USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 972 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 115 SER OG : rot 152:sc= 0 USER MOD Set 1.2: A 118 THR OG1 : rot 180:sc= 0 USER MOD Set 1.3: A 123 TYR OH : rot 133:sc=0.000149 USER MOD Set 2.1: A 51 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 90 TYR OH : rot 25:sc= 0.666 USER MOD Set 3.1: A 5 LYS NZ :NH3+ -156:sc= 0.184 (180deg=0.052) USER MOD Set 3.2: A 77 TYR OH : rot 167:sc= 0.107 USER MOD Set 4.1: A 59 GLN : amide:sc= -0.395 X(o=-0.5,f=0) USER MOD Set 4.2: A 61 ASN : amide:sc= -0.103 X(o=-0.5,f=-0.83) USER MOD Set 5.1: A 39 SER OG : rot -44:sc= 0.187 USER MOD Set 5.2: A 68 GLN : amide:sc= -0.63 K(o=-0.44,f=-3.8!) USER MOD Set 6.1: A 6 THR OG1 : rot -154:sc= 0.0953 USER MOD Set 6.2: A 150 SER OG : rot -49:sc= 0.121 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.00127) USER MOD Single : A 10 TYR OH : rot 30:sc= 0 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 37:sc= 0.29 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 154:sc= 1.39 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl 173:sc= -0.051 (180deg=-0.172) USER MOD Single : A 23 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0339) USER MOD Single : A 25 ASN : amide:sc= -0.762 X(o=-0.76,f=-0.79) USER MOD Single : A 26 SER OG : rot 77:sc= 0.0383 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 130:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ -169:sc= 0.0436 (180deg=-0.138) USER MOD Single : A 37 LYS NZ :NH3+ 170:sc=-0.00271 (180deg=-0.0947) USER MOD Single : A 42 THR OG1 : rot 82:sc= 0.165 USER MOD Single : A 47 MET CE :methyl -123:sc= -0.0035 (180deg=-0.253) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 143:sc= 0.0258 USER MOD Single : A 57 GLN : amide:sc= 0.649 K(o=0.65,f=0) USER MOD Single : A 62 LYS NZ :NH3+ 156:sc= -0.0418 (180deg=-0.288) USER MOD Single : A 71 ASN : amide:sc= -0.021 X(o=-0.021,f=0) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 ASN : amide:sc= 1.13 K(o=1.1,f=0) USER MOD Single : A 84 SER OG : rot 76:sc= 1.47 USER MOD Single : A 88 SER OG : rot 180:sc= 0.0594 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 156:sc= 0.137 (180deg=0.032) USER MOD Single : A 97 THR OG1 : rot -106:sc= 1.06 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 102 MET CE :methyl 170:sc= -0.0185 (180deg=-0.338) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc= 0.598 K(o=0.6,f=0) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot -169:sc= 1.92 USER MOD Single : A 114 THR OG1 : rot 37:sc= -0.0224 USER MOD Single : A 119 ASN : amide:sc= -0.0372 K(o=-0.037,f=-0.88) USER MOD Single : A 120 HIS :FLIP no HD1:sc= -0.0666 F(o=-0.84,f=-0.067) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 HIS : no HE2:sc= -1.89! C(o=-1.9!,f=-4.2!) USER MOD Single : A 128 ASN : amide:sc= 0.785 K(o=0.79,f=0) USER MOD Single : A 135 ASN :FLIP amide:sc=-0.00997 F(o=-1,f=-0.01) USER MOD Single : A 144 SER OG : rot 97:sc= 1.33 USER MOD Single : A 148 LYS NZ :NH3+ 156:sc= 0.0585 (180deg=-0.29) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -7.164 -24.909 -0.591 1.00 75.52 N ATOM 2 CA GLY A 1 -6.478 -23.631 -0.804 1.00 35.52 C ATOM 3 C GLY A 1 -6.223 -23.395 -2.273 1.00 40.22 C ATOM 4 O GLY A 1 -7.188 -23.200 -3.009 1.00 41.13 O ATOM 0 H1 GLY A 1 -7.329 -25.049 0.426 1.00 75.52 H new ATOM 0 H2 GLY A 1 -8.076 -24.901 -1.091 1.00 75.52 H new ATOM 0 H3 GLY A 1 -6.575 -25.684 -0.957 1.00 75.52 H new ATOM 0 HA2 GLY A 1 -7.081 -22.818 -0.400 1.00 35.52 H new ATOM 0 HA3 GLY A 1 -5.533 -23.626 -0.261 1.00 35.52 H new ATOM 8 N MET A 2 -4.955 -23.398 -2.705 1.00 0.22 N ATOM 9 CA MET A 2 -4.487 -22.999 -4.042 1.00 22.25 C ATOM 10 C MET A 2 -5.134 -21.687 -4.516 1.00 64.30 C ATOM 11 O MET A 2 -5.511 -21.532 -5.681 1.00 34.51 O ATOM 12 CB MET A 2 -4.557 -24.156 -5.061 1.00 23.45 C ATOM 13 CG MET A 2 -5.953 -24.743 -5.290 1.00 34.14 C ATOM 14 SD MET A 2 -6.089 -25.770 -6.775 1.00 32.53 S ATOM 15 CE MET A 2 -6.719 -24.500 -7.903 1.00 22.44 C ATOM 0 H MET A 2 -4.188 -23.694 -2.102 1.00 0.22 H new ATOM 0 HA MET A 2 -3.424 -22.772 -3.961 1.00 22.25 H new ATOM 0 HB2 MET A 2 -4.169 -23.801 -6.016 1.00 23.45 H new ATOM 0 HB3 MET A 2 -3.896 -24.955 -4.725 1.00 23.45 H new ATOM 0 HG2 MET A 2 -6.231 -25.340 -4.422 1.00 34.14 H new ATOM 0 HG3 MET A 2 -6.672 -23.927 -5.359 1.00 34.14 H new ATOM 0 HE1 MET A 2 -6.873 -24.935 -8.891 1.00 22.44 H new ATOM 0 HE2 MET A 2 -7.666 -24.114 -7.524 1.00 22.44 H new ATOM 0 HE3 MET A 2 -5.998 -23.686 -7.974 1.00 22.44 H new ATOM 23 N ALA A 3 -5.301 -20.747 -3.577 1.00 14.15 N ATOM 24 CA ALA A 3 -6.022 -19.506 -3.784 1.00 14.25 C ATOM 25 C ALA A 3 -5.452 -18.421 -2.862 1.00 54.03 C ATOM 26 O ALA A 3 -6.081 -18.044 -1.873 1.00 74.31 O ATOM 27 CB ALA A 3 -7.514 -19.771 -3.544 1.00 40.42 C ATOM 0 H ALA A 3 -4.926 -20.840 -2.633 1.00 14.15 H new ATOM 0 HA ALA A 3 -5.905 -19.142 -4.805 1.00 14.25 H new ATOM 0 HB1 ALA A 3 -8.076 -18.849 -3.695 1.00 40.42 H new ATOM 0 HB2 ALA A 3 -7.866 -20.529 -4.244 1.00 40.42 H new ATOM 0 HB3 ALA A 3 -7.661 -20.123 -2.523 1.00 40.42 H new ATOM 33 N LYS A 4 -4.238 -17.942 -3.150 1.00 21.12 N ATOM 34 CA LYS A 4 -3.577 -16.862 -2.408 1.00 23.32 C ATOM 35 C LYS A 4 -2.549 -16.177 -3.300 1.00 42.33 C ATOM 36 O LYS A 4 -1.995 -16.803 -4.205 1.00 20.25 O ATOM 37 CB LYS A 4 -2.959 -17.364 -1.089 1.00 2.21 C ATOM 38 CG LYS A 4 -1.723 -18.273 -1.200 1.00 3.44 C ATOM 39 CD LYS A 4 -1.967 -19.656 -1.826 1.00 31.14 C ATOM 40 CE LYS A 4 -1.558 -19.716 -3.306 1.00 22.42 C ATOM 41 NZ LYS A 4 -0.090 -19.781 -3.466 1.00 21.33 N ATOM 0 H LYS A 4 -3.675 -18.301 -3.921 1.00 21.12 H new ATOM 0 HA LYS A 4 -4.329 -16.126 -2.125 1.00 23.32 H new ATOM 0 HB2 LYS A 4 -2.688 -16.495 -0.489 1.00 2.21 H new ATOM 0 HB3 LYS A 4 -3.729 -17.904 -0.538 1.00 2.21 H new ATOM 0 HG2 LYS A 4 -0.966 -17.756 -1.790 1.00 3.44 H new ATOM 0 HG3 LYS A 4 -1.308 -18.414 -0.202 1.00 3.44 H new ATOM 0 HD2 LYS A 4 -1.408 -20.407 -1.268 1.00 31.14 H new ATOM 0 HD3 LYS A 4 -3.023 -19.911 -1.734 1.00 31.14 H new ATOM 0 HE2 LYS A 4 -2.014 -20.588 -3.774 1.00 22.42 H new ATOM 0 HE3 LYS A 4 -1.942 -18.838 -3.825 1.00 22.42 H new ATOM 0 HZ1 LYS A 4 0.168 -19.484 -4.429 1.00 21.33 H new ATOM 0 HZ2 LYS A 4 0.363 -19.149 -2.776 1.00 21.33 H new ATOM 0 HZ3 LYS A 4 0.234 -20.756 -3.306 1.00 21.33 H new ATOM 51 N LYS A 5 -2.279 -14.899 -3.067 1.00 13.42 N ATOM 52 CA LYS A 5 -1.306 -14.088 -3.796 1.00 43.21 C ATOM 53 C LYS A 5 -0.864 -13.009 -2.835 1.00 12.44 C ATOM 54 O LYS A 5 -1.452 -12.839 -1.761 1.00 53.23 O ATOM 55 CB LYS A 5 -1.908 -13.442 -5.079 1.00 40.03 C ATOM 56 CG LYS A 5 -2.822 -14.356 -5.903 1.00 72.30 C ATOM 57 CD LYS A 5 -3.353 -13.795 -7.234 1.00 15.42 C ATOM 58 CE LYS A 5 -2.272 -13.424 -8.255 1.00 64.53 C ATOM 59 NZ LYS A 5 -2.838 -13.105 -9.589 1.00 74.34 N ATOM 0 H LYS A 5 -2.752 -14.374 -2.332 1.00 13.42 H new ATOM 0 HA LYS A 5 -0.479 -14.713 -4.134 1.00 43.21 H new ATOM 0 HB2 LYS A 5 -2.473 -12.556 -4.789 1.00 40.03 H new ATOM 0 HB3 LYS A 5 -1.089 -13.105 -5.715 1.00 40.03 H new ATOM 0 HG2 LYS A 5 -2.278 -15.276 -6.116 1.00 72.30 H new ATOM 0 HG3 LYS A 5 -3.677 -14.627 -5.284 1.00 72.30 H new ATOM 0 HD2 LYS A 5 -4.018 -14.533 -7.683 1.00 15.42 H new ATOM 0 HD3 LYS A 5 -3.954 -12.910 -7.025 1.00 15.42 H new ATOM 0 HE2 LYS A 5 -1.709 -12.566 -7.888 1.00 64.53 H new ATOM 0 HE3 LYS A 5 -1.568 -14.250 -8.351 1.00 64.53 H new ATOM 0 HZ1 LYS A 5 -2.114 -13.259 -10.319 1.00 74.34 H new ATOM 0 HZ2 LYS A 5 -3.654 -13.721 -9.776 1.00 74.34 H new ATOM 0 HZ3 LYS A 5 -3.143 -12.111 -9.608 1.00 74.34 H new ATOM 69 N THR A 6 0.056 -12.185 -3.300 1.00 72.32 N ATOM 70 CA THR A 6 0.438 -10.954 -2.640 1.00 11.12 C ATOM 71 C THR A 6 0.641 -9.929 -3.752 1.00 40.11 C ATOM 72 O THR A 6 1.615 -9.977 -4.499 1.00 41.43 O ATOM 73 CB THR A 6 1.657 -11.212 -1.738 1.00 3.23 C ATOM 74 OG1 THR A 6 1.419 -12.283 -0.843 1.00 62.24 O ATOM 75 CG2 THR A 6 2.027 -9.966 -0.935 1.00 3.05 C ATOM 0 H THR A 6 0.568 -12.358 -4.165 1.00 72.32 H new ATOM 0 HA THR A 6 -0.316 -10.560 -1.959 1.00 