new ATOM 0 HD12 LEU A 100 0.836 -3.102 -13.102 1.00 0.00 H new ATOM 0 HD13 LEU A 100 1.218 -4.840 -13.056 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -1.589 -5.842 -13.823 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.574 -6.496 -12.515 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.227 -5.937 -12.164 1.00 0.00 H new ATOM 566 N GLU A 101 -1.984 -1.022 -10.812 1.00 0.00 N ATOM 567 CA GLU A 101 -3.276 -0.330 -10.681 1.00 0.00 C ATOM 568 C GLU A 101 -4.400 -1.109 -11.379 1.00 0.00 C ATOM 569 O GLU A 101 -4.493 -1.241 -12.599 1.00 0.00 O ATOM 570 CB GLU A 101 -3.141 1.089 -11.214 1.00 0.00 C ATOM 571 CG GLU A 101 -4.407 1.942 -11.070 1.00 0.00 C ATOM 572 CD GLU A 101 -4.224 3.318 -11.696 1.00 0.00 C ATOM 573 OE1 GLU A 101 -4.290 3.401 -12.943 1.00 0.00 O ATOM 574 OE2 GLU A 101 -3.967 4.275 -10.924 1.00 0.00 O ATOM 0 H GLU A 101 -1.308 -0.508 -11.377 1.00 0.00 H new ATOM 0 HA GLU A 101 -3.552 -0.277 -9.628 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -2.322 1.584 -10.692 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -2.866 1.044 -12.268 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -5.246 1.433 -11.545 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -4.656 2.051 -10.014 1.00 0.00 H new ATOM 575 N ARG A 102 -5.088 -1.768 -10.474 1.00 0.00 N ATOM 576 CA ARG A 102 -6.241 -2.671 -10.661 1.00 0.00 C ATOM 577 C ARG A 102 -7.591 -1.943 -10.625 1.00 0.00 C ATOM 578 O ARG A 102 -8.604 -2.545 -10.985 1.00 0.00 O ATOM 579 CB ARG A 102 -6.147 -3.651 -9.502 1.00 0.00 C ATOM 580 CG ARG A 102 -5.014 -4.669 -9.665 1.00 0.00 C ATOM 581 CD ARG A 102 -5.263 -5.655 -10.809 1.00 0.00 C ATOM 582 NE ARG A 102 -6.233 -6.674 -10.397 1.00 0.00 N ATOM 583 CZ ARG A 102 -6.912 -7.502 -11.199 1.00 0.00 C ATOM 584 NH1 ARG A 102 -6.803 -7.463 -12.526 1.00 0.00 N ATOM 585 NH2 ARG A 102 -7.728 -8.413 -10.697 1.00 0.00 N ATOM 0 H ARG A 102 -4.844 -1.689 -9.487 1.00 0.00 H new ATOM 0 HA ARG A 102 -6.201 -3.146 -11.641 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -5.998 -3.096 -8.576 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -7.094 -4.183 -9.406 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -4.079 -4.139 -9.845 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -4.892 -5.223 -8.734 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -5.634 -5.122 -11.684 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -4.326 -6.131 -11.099 1.00 0.00 H new ATOM 0 HE ARG A 102 -6.408 -6.761 -9.396 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -6.183 -6.783 -12.967 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -7.339 -8.113 -13.101 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -7.846 -8.491 -9.687 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -8.240 -9.038 -11.320 1.00 0.00 H new ATOM 586 N LEU A 103 -7.628 -0.947 -9.739 1.00 0.00 N ATOM 587 CA LEU A 103 -8.656 0.102 -9.647 1.00 0.00 C ATOM 588 C LEU A 103 -10.111 -0.382 -9.752 1.00 0.00 C ATOM 589 O LEU A 103 -10.635 -0.690 -10.825 1.00 0.00 O ATOM 590 CB LEU A 103 -8.323 1.172 -10.690 1.00 0.00 C ATOM 591 CG LEU A 103 -9.246 2.396 -10.789 1.00 0.00 C ATOM 592 CD1 LEU A 103 -9.433 3.141 -9.465 1.00 0.00 C ATOM 593 CD2 LEU A 103 -8.685 3.328 -11.873 1.00 0.00 C ATOM 0 H LEU A 103 -6.906 -0.841 -9.027 1.00 0.00 H new ATOM 0 HA LEU A 103 -8.618 0.511 -8.637 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -7.313 1.531 -10.489 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -8.302 0.690 -11.667 1.00 0.00 H new ATOM 0 HG LEU A 103 -10.244 2.045 -11.053 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -10.097 3.992 -9.617 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.869 2.468 -8.727 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -8.466 3.495 -9.107 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -9.324 4.207 -11.963 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -7.677 3.639 -11.599 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -8.656 2.801 -12.827 1.00 0.00 H new ATOM 594 N GLU A 104 -10.807 -0.015 -8.690 1.00 0.00 N ATOM 595 CA GLU A 104 -12.251 -0.280 -8.477 1.00 0.00 C ATOM 596 C GLU A 104 -13.187 0.698 -9.225 1.00 0.00 C ATOM 597 O GLU A 104 -14.367 0.789 -8.907 1.00 0.00 O ATOM 598 CB GLU A 104 -12.549 -0.180 -6.977 1.00 0.00 C ATOM 599 CG GLU A 104 -11.986 -1.359 -6.190 1.00 0.00 C ATOM 600 CD GLU A 104 -12.911 -2.589 -6.150 1.00 0.00 C ATOM 601 OE1 GLU A 104 -13.565 -2.902 -7.168 1.00 0.00 O ATOM 602 OE2 GLU A 104 -12.904 -3.243 -5.080 1.00 0.00 O ATOM 0 H GLU A 104 -10.383 0.495 -7.915 1.00 0.00 H new ATOM 0 HA GLU A 104 -12.448 -1.275 -8.876 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -12.128 0.747 -6.587 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -13.627 -0.129 -6.827 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -11.031 -1.650 -6.627 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -11.784 -1.037 -5.169 1.00 0.00 H new ATOM 603 N GLU A 105 -12.665 1.298 -10.296 1.00 0.00 N ATOM 604 CA GLU A 105 -13.279 2.401 -11.069 1.00 0.00 C ATOM 605 C GLU A 105 -13.565 3.685 -10.291 1.00 0.00 C ATOM 606 O GLU A 105 -12.946 4.722 -10.530 1.00 0.00 O ATOM 607 CB GLU A 105 -14.539 1.943 -11.835 1.00 0.00 C ATOM 608 CG GLU A 105 -14.227 0.958 -12.970 1.00 0.00 C ATOM 609 CD GLU A 105 -13.390 1.605 -14.083 1.00 0.00 C ATOM 610 OE1 GLU A 105 -14.021 2.242 -14.963 1.00 0.00 O ATOM 611 OE2 GLU A 105 -12.154 1.447 -14.031 1.00 0.00 O ATOM 0 H GLU A 105 -11.759 1.021 -10.674 1.00 0.00 H new ATOM 0 HA GLU A 105 -12.497 2.669 -11.780 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -15.232 1.475 -11.136 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -15.044 2.816 -12.248 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -13.691 0.099 -12.567 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -15.160 0.583 -13.390 1.00 0.00 H new ATOM 612 N ASN A 106 -14.332 3.509 -9.223 1.00 0.00 N ATOM 613 CA ASN A 106 -14.802 4.550 -8.306 1.00 0.00 C ATOM 614 C ASN A 106 -13.741 4.964 -7.269 1.00 0.00 C ATOM 615 O ASN A 106 -13.805 4.622 -6.093 1.00 0.00 O ATOM 616 CB ASN A 106 -16.063 3.962 -7.692 1.00 0.00 C ATOM 617 CG ASN A 106 -17.272 