11.12 H new ATOM 0 HB THR A 6 2.485 -11.474 -2.397 1.00 3.23 H new ATOM 0 HG1 THR A 6 1.985 -12.178 -0.050 1.00 62.24 H new ATOM 0 HG21 THR A 6 2.892 -10.181 -0.308 1.00 3.05 H new ATOM 0 HG22 THR A 6 2.268 -9.151 -1.618 1.00 3.05 H new ATOM 0 HG23 THR A 6 1.186 -9.676 -0.306 1.00 3.05 H new ATOM 83 N LEU A 7 -0.345 -9.063 -3.974 1.00 1.05 N ATOM 84 CA LEU A 7 -0.137 -7.909 -4.841 1.00 11.31 C ATOM 85 C LEU A 7 0.699 -6.894 -4.062 1.00 52.42 C ATOM 86 O LEU A 7 0.597 -6.799 -2.840 1.00 44.51 O ATOM 87 CB LEU A 7 -1.498 -7.376 -5.277 1.00 43.22 C ATOM 88 CG LEU A 7 -1.501 -6.338 -6.414 1.00 35.34 C ATOM 89 CD1 LEU A 7 -0.902 -6.802 -7.757 1.00 35.22 C ATOM 90 CD2 LEU A 7 -2.969 -5.975 -6.677 1.00 64.22 C ATOM 0 H LEU A 7 -1.280 -9.136 -3.573 1.00 1.05 H new ATOM 0 HA LEU A 7 0.407 -8.157 -5.753 1.00 11.31 H new ATOM 0 HB2 LEU A 7 -2.112 -8.222 -5.587 1.00 43.22 H new ATOM 0 HB3 LEU A 7 -1.984 -6.931 -4.408 1.00 43.22 H new ATOM 0 HG LEU A 7 -0.871 -5.516 -6.076 1.00 35.34 H new ATOM 0 HD11 LEU A 7 -0.958 -5.989 -8.481 1.00 35.22 H new ATOM 0 HD12 LEU A 7 0.140 -7.087 -7.612 1.00 35.22 H new ATOM 0 HD13 LEU A 7 -1.464 -7.659 -8.129 1.00 35.22 H new ATOM 0 HD21 LEU A 7 -3.024 -5.239 -7.479 1.00 64.22 H new ATOM 0 HD22 LEU A 7 -3.519 -6.870 -6.968 1.00 64.22 H new ATOM 0 HD23 LEU A 7 -3.409 -5.558 -5.771 1.00 64.22 H new ATOM 101 N ILE A 8 1.546 -6.156 -4.761 1.00 21.44 N ATOM 102 CA ILE A 8 2.468 -5.171 -4.208 1.00 73.24 C ATOM 103 C ILE A 8 2.353 -3.950 -5.121 1.00 41.51 C ATOM 104 O ILE A 8 2.698 -4.047 -6.300 1.00 63.11 O ATOM 105 CB ILE A 8 3.907 -5.748 -4.147 1.00 23.23 C ATOM 106 CG1 ILE A 8 3.983 -7.099 -3.392 1.00 1.53 C ATOM 107 CG2 ILE A 8 4.851 -4.715 -3.511 1.00 72.11 C ATOM 108 CD1 ILE A 8 5.351 -7.782 -3.457 1.00 33.45 C ATOM 0 H ILE A 8 1.614 -6.229 -5.776 1.00 21.44 H new ATOM 0 HA ILE A 8 2.227 -4.898 -3.181 1.00 73.24 H new ATOM 0 HB ILE A 8 4.221 -5.952 -5.171 1.00 23.23 H new ATOM 0 HG12 ILE A 8 3.723 -6.933 -2.347 1.00 1.53 H new ATOM 0 HG13 ILE A 8 3.233 -7.774 -3.804 1.00 1.53 H new ATOM 0 HG21 ILE A 8 5.861 -5.122 -3.469 1.00 72.11 H new ATOM 0 HG22 ILE A 8 4.851 -3.805 -4.111 1.00 72.11 H new ATOM 0 HG23 ILE A 8 4.511 -4.484 -2.501 1.00 72.11 H new ATOM 0 HD11 ILE A 8 5.316 -8.720 -2.903 1.00 33.45 H new ATOM 0 HD12 ILE A 8 5.608 -7.984 -4.497 1.00 33.45 H new ATOM 0 HD13 ILE A 8 6.105 -7.129 -3.017 1.00 33.45 H new ATOM 119 N LEU A 9 1.813 -2.839 -4.617 1.00 73.22 N ATOM 120 CA LEU A 9 1.451 -1.643 -5.379 1.00 71.24 C ATOM 121 C LEU A 9 1.938 -0.416 -4.633 1.00 20.31 C ATOM 122 O LEU A 9 1.317 0.038 -3.675 1.00 11.12 O ATOM 123 CB LEU A 9 -0.070 -1.567 -5.554 1.00 73.13 C ATOM 124 CG LEU A 9 -0.543 -2.295 -6.815 1.00 55.11 C ATOM 125 CD1 LEU A 9 -1.970 -2.786 -6.628 1.00 72.34 C ATOM 126 CD2 LEU A 9 -0.489 -1.366 -8.032 1.00 13.25 C ATOM 0 H LEU A 9 1.607 -2.744 -3.623 1.00 73.22 H new ATOM 0 HA LEU A 9 1.916 -1.689 -6.364 1.00 71.24 H new ATOM 0 HB2 LEU A 9 -0.557 -2.002 -4.681 1.00 73.13 H new ATOM 0 HB3 LEU A 9 -0.377 -0.522 -5.603 1.00 73.13 H new ATOM 0 HG LEU A 9 0.121 -3.143 -6.985 1.00 55.11 H new ATOM 0 HD11 LEU A 9 -2.298 -3.303 -7.530 1.00 72.34 H new ATOM 0 HD12 LEU A 9 -2.011 -3.472 -5.782 1.00 72.34 H new ATOM 0 HD13 LEU A 9 -2.625 -1.936 -6.438 1.00 72.34 H new ATOM 0 HD21 LEU A 9 -0.829 -1.905 -8.916 1.00 13.25 H new ATOM 0 HD22 LEU A 9 -1.134 -0.504 -7.861 1.00 13.25 H new ATOM 0 HD23 LEU A 9 0.535 -1.027 -8.186 1.00 13.25 H new ATOM 137 N TYR A 10 3.059 0.138 -5.068 1.00 21.34 N ATOM 138 CA TYR A 10 3.738 1.233 -4.381 1.00 54.31 C ATOM 139 C TYR A 10 3.980 2.432 -5.299 1.00 24.02 C ATOM 140 O TYR A 10 3.970 2.297 -6.527 1.00 40.44 O ATOM 141 CB TYR A 10 5.055 0.723 -3.770 1.00 0.25 C ATOM 142 CG TYR A 10 6.224 0.514 -4.717 1.00 22.05 C ATOM 143 CD1 TYR A 10 6.064 0.168 -6.078 1.00 71.04 C ATOM 144 CD2 TYR A 10 7.514 0.722 -4.208 1.00 15.55 C ATOM 145 CE1 TYR A 10 7.157 0.146 -6.958 1.00 22.31 C ATOM 146 CE2 TYR A 10 8.598 0.733 -5.093 1.00 75.23 C ATOM 147 CZ TYR A 10 8.436 0.468 -6.469 1.00 63.13 C ATOM 148 OH TYR A 10 9.507 0.499 -7.304 1.00 11.21 O ATOM 0 H TYR A 10 3.532 -0.163 -5.920 1.00 21.34 H new ATOM 0 HA TYR A 10 3.086 1.586 -3.582 1.00 54.31 H new ATOM 0 HB2 TYR A 10 5.366 1.429 -3.000 1.00 0.25 H new ATOM 0 HB3 TYR A 10 4.851 -0.224 -3.270 1.00 0.25 H new ATOM 0 HD1 TYR A 10 5.081 -0.084 -6.448 1.00 71.04 H new ATOM 0 HD2 TYR A 10 7.669 0.871 -3.150 1.00 15.55 H new ATOM 0 HE1 TYR A 10 7.018 -0.115 -7.997 1.00 22.31 H new ATOM 0 HE2 TYR A 10 9.585 0.950 -4.712 1.00 75.23 H new ATOM 0 HH TYR A 10 9.213 0.750 -8.204 1.00 11.21 H new ATOM 157 N TYR A 11 4.318 3.575 -4.696 1.00 62.11 N ATOM 158 CA TYR A 11 4.818 4.762 -5.373 1.00 55.34 C ATOM 159 C TYR A 11 6.288 4.994 -5.002 1.00 41.14 C ATOM 160 O TYR A 11 6.592 5.369 -3.868 1.00 0.11 O ATOM 161 CB TYR A 11 3.977 6.003 -5.041 1.00 71.13 C ATOM 162 CG TYR A 11 4.554 7.270 -5.678 1.00 42.30 C ATOM 163 CD1 TYR A 11 5.058 7.265 -6.997 1.00 62.31 C ATOM 164 CD2 TYR A 11 4.585 8.478 -4.957 1.00 51.50 C ATOM 165 CE1 TYR A 11 5.603 8.427 -7.565 1.00 3.55 C ATOM 166 CE2 TYR A 11 5.147 9.647 -5.514 1.00 15.52 C ATOM 167 CZ TYR A 11 5.669 9.623 -6.825 1.00 12.43 C ATOM 168 OH TYR A 11 6.220 10.723 -7.407 1.00 51.50 O ATOM 0 H TYR A 11 4.246 3.698 -3.686 1.00 62.11 H new ATOM 0 HA TYR A 11 4.740 4.595 -6.447 1.00 55.34 H new ATOM 0 HB2 TYR A 11 2.955 5.854 -5.391 1.00 71.13 H new ATOM 0 HB3 TYR A 11 3.928 6.130 -3.960 1.00 71.13 H new ATOM 0 HD1 TYR A 11 5.024 6.354 -7.577 1.00 62.31 H new ATOM 0 HD2 TYR A 11 4.172 8.511 -3.960 1.00 51.50 H new ATOM 0 HE1 TYR A 11 5.975 8.404 -8.579 1.00 3.55 H new ATOM 0 HE2 TYR A 11 5.178 10.559 -4.937 1.00 15.52 H new ATOM 0 HH TYR A 11 6.196 11.473 -6.777 1.00 51.50 H new ATOM 177 N SER A 12 7.210 4.763 -5.937 1.00 1.53 N ATOM 178 CA SER A 12 8.596 5.215 -5.884 1.00 43.31 C ATOM 179 C SER A 12 8.650 6.694 -6.254 1.00 13.44 C ATOM 180 O SER A 12 8.355 7.012 -7.400 1.00 44.34 O ATOM 181 CB SER A 12 9.467 4.373 -6.831 1.00 24.01 C ATOM 182 OG SER A 12 8.979 4.314 -8.163 1.00 23.42 O ATOM 0 H SER A 12 7.001 4.235 -6.784 1.00 1.53 H new ATOM 0 HA SER A 12 8.989 5.089 -4.875 1.00 43.31 H new ATOM 0 HB2 SER A 12 10.476 4.784 -6.842 1.00 24.01 H new ATOM 0 HB3 SER A 12 9.540 3.360 -6.436 1.00 24.01 H new ATOM 0 HG SER A 12 8.590 5.180 -8.408 1.00 23.42 H new ATOM 187 N TRP A 13 9.049 7.557 -5.312 1.00 13.52 N ATOM 188 CA TRP A 13 9.295 8.985 -5.523 1.00 60.03 C ATOM 189 C TRP A 13 10.294 9.161 -6.681 1.00 20.24 C ATOM 190 O TRP A 13 9.890 9.379 -7.821 1.00 33.15 O ATOM 191 CB TRP A 13 9.750 9.587 -4.177 1.00 4.21 C ATOM 192 CG TRP A 13 9.656 11.071 -3.977 1.00 22.11 C ATOM 193 CD1 TRP A 13 8.586 11.705 -3.450 1.00 14.43 C ATOM 194 CD2 TRP A 13 10.676 12.111 -4.138 1.00 31.02 C ATOM 195 NE1 TRP A 13 8.874 13.037 -3.255 1.00 14.45 N ATOM 196 CE2 TRP A 13 10.155 13.345 -3.648 1.00 1.35 C ATOM 197 CE3 TRP A 13 11.998 12.141 -4.623 1.00 62.32 C ATOM 198 CZ2 TRP A 13 10.910 14.526 -3.611 1.00 41.24 C ATOM 199 CZ3 TRP A 13 12.773 13.314 -4.587 1.00 0.43 C ATOM 200 CH2 TRP A 13 12.236 14.506 -4.073 1.00 43.41 C ATOM 0 H TRP A 13 9.215 7.268 -4.348 1.00 13.52 H new ATOM 0 HA TRP A 13 8.400 9.528 -5.828 1.00 60.03 H new ATOM 0 HB2 TRP A 13 9.166 9.111 -3.389 1.00 4.21 H new ATOM 0 HB3 TRP A 13 10.790 9.299 -4.022 1.00 4.21 H new ATOM 0 HD1 TRP A 13 7.642 11.235 -3.216 1.00 14.43 H new ATOM 0 HE1 TRP A 13 8.217 13.713 -2.866 1.00 14.45 H new ATOM 0 HE3 TRP A 13 12.428 11.239 -5.033 1.00 62.32 H new ATOM 0 HZ2 TRP A 13 10.477 15.440 -3.232 1.00 41.24 H new ATOM 0 HZ3 TRP A 13 13.788 13.298 -4.957 1.00 0.43 H new ATOM 0 HH2 TRP A 13 12.839 15.401 -4.033 1.00 43.41 H new ATOM 210 N SER A 14 11.590 8.951 -6.423 1.00 44.52 N ATOM 211 CA SER A 14 12.643 8.912 -7.436 1.00 53.34 C ATOM 212 C SER A 14 13.658 7.786 -7.146 1.00 31.34 C ATOM 213 O SER A 14 14.447 7.403 -8.013 1.00 12.55 O ATOM 214 CB SER A 14 13.274 10.312 -7.501 1.00 62.10 C ATOM 215 OG SER A 14 14.121 10.508 -8.614 1.00 13.45 O ATOM 0 H SER A 14 11.941 8.800 -5.477 1.00 44.52 H new ATOM 0 HA SER A 14 12.236 8.669 -8.417 1.00 53.34 H new ATOM 0 HB2 SER A 14 12.479 11.057 -7.527 1.00 62.10 H new ATOM 0 HB3 SER A 14 13.844 10.485 -6.588 1.00 62.10 H new ATOM 0 HG SER A 14 14.485 11.418 -8.592 1.00 13.45 H new ATOM 220 N GLY A 15 13.620 7.175 -5.956 1.00 41.34 N ATOM 221 CA GLY A 15 14.489 6.073 -5.562 1.00 24.33 C ATOM 222 C GLY A 15 14.134 5.477 -4.201 1.00 24.31 C ATOM 223 O GLY A 15 14.415 4.305 -3.970 1.00 55.24 O ATOM 0 H GLY A 15 12.963 7.445 -5.224 1.00 41.34 H new ATOM 0 HA2 GLY A 15 14.436 5.290 -6.318 1.00 24.33 H new ATOM 0 HA3 GLY A 15 15.521 6.424 -5.539 1.00 24.33 H new ATOM 227 N GLU A 16 13.483 6.244 -3.320 1.00 4.22 N ATOM 228 CA GLU A 16 13.319 5.890 -1.913 1.00 20.11 C ATOM 229 C GLU A 16 12.560 4.584 -1.754 1.00 3.31 C ATOM 230 O GLU A 16 13.127 3.553 -1.389 1.00 34.25 O ATOM 231 CB GLU A 16 12.574 7.013 -1.176 1.00 33.04 C ATOM 232 CG GLU A 16 13.488 8.205 -0.881 1.00 20.14 C ATOM 233 CD GLU A 16 14.502 7.939 0.236 1.00 35.02 C ATOM 234 OE1 GLU A 16 14.697 6.772 0.649 1.00 73.24 O ATOM 235 OE2 GLU A 16 15.166 8.920 0.639 1.00 11.33 O ATOM 0 H GLU A 16 13.053 7.135 -3.569 1.00 4.22 H new ATOM 0 HA GLU A 16 14.312 5.761 -1.482 1.00 20.11 H new ATOM 0 HB2 GLU A 16 11.728 7.344 -1.779 1.00 33.04 H new ATOM 0 HB3 GLU A 16 12.168 6.627 -0.241 1.00 33.04 H new ATOM 0 HG2 GLU A 16 14.025 8.474 -1.791 1.00 20.14 H new ATOM 0 HG3 GLU A 16 12.875 9.063 -0.607 1.00 20.14 H new ATOM 240 N THR A 17 11.273 4.629 -2.079 1.00 0.54 N ATOM 241 CA THR A 17 10.399 3.483 -2.044 1.00 22.44 C ATOM 242 C THR A 17 10.922 2.413 -3.010 1.00 73.10 C ATOM 243 O THR A 17 10.765 1.231 -2.723 1.00 62.33 O ATOM 244 CB THR A 17 8.966 3.929 -2.400 1.00 12.13 C ATOM 245 OG1 THR A 17 8.792 5.340 -2.363 1.00 42.20 O ATOM 246 CG2 THR A 17 7.897 3.271 -1.521 1.00 4.25 C ATOM 0 H THR A 17 10.807 5.485 -2.379 1.00 0.54 H new ATOM 0 HA THR A 17 10.378 3.047 -1.045 1.00 22.44 H new ATOM 0 HB THR A 17 8.831 3.591 -3.427 1.00 12.13 H new ATOM 0 HG1 THR A 17 8.057 5.595 -2.959 1.00 42.20 H new ATOM 0 HG21 THR A 17 6.911 3.625 -1.821 1.00 4.25 H new ATOM 0 HG22 THR A 17 7.945 2.188 -1.639 1.00 4.25 H new ATOM 0 HG23 THR A 17 8.074 3.531 -0.477 1.00 4.25 H new ATOM 254 N LYS A 18 11.569 2.793 -4.130 1.00 23.22 N ATOM 255 CA LYS A 18 12.112 1.859 -5.126 1.00 3.42 C ATOM 256 C LYS A 18 13.022 0.844 -4.454 1.00 22.31 C ATOM 257 O LYS A 18 12.802 -0.359 -4.597 1.00 23.15 O ATOM 258 CB LYS A 18 12.780 2.586 -6.308 1.00 72.14 C ATOM 259 CG LYS A 18 13.382 1.595 -7.317 1.00 15.43 C ATOM 260 CD LYS A 18 14.878 1.330 -7.071 1.00 34.02 C ATOM 261 CE LYS A 18 15.344 -0.032 -7.599 1.00 53.24 C ATOM 262 NZ LYS A 18 15.166 -0.179 -9.055 1.00 41.53 N ATOM 0 H LYS A 18 11.729 3.772 -4.368 1.00 23.22 H new ATOM 0 HA LYS A 18 11.282 1.308 -5.568 1.00 3.42 H new ATOM 0 HB2 LYS A 18 12.046 3.216 -6.810 1.00 72.14 H new ATOM 0 HB3 LYS A 18 13.563 3.246 -5.934 1.00 72.14 H new ATOM 0 HG2 LYS A 18 12.837 0.653 -7.263 1.00 15.43 H new ATOM 0 HG3 LYS A 18 13.248 1.984 -8.326 1.00 15.43 H new ATOM 0 HD2 LYS A 18 15.463 2.117 -7.547 1.00 34.02 H new ATOM 0 HD3 LYS A 18 15.079 1.386 -6.001 1.00 34.02 H new ATOM 0 HE2 LYS A 18 16.397 -0.170 -7.352 1.00 53.24 H new ATOM 0 HE3 LYS A 18 14.791 -0.821 -7.090 1.00 53.24 H new ATOM 0 HZ1 LYS A 18 15.498 -1.119 -9.352 1.00 41.53 H new ATOM 0 HZ2 LYS A 18 14.159 -0.076 -9.294 1.00 41.53 H new ATOM 0 HZ3 LYS A 18 15.715 0.554 -9.548 1.00 41.53 H new ATOM 272 N LYS A 19 14.025 1.303 -3.704 1.00 20.21 N ATOM 273 CA LYS A 19 14.990 0.403 -3.071 1.00 23.01 C ATOM 274 C LYS A 19 14.335 -0.448 -1.978 1.00 53.54 C ATOM 275 O LYS A 19 14.946 -1.388 -1.471 1.00 62.03 O ATOM 276 CB LYS A 19 16.158 1.246 -2.525 1.00 61.30 C ATOM 277 CG LYS A 19 17.534 0.723 -2.967 1.00 0.55 C ATOM 278 CD LYS A 19 17.996 -0.585 -2.323 1.00 33.11 C ATOM 279 CE LYS A 19 18.085 -0.441 -0.799 1.00 22.32 C ATOM 280 NZ LYS A 19 18.793 -1.580 -0.195 1.00 1.25 N ATOM 0 H LYS A 19 14.190 2.293 -3.520 1.00 20.21 H new ATOM 0 HA LYS A 19 15.372 -0.302 -3.809 1.00 23.01 H new ATOM 0 HB2 LYS A 19 16.043 2.277 -2.860 1.00 61.30 H new ATOM 0 HB3 LYS A 19 16.113 1.258 -1.436 1.00 61.30 H new ATOM 0 HG2 LYS A 19 17.518 0.586 -4.048 1.00 0.55 H new ATOM 0 HG3 LYS A 19 18.277 1.491 -2.754 1.00 0.55 H new ATOM 0 HD2 LYS A 19 17.301 -1.386 -2.577 1.00 33.11 H new ATOM 0 HD3 LYS A 19 18.969 -0.869 -2.723 1.00 33.11 H new ATOM 0 HE2 LYS A 19 18.602 0.485 -0.549 1.00 22.32 H new ATOM 0 HE3 LYS A 19 17.082 -0.370 -0.379 1.00 22.32 H new ATOM 0 HZ1 LYS A 19 18.837 -1.454 0.836 1.00 1.25 H new ATOM 0 HZ2 LYS A 19 18.285 -2.461 -0.415 1.00 1.25 H new ATOM 0 HZ3 LYS A 19 19.758 -1.632 -0.579 1.00 1.25 H new ATOM 290 N MET A 20 13.097 -0.135 -1.608 1.00 72.04 N ATOM 291 CA MET A 20 12.324 -0.855 -0.622 1.00 3.13 C ATOM 292 C MET A 20 11.391 -1.887 -1.256 1.00 55.20 C ATOM 293 O MET A 20 11.050 -2.864 -0.594 1.00 13.32 O ATOM 294 CB MET A 20 11.546 0.197 0.190 1.00 0.42 C ATOM 295 CG MET A 20 11.154 -0.313 1.567 1.00 40.12 C ATOM 296 SD MET A 20 12.549 -0.975 2.529 1.00 52.33 S ATOM 297 CE MET A 20 13.691 0.434 2.547 1.00 51.20 C ATOM 0 H MET A 20 12.593 0.658 -2.006 1.00 72.04 H new ATOM 0 HA MET A 20 12.984 -1.431 0.026 1.00 3.13 H new ATOM 0 HB2 MET A 20 12.156 1.094 0.297 1.00 0.42 H new ATOM 0 HB3 MET A 20 10.649 0.485 -0.358 1.00 0.42 H new ATOM 0 HG2 MET A 20 10.692 0.500 2.127 1.00 40.12 H new ATOM 0 HG3 MET A 20 10.400 -1.092 1.455 1.00 40.12 H new ATOM 0 HE1 MET A 20 14.531 0.213 3.205 1.00 51.20 H new ATOM 0 HE2 MET A 20 14.059 0.617 1.537 1.00 51.20 H new ATOM 0 HE3 MET A 20 13.170 1.320 2.909 1.00 51.20 H new ATOM 305 N ALA A 21 10.999 -1.725 -2.527 1.00 44.12 N ATOM 306 CA ALA A 21 10.052 -2.624 -3.166 1.00 73.14 C ATOM 307 C ALA A 21 10.702 -3.981 -3.270 1.00 75.44 C ATOM 308 O ALA A 21 10.124 -4.992 -2.880 1.00 3.42 O ATOM 309 CB ALA A 21 9.660 -2.166 -4.576 1.00 23.13 C ATOM 0 H ALA A 21 11.331 -0.972 -3.129 1.00 44.12 H new ATOM 0 HA ALA A 21 9.144 -2.643 -2.563 1.00 73.14 H new ATOM 0 HB1 ALA A 21 8.951 -2.875 -5.005 1.00 23.13 H new ATOM 0 HB2 ALA A 21 9.200 -1.179 -4.523 1.00 23.13 H new ATOM 0 HB3 ALA A 21 10.550 -2.118 -5.204 1.00 23.13 H new ATOM 315 N GLU A 22 11.905 -3.969 -3.841 1.00 60.20 N ATOM 316 CA GLU A 22 12.531 -5.167 -4.344 1.00 55.33 C ATOM 317 C GLU A 22 12.873 -6.105 -3.185 1.00 2.55 C ATOM 318 O GLU A 22 12.689 -7.313 -3.281 1.00 2.23 O ATOM 319 CB GLU A 22 13.803 -4.826 -5.127 1.00 64.41 C ATOM 320 CG GLU A 22 13.631 -3.685 -6.140 1.00 75.23 C ATOM 321 CD GLU A 22 14.914 -3.460 -6.934 1.00 24.35 C ATOM 322 OE1 GLU A 22 15.996 -3.333 -6.315 1.00 43.22 O ATOM 323 OE2 GLU A 22 14.859 -3.392 -8.185 1.00 71.10 O ATOM 0 H GLU A 22 12.464 -3.124 -3.963 1.00 60.20 H new ATOM 0 HA GLU A 22 11.831 -5.664 -5.016 1.00 55.33 H new ATOM 0 HB2 GLU A 22 14.589 -4.555 -4.422 1.00 64.41 H new ATOM 0 HB3 GLU A 22 14.141 -5.718 -5.655 1.00 64.41 H new ATOM 0 HG2 GLU A 22 12.814 -3.920 -6.822 1.00 75.23 H new ATOM 0 HG3 GLU A 22 13.357 -2.768 -5.618 1.00 75.23 H new ATOM 328 N LYS A 23 13.341 -5.524 -2.072 1.00 55.13 N ATOM 329 CA LYS A 23 13.693 -6.231 -0.848 1.00 32.04 C ATOM 330 C LYS A 23 12.507 -7.060 -0.365 1.00 51.24 C ATOM 331 O LYS A 23 12.597 -8.272 -0.209 1.00 24.21 O ATOM 332 CB LYS A 23 14.161 -5.220 0.213 1.00 24.12 C ATOM 333 CG LYS A 23 15.261 -5.792 1.112 1.00 65.13 C ATOM 334 CD LYS A 23 16.640 -5.673 0.444 1.00 11.25 C ATOM 335 CE LYS A 23 17.749 -6.386 1.222 1.00 52.34 C ATOM 336 NZ LYS A 23 17.814 -5.979 2.639 1.00 41.24 N ATOM 0 H LYS A 23 13.487 -4.517 -2.004 1.00 55.13 H new ATOM 0 HA LYS A 23 14.516 -6.920 -1.039 1.00 32.04 H new ATOM 0 HB2 LYS A 23 14.529 -4.321 -0.282 1.00 24.12 H new ATOM 0 HB3 LYS A 23 13.311 -4.921 0.827 1.00 24.12 H new ATOM 0 HG2 LYS A 23 15.268 -5.262 2.065 1.00 65.13 H new ATOM 0 HG3 LYS A 23 15.049 -6.839 1.331 1.00 65.13 H new ATOM 0 HD2 LYS A 23 16.586 -6.088 -0.562 1.00 11.25 H new ATOM 0 HD3 LYS A 23 16.897 -4.619 0.341 1.00 11.25 H new ATOM 0 HE2 LYS A 23 17.589 -7.463 1.166 1.00 52.34 H new ATOM 0 HE3 LYS A 23 18.708 -6.181 0.747 1.00 52.34 H new ATOM 0 HZ1 LYS A 23 18.663 -6.389 3.079 1.00 41.24 H new ATOM 0 HZ2 LYS A 23 17.858 -4.942 2.701 1.00 41.24 H new ATOM 0 HZ3 LYS A 23 16.967 -6.319 3.137 1.00 41.24 H new ATOM 346 N ILE A 24 11.388 -6.371 -0.158 1.00 74.13 N ATOM 347 CA ILE A 24 10.138 -6.916 0.336 1.00 1.54 C ATOM 348 C ILE A 24 9.635 -7.963 -0.664 1.00 34.05 C ATOM 349 O ILE A 24 9.269 -9.061 -0.262 1.00 73.21 O ATOM 350 CB ILE A 24 9.195 -5.704 0.562 1.00 2.35 C ATOM 351 CG1 ILE A 24 9.735 -4.856 1.741 1.00 1.53 C ATOM 352 CG2 ILE A 24 7.711 -6.060 0.770 1.00 75.03 C ATOM 353 CD1 ILE A 24 9.008 -3.526 1.936 1.00 44.12 C ATOM 0 H ILE A 24 11.331 -5.369 -0.341 1.00 74.13 H new ATOM 0 HA ILE A 24 10.221 -7.446 1.285 1.00 1.54 H new ATOM 0 HB ILE A 24 9.204 -5.130 -0.365 1.00 2.35 H new ATOM 0 HG12 ILE A 24 9.657 -5.438 2.659 1.00 1.53 H new ATOM 0 HG13 ILE A 24 10.794 -4.658 1.577 1.00 1.53 H new ATOM 0 HG21 ILE A 24 7.135 -5.147 0.919 1.00 75.03 H new ATOM 0 HG22 ILE A 24 7.336 -6.586 -0.108 1.00 75.03 H new ATOM 0 HG23 ILE A 24 7.610 -6.700 1.646 1.00 75.03 H new ATOM 0 HD11 ILE A 24 9.445 -2.993 2.780 1.00 44.12 H new ATOM 0 HD12 ILE A 24 9.107 -2.922 1.034 1.00 44.12 H new ATOM 0 HD13 ILE A 24 7.952 -3.714 2.133 1.00 44.12 H new ATOM 364 N ASN A 25 9.654 -7.649 -1.962 1.00 54.23 N ATOM 365 CA ASN A 25 9.263 -8.570 -3.020 1.00 4.45 C ATOM 366 C ASN A 25 10.059 -9.885 -2.956 1.00 74.43 C ATOM 367 O ASN A 25 9.442 -10.942 -3.046 1.00 21.54 O ATOM 368 CB ASN A 25 9.354 -7.864 -4.381 1.00 74.54 C ATOM 369 CG ASN A 25 9.297 -8.852 -5.526 1.00 40.00 C ATOM 370 OD1 ASN A 25 10.288 -9.071 -6.213 1.00 13.25 O ATOM 371 ND2 ASN A 25 8.144 -9.438 -5.774 1.00 64.53 N ATOM 0 H ASN A 25 9.946 -6.735 -2.307 1.00 54.23 H new ATOM 0 HA ASN A 25 8.223 -8.862 -2.875 1.00 4.45 H new ATOM 0 HB2 ASN A 25 8.537 -7.149 -4.476 1.00 74.54 H new ATOM 0 HB3 ASN A 25 10.283 -7.296 -4.436 1.00 74.54 H new ATOM 0 HD21 ASN A 25 8.061 -10.091 -6.553 1.00 64.53 H new ATOM 0 HD22 ASN A 25 7.334 -9.239 -5.187 1.00 64.53 H new ATOM 377 N SER A 26 11.381 -9.864 -2.772 1.00 62.40 N ATOM 378 CA SER A 26 12.183 -11.083 -2.654 1.00 54.34 C ATOM 379 C SER A 26 11.865 -11.924 -1.405 1.00 44.42 C ATOM 380 O SER A 26 12.130 -13.127 -1.402 1.00 73.32 O ATOM 381 CB SER A 26 13.671 -10.715 -2.640 1.00 13.13 C ATOM 382 OG SER A 26 14.090 -10.154 -3.872 1.00 20.14 O ATOM 0 H SER A 26 11.924 -9.004 -2.701 1.00 62.40 H new ATOM 0 HA SER A 26 11.931 -11.697 -3.518 1.00 54.34 H new ATOM 0 HB2 SER A 26 13.862 -10.005 -1.835 1.00 13.13 H new ATOM 0 HB3 SER A 26 14.263 -11.605 -2.427 1.00 13.13 H new ATOM 0 HG SER A 26 13.780 -9.226 -3.931 1.00 20.14 H new ATOM 387 N GLU A 27 11.332 -11.323 -0.338 1.00 61.13 N ATOM 388 CA GLU A 27 11.047 -12.015 0.920 1.00 22.34 C ATOM 389 C GLU A 27 9.681 -12.717 0.900 1.00 71.30 C ATOM 390 O GLU A 27 9.466 -13.686 1.637 1.00 35.45 O ATOM 391 CB GLU A 27 11.127 -10.987 2.066 1.00 21.11 C ATOM 392 CG GLU A 27 12.572 -10.672 2.479 1.00 3.24 C ATOM 393 CD GLU A 27 13.311 -11.892 3.038 1.00 72.34 C ATOM 394 OE1 GLU A 27 13.249 -12.121 4.268 1.00 22.32 O ATOM 395 OE2 GLU A 27 13.989 -12.598 2.254 1.00 11.14 O ATOM 0 H GLU A 27 11.084 -10.334 -0.324 1.00 61.13 H new ATOM 0 HA GLU A 27 11.787 -12.801 1.069 1.00 22.34 H new ATOM 0 HB2 GLU A 27 10.633 -10.066 1.758 1.00 21.11 H new ATOM 0 HB3 GLU A 27 10.581 -11.368 2.929 1.00 21.11 H new ATOM 0 HG2 GLU A 27 13.116 -10.288 1.616 1.00 3.24 H new ATOM 0 HG3 GLU A 27 12.566 -9.882 3.230 1.00 3.24 H new ATOM 400 N ILE A 28 8.768 -12.241 0.059 1.00 42.04 N ATOM 401 CA ILE A 28 7.433 -12.777 -0.156 1.00 61.44 C ATOM 402 C ILE A 28 7.558 -14.021 -1.061 1.00 11.44 C ATOM 403 O ILE A 28 8.607 -14.301 -1.644 1.00 74.11 O ATOM 404 CB ILE A 28 6.540 -11.627 -0.700 1.00 71.20 C ATOM 405 CG1 ILE A 28 6.366 -10.533 0.389 1.00 71.53 C ATOM 406 CG2 ILE A 28 5.136 -12.069 -1.138 1.00 32.35 C ATOM 407 CD1 ILE A 28 5.887 -9.178 -0.145 1.00 53.12 C ATOM 0 H ILE A 28 8.953 -11.424 -0.523 1.00 42.04 H new ATOM 0 HA ILE A 28 6.944 -13.126 0.753 1.00 61.44 H new ATOM 0 HB ILE A 28 7.060 -11.254 -1.582 1.00 71.20 H new ATOM 0 HG12 ILE A 28 5.654 -10.889 1.133 1.00 71.53 H new ATOM 0 HG13 ILE A 28 7.318 -10.392 0.901 1.00 71.53 H new ATOM 0 HG21 ILE A 28 4.580 -11.206 -1.504 1.00 32.35 H new ATOM 0 HG22 ILE A 28 5.219 -12.810 -1.933 1.00 32.35 H new ATOM 0 HG23 ILE A 28 4.610 -12.505 -0.289 1.00 32.35 H new ATOM 0 HD11 ILE A 28 5.793 -8.474 0.682 1.00 53.12 H new ATOM 0 HD12 ILE A 28 6.609 -8.796 -0.867 1.00 53.12 H new ATOM 0 HD13 ILE A 28 4.919 -9.300 -0.630 1.00 53.12 H new ATOM 418 N LYS A 29 6.491 -14.820 -1.145 1.00 22.11 N ATOM 419 CA LYS A 29 6.270 -15.859 -2.162 1.00 15.34 C ATOM 420 C LYS A 29 6.498 -15.342 -3.585 1.00 20.52 C ATOM 421 O LYS A 29 6.764 -14.170 -3.788 1.00 75.24 O ATOM 422 CB LYS A 29 4.828 -16.400 -2.002 1.00 51.33 C ATOM 423 CG LYS A 29 4.793 -17.863 -1.558 1.00 33.15 C ATOM 424 CD LYS A 29 5.273 -18.879 -2.602 1.00 63.11 C ATOM 425 CE LYS A 29 4.284 -19.055 -3.763 1.00 4.43 C ATOM 426 NZ LYS A 29 4.777 -20.059 -4.730 1.00 1.25 N ATOM 0 H LYS A 29 5.722 -14.760 -0.478 1.00 22.11 H new ATOM 0 HA LYS A 29 6.996 -16.657 -2.007 1.00 15.34 H new ATOM 0 HB2 LYS A 29 4.294 -15.790 -1.273 1.00 51.33 H new ATOM 0 HB3 LYS A 29 4.299 -16.299 -2.950 1.00 51.33 H new ATOM 0 HG2 LYS A 29 5.407 -17.968 -0.664 1.00 33.15 H new ATOM 0 HG3 LYS A 29 3.771 -18.115 -1.274 1.00 33.15 H new ATOM 0 HD2 LYS A 29 6.237 -18.558 -2.998 1.00 63.11 H new ATOM 0 HD3 LYS A 29 5.432 -19.842 -2.118 1.00 63.11 H new ATOM 0 HE2 LYS A 29 3.313 -19.364 -3.375 1.00 4.43 H new ATOM 0 HE3 LYS A 29 4.136 -18.100 -4.268 1.00 4.43 H new ATOM 0 HZ1 LYS A 29 4.091 -20.160 -5.505 1.00 1.25 H new ATOM 0 HZ2 LYS A 29 5.692 -19.750 -5.115 1.00 1.25 H new ATOM 0 HZ3 LYS A 29 4.895 -20.974 -4.250 1.00 1.25 H new ATOM 436 N ASP A 30 6.310 -16.198 -4.589 1.00 71.31 N ATOM 437 CA ASP A 30 6.235 -15.929 -6.026 1.00 1.12 C ATOM 438 C ASP A 30 4.955 -15.142 -6.325 1.00 51.01 C ATOM 439 O ASP A 30 3.963 -15.624 -6.885 1.00 73.22 O ATOM 440 CB ASP A 30 6.334 -17.242 -6.815 1.00 54.24 C ATOM 441 CG ASP A 30 5.965 -17.127 -8.297 1.00 0.21 C ATOM 442 OD1 ASP A 30 6.405 -16.188 -8.997 1.00 13.11 O ATOM 443 OD2 ASP A 30 5.188 -17.985 -8.775 1.00 21.25 O ATOM 0 H ASP A 30 6.195 -17.193 -4.399 1.00 71.31 H new ATOM 0 HA ASP A 30 7.077 -15.314 -6.345 1.00 1.12 H new ATOM 0 HB2 ASP A 30 7.353 -17.621 -6.737 1.00 54.24 H new ATOM 0 HB3 ASP A 30 5.682 -17.981 -6.348 1.00 54.24 H new ATOM 447 N SER A 31 4.965 -13.933 -5.798 1.00 13.25 N ATOM 448 CA SER A 31 3.919 -12.930 -5.823 1.00 31.55 C ATOM 449 C SER A 31 4.082 -12.035 -7.055 1.00 64.23 C ATOM 450 O SER A 31 4.634 -12.484 -8.062 1.00 60.51 O ATOM 451 CB SER A 31 3.922 -12.214 -4.470 1.00 51.33 C ATOM 452 OG SER A 31 4.837 -11.147 -4.340 1.00 73.11 O ATOM 0 H SER A 31 5.785 -13.597 -5.293 1.00 13.25 H new ATOM 0 HA SER A 31 2.925 -13.361 -5.939 1.00 31.55 H new ATOM 0 HB2 SER A 31 2.919 -11.832 -4.280 1.00 51.33 H new ATOM 0 HB3 SER A 31 4.136 -12.948 -3.693 1.00 51.33 H new ATOM 0 HG SER A 31 4.372 -10.358 -3.992 1.00 73.11 H new ATOM 457 N GLU A 32 3.595 -10.793 -7.028 1.00 43.30 N ATOM 458 CA GLU A 32 3.756 -9.860 -8.129 1.00 61.14 C ATOM 459 C GLU A 32 4.257 -8.521 -7.623 1.00 32.13 C ATOM 460 O GLU A 32 4.064 -8.167 -6.461 1.00 22.53 O ATOM 461 CB GLU A 32 2.413 -9.658 -8.829 1.00 62.14 C ATOM 462 CG GLU A 32 2.554 -9.455 -10.337 1.00 11.05 C ATOM 463 CD GLU A 32 1.925 -10.587 -11.145 1.00 54.22 C ATOM 464 OE1 GLU A 32 2.452 -11.728 -11.153 1.00 61.43 O ATOM 465 OE2 GLU A 32 0.837 -10.323 -11.710 1.00 61.43 O ATOM 0 H GLU A 32 3.077 -10.411 -6.236 1.00 43.30 H new ATOM 0 HA GLU A 32 4.484 -10.271 -8.828 1.00 61.14 H new ATOM 0 HB2 GLU A 32 1.777 -10.523 -8.642 1.00 62.14 H new ATOM 0 HB3 GLU A 32 1.910 -8.793 -8.396 1.00 62.14 H new ATOM 0 HG2 GLU A 32 2.087 -8.511 -10.618 1.00 11.05 H new ATOM 0 HG3 GLU A 32 3.611 -9.376 -10.592 1.00 11.05 H new ATOM 470 N LEU A 33 4.762 -7.704 -8.536 1.00 21.15 N ATOM 471 CA LEU A 33 5.285 -6.369 -8.259 1.00 71.53 C ATOM 472 C LEU A 33 4.754 -5.392 -9.311 1.00 33.51 C ATOM 473 O LEU A 33 5.008 -5.559 -10.500 1.00 0.03 O ATOM 474 CB LEU A 33 6.826 -6.407 -8.202 1.00 22.22 C ATOM 475 CG LEU A 33 7.438 -5.772 -6.946 1.00 54.34 C ATOM 476 CD1 LEU A 33 8.969 -5.811 -7.070 1.00 75.43 C ATOM 477 CD2 LEU A 33 7.051 -4.325 -6.646 1.00 32.23 C ATOM 0 H LEU A 33 4.822 -7.958 -9.522 1.00 21.15 H new ATOM 0 HA LEU A 33 4.944 -6.020 -7.284 1.00 71.53 H new ATOM 0 HB2 LEU A 33 7.153 -7.445 -8.263 1.00 22.22 H new ATOM 0 HB3 LEU A 33 7.221 -5.896 -9.080 1.00 22.22 H new ATOM 0 HG LEU A 33 7.036 -6.366 -6.125 1.00 54.34 H new ATOM 0 HD11 LEU A 33 9.417 -5.363 -6.183 1.00 75.43 H new ATOM 0 HD12 LEU A 33 9.300 -6.845 -7.161 1.00 75.43 H new ATOM 0 HD13 LEU A 33 9.277 -5.253 -7.954 1.00 75.43 H new ATOM 0 HD21 LEU A 33 7.550 -3.997 -5.734 1.00 32.23 H new ATOM 0 HD22 LEU A 33 7.355 -3.687 -7.476 1.00 32.23 H new ATOM 0 HD23 LEU A 33 5.971 -4.257 -6.513 1.00 32.23 H new ATOM 488 N LYS A 34 3.965 -4.409 -8.871 1.00 62.30 N ATOM 489 CA LYS A 34 3.282 -3.411 -9.672 1.00 11.14 C ATOM 490 C LYS A 34 3.627 -2.024 -9.131 1.00 62.14 C ATOM 491 O LYS A 34 4.089 -1.883 -7.995 1.00 63.12 O ATOM 492 CB LYS A 34 1.771 -3.648 -9.589 1.00 43.20 C ATOM 493 CG LYS A 34 1.170 -4.316 -10.817 1.00 23.01 C ATOM 494 CD LYS A 34 1.564 -5.766 -11.120 1.00 62.23 C ATOM 495 CE LYS A 34 0.665 -6.215 -12.283 1.00 1.04 C ATOM 496 NZ LYS A 34 0.836 -7.624 -12.690 1.00 14.24 N ATOM 0 H LYS A 34 3.779 -4.288 -7.875 1.00 62.30 H new ATOM 0 HA LYS A 34 3.596 -3.481 -10.713 1.00 11.14 H new ATOM 0 HB2 LYS A 34 1.560 -4.265 -8.715 1.00 43.20 H new ATOM 0 HB3 LYS A 34 1.274 -2.691 -9.431 1.00 43.20 H new ATOM 0 HG2 LYS A 34 0.085 -4.280 -10.718 1.00 23.01 H new ATOM 0 HG3 LYS A 34 1.431 -3.712 -11.686 1.00 23.01 H new ATOM 0 HD2 LYS A 34 2.617 -5.835 -11.392 1.00 62.23 H new ATOM 0 HD3 LYS A 34 1.418 -6.401 -10.246 1.00 62.23 H new ATOM 0 HE2 LYS A 34 -0.376 -6.057 -12.001 1.00 1.04 H new ATOM 0 HE3 LYS A 34 0.863 -5.576 -13.144 1.00 1.04 H new ATOM 0 HZ1 LYS A 34 0.337 -7.789 -13.587 1.00 14.24 H new ATOM 0 HZ2 LYS A 34 1.848 -7.829 -12.814 1.00 14.24 H new ATOM 0 HZ3 LYS A 34 0.444 -8.247 -11.956 1.00 14.24 H new ATOM 506 N GLU A 35 3.318 -0.973 -9.890 1.00 62.34 N ATOM 507 CA GLU A 35 3.585 0.402 -9.483 1.00 34.14 C ATOM 508 C GLU A 35 2.380 1.323 -9.673 1.00 22.33 C ATOM 509 O GLU A 35 1.398 0.968 -10.326 1.00 1.34 O ATOM 510 CB GLU A 35 4.844 0.912 -10.193 1.00 52.24 C ATOM 511 CG GLU A 35 4.671 1.305 -11.665 1.00 2.33 C ATOM 512 CD GLU A 35 5.999 1.727 -12.303 1.00 1.13 C ATOM 513 OE1 GLU A 35 6.884 2.247 -11.580 1.00 55.12 O ATOM 514 OE2 GLU A 35 6.115 1.549 -13.538 1.00 60.23 O ATOM 0 H GLU A 35 2.875 -1.053 -10.805 1.00 62.34 H new ATOM 0 HA GLU A 35 3.771 0.411 -8.409 1.00 34.14 H new ATOM 0 HB2 GLU A 35 5.219 1.778 -9.648 1.00 52.24 H new ATOM 0 HB3 GLU A 35 5.611 0.140 -10.131 1.00 52.24 H new ATOM 0 HG2 GLU A 35 4.253 0.464 -12.219 1.00 2.33 H new ATOM 0 HG3 GLU A 35 3.955 2.124 -11.741 1.00 2.33 H new ATOM 519 N VAL A 36 2.475 2.522 -9.098 1.00 75.34 N ATOM 520 CA VAL A 36 1.495 3.601 -9.121 1.00 0.22 C ATOM 521 C VAL A 36 2.313 4.900 -9.218 1.00 35.34 C ATOM 522 O VAL A 36 3.386 4.972 -8.612 1.00 34.12 O ATOM 523 CB VAL A 36 0.683 3.578 -7.802 1.00 0.41 C ATOM 524 CG1 VAL A 36 -0.536 4.505 -7.914 1.00 72.24 C ATOM 525 CG2 VAL A 36 0.153 2.177 -7.441 1.00 73.30 C ATOM 0 H VAL A 36 3.304 2.781 -8.564 1.00 75.34 H new ATOM 0 HA VAL A 36 0.794 3.509 -9.950 1.00 0.22 H new ATOM 0 HB VAL A 36 1.374 3.905 -7.025 1.00 0.41 H new ATOM 0 HG11 VAL A 36 -1.099 4.480 -6.981 1.00 72.24 H new ATOM 0 HG12 VAL A 36 -0.202 5.524 -8.109 1.00 72.24 H new ATOM 0 HG13 VAL A 36 -1.174 4.170 -8.732 1.00 72.24 H new ATOM 0 HG21 VAL A 36 -0.407 2.229 -6.507 1.00 73.30 H new ATOM 0 HG22 VAL A 36 -0.501 1.819 -8.236 1.00 73.30 H new ATOM 0 HG23 VAL A 36 0.991 1.490 -7.324 1.00 73.30 H new ATOM 535 N LYS A 37 1.832 5.933 -9.916 1.00 20.21 N ATOM 536 CA LYS A 37 2.328 7.305 -9.803 1.00 60.40 C ATOM 537 C LYS A 37 1.157 8.300 -9.764 1.00 20.14 C ATOM 538 O LYS A 37 0.007 7.879 -9.603 1.00 4.53 O ATOM 539 CB LYS A 37 3.437 7.588 -10.831 1.00 64.14 C ATOM 540 CG LYS A 37 3.052 7.780 -12.305 1.00 42.40 C ATOM 541 CD LYS A 37 2.866 6.469 -13.085 1.00 13.44 C ATOM 542 CE LYS A 37 2.601 6.735 -14.574 1.00 52.50 C ATOM 543 NZ LYS A 37 3.761 7.322 -15.282 1.00 21.14 N ATOM 0 H LYS A 37 1.071 5.835 -10.589 1.00 20.21 H new ATOM 0 HA LYS A 37 2.832 7.446 -8.847 1.00 60.40 H new ATOM 0 HB2 LYS A 37 3.964 8.486 -10.508 1.00 64.14 H new ATOM 0 HB3 LYS A 37 4.150 6.765 -10.781 1.00 64.14 H new ATOM 0 HG2 LYS A 37 2.126 8.354 -12.355 1.00 42.40 H new ATOM 0 HG3 LYS A 37 3.823 8.375 -12.795 1.00 42.40 H new ATOM 0 HD2 LYS A 37 3.757 5.850 -12.977 1.00 13.44 H new ATOM 0 HD3 LYS A 37 2.034 5.906 -12.661 1.00 13.44 H new ATOM 0 HE2 LYS A 37 2.324 5.799 -15.059 1.00 52.50 H new ATOM 0 HE3 LYS A 37 1.748 7.407 -14.669 1.00 52.50 H new ATOM 0 HZ1 LYS A 37 3.580 7.320 -16.306 1.00 21.14 H new ATOM 0 HZ2 LYS A 37 3.907 8.299 -14.958 1.00 21.14 H new ATOM 0 HZ3 LYS A 37 4.612 6.760 -15.080 1.00 21.14 H new ATOM 553 N VAL A 38 1.422 9.604 -9.867 1.00 1.33 N ATOM 554 CA VAL A 38 0.410 10.661 -9.980 1.00 52.20 C ATOM 555 C VAL A 38 0.733 11.547 -11.184 1.00 72.45 C ATOM 556 O VAL A 38 1.749 11.349 -11.854 1.00 51.50 O ATOM 557 CB VAL A 38 0.278 11.499 -8.687 1.00 41.52 C ATOM 558 CG1 VAL A 38 -0.329 10.710 -7.528 1.00 73.30 C ATOM 559 CG2 VAL A 38 1.608 12.130 -8.252 1.00 55.35 C ATOM 0 H VAL A 38 2.375 9.966 -9.874 1.00 1.33 H new ATOM 0 HA VAL A 38 -0.559 10.184 -10.130 1.00 52.20 H new ATOM 0 HB VAL A 38 -0.411 12.304 -8.943 1.00 41.52 H new ATOM 0 HG11 VAL A 38 -0.397 11.350 -6.648 1.00 73.30 H new ATOM 0 HG12 VAL A 38 -1.326 10.366 -7.804 1.00 73.30 H new ATOM 0 HG13 VAL A 38 0.302 9.850 -7.303 1.00 73.30 H new ATOM 0 HG21 VAL A 38 1.456 12.706 -7.339 1.00 55.35 H new ATOM 0 HG22 VAL A 38 2.340 11.344 -8.067 1.00 55.35 H new ATOM 0 HG23 VAL A 38 1.973 12.788 -9.040 1.00 55.35 H new ATOM 569 N SER A 39 -0.141 12.515 -11.452 1.00 33.41 N ATOM 570 CA SER A 39 0.002 13.535 -12.461 1.00 61.44 C ATOM 571 C SER A 39 1.007 14.596 -11.980 1.00 62.21 C ATOM 572 O SER A 39 1.495 14.563 -10.849 1.00 60.21 O ATOM 573 CB SER A 39 -1.398 14.117 -12.634 1.00 62.24 C ATOM 574 OG SER A 39 -2.028 13.640 -13.807 1.00 53.24 O ATOM 0 H SER A 39 -1.015 12.604 -10.934 1.00 33.41 H new ATOM 0 HA SER A 39 0.384 13.152 -13.407 1.00 61.44 H new ATOM 0 HB2 SER A 39 -2.006 13.862 -11.766 1.00 62.24 H new ATOM 0 HB3 SER A 39 -1.337 15.205 -12.672 1.00 62.24 H new ATOM 0 HG SER A 39 -1.391 13.659 -14.551 1.00 53.24 H new ATOM 579 N GLU A 40 1.319 15.557 -12.846 1.00 51.21 N ATOM 580 CA GLU A 40 2.550 16.349 -12.792 1.00 42.45 C ATOM 581 C GLU A 40 2.335 17.817 -12.426 1.00 4.53 C ATOM 582 O GLU A 40 3.056 18.725 -12.846 1.00 11.34 O ATOM 583 CB GLU A 40 3.330 16.147 -14.081 1.00 52.34 C ATOM 584 CG GLU A 40 2.601 16.599 -15.350 1.00 21.32 C ATOM 585 CD GLU A 40 3.599 16.735 -16.498 1.00 60.14 C ATOM 586 OE1 GLU A 40 4.413 15.799 -16.692 1.00 42.22 O ATOM 587 OE2 GLU A 40 3.618 17.806 -17.150 1.00 74.02 O ATOM 0 H GLU A 40 0.711 15.814 -13.623 1.00 51.21 H new ATOM 0 HA GLU A 40 3.152 15.980 -11.962 1.00 42.45 H new ATOM 0 HB2 GLU A 40 4.273 16.689 -14.008 1.00 52.34 H new ATOM 0 HB3 GLU A 40 3.577 15.090 -14.178 1.00 52.34 H new ATOM 0 HG2 GLU A 40 1.827 15.878 -15.612 1.00 21.32 H new ATOM 0 HG3 GLU A 40 2.102 17.552 -15.174 1.00 21.32 H new ATOM 592 N GLY A 41 1.306 18.038 -11.632 1.00 2.12 N ATOM 593 CA GLY A 41 0.896 19.323 -11.093 1.00 71.15 C ATOM 594 C GLY A 41 0.382 19.217 -9.671 1.00 23.31 C ATOM 595 O GLY A 41 -0.247 20.159 -9.188 1.00 54.41 O ATOM 0 H GLY A 41 0.696 17.280 -11.326 1.00 2.12 H new ATOM 0 HA2 GLY A 41 1.741 20.011 -11.121 1.00 71.15 H new ATOM 0 HA3 GLY A 41 0.118 19.748 -11.727 1.00 71.15 H new ATOM 599 N THR A 42 0.646 18.101 -8.993 1.00 31.42 N ATOM 