4.154 -8.630 1.00 0.00 C ATOM 618 OD1 ASN A 106 -17.242 3.841 -9.815 1.00 0.00 O ATOM 619 ND2 ASN A 106 -18.332 4.727 -8.128 1.00 0.00 N ATOM 0 H ASN A 106 -14.665 2.583 -8.954 1.00 0.00 H new ATOM 0 HA ASN A 106 -15.007 5.490 -8.818 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -15.915 2.900 -7.495 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -16.262 4.440 -6.733 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -19.139 4.916 -8.722 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -18.353 4.986 -7.142 1.00 0.00 H new ATOM 620 N HIS A 107 -12.623 5.430 -7.844 1.00 0.00 N ATOM 621 CA HIS A 107 -11.495 6.115 -7.175 1.00 0.00 C ATOM 622 C HIS A 107 -10.536 5.220 -6.364 1.00 0.00 C ATOM 623 O HIS A 107 -9.330 5.451 -6.321 1.00 0.00 O ATOM 624 CB HIS A 107 -11.984 7.272 -6.295 1.00 0.00 C ATOM 625 CG HIS A 107 -12.715 8.380 -7.069 1.00 0.00 C ATOM 626 ND1 HIS A 107 -13.382 8.255 -8.216 1.00 0.00 N ATOM 627 CD2 HIS A 107 -12.900 9.617 -6.620 1.00 0.00 C ATOM 628 CE1 HIS A 107 -13.998 9.410 -8.469 1.00 0.00 C ATOM 629 NE2 HIS A 107 -13.688 10.245 -7.484 1.00 0.00 N ATOM 0 H HIS A 107 -12.468 5.336 -8.848 1.00 0.00 H new ATOM 0 HA HIS A 107 -10.902 6.488 -8.010 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -12.652 6.876 -5.530 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -11.129 7.708 -5.777 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -12.484 10.036 -5.715 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -14.631 9.626 -9.317 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -14.004 11.212 -7.404 1.00 0.00 H new ATOM 630 N TYR A 108 -11.111 4.221 -5.699 1.00 0.00 N ATOM 631 CA TYR A 108 -10.375 3.240 -4.883 1.00 0.00 C ATOM 632 C TYR A 108 -9.426 2.377 -5.703 1.00 0.00 C ATOM 633 O TYR A 108 -9.821 1.517 -6.493 1.00 0.00 O ATOM 634 CB TYR A 108 -11.341 2.336 -4.105 1.00 0.00 C ATOM 635 CG TYR A 108 -12.272 3.105 -3.168 1.00 0.00 C ATOM 636 CD1 TYR A 108 -11.728 4.013 -2.224 1.00 0.00 C ATOM 637 CD2 TYR A 108 -13.627 3.126 -3.532 1.00 0.00 C ATOM 638 CE1 TYR A 108 -12.558 5.013 -1.697 1.00 0.00 C ATOM 639 CE2 TYR A 108 -14.463 4.132 -3.009 1.00 0.00 C ATOM 640 CZ TYR A 108 -13.907 5.067 -2.115 1.00 0.00 C ATOM 641 OH TYR A 108 -14.732 5.955 -1.502 1.00 0.00 O ATOM 0 H TYR A 108 -12.118 4.062 -5.708 1.00 0.00 H new ATOM 0 HA TYR A 108 -9.773 3.823 -4.186 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -11.941 1.764 -4.813 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -10.765 1.617 -3.523 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -10.695 3.936 -1.917 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -14.024 2.380 -4.205 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -12.174 5.728 -0.985 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -15.505 4.185 -3.287 1.00 0.00 H new ATOM 0 HH TYR A 108 -15.630 5.887 -1.888 1.00 0.00 H new ATOM 642 N ASN A 109 -8.157 2.713 -5.528 1.00 0.00 N ATOM 643 CA ASN A 109 -7.051 2.006 -6.188 1.00 0.00 C ATOM 644 C ASN A 109 -6.575 0.770 -5.424 1.00 0.00 C ATOM 645 O ASN A 109 -6.226 0.822 -4.249 1.00 0.00 O ATOM 646 CB ASN A 109 -5.918 3.009 -6.373 1.00 0.00 C ATOM 647 CG ASN A 109 -5.799 3.513 -7.826 1.00 0.00 C ATOM 648 OD1 ASN A 109 -6.475 3.074 -8.738 1.00 0.00 O ATOM 649 ND2 ASN A 109 -4.751 4.233 -8.117 1.00 0.00 N ATOM 0 H ASN A 109 -7.857 3.481 -4.927 1.00 0.00 H new ATOM 0 HA ASN A 109 -7.401 1.623 -7.147 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -6.079 3.859 -5.710 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -4.977 2.547 -6.075 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -4.513 4.417 -9.092 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -4.169 4.612 -7.370 1.00 0.00 H new ATOM 650 N THR A 110 -6.848 -0.359 -6.070 1.00 0.00 N ATOM 651 CA THR A 110 -6.293 -1.672 -5.720 1.00 0.00 C ATOM 652 C THR A 110 -4.992 -1.846 -6.524 1.00 0.00 C ATOM 653 O THR A 110 -4.886 -1.371 -7.662 1.00 0.00 O ATOM 654 CB THR A 110 -7.327 -2.743 -6.110 1.00 0.00 C ATOM 655 OG1 THR A 110 -7.963 -2.347 -7.331 1.00 0.00 O ATOM 656 CG2 THR A 110 -8.356 -2.950 -5.013 1.00 0.00 C ATOM 0 H THR A 110 -7.477 -0.392 -6.872 1.00 0.00 H new ATOM 0 HA THR A 110 -6.078 -1.762 -4.655 1.00 0.00 H new ATOM 0 HB THR A 110 -6.815 -3.695 -6.251 1.00 0.00 H new ATOM 0 HG1 THR A 110 -8.604 -3.036 -7.604 1.00 0.00 H new ATOM 0 HG21 THR A 110 -9.070 -3.713 -5.323 1.00 0.00 H new ATOM 0 HG22 THR A 110 -7.855 -3.272 -4.100 1.00 0.00 H new ATOM 0 HG23 THR A 110 -8.883 -2.014 -4.827 1.00 0.00 H new ATOM 657 N TYR A 111 -3.999 -2.492 -5.917 1.00 0.00 N ATOM 658 CA TYR A 111 -2.653 -2.577 -6.489 1.00 0.00 C ATOM 659 C TYR A 111 -1.970 -3.926 -6.200 1.00 0.00 C ATOM 660 O TYR A 111 -1.727 -4.238 -5.028 1.00 0.00 O ATOM 661 CB TYR A 111 -1.748 -1.473 -5.937 1.00 0.00 C ATOM 662 CG TYR A 111 -2.227 -0.034 -6.094 1.00 0.00 C ATOM 663 CD1 TYR A 111 -2.073 0.581 -7.359 1.00 0.00 C ATOM 664 CD2 TYR A 111 -2.527 0.711 -4.933 1.00 0.00 C ATOM 665 CE1 TYR A 111 -2.213 1.978 -7.463 1.00 0.00 C ATOM 666 CE2 TYR A 111 -2.653 2.109 -5.034 1.00 0.00 C ATOM 667 CZ TYR A 111 -2.486 2.725 -6.295 1.00 0.00 C ATOM 668 OH TYR A 111 -2.576 4.074 -6.358 1.00 0.00 O ATOM 0 H TYR A 111 -4.101 -2.969 -5.021 1.00 0.00 H new ATOM 0 HA TYR A 111 -2.786 -2.466 -7.565 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -1.593 -1.663 -4.875 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -0.776 -1.560 -6.422 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -1.851 -0.013 -8.233 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -2.658 0.216 -3.982 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -2.113 2.470 -8.419 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -2.874 2.703 -4.160 1.00 0.00 H new ATOM 0 HH TYR A 111 -2.198 4.388 -7.206 1.00 0.00 H new ATOM 669 N ILE A 112 -1.705 -4.711 -7.246 1.00 0.00 N ATOM 670 CA ILE A 112 -0.919 -5.959 -7.066 1.00 0.00 C ATOM 671 C ILE A 112 0.583 -5.619 -7.060 1.00 0.00 C ATOM 672 O ILE A 112 1.081 -4.920 -7.943 1.00 0.00 O ATOM 673 CB ILE A 112 -1.068 -7.070 -8.147 1.00 0.00 C ATOM 674 CG1 ILE A 112 -2.475 -7.174 -8.742 1.00 0.00 C ATOM 675 CG2 ILE A 112 -0.466 -8.401 -7.633 