600 CA THR A 42 0.164 17.869 -7.656 1.00 2.11 C ATOM 601 C THR A 42 1.082 18.655 -6.718 1.00 52.22 C ATOM 602 O THR A 42 0.595 19.435 -5.904 1.00 63.24 O ATOM 603 CB THR A 42 0.133 16.354 -7.366 1.00 3.44 C ATOM 604 OG1 THR A 42 -0.159 15.570 -8.515 1.00 60.01 O ATOM 605 CG2 THR A 42 -0.955 16.042 -6.341 1.00 55.53 C ATOM 0 H THR A 42 1.205 17.335 -9.369 1.00 31.42 H new ATOM 0 HA THR A 42 -0.860 18.213 -7.513 1.00 2.11 H new ATOM 0 HB THR A 42 1.130 16.103 -7.005 1.00 3.44 H new ATOM 0 HG1 THR A 42 0.658 15.442 -9.040 1.00 60.01 H new ATOM 0 HG21 THR A 42 -0.971 14.971 -6.142 1.00 55.53 H new ATOM 0 HG22 THR A 42 -0.749 16.580 -5.416 1.00 55.53 H new ATOM 0 HG23 THR A 42 -1.924 16.352 -6.733 1.00 55.53 H new ATOM 613 N PHE A 43 2.403 18.482 -6.859 1.00 32.13 N ATOM 614 CA PHE A 43 3.422 19.063 -5.998 1.00 23.32 C ATOM 615 C PHE A 43 4.758 19.215 -6.725 1.00 20.44 C ATOM 616 O PHE A 43 4.819 19.191 -7.953 1.00 35.41 O ATOM 617 CB PHE A 43 3.516 18.282 -4.683 1.00 44.45 C ATOM 618 CG PHE A 43 3.157 16.836 -4.780 1.00 11.24 C ATOM 619 CD1 PHE A 43 4.002 15.941 -5.448 1.00 72.31 C ATOM 620 CD2 PHE A 43 1.907 16.439 -4.292 1.00 42.14 C ATOM 621 CE1 PHE A 43 3.591 14.612 -5.629 1.00 14.14 C ATOM 622 CE2 PHE A 43 1.502 15.109 -4.451 1.00 52.12 C ATOM 623 CZ PHE A 43 2.346 14.204 -5.118 1.00 35.00 C ATOM 0 H PHE A 43 2.798 17.911 -7.606 1.00 32.13 H new ATOM 0 HA PHE A 43 3.127 20.079 -5.736 1.00 23.32 H new ATOM 0 HB2 PHE A 43 4.534 18.363 -4.302 1.00 44.45 H new ATOM 0 HB3 PHE A 43 2.862 18.755 -3.950 1.00 44.45 H new ATOM 0 HD1 PHE A 43 4.961 16.271 -5.820 1.00 72.31 H new ATOM 0 HD2 PHE A 43 1.262 17.151 -3.798 1.00 42.14 H new ATOM 0 HE1 PHE A 43 4.223 13.911 -6.154 1.00 14.14 H new ATOM 0 HE2 PHE A 43 0.549 14.780 -4.064 1.00 52.12 H new ATOM 0 HZ PHE A 43 2.033 13.178 -5.240 1.00 35.00 H new ATOM 632 N ASP A 44 5.808 19.458 -5.949 1.00 1.10 N ATOM 633 CA ASP A 44 7.171 19.812 -6.304 1.00 20.31 C ATOM 634 C ASP A 44 8.074 19.038 -5.328 1.00 11.34 C ATOM 635 O ASP A 44 7.574 18.379 -4.413 1.00 13.22 O ATOM 636 CB ASP A 44 7.297 21.335 -6.111 1.00 34.00 C ATOM 637 CG ASP A 44 8.550 21.991 -6.704 1.00 51.21 C ATOM 638 OD1 ASP A 44 9.528 21.309 -7.093 1.00 1.21 O ATOM 639 OD2 ASP A 44 8.604 23.238 -6.672 1.00 11.41 O ATOM 0 H ASP A 44 5.708 19.404 -4.935 1.00 1.10 H new ATOM 0 HA ASP A 44 7.446 19.565 -7.329 1.00 20.31 H new ATOM 0 HB2 ASP A 44 6.420 21.810 -6.552 1.00 34.00 H new ATOM 0 HB3 ASP A 44 7.272 21.548 -5.042 1.00 34.00 H new ATOM 643 N ALA A 45 9.389 19.144 -5.462 1.00 0.34 N ATOM 644 CA ALA A 45 10.387 18.634 -4.532 1.00 63.34 C ATOM 645 C ALA A 45 10.826 19.738 -3.552 1.00 42.34 C ATOM 646 O ALA A 45 12.006 19.809 -3.196 1.00 53.23 O ATOM 647 CB ALA A 45 11.557 18.087 -5.359 1.00 41.51 C ATOM 0 H ALA A 45 9.810 19.613 -6.264 1.00 0.34 H new ATOM 0 HA ALA A 45 9.977 17.831 -3.920 1.00 63.34 H new ATOM 0 HB1 ALA A 45 12.324 17.696 -4.690 1.00 41.51 H new ATOM 0 HB2 ALA A 45 11.201 17.288 -6.009 1.00 41.51 H new ATOM 0 HB3 ALA A 45 11.979 18.888 -5.966 1.00 41.51 H new ATOM 653 N ASP A 46 9.919 20.651 -3.179 1.00 33.40 N ATOM 654 CA ASP A 46 10.184 21.846 -2.385 1.00 72.42 C ATOM 655 C ASP A 46 10.207 21.507 -0.876 1.00 51.51 C ATOM 656 O ASP A 46 10.223 20.332 -0.492 1.00 24.10 O ATOM 657 CB ASP A 46 9.118 22.887 -2.767 1.00 12.33 C ATOM 658 CG ASP A 46 9.572 24.313 -2.493 1.00 74.44 C ATOM 659 OD1 ASP A 46 9.364 24.741 -1.340 1.00 44.15 O ATOM 660 OD2 ASP A 46 10.088 24.972 -3.426 1.00 24.04 O ATOM 0 H ASP A 46 8.936 20.567 -3.438 1.00 33.40 H new ATOM 0 HA ASP A 46 11.170 22.261 -2.595 1.00 72.42 H new ATOM 0 HB2 ASP A 46 8.876 22.783 -3.825 1.00 12.33 H new ATOM 0 HB3 ASP A 46 8.203 22.687 -2.209 1.00 12.33 H new ATOM 664 N MET A 47 10.234 22.516 -0.002 1.00 75.14 N ATOM 665 CA MET A 47 10.204 22.390 1.458 1.00 53.24 C ATOM 666 C MET A 47 9.276 23.413 2.120 1.00 61.15 C ATOM 667 O MET A 47 8.930 23.270 3.292 1.00 62.43 O ATOM 668 CB MET A 47 11.630 22.524 2.009 1.00 3.20 C ATOM 669 CG MET A 47 12.180 23.955 1.909 1.00 51.51 C ATOM 670 SD MET A 47 13.964 24.100 2.156 1.00 64.45 S ATOM 671 CE MET A 47 14.520 23.396 0.581 1.00 75.21 C ATOM 0 H MET A 47 10.279 23.488 -0.307 1.00 75.14 H new ATOM 0 HA MET A 47 9.802 21.406 1.698 1.00 53.24 H new ATOM 0 HB2 MET A 47 11.642 22.208 3.052 1.00 3.20 H new ATOM 0 HB3 MET A 47 12.289 21.848 1.464 1.00 3.20 H new ATOM 0 HG2 MET A 47 11.929 24.358 0.928 1.00 51.51 H new ATOM 0 HG3 MET A 47 11.673 24.576 2.648 1.00 51.51 H new ATOM 0 HE1 MET A 47 15.179 22.549 0.773 1.00 75.21 H new ATOM 0 HE2 MET A 47 13.656 23.061 0.007 1.00 75.21 H new ATOM 0 HE3 MET A 47 15.060 24.154 0.014 1.00 75.21 H new ATOM 679 N TYR A 48 8.866 24.465 1.411 1.00 33.41 N ATOM 680 CA TYR A 48 7.907 25.447 1.877 1.00 24.04 C ATOM 681 C TYR A 48 6.655 25.411 1.009 1.00 23.34 C ATOM 682 O TYR A 48 5.555 25.538 1.549 1.00 11.10 O ATOM 683 CB TYR A 48 8.569 26.828 1.922 1.00 13.43 C ATOM 684 CG TYR A 48 9.273 27.287 0.660 1.00 31.30 C ATOM 685 CD1 TYR A 48 8.548 27.943 -0.352 1.00 61.43 C ATOM 686 CD2 TYR A 48 10.660 27.078 0.506 1.00 44.51 C ATOM 687 CE1 TYR A 48 9.190 28.334 -1.538 1.00 32.12 C ATOM 688 CE2 TYR A 48 11.311 27.482 -0.674 1.00 13.24 C ATOM 689 CZ TYR A 48 10.568 28.087 -1.712 1.00 71.02 C ATOM 690 OH TYR A 48 11.174 28.436 -2.878 1.00 22.41 O ATOM 0 H TYR A 48 9.207 24.656 0.469 1.00 33.41 H new ATOM 0 HA TYR A 48 7.587 25.211 2.892 1.00 24.04 H new ATOM 0 HB2 TYR A 48 7.805 27.564 2.172 1.00 13.43 H new ATOM 0 HB3 TYR A 48 9.294 26.832 2.736 1.00 13.43 H new ATOM 0 HD1 TYR A 48 7.496 28.146 -0.216 1.00 61.43 H new ATOM 0 HD2 TYR A 48 11.224 26.606 1.297 1.00 44.51 H new ATOM 0 HE1 TYR A 48 8.628 28.825 -2.319 1.00 32.12 H new ATOM 0 HE2 TYR A 48 12.374 27.330 -0.786 1.00 13.24 H new ATOM 0 HH TYR A 48 12.124 28.199 -2.837 1.00 22.41 H new ATOM 699 N LYS A 49 6.781 25.162 -0.299 1.00 35.42 N ATOM 700 CA LYS A 49 5.602 25.114 -1.154 1.00 34.21 C ATOM 701 C LYS A 49 4.787 23.881 -0.788 1.00 61.33 C ATOM 702 O LYS A 49 3.619 23.982 -0.441 1.00 41.51 O ATOM 703 CB LYS A 49 6.002 25.158 -2.643 1.00 51.33 C ATOM 704 CG LYS A 49 4.932 25.844 -3.509 1.00 20.03 C ATOM 705 CD LYS A 49 4.894 27.370 -3.277 1.00 72.12 C ATOM 706 CE LYS A 49 3.982 28.083 -4.280 1.00 24.23 C ATOM 707 NZ LYS A 49 4.636 28.263 -5.591 1.00 42.51 N ATOM 0 H LYS A 49 7.667 24.995 -0.775 1.00 35.42 H new ATOM 0 HA LYS A 49 4.977 25.992 -0.992 1.00 34.21 H new ATOM 0 HB2 LYS A 49 6.948 25.689 -2.748 1.00 51.33 H new ATOM 0 HB3 LYS A 49 6.164 24.143 -3.005 1.00 51.33 H new ATOM 0 HG2 LYS A 49 5.132 25.642 -4.561 1.00 20.03 H new ATOM 0 HG3 LYS A 49 3.954 25.418 -3.283 1.00 20.03 H new ATOM 0 HD2 LYS A 49 4.547 27.574 -2.264 1.00 72.12 H new ATOM 0 HD3 LYS A 49 5.904 27.773 -3.355 1.00 72.12 H new ATOM 0 HE2 LYS A 49 3.065 27.508 -4.408 1.00 24.23 H new ATOM 0 HE3 LYS A 49 3.695 29.056 -3.881 1.00 24.23 H new ATOM 0 HZ1 LYS A 49 3.985 28.749 -6.240 1.00 42.51 H new ATOM 0 HZ2 LYS A 49 5.498 28.833 -5.474 1.00 42.51 H new ATOM 0 HZ3 LYS A 49 4.887 27.334 -5.984 1.00 42.51 H new ATOM 717 N THR A 50 5.414 22.709 -0.805 1.00 3.31 N ATOM 718 CA THR A 50 4.737 21.426 -0.668 1.00 14.32 C ATOM 719 C THR A 50 4.043 21.233 0.676 1.00 32.20 C ATOM 720 O THR A 50 3.035 20.535 0.733 1.00 72.01 O ATOM 721 CB THR A 50 5.761 20.320 -0.914 1.00 60.34 C ATOM 722 OG1 THR A 50 6.945 20.546 -0.163 1.00 21.13 O ATOM 723 CG2 THR A 50 6.178 20.319 -2.379 1.00 43.12 C ATOM 0 H THR A 50 6.424 22.624 -0.916 1.00 3.31 H new ATOM 0 HA THR A 50 3.936 21.391 -1.406 1.00 14.32 H new ATOM 0 HB THR A 50 5.295 19.378 -0.624 1.00 60.34 H new ATOM 0 HG1 THR A 50 7.296 19.690 0.159 1.00 21.13 H new ATOM 0 HG21 THR A 50 6.909 19.528 -2.549 1.00 43.12 H new ATOM 0 HG22 THR A 50 5.303 20.146 -3.006 1.00 43.12 H new ATOM 0 HG23 THR A 50 6.621 21.282 -2.632 1.00 43.12 H new ATOM 731 N SER A 51 4.570 21.842 1.741 1.00 1.53 N ATOM 732 CA SER A 51 3.947 21.780 3.051 1.00 22.12 C ATOM 733 C SER A 51 2.540 22.379 2.970 1.00 3.34 C ATOM 734 O SER A 51 1.600 21.814 3.533 1.00 73.42 