1.00 0.00 C ATOM 676 CD1 ILE A 112 -3.313 -8.456 -8.605 1.00 0.00 C ATOM 0 H ILE A 112 -2.006 -4.524 -8.202 1.00 0.00 H new ATOM 0 HA ILE A 112 -1.321 -6.358 -6.135 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.476 -6.779 -9.015 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -3.062 -6.364 -8.310 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -2.384 -6.968 -9.808 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -0.576 -9.170 -8.398 1.00 0.00 H new ATOM 0 HG22 ILE A 112 0.592 -8.260 -7.410 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -0.989 -8.712 -6.728 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -4.275 -8.316 -9.097 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.785 -9.288 -9.071 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.474 -8.675 -7.549 1.00 0.00 H new ATOM 677 N SER A 113 1.290 -6.259 -6.136 1.00 0.00 N ATOM 678 CA SER A 113 2.766 -6.280 -6.135 1.00 0.00 C ATOM 679 C SER A 113 3.258 -7.002 -7.396 1.00 0.00 C ATOM 680 O SER A 113 2.909 -8.158 -7.623 1.00 0.00 O ATOM 681 CB SER A 113 3.301 -6.987 -4.892 1.00 0.00 C ATOM 682 OG SER A 113 4.731 -7.033 -4.906 1.00 0.00 O ATOM 0 H SER A 113 0.868 -6.778 -5.366 1.00 0.00 H new ATOM 0 HA SER A 113 3.133 -5.254 -6.125 1.00 0.00 H new ATOM 0 HB2 SER A 113 2.959 -6.467 -3.997 1.00 0.00 H new ATOM 0 HB3 SER A 113 2.901 -8.000 -4.844 1.00 0.00 H new ATOM 0 HG SER A 113 5.038 -7.808 -4.392 1.00 0.00 H new ATOM 683 N LYS A 114 3.908 -6.257 -8.277 1.00 0.00 N ATOM 684 CA LYS A 114 4.492 -6.772 -9.535 1.00 0.00 C ATOM 685 C LYS A 114 5.321 -8.056 -9.406 1.00 0.00 C ATOM 686 O LYS A 114 5.285 -8.905 -10.290 1.00 0.00 O ATOM 687 CB LYS A 114 5.317 -5.686 -10.220 1.00 0.00 C ATOM 688 CG LYS A 114 4.400 -4.646 -10.853 1.00 0.00 C ATOM 689 CD LYS A 114 3.673 -5.193 -12.091 1.00 0.00 C ATOM 690 CE LYS A 114 4.599 -5.135 -13.303 1.00 0.00 C ATOM 691 NZ LYS A 114 4.006 -5.811 -14.468 1.00 0.00 N ATOM 0 H LYS A 114 4.055 -5.256 -8.148 1.00 0.00 H new ATOM 0 HA LYS A 114 3.632 -7.051 -10.144 1.00 0.00 H new ATOM 0 HB2 LYS A 114 5.975 -5.207 -9.495 1.00 0.00 H new ATOM 0 HB3 LYS A 114 5.955 -6.131 -10.983 1.00 0.00 H new ATOM 0 HG2 LYS A 114 3.666 -4.316 -10.118 1.00 0.00 H new ATOM 0 HG3 LYS A 114 4.985 -3.771 -11.134 1.00 0.00 H new ATOM 0 HD2 LYS A 114 3.356 -6.221 -11.913 1.00 0.00 H new ATOM 0 HD3 LYS A 114 2.772 -4.610 -12.282 1.00 0.00 H new ATOM 0 HE2 LYS A 114 4.809 -4.095 -13.552 1.00 0.00 H new ATOM 0 HE3 LYS A 114 5.552 -5.602 -13.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 4.661 -5.753 -15.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 3.829 -6.809 -14.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 3.108 -5.349 -14.718 1.00 0.00 H new ATOM 692 N LYS A 115 6.043 -8.176 -8.286 1.00 0.00 N ATOM 693 CA LYS A 115 6.720 -9.444 -7.963 1.00 0.00 C ATOM 694 C LYS A 115 5.668 -10.514 -7.621 1.00 0.00 C ATOM 695 O LYS A 115 5.513 -11.512 -8.327 1.00 0.00 O ATOM 696 CB LYS A 115 7.729 -9.267 -6.820 1.00 0.00 C ATOM 697 CG LYS A 115 8.380 -10.627 -6.547 1.00 0.00 C ATOM 698 CD LYS A 115 8.870 -10.856 -5.130 1.00 0.00 C ATOM 699 CE LYS A 115 8.801 -12.357 -4.901 1.00 0.00 C ATOM 700 NZ LYS A 115 9.964 -13.083 -5.439 1.00 0.00 N ATOM 0 H LYS A 115 6.174 -7.432 -7.601 1.00 0.00 H new ATOM 0 HA LYS A 115 7.286 -9.771 -8.835 1.00 0.00 H new ATOM 0 HB2 LYS A 115 8.485 -8.530 -7.090 1.00 0.00 H new ATOM 0 HB3 LYS A 115 7.229 -8.897 -5.925 1.00 0.00 H new ATOM 0 HG2 LYS A 115 7.660 -11.408 -6.792 1.00 0.00 H new ATOM 0 HG3 LYS A 115 9.224 -10.747 -7.226 1.00 0.00 H new ATOM 0 HD2 LYS A 115 9.889 -10.489 -5.005 1.00 0.00 H new ATOM 0 HD3 LYS A 115 8.248 -10.323 -4.411 1.00 0.00 H new ATOM 0 HE2 LYS A 115 8.724 -12.551 -3.831 1.00 0.00 H new ATOM 0 HE3 LYS A 115 7.893 -12.746 -5.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 9.856 -14.100 -5.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 10.027 -12.926 -6.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 10.831 -12.737 -4.982 1.00 0.00 H new ATOM 701 N HIS A 116 4.833 -10.185 -6.637 1.00 0.00 N ATOM 702 CA HIS A 116 3.814 -11.097 -6.080 1.00 0.00 C ATOM 703 C HIS A 116 2.521 -11.167 -6.900 1.00 0.00 C ATOM 704 O HIS A 116 1.466 -11.561 -6.412 1.00 0.00 O ATOM 705 CB HIS A 116 3.552 -10.666 -4.639 1.00 0.00 C ATOM 706 CG HIS A 116 4.844 -10.623 -3.809 1.00 0.00 C ATOM 707 ND1 HIS A 116 5.356 -9.545 -3.234 1.00 0.00 N ATOM 708 CD2 HIS A 116 5.591 -11.661 -3.487 1.00 0.00 C ATOM 709 CE1 HIS A 116 6.415 -9.920 -2.533 1.00 0.00 C ATOM 710 NE2 HIS A 116 6.559 -11.231 -2.690 1.00 0.00 N ATOM 0 H HIS A 116 4.839 -9.267 -6.193 1.00 0.00 H new ATOM 0 HA HIS A 116 4.201 -12.115 -6.118 1.00 0.00 H new ATOM 0 HB2 HIS A 116 3.085 -9.681 -4.634 1.00 0.00 H new ATOM 0 HB3 HIS A 116 2.846 -11.356 -4.176 1.00 0.00 H new ATOM 0 HD2 HIS A 116 5.441 -12.679 -3.814 1.00 0.00 H new ATOM 0 HE1 HIS A 116 7.048 -9.276 -1.940 1.00 0.00 H new ATOM 0 HE2 HIS A 116 7.288 -11.807 -2.270 1.00 0.00 H new ATOM 711 N ALA A 117 2.700 -10.999 -8.212 1.00 0.00 N ATOM 712 CA ALA A 117 1.699 -11.317 -9.246 1.00 0.00 C ATOM 713 C ALA A 117 1.482 -12.848 -9.265 1.00 0.00 C ATOM 714 O ALA A 117 0.335 -13.293 -9.268 1.00 0.00 O ATOM 715 CB ALA A 117 2.226 -10.834 -10.602 1.00 0.00 C ATOM 0 H ALA A 117 3.567 -10.628 -8.600 1.00 0.00 H new ATOM 0 HA ALA A 117 0.750 -10.823 -9.036 1.00 0.00 H new ATOM 0 HB1 ALA A 117 1.496 -11.062 -11.378 1.00 0.00 H new ATOM 0 HB2 ALA A 117 2.392 -9.757 -10.565 1.00 0.00 H new ATOM 0 HB3 ALA A 117 3.165 -11.338 -10.828 1.00 0.00 H new ATOM 716 N GLU A 118 2.565 -13.572 -8.968 1.00 0.00 N ATOM 717 CA GLU A 118 2.537 -15.035 -8.796 1.00 0.00 C ATOM 718 C GLU A 118 1.722 -15.565 -7.588 1.00 0.00 C ATOM 719 O GLU A 118 1.454 -16.760 -7.494 1.00 0.00 O ATOM 720 CB GLU A 118 3.962 -15.613 -8.867 1.00 0.00 C ATOM 721 CG GLU A 118 4.962 -14.930 -7.925 1.00 0.00 C ATOM 722 CD GLU A 118 6.397 -15.367 -8.233 1.00 0.00 C ATOM 723 OE1 GLU A 118 6.916 -14.890 -9.270 1.00 0.00 O ATOM 724 OE2 GLU A 118 6.940 -16.167 -7.437 1.00 0.00 O ATOM 0 H GLU A 118 3.490 -13.163 -8.839 1.00 0.00 H new ATOM 0 HA GLU A 118 1.962 -15.413 -9.641 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.924 -16.676 -8.630 1.00 0.00 H new ATOM 0 HB3 GLU A 118 4.327 -15.528 -9.891 1.00 0.00 H new ATOM 0 HG2 GLU A 118 4.879 -13.848 -8.024 1.00 0.00 H new ATOM 0 HG3 GLU A 118 4.718 -15.175 -6.891 1.00 0.00 H new ATOM 725 N LYS A 119 1.396 -14.658 -6.670 1.00 0.00 N ATOM 726 CA LYS A 119 0.515 -14.925 -5.512 1.00 0.00 C ATOM 727 C LYS A 119 -0.724 -14.018 -5.424 1.00 0.00 C ATOM 728 O LYS A 119 -1.495 -14.130 -4.469 1.00 0.00 O ATOM 729 CB LYS A 119 1.399 -14.769 -4.274 1.00 0.00 C ATOM 730 CG LYS A 119 2.223 -16.022 -4.015 1.00 0.00 C ATOM 731 CD LYS A 119 3.566 -15.689 -3.379 1.00 0.00 C ATOM 732 CE LYS A 119 4.536 -15.086 -4.407 1.00 0.00 C ATOM 733 NZ LYS A 119 5.800 -14.782 -3.715 1.00 0.00 N ATOM 0 H LYS A 119 1.737 -13.697 -6.701 1.00 0.00 H new ATOM 0 HA LYS A 119 0.093 -15.925 -5.608 1.00 0.00 H new ATOM 0 HB2 LYS A 119 2.064 -13.916 -4.406 1.00 0.00 H new ATOM 0 HB3 LYS A 119 0.776 -14.556 -3.405 1.00 0.00 H new ATOM 0 HG2 LYS A 119 1.667 -16.695 -3.362 1.00 0.00 H new ATOM 0 HG3 LYS A 119 2.386 -16.551 -4.954 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.418 -14.986 -2.559 1.00 0.00 H new ATOM 0 HD3 LYS A 119 4.002 -16.592 -2.950 1.00 0.00 H new ATOM 0 HE2 LYS A 119 4.708 -15.786 -5.225 1.00 0.00 H new ATOM 0 HE3 LYS A 119 4.114 -14.181 -4.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 6.419 -14.235 -4.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 5.602 -14.226 -2.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 6.273 -15.670 -3.450 1.00 0.00 H new ATOM 734 N ASN A 120 -0.945 -13.199 -6.459 1.00 0.00 N ATOM 735 CA ASN A 120 -1.993 -12.160 -6.545 1.00 0.00 C ATOM 736 C ASN A 120 -2.044 -11.167 -5.375 1.00 0.00 C ATOM 737 O ASN A 120 -2.980 -10.384 -5.280 1.00 0.00 O ATOM 738 CB ASN A 120 -3.376 -12.834 -6.670 1.00 0.00 C ATOM 739 CG ASN A 120 -3.554 -13.714 -7.910 1.00 0.00 C ATOM 740 OD1 ASN A 120 -3.899 -14.889 -7.832 1.00 0.00 O ATOM 741 ND2 ASN A 120 -3.427 -13.149 -9.086 1.00 0.00 N ATOM 0 H ASN A 120 -0.374 -13.240 -7.303 1.00 0.00 H new ATOM 0 HA ASN A 120 -1.731 -11.573 -7.425 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -3.549 -13.443 -5.782 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -4.142 -12.059 -6.679 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -3.615 -13.686 -9.933 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -3.140 -12.172 -9.154 1.00 0.00 H new ATOM 742 N TRP A 121 -0.920 -10.993 -4.684 1.00 0.00 N ATOM 743 CA TRP A 121 -0.892 -10.202 -3.440 1.00 0.00 C ATOM 744 C TRP A 121 -1.041 -8.694 -3.676 1.00 0.00 C ATOM 745 O TRP A 121 -0.227 -8.055 -4.352 1.00 0.00 O ATOM 746 CB TRP A 121 0.376 -10.437 -2.613 1.00 0.00 C ATOM 747 CG TRP A 121 0.554 -11.842 -2.022 1.00 0.00 C ATOM 748 CD1 TRP A 121 -0.398 -12.761 -1.874 1.00 0.00 C ATOM 749 CD2 TRP A 121 1.701 -12.332 -1.420 1.00 0.00 C ATOM 750 NE1 TRP A 121 0.095 -13.825 -1.236 1.00 0.00 N ATOM 751 CE2 TRP A 121 1.358 -13.596 -0.901 1.00 0.00 C ATOM 752 CE3 TRP A 121 3.004 -11.830 -1.264 1.00 0.00 C ATOM 753 CZ2 TRP A 121 2.311 -14.367 -0.204 1.00 0.00 C ATOM 754 CZ3 TRP A 121 3.975 -12.607 -0.603 1.00 0.00 C ATOM 755 CH2 TRP A 121 3.624 -13.862 -0.057 1.00 0.00 C ATOM 0 H TRP A 121 -0.018 -11.383 -4.956 1.00 0.00 H new ATOM 0 HA TRP A 121 -1.758 -10.559 -2.883 1.00 0.00 H new ATOM 0 HB2 TRP A 121 1.239 -10.219 -3.242 1.00 0.00 H new ATOM 0 HB3 TRP A 121 0.388 -9.718 -1.794 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -1.417 -12.661 -2.219 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -0.420 -14.682 -1.037 1.00 0.00 H new ATOM 0 HE3 TRP A 121 3.260 -10.854 -1.649 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 2.043 -15.327 0.211 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 4.988 -12.244 -0.513 1.00 0.00 H new ATOM 0 HH2 TRP A 121 4.364 -14.440 0.477 1.00 0.00 H new ATOM 756 N PHE A 122 -2.146 -8.186 -3.151 1.00 0.00 N ATOM 757 CA PHE A 122 -2.414 -6.736 -3.167 1.00 0.00 C ATOM 758 C PHE A 122 -1.942 -6.079 -1.863 1.00 0.00 C ATOM 759 O PHE A 122 -1.826 -6.719 -0.824 1.00 0.00 O ATOM 760 CB PHE A 122 -3.917 -6.467 -3.277 1.00 0.00 C ATOM 761 CG PHE A 122 -4.579 -6.928 -4.584 1.00 0.00 C ATOM 762 CD1 PHE A 122 -4.962 -8.271 -4.730 1.00 0.00 C ATOM 763 CD2 PHE A 122 -4.999 -5.952 -5.522 1.00 0.00 C ATOM 764 CE1 PHE A 122 -5.774 -8.672 -5.803 1.00 0.00 C ATOM 765 CE2 PHE A 122 -5.824 -6.340 -6.603 1.00 0.00 C ATOM 766 CZ PHE A 122 -6.204 -7.699 -6.730 1.00 0.00 C ATOM 0 H PHE A 122 -2.875 -8.745 -2.708 1.00 0.00 H new ATOM 0 HA PHE A 122 -1.879 -6.324 -4.023 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -4.418 -6.959 -2.443 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -4.086 -5.396 -3.163 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -4.629 -9.003 -4.009 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -4.692 -4.922 -5.412 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -6.064 -9.706 -5.917 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -6.160 -5.609 -7.323 1.00 0.00 H new ATOM 0 HZ PHE A 122 -6.836 -7.996 -7.554 1.00 0.00 H new ATOM 767 N VAL A 123 -1.633 -4.800 -1.989 1.00 0.00 N ATOM 768 CA VAL A 123 -1.493 -3.876 -0.841 1.00 0.00 C ATOM 769 C VAL A 123 -2.858 -3.816 -0.133 1.00 0.00 C ATOM 770 O VAL A 123 -3.891 -3.853 -0.806 1.00 0.00 O ATOM 771 CB VAL A 123 -1.021 -2.499 -1.366 1.00 0.00 C ATOM 772 CG1 VAL A 123 -1.812 -2.000 -2.569 1.00 0.00 C ATOM 773 CG2 VAL A 123 -1.069 -1.405 -0.311 1.00 0.00 C ATOM 0 H VAL A 123 -1.468 -4.355 -2.892 1.00 0.00 H new ATOM 0 HA VAL A 123 -0.748 -4.212 -0.120 1.00 0.00 H new ATOM 0 HB VAL A 123 0.011 -2.689 -1.660 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -1.425 -1.030 -2.882 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -1.714 -2.711 -3.389 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -2.863 -1.901 -2.298 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -0.725 -0.466 -0.745 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -2.093 -1.287 0.045 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -0.424 -1.677 0.524 1.00 0.00 H new ATOM 774 N GLY A 124 -2.843 -3.610 1.181 1.00 0.00 N ATOM 775 CA GLY A 124 -4.085 -3.597 1.984 1.00 0.00 C ATOM 776 C GLY A 124 -3.896 -3.101 3.392 1.00 0.00 C ATOM 777 O GLY A 124 -2.808 -3.130 3.973 1.00 0.00 O ATOM 0 H GLY A 124 -1.993 -3.449 1.721 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -4.823 -2.969 1.484 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -4.495 -4.606 2.017 1.00 0.00 H new ATOM 778 N LEU A 125 -4.924 -2.358 3.741 1.00 0.00 N ATOM 779 CA LEU A 125 -5.074 -1.738 5.055 1.00 0.00 C ATOM 780 C LEU A 125 -5.632 -2.677 6.099 1.00 0.00 C ATOM 781 O LEU A 125 -6.765 -3.156 6.046 1.00 0.00 O ATOM 782 CB LEU A 125 -5.844 -0.427 4.944 1.00 0.00 C ATOM 783 CG LEU A 125 -4.801 0.679 5.036 1.00 0.00 C ATOM 784 CD1 LEU A 125 -3.771 0.639 3.922 1.00 0.00 C ATOM 785 CD2 LEU A 125 -5.497 2.042 5.058 1.00 0.00 C ATOM 0 H LEU A 125 -5.700 -2.159 3.110 1.00 0.00 H new ATOM 0 HA LEU A 125 -4.075 -1.497 5.419 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -6.389 -0.373 4.001 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -6.580 -0.337 5.743 1.00 0.00 H new ATOM 0 HG LEU A 125 -4.253 0.515 5.964 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -3.061 1.456 4.053 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -3.239 -0.312 3.952 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -4.272 0.744 2.960 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -4.749 2.832 5.124 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -6.078 2.168 4.145 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -6.160 2.098 5.921 1.00 0.00 H new ATOM 786 N LYS A 126 -4.715 -3.019 6.980 1.00 0.00 N ATOM 787 CA LYS A 126 -5.034 -3.927 8.055 1.00 0.00 C ATOM 788 C LYS A 126 -5.867 -3.202 9.135 1.00 0.00 C ATOM 789 O LYS A 126 -5.327 -2.447 9.947 1.00 0.00 O ATOM 790 CB LYS A 126 -3.715 -4.497 8.602 1.00 0.00 C ATOM 791 CG LYS A 126 -3.761 -6.003 8.883 1.00 0.00 C ATOM 792 CD LYS A 126 -3.745 -6.341 10.377 1.00 0.00 C ATOM 793 CE LYS A 126 -4.792 -5.605 11.229 1.00 0.00 C ATOM 794 NZ LYS A 126 -5.571 -6.605 11.950 1.00 0.00 N ATOM 0 H LYS A 126 -3.752 -2.684 6.971 1.00 0.00 H new ATOM 0 HA LYS A 126 -5.648 -4.755 7.702 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -2.918 -4.295 7.886 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -3.458 -3.973 9.522 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -4.660 -6.422 8.432 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -2.909 -6.482 8.400 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -3.897 -7.414 10.491 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -2.755 -6.115 10.773 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -4.305 -4.925 11.928 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -5.441 -5.000 10.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -6.575 -6.512 11.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -5.236 -7.556 11.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -5.458 -6.461 12.974 1.00 0.00 H new ATOM 795 N LYS A 127 -7.174 -3.475 9.069 1.00 0.00 N ATOM 796 CA LYS A 127 -8.284 -2.748 9.742 1.00 0.00 C ATOM 797 C LYS A 127 -8.367 -2.766 11.277 1.00 0.00 C ATOM 798 O LYS A 127 -9.420 -2.917 11.917 1.00 0.00 O ATOM 799 CB LYS A 127 -9.646 -3.102 9.130 1.00 0.00 C ATOM 800 CG LYS A 127 -9.925 -4.594 9.002 1.00 0.00 C ATOM 801 CD LYS A 127 -9.782 -4.963 7.527 1.00 0.00 C ATOM 802 CE LYS A 127 -9.651 -6.475 7.374 1.00 0.00 C ATOM 803 NZ LYS A 127 -9.201 -6.833 6.011 1.00 0.00 N ATOM 0 H LYS A 127 -7.519 -4.257 8.512 1.00 0.00 H new ATOM 0 HA LYS A 127 -8.008 -1.714 9.534 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -10.430 -2.652 9.740 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -9.712 -2.649 8.141 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -9.226 -5.168 9.610 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -10.927 -4.829 9.361 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -10.649 -4.607 6.970 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -8.907 -4.470 7.104 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -8.942 -6.858 8.107 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -10.610 -6.949 7.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -9.266 -7.863 5.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -9.806 -6.359 5.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -8.215 -6.529 5.880 1.00 0.00 H new ATOM 804 N ASN A 128 -7.207 -2.538 11.848 1.00 0.00 N ATOM 805 CA ASN A 128 -6.962 -2.369 13.294 1.00 0.00 C ATOM 806 C ASN A 128 -6.074 -1.138 13.485 1.00 0.00 C ATOM 807 O ASN A 128 -6.558 -0.084 13.910 1.00 0.00 O ATOM 808 CB ASN A 128 -6.260 -3.630 13.808 1.00 0.00 C ATOM 809 CG ASN A 128 -7.168 -4.817 14.178 1.00 0.00 C ATOM 810 OD1 ASN A 128 -6.713 -5.825 14.696 1.00 0.00 O ATOM 811 ND2 ASN A 128 -8.439 -4.792 13.857 1.00 0.00 N ATOM 0 H ASN A 128 -6.350 -2.458 11.301 1.00 0.00 H new ATOM 0 HA ASN A 128 -7.891 -2.228 13.847 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.556 -3.963 13.046 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.675 -3.361 14.687 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -9.028 -5.605 14.041 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -8.839 -3.960 13.423 1.00 0.00 H new ATOM 812 N GLY A 129 -4.828 -1.265 13.034 1.00 0.00 N ATOM 813 CA GLY A 129 -3.830 -0.192 13.049 1.00 0.00 C ATOM 814 C GLY A 129 -2.479 -0.627 12.465 1.00 0.00 C ATOM 815 O GLY A 129 -1.474 -0.631 13.168 1.00 0.00 O ATOM 0 H GLY A 129 -4.474 -2.136 12.638 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -4.209 0.658 12.482 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -3.685 0.148 14.074 1.00 0.00 H new ATOM 816 N SER A 130 -2.569 -1.233 11.290 1.00 0.00 N ATOM 817 CA SER A 130 -1.411 -1.663 10.487 1.00 0.00 C ATOM 818 C SER A 130 -1.771 -1.803 9.000 1.00 0.00 C ATOM 819 O SER A 130 -2.784 -1.266 8.548 1.00 0.00 O ATOM 820 CB SER A 130 -0.808 -2.960 11.054 1.00 0.00 C ATOM 821 OG SER A 130 -1.828 -3.950 11.078 1.00 0.00 O ATOM 0 H SER A 130 -3.464 -1.449 10.850 1.00 0.00 H new ATOM 0 HA SER A 130 -0.650 -0.885 10.553 1.00 0.00 H new ATOM 0 HB2 SER A 130 0.029 -3.291 10.439 1.00 0.00 H new ATOM 0 HB3 SER A 130 -0.418 -2.791 12.058 1.00 0.00 H new ATOM 0 HG SER A 130 -1.661 -4.574 11.815 1.00 0.00 H new ATOM 822 N CYS A 131 -0.791 -2.208 8.205 1.00 0.00 N ATOM 823 CA CYS A 131 -0.998 -2.488 6.767 1.00 0.00 C ATOM 824 C CYS A 131 -0.463 -3.862 6.376 1.00 0.00 C ATOM 825 O CYS A 131 -1.161 -4.642 5.728 1.00 0.00 O ATOM 826 CB CYS A 131 -0.342 -1.436 5.862 1.00 0.00 C ATOM 827 SG CYS A 131 -1.134 0.204 5.953 1.00 0.00 S ATOM 0 H CYS A 131 0.167 -2.355 8.522 1.00 0.00 H new ATOM 0 HA CYS A 131 -2.077 -2.457 6.619 1.00 0.00 H new ATOM 0 HB2 CYS A 131 0.709 -1.338 6.136 1.00 0.00 H new ATOM 0 HB3 CYS A 131 -0.371 -1.787 4.831 1.00 0.00 H new ATOM 0 HG CYS A 131 -2.129 0.160 6.789 1.00 0.00 H new ATOM 828 N LYS A 132 0.819 -4.044 6.681 1.00 0.00 N ATOM 829 CA LYS A 132 1.590 -5.286 6.458 1.00 0.00 C ATOM 830 C LYS A 132 0.896 -6.629 6.273 1.00 0.00 C ATOM 831 O LYS A 132 0.587 -7.329 7.241 1.00 0.00 O ATOM 832 CB LYS A 132 2.754 -5.339 7.464 1.00 0.00 C ATOM 833 CG LYS A 132 2.258 -5.228 8.907 1.00 0.00 C ATOM 834 CD LYS A 132 3.280 -5.737 9.922 1.00 0.00 C ATOM 835 CE LYS A 132 2.631 -5.734 11.297 1.00 0.00 C ATOM 836 NZ LYS A 132 3.545 -6.352 12.268 1.00 0.00 N ATOM 0 H LYS A 132 1.381 -3.307 7.108 1.00 0.00 H new ATOM 0 HA LYS A 132 1.924 -5.171 5.427 1.00 0.00 H new ATOM 0 HB2 LYS A 132 3.302 -6.273 7.338 1.00 0.00 H new ATOM 0 HB3 LYS A 132 3.453 -4.529 7.256 1.00 0.00 H new ATOM 0 HG2 LYS A 132 2.021 -4.187 9.127 1.00 0.00 H new ATOM 0 HG3 LYS A 132 1.333 -5.794 9.014 1.00 0.00 H new ATOM 0 HD2 LYS A 132 3.607 -6.743 9.659 1.00 0.00 H new ATOM 0 HD3 LYS A 132 4.166 -5.102 9.919 1.00 0.00 H new ATOM 0 HE2 LYS A 132 2.397 -4.713 11.599 1.00 0.00 H new ATOM 0 HE3 LYS A 132 1.689 -6.281 11.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 3.103 -6.351 13.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 3.746 -7.331 11.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 4.433 -5.812 12.302 1.00 0.00 H new ATOM 837 N ARG A 133 0.541 -6.857 5.007 1.00 0.00 N ATOM 838 CA ARG A 133 0.019 -8.156 4.566 1.00 0.00 C ATOM 839 C ARG A 133 0.124 -8.461 3.057 1.00 0.00 C ATOM 840 O ARG A 133 0.470 -7.598 2.258 1.00 0.00 O ATOM 841 CB ARG A 133 -1.455 -8.299 4.989 1.00 0.00 C ATOM 842 CG ARG A 133 -1.748 -9.744 5.368 1.00 0.00 C ATOM 843 CD ARG A 133 -1.099 -10.127 6.709 1.00 0.00 C ATOM 844 NE ARG A 133 -1.394 -11.537 6.976 1.00 0.00 N ATOM 845 CZ ARG A 133 -0.531 -12.560 6.895 1.00 0.00 C ATOM 846 NH1 ARG A 133 0.756 -12.382 6.628 1.00 0.00 N ATOM 847 NH2 ARG A 133 -0.965 -13.786 7.133 1.00 0.00 N ATOM 0 H ARG A 133 0.605 -6.159 4.266 1.00 0.00 H new ATOM 0 HA ARG A 133 0.669 -8.880 5.057 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -1.665 -7.643 5.834 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -2.108 -7.988 4.174 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -2.826 -9.892 5.431 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -1.381 -10.407 4.584 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -0.022 -9.965 6.670 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -1.486 -9.499 7.511 1.00 0.00 H new ATOM 0 HE ARG A 133 -2.350 -11.763 7.251 1.00 0.00 H new ATOM 0 HH11 ARG A 133 1.120 -11.441 6.476 1.00 0.00 H new ATOM 0 HH12 ARG A 133 1.382 -13.186 6.575 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -1.944 -13.943 7.374 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -0.321 -14.575 7.075 1.00 0.00 H new ATOM 848 N GLY A 134 0.231 -9.768 2.843 1.00 0.00 N ATOM 849 CA GLY A 134 0.216 -10.462 1.534 1.00 0.00 C ATOM 850 C GLY A 134 -0.875 -11.555 1.368 1.00 0.00 C ATOM 851 O GLY A 134 -1.811 -11.356 0.590 1.00 0.00 O ATOM 0 H GLY A 134 0.338 -10.423 3.618 1.00 0.00 H new ATOM 0 HA2 GLY A 134 0.082 -9.717 0.749 1.00 0.00 H new ATOM 0 HA3 GLY A 134 1.192 -10.921 1.375 1.00 0.00 H new ATOM 852 N PRO A 135 -0.751 -12.745 1.986 1.00 0.00 N ATOM 853 CA PRO A 135 -1.612 -13.914 1.680 1.00 0.00 C ATOM 854 C PRO A 135 -2.915 -13.923 2.497 1.00 0.00 C ATOM 855 O PRO A 135 -3.246 -14.851 3.223 1.00 0.00 O ATOM 856 CB PRO A 135 -0.679 -15.092 1.929 1.00 0.00 C ATOM 857 CG PRO A 135 0.104 -14.647 3.164 1.00 0.00 C ATOM 858 CD PRO A 135 0.268 -13.138 2.991 1.00 0.00 C ATOM 0 HA PRO A 135 -2.002 -13.924 0.662 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -1.231 -16.014 2.110 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -0.023 -15.275 1.078 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -0.434 -14.885 4.082 1.00 0.00 H new ATOM 0 HG3 PRO A 135 1.071 -15.147 3.222 1.00 0.00 H new ATOM 0 HD2 PRO A 135 0.112 -12.615 3.934 1.00 0.00 H new ATOM 0 HD3 PRO A 135 1.273 -12.888 2.650 1.00 0.00 H new ATOM 859 N ARG A 136 -3.706 -12.931 2.124 1.00 0.00 N ATOM 860 CA ARG A 136 -4.961 -12.518 2.764 1.00 0.00 C ATOM 861 C ARG A 136 -5.611 -11.396 1.930 1.00 0.00 C ATOM 862 O ARG A 136 -6.795 -11.444 1.627 1.00 0.00 O ATOM 863 CB ARG A 136 -4.620 -12.019 4.179 1.00 0.00 C ATOM 864 CG ARG A 136 -5.796 -11.456 4.972 1.00 0.00 C ATOM 865 CD ARG A 136 -5.288 -11.060 6.349 1.00 0.00 C ATOM 866 NE ARG A 136 -6.305 -10.243 7.014 1.00 0.00 N ATOM 867 CZ ARG A 136 -6.356 -8.914 7.003 1.00 0.00 C ATOM 868 NH1 ARG A 136 -5.335 -8.138 6.695 1.00 0.00 N ATOM 869 NH2 ARG A 136 -7.371 -8.347 7.618 1.00 0.00 N ATOM 0 H ARG A 136 -3.482 -12.351 1.316 1.00 0.00 H new ATOM 0 HA ARG A 136 -5.666 -13.347 2.826 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -4.185 -12.844 4.743 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -3.854 -11.248 4.100 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -6.222 -10.593 4.460 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -6.589 -12.199 5.058 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -5.073 -11.949 6.941 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -4.356 -10.503 6.261 1.00 0.00 H new ATOM 0 HE ARG A 136 -7.036 -10.734 7.529 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -4.437 -8.552 6.445 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -5.444 -7.124 6.707 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -8.076 -8.924 8.077 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -7.453 -7.330 7.636 1.00 0.00 H new ATOM 870 N THR A 137 -4.748 -10.503 1.448 1.00 0.00 N ATOM 871 CA THR A 137 -5.098 -9.311 0.680 1.00 0.00 C ATOM 872 C THR A 137 -5.261 -9.597 -0.809 1.00 0.00 C ATOM 873 O THR A 137 -4.304 -9.575 -1.593 1.00 0.00 O ATOM 874 CB THR A 137 -4.026 -8.235 0.924 1.00 0.00 C ATOM 875 OG1 THR A 137 -2.735 -8.850 0.984 1.00 0.00 O ATOM 876 CG2 THR A 137 -4.350 -7.399 2.166 1.00 0.00 C ATOM 0 H THR A 137 -3.742 -10.595 1.589 1.00 0.00 H new ATOM 0 HA THR A 137 -6.070 -8.955 1.022 1.00 0.00 H new ATOM 0 HB THR A 137 -4.018 -7.534 0.090 1.00 0.00 H new ATOM 0 HG1 THR A 137 -2.102 -8.335 0.442 1.00 0.00 H new ATOM 0 HG21 THR A 137 -3.574 -6.648 2.311 1.00 0.00 H new ATOM 0 HG22 THR A 137 -5.312 -6.905 2.031 1.00 0.00 H new ATOM 0 HG23 THR A 137 -4.395 -8.048 3.040 1.00 0.00 H new ATOM 877 N HIS A 138 -6.478 -10.013 -1.117 1.00 0.00 N ATOM 878 CA HIS A 138 -6.959 -10.208 -2.496 1.00 0.00 C ATOM 879 C HIS A 138 -8.272 -9.442 -2.728 1.00 0.00 C ATOM 880 O HIS A 138 -8.808 -8.794 -1.826 1.00 0.00 O ATOM 881 CB HIS A 138 -7.087 -11.699 -2.814 1.00 0.00 C ATOM 882 CG HIS A 138 -8.157 -12.419 -1.979 1.00 0.00 C ATOM 883 ND1 HIS A 138 -9.472 -12.368 -2.189 1.00 0.00 N ATOM 884 CD2 HIS A 138 -7.932 -13.293 -1.011 1.00 0.00 C ATOM 885 CE1 HIS A 138 -10.052 -13.218 -1.360 1.00 0.00 C ATOM 886 NE2 HIS A 138 -9.100 -13.797 -0.634 1.00 0.00 N ATOM 0 H HIS A 138 -7.181 -10.232 -0.411 1.00 0.00 H new ATOM 0 HA HIS A 138 -6.226 -9.795 -3.189 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -7.324 -11.817 -3.871 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -6.124 -12.181 -2.647 1.00 0.00 H new ATOM 0 HD1 HIS A 138 -9.948 -11.776 -2.870 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -6.967 -13.551 -0.600 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -11.112 -13.409 -1.285 1.00 0.00 H new ATOM 887 N TYR A 139 -8.584 -9.241 -4.009 1.00 0.00 N ATOM 888 CA TYR A 139 -9.881 -8.699 -4.463 1.00 0.00 C ATOM 889 C TYR A 139 -11.072 -9.379 -3.763 1.00 0.00 C ATOM 890 O TYR A 139 -11.282 -10.572 -3.928 1.00 0.00 O ATOM 891 CB TYR A 139 -10.009 -8.780 -5.986 1.00 0.00 C ATOM 892 CG TYR A 139 -10.116 -7.413 -6.675 1.00 0.00 C ATOM 893 CD1 TYR A 139 -10.797 -6.342 -6.057 1.00 0.00 C ATOM 894 CD2 TYR A 139 -9.441 -7.229 -7.902 1.00 0.00 C ATOM 895 CE1 TYR A 139 -10.763 -5.068 -6.652 1.00 0.00 C ATOM 896 CE2 TYR A 139 -9.407 -5.956 -8.497 1.00 0.00 C ATOM 897 CZ TYR A 139 -10.063 -4.879 -7.863 1.00 0.00 C ATOM 898 OH TYR A 139 -9.999 -3.630 -8.397 1.00 0.00 O ATOM 0 H TYR A 139 -7.942 -9.450 -4.774 1.00 0.00 H new ATOM 0 HA TYR A 139 -9.907 -7.647 -4.178 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -9.145 -9.311 -6.386 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -10.890 -9.372 -6.236 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -11.339 -6.499 -5.136 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -8.952 -8.064 -8.382 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -11.271 -4.237 -6.184 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -8.884 -5.804 -9.430 1.00 0.00 H new ATOM 0 HH TYR A 139 -9.443 -3.647 -9.204 1.00 0.00 H new ATOM 899 N GLY A 140 -11.490 -8.680 -2.704 1.00 0.00 N ATOM 900 CA GLY A 140 -12.561 -9.119 -1.798 1.00 0.00 C ATOM 901 C GLY A 140 -12.489 -8.352 -0.467 1.00 0.00 C ATOM 902 O GLY A 140 -13.486 -7.804 -0.005 1.00 0.00 O ATOM 0 H GLY A 140 -11.089 -7.778 -2.446 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -13.531 -8.956 -2.267 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -12.473 -10.190 -1.613 1.00 0.00 H new ATOM 903 N GLN A 141 -11.277 -8.266 0.094 1.00 0.00 N ATOM 904 CA GLN A 141 -11.036 -7.454 1.299 1.00 0.00 C ATOM 905 C GLN A 141 -11.044 -5.989 0.919 1.00 0.00 C ATOM 906 O GLN A 141 -10.218 -5.484 0.164 1.00 0.00 O ATOM 907 CB GLN A 141 -9.674 -7.761 1.914 1.00 0.00 C ATOM 908 CG GLN A 141 -9.491 -9.173 2.487 1.00 0.00 C ATOM 909 CD GLN A 141 -9.541 -10.295 1.448 1.00 0.00 C ATOM 910 OE1 GLN A 141 -8.906 -10.254 0.405 1.00 0.00 O ATOM 911 NE2 GLN A 141 -10.382 -11.278 1.661 1.00 0.00 N ATOM 0 H GLN A 141 -10.450 -8.745 -0.263 1.00 0.00 H new ATOM 0 HA GLN A 141 -11.820 -7.687 2.020 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -8.910 -7.599 1.153 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -9.488 -7.041 2.711 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -8.533 -9.219 3.006 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -10.266 -9.351 3.232 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -10.914 -11.315 2.531 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -10.505 -12.006 0.957 1.00 0.00 H new ATOM 912 N LYS A 142 -11.964 -5.314 1.575 1.00 0.00 N ATOM 913 CA LYS A 142 -12.082 -3.844 1.571 1.00 0.00 C ATOM 914 C LYS A 142 -10.752 -3.139 1.901 1.00 0.00 C ATOM 915 O LYS A 142 -10.459 -2.066 1.385 1.00 0.00 O ATOM 916 CB LYS A 142 -13.162 -3.491 2.567 1.00 0.00 C ATOM 917 CG LYS A 142 -14.482 -4.144 2.132 1.00 0.00 C ATOM 918 CD LYS A 142 -15.617 -3.781 3.087 1.00 0.00 C ATOM 919 CE LYS A 142 -15.385 -4.334 4.488 1.00 0.00 C ATOM 920 NZ LYS A 142 -16.129 -3.418 5.356 1.00 0.00 N ATOM 0 H LYS A 142 -12.676 -5.770 2.145 1.00 0.00 H new ATOM 0 HA LYS A 142 -12.342 -3.495 0.572 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -12.882 -3.836 3.562 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -13.280 -2.409 2.626 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -14.735 -3.821 1.122 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -14.362 -5.227 2.100 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -15.715 -2.697 3.137 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -16.558 -4.169 2.696 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -15.751 -5.357 4.579 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -14.325 -4.351 4.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -16.028 -3.719 6.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -15.753 -2.454 5.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -17.135 -3.429 5.091 1.00 0.00 H new ATOM 921 N ALA A 143 -9.939 -3.874 2.658 1.00 0.00 N ATOM 922 CA ALA A 143 -8.524 -3.590 2.958 1.00 0.00 C ATOM 923 C ALA A 143 -7.712 -3.069 1.764 1.00 0.00 C ATOM 924 O ALA A 143 -7.027 -2.051 1.902 1.00 0.00 O ATOM 925 CB ALA A 143 -7.861 -4.834 3.533 1.00 0.00 C ATOM 0 H ALA A 143 -10.261 -4.732 3.106 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.529 -2.780 3.687 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -6.815 -4.620 3.753 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -8.372 -5.128 4.450 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -7.920 -5.646 2.808 1.00 0.00 H new ATOM 926 N ILE A 144 -7.909 -3.692 0.610 1.00 0.00 N ATOM 927 CA ILE A 144 -7.074 -3.467 -0.590 1.00 0.00 C ATOM 928 C ILE A 144 -7.414 -2.237 -1.457 1.00 0.00 C ATOM 929 O ILE A 144 -6.608 -1.865 -2.312 1.00 0.00 O ATOM 930 CB ILE A 144 -6.937 -4.736 -1.447 1.00 0.00 C ATOM 931 CG1 ILE A 144 -8.241 -5.155 -2.130 1.00 0.00 C ATOM 932 CG2 ILE A 144 -6.279 -5.837 -0.619 1.00 0.00 C ATOM 933 CD1 ILE A 144 -7.930 -6.004 -3.348 1.00 0.00 C ATOM 0 H ILE A 144 -8.654 -4.374 0.466 1.00 0.00 H new ATOM 0 HA ILE A 144 -6.104 -3.216 -0.161 1.00 0.00 H new ATOM 0 HB ILE A 144 -6.280 -4.518 -2.289 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -8.864 -5.716 -1.433 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -8.808 -4.272 -2.425 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -6.181 -6.738 -1.224 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -5.292 -5.508 -0.295 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -6.894 -6.052 0.255 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -8.861 -6.301 -3.832 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -7.325 -5.428 -4.048 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -7.381 -6.894 -3.041 1.00 0.00 H new ATOM 934 N LEU A 145 -8.562 -1.598 -1.224 1.00 0.00 N ATOM 935 CA LEU A 145 -9.033 -0.506 -2.097 1.00 0.00 C ATOM 936 C LEU A 145 -9.050 0.904 -1.479 1.00 0.00 C ATOM 937 O LEU A 145 -9.922 1.269 -0.674 1.00 0.00 O ATOM 938 CB LEU A 145 -10.333 -0.849 -2.839 1.00 0.00 C ATOM 939 CG LEU A 145 -11.442 -1.501 -2.007 1.00 0.00 C ATOM 940 CD1 LEU A 145 -12.810 -1.049 -2.512 1.00 0.00 C ATOM 941 CD2 LEU A 145 -11.331 -3.029 -2.082 1.00 0.00 C ATOM 0 H LEU A 145 -9.184 -1.812 -0.444 1.00 0.00 H new ATOM 0 HA LEU A 145 -8.243 -0.436 -2.845 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -10.728 0.068 -3.276 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -10.089 -1.517 -3.665 1.00 0.00 H new ATOM 0 HG LEU A 145 -11.330 -1.192 -0.968 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -13.592 -1.518 -1.914 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -12.889 0.035 -2.427 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -12.927 -1.341 -3.556 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -12.124 -3.481 -1.487 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -11.427 -3.350 -3.119 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -10.362 -3.343 -1.693 1.00 0.00 H new ATOM 942 N PHE A 146 -7.978 1.611 -1.803 1.00 0.00 N ATOM 943 CA PHE A 146 -7.728 3.016 -1.376 1.00 0.00 C ATOM 944 C PHE A 146 -7.289 4.034 -2.426 1.00 0.00 C ATOM 945 O PHE A 146 -6.549 3.734 -3.358 1.00 0.00 O ATOM 946 CB PHE A 146 -6.697 3.097 -0.246 1.00 0.00 C ATOM 947 CG PHE A 146 -5.657 1.986 -0.257 1.00 0.00 C ATOM 948 CD1 PHE A 146 -4.790 1.826 -1.371 1.00 0.00 C ATOM 949 CD2 PHE A 146 -5.799 0.973 0.718 1.00 0.00 C ATOM 950 CE1 PHE A 146 -4.096 0.612 -1.525 1.00 0.00 C ATOM 951 CE2 PHE A 146 -5.096 -0.237 0.554 1.00 0.00 C ATOM 952 CZ PHE A 146 -4.263 -0.405 -0.567 1.00 0.00 C ATOM 0 H PHE A 146 -7.229 1.232 -2.383 1.00 0.00 H new ATOM 0 HA PHE A 146 -8.736 3.300 -1.075 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -6.185 4.057 -0.307 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -7.222 3.076 0.709 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -4.666 2.624 -2.088 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -6.437 1.124 1.576 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -3.441 0.462 -2.371 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -5.196 -1.028 1.282 1.00 0.00 H new ATOM 0 HZ PHE A 146 -3.738 -1.340 -0.696 1.00 0.00 H new ATOM 953 N LEU A 147 -7.653 5.267 -2.135 1.00 0.00 N ATOM 954 CA LEU A 147 -7.236 6.461 -2.904 1.00 0.00 C ATOM 955 C LEU A 147 -5.738 6.813 -2.826 1.00 0.00 C ATOM 956 O LEU A 147 -5.073 6.525 -1.825 1.00 0.00 O ATOM 957 CB LEU A 147 -8.097 7.633 -2.427 1.00 0.00 C ATOM 958 CG LEU A 147 -9.309 7.715 -3.336 1.00 0.00 C ATOM 959 CD1 LEU A 147 -10.537 8.159 -2.546 1.00 0.00 C ATOM 960 CD2 LEU A 147 -9.027 8.637 -4.526 1.00 0.00 C ATOM 0 H LEU A 147 -8.259 5.490 -1.345 1.00 0.00 H new ATOM 0 HA LEU A 147 -7.389 6.236 -3.960 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -8.405 7.485 -1.392 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -7.530 8.563 -2.461 1.00 0.00 H new ATOM 0 HG LEU A 147 -9.520 6.724 -3.737 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -11.398 8.213 -3.212 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -10.738 7.441 -1.751 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -10.354 9.141 -2.110 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -9.907 8.683 -5.167 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -8.789 9.637 -4.163 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -8.183 8.248 -5.096 1.00 0.00 H new ATOM 961 N PRO A 148 -5.175 7.294 -3.952 1.00 0.00 N ATOM 962 CA PRO A 148 -3.867 7.989 -3.966 1.00 0.00 C ATOM 963 C PRO A 148 -3.953 9.374 -3.303 1.00 0.00 C ATOM 964 O PRO A 148 -5.042 9.943 -3.171 1.00 0.00 O ATOM 965 CB PRO A 148 -3.513 8.136 -5.443 1.00 0.00 C ATOM 966 CG PRO A 148 -4.203 6.933 -6.075 1.00 0.00 C ATOM 967 CD PRO A 148 -5.523 6.822 -5.313 1.00 0.00 C ATOM 0 HA PRO A 148 -3.117 7.429 -3.407 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -3.880 9.076 -5.856 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -2.435 8.116 -5.605 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -4.369 7.083 -7.142 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -3.604 6.028 -5.970 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -6.301 7.437 -5.765 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -5.895 5.797 -5.300 1.00 0.00 H new