O ATOM 735 CB SER A 51 4.850 22.501 4.058 1.00 43.21 C ATOM 736 OG SER A 51 4.459 22.195 5.374 1.00 61.44 O ATOM 0 H SER A 51 5.433 22.385 1.713 1.00 1.53 H new ATOM 0 HA SER A 51 3.834 20.750 3.390 1.00 22.12 H new ATOM 0 HB2 SER A 51 5.888 22.206 3.902 1.00 43.21 H new ATOM 0 HB3 SER A 51 4.797 23.578 3.897 1.00 43.21 H new ATOM 0 HG SER A 51 5.045 22.661 6.006 1.00 61.44 H new ATOM 741 N ASP A 52 2.399 23.480 2.224 1.00 24.24 N ATOM 742 CA ASP A 52 1.148 24.197 2.012 1.00 11.22 C ATOM 743 C ASP A 52 0.212 23.416 1.098 1.00 62.45 C ATOM 744 O ASP A 52 -0.978 23.342 1.375 1.00 61.34 O ATOM 745 CB ASP A 52 1.432 25.555 1.371 1.00 33.21 C ATOM 746 CG ASP A 52 0.235 26.483 1.528 1.00 51.22 C ATOM 747 OD1 ASP A 52 0.050 26.997 2.655 1.00 44.33 O ATOM 748 OD2 ASP A 52 -0.421 26.779 0.504 1.00 44.23 O ATOM 0 H ASP A 52 3.185 23.908 1.735 1.00 24.24 H new ATOM 0 HA ASP A 52 0.670 24.326 2.983 1.00 11.22 H new ATOM 0 HB2 ASP A 52 2.311 26.005 1.833 1.00 33.21 H new ATOM 0 HB3 ASP A 52 1.661 25.423 0.313 1.00 33.21 H new ATOM 752 N ILE A 53 0.755 22.818 0.027 1.00 31.20 N ATOM 753 CA ILE A 53 0.005 21.985 -0.915 1.00 32.14 C ATOM 754 C ILE A 53 -0.708 20.890 -0.119 1.00 20.43 C ATOM 755 O ILE A 53 -1.925 20.757 -0.202 1.00 15.50 O ATOM 756 CB ILE A 53 0.934 21.409 -2.019 1.00 41.45 C ATOM 757 CG1 ILE A 53 1.583 22.553 -2.844 1.00 72.24 C ATOM 758 CG2 ILE A 53 0.200 20.441 -2.965 1.00 63.12 C ATOM 759 CD1 ILE A 53 2.601 22.102 -3.904 1.00 14.34 C ATOM 0 H ILE A 53 1.744 22.903 -0.209 1.00 31.20 H new ATOM 0 HA ILE A 53 -0.740 22.584 -1.439 1.00 32.14 H new ATOM 0 HB ILE A 53 1.710 20.843 -1.505 1.00 41.45 H new ATOM 0 HG12 ILE A 53 0.792 23.115 -3.340 1.00 72.24 H new ATOM 0 HG13 ILE A 53 2.078 23.239 -2.157 1.00 72.24 H new ATOM 0 HG21 ILE A 53 0.896 20.069 -3.717 1.00 63.12 H new ATOM 0 HG22 ILE A 53 -0.197 19.603 -2.392 1.00 63.12 H new ATOM 0 HG23 ILE A 53 -0.619 20.965 -3.457 1.00 63.12 H new ATOM 0 HD11 ILE A 53 2.996 22.975 -4.424 1.00 14.34 H new ATOM 0 HD12 ILE A 53 3.418 21.568 -3.419 1.00 14.34 H new ATOM 0 HD13 ILE A 53 2.112 21.443 -4.621 1.00 14.34 H new ATOM 770 N ALA A 54 0.041 20.115 0.667 1.00 75.11 N ATOM 771 CA ALA A 54 -0.548 19.046 1.451 1.00 1.53 C ATOM 772 C ALA A 54 -1.546 19.602 2.470 1.00 40.43 C ATOM 773 O ALA A 54 -2.636 19.053 2.579 1.00 1.11 O ATOM 774 CB ALA A 54 0.561 18.239 2.116 1.00 61.03 C ATOM 0 H ALA A 54 1.051 20.212 0.773 1.00 75.11 H new ATOM 0 HA ALA A 54 -1.110 18.380 0.796 1.00 1.53 H new ATOM 0 HB1 ALA A 54 0.122 17.435 2.706 1.00 61.03 H new ATOM 0 HB2 ALA A 54 1.211 17.815 1.351 1.00 61.03 H new ATOM 0 HB3 ALA A 54 1.144 18.890 2.767 1.00 61.03 H new ATOM 780 N LEU A 55 -1.212 20.682 3.190 1.00 75.35 N ATOM 781 CA LEU A 55 -2.081 21.297 4.202 1.00 71.22 C ATOM 782 C LEU A 55 -3.446 21.667 3.609 1.00 60.32 C ATOM 783 O LEU A 55 -4.492 21.439 4.221 1.00 40.14 O ATOM 784 CB LEU A 55 -1.346 22.518 4.793 1.00 62.03 C ATOM 785 CG LEU A 55 -1.972 23.245 5.995 1.00 3.30 C ATOM 786 CD1 LEU A 55 -2.951 24.321 5.536 1.00 3.30 C ATOM 787 CD2 LEU A 55 -2.595 22.310 7.036 1.00 2.12 C ATOM 0 H LEU A 55 -0.317 21.160 3.084 1.00 75.35 H new ATOM 0 HA LEU A 55 -2.287 20.587 5.003 1.00 71.22 H new ATOM 0 HB2 LEU A 55 -0.348 22.193 5.086 1.00 62.03 H new ATOM 0 HB3 LEU A 55 -1.221 23.248 3.993 1.00 62.03 H new ATOM 0 HG LEU A 55 -1.146 23.731 6.514 1.00 3.30 H new ATOM 0 HD11 LEU A 55 -3.379 24.819 6.406 1.00 3.30 H new ATOM 0 HD12 LEU A 55 -2.426 25.052 4.921 1.00 3.30 H new ATOM 0 HD13 LEU A 55 -3.749 23.862 4.952 1.00 3.30 H new ATOM 0 HD21 LEU A 55 -3.014 22.900 7.851 1.00 2.12 H new ATOM 0 HD22 LEU A 55 -3.386 21.722 6.570 1.00 2.12 H new ATOM 0 HD23 LEU A 55 -1.829 21.641 7.429 1.00 2.12 H new ATOM 798 N ASP A 56 -3.437 22.228 2.405 1.00 43.35 N ATOM 799 CA ASP A 56 -4.622 22.556 1.625 1.00 34.31 C ATOM 800 C ASP A 56 -5.425 21.289 1.284 1.00 72.44 C ATOM 801 O ASP A 56 -6.636 21.222 1.517 1.00 23.44 O ATOM 802 CB ASP A 56 -4.167 23.312 0.370 1.00 1.11 C ATOM 803 CG ASP A 56 -5.186 23.317 -0.675 1.00 32.40 C ATOM 804 OD1 ASP A 56 -6.227 23.896 -0.322 1.00 21.01 O ATOM 805 OD2 ASP A 56 -4.855 22.905 -1.816 1.00 63.12 O ATOM 0 H ASP A 56 -2.570 22.476 1.928 1.00 43.35 H new ATOM 0 HA ASP A 56 -5.294 23.192 2.201 1.00 34.31 H new ATOM 0 HB2 ASP A 56 -3.919 24.339 0.637 1.00 1.11 H new ATOM 0 HB3 ASP A 56 -3.256 22.855 -0.016 1.00 1.11 H new ATOM 809 N GLN A 57 -4.753 20.239 0.805 1.00 74.35 N ATOM 810 CA GLN A 57 -5.353 18.935 0.495 1.00 23.01 C ATOM 811 C GLN A 57 -5.621 18.073 1.747 1.00 24.04 C ATOM 812 O GLN A 57 -5.926 16.883 1.612 1.00 22.03 O ATOM 813 CB GLN A 57 -4.511 18.187 -0.556 1.00 71.13 C ATOM 814 CG GLN A 57 -4.347 19.030 -1.834 1.00 35.02 C ATOM 815 CD GLN A 57 -3.766 18.234 -2.998 1.00 24.23 C ATOM 816 OE1 GLN A 57 -2.583 17.900 -3.028 1.00 43.15 O ATOM 817 NE2 GLN A 57 -4.579 17.926 -3.991 1.00 52.43 N ATOM 0 H GLN A 57 -3.751 20.271 0.617 1.00 74.35 H new ATOM 0 HA GLN A 57 -6.336 19.131 0.067 1.00 23.01 H new ATOM 0 HB2 GLN A 57 -3.530 17.953 -0.142 1.00 71.13 H new ATOM 0 HB3 GLN A 57 -4.988 17.238 -0.801 1.00 71.13 H new ATOM 0 HG2 GLN A 57 -5.317 19.433 -2.124 1.00 35.02 H new ATOM 0 HG3 GLN A 57 -3.699 19.880 -1.622 1.00 35.02 H new ATOM 0 HE21 GLN A 57 -5.558 18.209 -3.955 1.00 52.43 H new ATOM 0 HE22 GLN A 57 -4.228 17.405 -4.795 1.00 52.43 H new ATOM 824 N ILE A 58 -5.519 18.644 2.952 1.00 3.40 N ATOM 825 CA ILE A 58 -5.850 18.021 4.232 1.00 63.23 C ATOM 826 C ILE A 58 -7.091 18.690 4.810 1.00 75.02 C ATOM 827 O ILE A 58 -8.027 17.994 5.189 1.00 73.43 O ATOM 828 CB ILE A 58 -4.631 18.094 5.186 1.00 21.20 C ATOM 829 CG1 ILE A 58 -3.581 17.051 4.758 1.00 31.04 C ATOM 830 CG2 ILE A 58 -4.963 17.941 6.687 1.00 41.51 C ATOM 831 CD1 ILE A 58 -2.194 17.393 5.307 1.00 41.12 C ATOM 0 H ILE A 58 -5.186 19.602 3.063 1.00 3.40 H new ATOM 0 HA ILE A 58 -6.080 16.965 4.094 1.00 63.23 H new ATOM 0 HB ILE A 58 -4.238 19.106 5.090 1.00 21.20 H new ATOM 0 HG12 ILE A 58 -3.881 16.065 5.113 1.00 31.04 H new ATOM 0 HG13 ILE A 58 -3.540 17.000 3.670 1.00 31.04 H new ATOM 0 HG21 ILE A 58 -4.045 18.006 7.271 1.00 41.51 H new ATOM 0 HG22 ILE A 58 -5.644 18.735 6.992 1.00 41.51 H new ATOM 0 HG23 ILE A 58 -5.434 16.973 6.859 1.00 41.51 H new ATOM 0 HD11 ILE A 58 -1.479 16.636 4.985 1.00 41.12 H new ATOM 0 HD12 ILE A 58 -1.884 18.368 4.931 1.00 41.12 H new ATOM 0 HD13 ILE A 58 -2.230 17.419 6.396 1.00 41.12 H new ATOM 842 N GLN A 59 -7.089 20.021 4.934 1.00 3.30 N ATOM 843 CA GLN A 59 -8.050 20.715 5.787 1.00 4.51 C ATOM 844 C GLN A 59 -9.504 20.672 5.289 1.00 31.43 C ATOM 845 O GLN A 59 -10.382 21.151 6.015 1.00 72.31 O ATOM 846 CB GLN A 59 -7.613 22.176 5.984 1.00 72.05 C ATOM 847 CG GLN A 59 -6.563 22.344 7.089 1.00 24.20 C ATOM 848 CD GLN A 59 -6.273 23.820 7.362 1.00 32.12 C ATOM 849 OE1 GLN A 59 -6.342 24.295 8.495 1.00 20.12 O ATOM 850 NE2 GLN A 59 -5.968 24.587 6.329 1.00 14.44 N ATOM 0 H GLN A 59 -6.432 20.636 4.454 1.00 3.30 H new ATOM 0 HA GLN A 59 -8.046 20.173 6.733 1.00 4.51 H new ATOM 0 HB2 GLN A 59 -7.210 22.558 5.046 1.00 72.05 H new ATOM 0 HB3 GLN A 59 -8.487 22.781 6.226 1.00 72.05 H new ATOM 0 HG2 GLN A 59 -6.915 21.865 8.003 1.00 24.20 H new ATOM 0 HG3 GLN A 59 -5.642 21.838 6.798 1.00 24.20 H new ATOM 0 HE21 GLN A 59 -5.913 24.184 5.393 1.00 14.44 H new ATOM 0 HE22 GLN A 59 -5.788 25.581 6.468 1.00 14.44 H new ATOM 857 N GLY A 60 -9.768 20.152 4.089 1.00 15.21 N ATOM 858 CA GLY A 60 -11.046 20.262 3.398 1.00 40.24 C ATOM 859 C GLY A 60 -11.092 21.469 2.462 1.00 61.02 C ATOM 860 O GLY A 60 -12.102 21.695 1.797 1.00 55.14 O ATOM 0 H GLY A 60 -9.074 19.627 3.558 1.00 15.21 H new ATOM 0 HA2 GLY A 60 -11.227 19.353 2.825 1.00 40.24 H new ATOM 0 HA3 GLY A 60 -11.848 20.342 4.131 1.00 40.24 H new ATOM 864 N ASN A 61 -10.012 22.256 2.408 1.00 72.21 N ATOM 865 CA ASN A 61 -9.934 23.494 1.640 1.00 31.43 C ATOM 866 C ASN A 61 -10.011 23.189 0.144 1.00 0.10 C ATOM 867 O ASN A 61 -10.729 23.869 -0.591 1.00 42.53 O ATOM 868 CB ASN A 61 -8.621 24.239 1.937 1.00 73.25 C ATOM 869 CG ASN A 61 -8.455 24.732 3.368 1.00 32.41 C ATOM 870 OD1 ASN A 61 -9.239 24.444 4.267 1.00 55.42 O ATOM 871 ND2 ASN A 61 -7.379 25.450 3.624 1.00 42.24 N ATOM 0 H ASN A 61 -9.151 22.041 2.910 1.00 72.21 H new ATOM 0 HA ASN A 61 -10.774 24.126 1.930 1.00 31.43 H new ATOM 0 HB2 ASN A 61 -7.787 23.578 1.700 1.00 73.25 H new ATOM 0 HB3 ASN A 61 -8.550 25.095 1.266 1.00 73.25 H new ATOM 0 HD21 ASN A 61 -7.194 25.770 4.575 1.00 42.24 H new ATOM 0 HD22 ASN A 61 -6.732 25.685 2.871 1.00 42.24 H new ATOM 877 N LYS A 62 -9.288 22.161 -0.307 1.00 60.43 N ATOM 878 CA LYS A 62 -9.168 21.762 -1.706 1.00 1.50 C ATOM 879 C LYS A 62 -9.414 20.280 -1.888 1.00 33.43 C ATOM 880 O LYS A 62 -9.641 19.531 -0.929 1.00 32.41 O ATOM 881 CB LYS A 62 -7.767 22.134 -2.218 1.00 32.44 C ATOM 882 CG LYS A 62 -7.645 23.574 -2.750 1.00 72.34 C ATOM 883 CD LYS A 62 -8.656 23.932 -3.848 1.00 20.10 C ATOM 884 CE LYS A 62 -7.982 24.652 -5.020 1.00 61.12 C ATOM 885 NZ LYS A 62 -7.021 23.785 -5.739 1.00 63.11 N ATOM 0 H LYS A 62 -8.750 21.562 0.319 1.00 60.43 H new ATOM 0 HA LYS A 62 -9.928 22.291 -2.282 1.00 1.50 H new ATOM 0 HB2 LYS A 62 -7.050 21.997 -1.409 1.00 32.44 H new ATOM 0 HB3 LYS A 62 -7.488 21.441 -3.012 1.00 32.44 H new ATOM 0 HG2 LYS A 62 -7.770 24.267 -1.918 1.00 72.34 H new ATOM 0 HG3 LYS A 62 -6.637 23.721 -3.139 1.00 72.34 H new ATOM 0 HD2 LYS A 62 -9.140 23.024 -4.208 1.00 20.10 H new ATOM 0 HD3 LYS A 62 -9.438 24.567 -3.431 1.00 20.10 H new ATOM 0 HE2 LYS A 62 -8.745 24.999 -5.717 1.00 61.12 H new ATOM 0 HE3 LYS A 62 -7.463 25.536 -4.649 1.00 61.12 H new ATOM 0 HZ1 LYS A 62 -6.901 24.132 -6.712 1.00 63.11 H new ATOM 0 HZ2 LYS A 62 -6.104 23.803 -5.250 1.00 63.11 H new ATOM 0 HZ3 LYS A 62 -7.382 22.810 -5.761 1.00 63.11 H new ATOM 895 N ASP A 63 -9.376 19.891 -3.154 1.00 73.42 N ATOM 896 CA ASP A 63 -9.677 18.541 -3.596 1.00 64.44 C ATOM 897 C ASP A 63 -8.487 17.623 -3.329 1.00 21.22 C ATOM 898 O ASP A 63 -7.348 18.081 -3.175 1.00 20.43 O ATOM 899 CB ASP A 63 -10.043 18.559 -5.080 1.00 21.22 C ATOM 900 CG ASP A 63 -10.995 17.437 -5.487 1.00 44.53 C ATOM 901 OD1 ASP A 63 -11.148 16.432 -4.762 1.00 35.04 O ATOM 902 OD2 ASP A 63 -11.638 17.592 -6.552 1.00 13.14 O ATOM 0 H ASP A 63 -9.129 20.520 -3.918 1.00 73.42 H new ATOM 0 HA ASP A 63 -10.528 18.154 -3.036 1.00 64.44 H new ATOM 0 HB2 ASP A 63 -10.501 19.518 -5.321 1.00 21.22 H new ATOM 0 HB3 ASP A 63 -9.131 18.483 -5.672 1.00 21.22 H new ATOM 906 N PHE A 64 -8.746 16.322 -3.293 1.00 24.31 N ATOM 907 CA PHE A 64 -7.712 15.303 -3.164 1.00 73.04 C ATOM 908 C PHE A 64 -7.079 15.029 -4.537 1.00 15.22 C ATOM 909 O PHE A 64 -7.688 15.322 -5.571 1.00 4.50 O ATOM 910 CB PHE A 64 -8.277 14.031 -2.506 1.00 22.01 C ATOM 911 CG PHE A 64 -9.605 13.511 -3.019 1.00 35.34 C ATOM 912 CD1 PHE A 64 -10.804 14.011 -2.479 1.00 21.33 C ATOM 913 CD2 PHE A 64 -9.649 12.483 -3.980 1.00 21.40 C ATOM 914 CE1 PHE A 64 -12.039 13.499 -2.906 1.00 31.24 C ATOM 915 CE2 PHE A 64 -10.887 11.964 -4.398 1.00 63.05 C ATOM 916 CZ PHE A 64 -12.083 12.471 -3.862 1.00 71.02 C ATOM 0 H PHE A 64 -9.690 15.941 -3.353 1.00 24.31 H new ATOM 0 HA PHE A 64 -6.923 15.666 -2.505 1.00 73.04 H new ATOM 0 HB2 PHE A 64 -7.538 13.237 -2.618 1.00 22.01 H new ATOM 0 HB3 PHE A 64 -8.380 14.222 -1.438 1.00 22.01 H new ATOM 0 HD1 PHE A 64 -10.774 14.792 -1.733 1.00 21.33 H new ATOM 0 HD2 PHE A 64 -8.732 12.093 -4.396 1.00 21.40 H new ATOM 0 HE1 PHE A 64 -12.957 13.896 -2.499 1.00 31.24 H new ATOM 0 HE2 PHE A 64 -10.919 11.173 -5.133 1.00 63.05 H new ATOM 0 HZ PHE A 64 -13.033 12.071 -4.184 1.00 71.02 H new ATOM 925 N PRO A 65 -5.851 14.482 -4.583 1.00 31.13 N ATOM 926 CA PRO A 65 -5.200 14.137 -5.838 1.00 71.44 C ATOM 927 C PRO A 65 -5.849 12.919 -6.502 1.00 60.22 C ATOM 928 O PRO A 65 -6.676 12.217 -5.913 1.00 0.24 O ATOM 929 CB PRO A 65 -3.735 13.886 -5.471 1.00 55.32 C ATOM 930 CG PRO A 65 -3.805 13.409 -4.026 1.00 4.41 C ATOM 931 CD PRO A 65 -4.957 14.232 -3.459 1.00 32.34 C ATOM 0 HA PRO A 65 -5.295 14.934 -6.576 1.00 71.44 H new ATOM 0 HB2 PRO A 65 -3.282 13.136 -6.119 1.00 55.32 H new ATOM 0 HB3 PRO A 65 -3.137 14.792 -5.566 1.00 55.32 H new ATOM 0 HG2 PRO A 65 -4.001 12.339 -3.962 1.00 4.41 H new ATOM 0 HG3 PRO A 65 -2.873 13.595 -3.492 1.00 4.41 H new ATOM 0 HD2 PRO A 65 -5.470 13.692 -2.663 1.00 32.34 H new ATOM 0 HD3 PRO A 65 -4.597 15.167 -3.029 1.00 32.34 H new ATOM 936 N GLU A 66 -5.393 12.624 -7.717 1.00 72.25 N ATOM 937 CA GLU A 66 -5.715 11.411 -8.458 1.00 73.34 C ATOM 938 C GLU A 66 -4.428 10.637 -8.733 1.00 74.42 C ATOM 939 O GLU A 66 -3.336 11.122 -8.430 1.00 0.34 O ATOM 940 CB GLU A 66 -6.481 11.737 -9.748 1.00 72.41 C ATOM 941 CG GLU A 66 -5.588 12.269 -10.882 1.00 71.01 C ATOM 942 CD GLU A 66 -6.376 12.440 -12.172 1.00 11.30 C ATOM 943 OE1 GLU A 66 -6.816 11.411 -12.732 1.00 75.25 O ATOM 944 OE2 GLU A 66 -6.513 13.600 -12.618 1.00 23.23 O ATOM 0 H GLU A 66 -4.767 13.246 -8.229 1.00 72.25 H new ATOM 0 HA GLU A 66 -6.375 10.783 -7.860 1.00 73.34 H new ATOM 0 HB2 GLU A 66 -6.993 10.839 -10.092 1.00 72.41 H new ATOM 0 HB3 GLU A 66 -7.250 12.477 -9.526 1.00 72.41 H new ATOM 0 HG2 GLU A 66 -5.155 13.225 -10.588 1.00 71.01 H new ATOM 0 HG3 GLU A 66 -4.759 11.581 -11.048 1.00 71.01 H new ATOM 949 N ILE A 67 -4.549 9.461 -9.351 1.00 74.11 N ATOM 950 CA ILE A 67 -3.455 8.520 -9.554 1.00 44.30 C ATOM 951 C ILE A 67 -3.375 8.099 -11.018 1.00 63.14 C ATOM 952 O ILE A 67 -4.360 8.185 -11.757 1.00 32.33 O ATOM 953 CB ILE A 67 -3.631 7.306 -8.610 1.00 52.44 C ATOM 954 CG1 ILE A 67 -4.878 6.471 -9.004 1.00 40.24 C ATOM 955 CG2 ILE A 67 -3.681 7.774 -7.144 1.00 55.22 C ATOM 956 CD1 ILE A 67 -5.211 5.349 -8.025 1.00 32.13 C ATOM 0 H ILE A 67 -5.436 9.131 -9.733 1.00 74.11 H new ATOM 0 HA ILE A 67 -2.509 9.003 -9.309 1.00 44.30 H new ATOM 0 HB ILE A 67 -2.768 6.649 -8.716 1.00 52.44 H new ATOM 0 HG12 ILE A 67 -5.738 7.137 -9.083 1.00 40.24 H new ATOM 0 HG13 ILE A 67 -4.716 6.040 -9.992 1.00 40.24 H new ATOM 0 HG21 ILE A 67 -3.805 6.911 -6.490 1.00 55.22 H new ATOM 0 HG22 ILE A 67 -2.753 8.288 -6.894 1.00 55.22 H new ATOM 0 HG23 ILE A 67 -4.521 8.456 -7.008 1.00 55.22 H new ATOM 0 HD11 ILE A 67 -6.095 4.814 -8.372 1.00 32.13 H new ATOM 0 HD12 ILE A 67 -4.370 4.659 -7.963 1.00 32.13 H new ATOM 0 HD13 ILE A 67 -5.407 5.772 -7.040 1.00 32.13 H new ATOM 967 N GLN A 68 -2.208 7.589 -11.400 1.00 60.41 N ATOM 968 CA GLN A 68 -1.916 6.947 -12.663 1.00 53.30 C ATOM 969 C GLN A 68 -1.409 5.562 -12.328 1.00 24.35 C ATOM 970 O GLN A 68 -0.406 5.396 -11.631 1.00 31.05 O ATOM 971 CB GLN A 68 -0.862 7.719 -13.445 1.00 44.40 C ATOM 972 CG GLN A 68 -1.385 9.106 -13.809 1.00 75.03 C ATOM 973 CD GLN A 68 -0.371 9.898 -14.639 1.00 1.42 C ATOM 974 OE1 GLN A 68 0.588 9.341 -15.166 1.00 53.24 O ATOM 975 NE2 GLN A 68 -0.544 11.200 -14.788 1.00 74.01 N ATOM 0 H GLN A 68 -1.391 7.619 -10.790 1.00 60.41 H new ATOM 0 HA GLN A 68 -2.807 6.909 -13.290 1.00 53.30 H new ATOM 0 HB2 GLN A 68 0.048 7.810 -12.851 1.00 44.40 H new ATOM 0 HB3 GLN A 68 -0.598 7.173 -14.351 1.00 44.40 H new ATOM 0 HG2 GLN A 68 -2.315 9.008 -14.369 1.00 75.03 H new ATOM 0 HG3 GLN A 68 -1.618 9.657 -12.898 1.00 75.03 H new ATOM 0 HE21 GLN A 68 -1.341 11.662 -14.350 1.00 74.01 H new ATOM 0 HE22 GLN A 68 0.119 11.743 -15.341 1.00 74.01 H new ATOM 982 N LEU A 69 -2.177 4.583 -12.760 1.00 12.23 N ATOM 983 CA LEU A 69 -1.956 3.173 -12.624 1.00 71.11 C ATOM 984 C LEU A 69 -2.802 2.421 -13.657 1.00 62.41 C ATOM 985 O LEU A 69 -3.678 3.003 -14.302 1.00 75.22 O ATOM 986 CB LEU A 69 -2.329 2.733 -11.210 1.00 11.35 C ATOM 987 CG LEU A 69 -3.521 3.333 -10.457 1.00 22.01 C ATOM 988 CD1 LEU A 69 -4.822 3.402 -11.268 1.00 51.30 C ATOM 989 CD2 LEU A 69 -3.739 2.418 -9.248 1.00 14.45 C ATOM 0 H LEU A 69 -3.045 4.780 -13.257 1.00 12.23 H new ATOM 0 HA LEU A 69 -0.904 2.947 -12.798 1.00 71.11 H new ATOM 0 HB2 LEU A 69 -2.493 1.656 -11.250 1.00 11.35 H new ATOM 0 HB3 LEU A 69 -1.449 2.899 -10.588 1.00 11.35 H new ATOM 0 HG LEU A 69 -3.289 4.367 -10.204 1.00 22.01 H new ATOM 0 HD11 LEU A 69 -5.610 3.840 -10.655 1.00 51.30 H new ATOM 0 HD12 LEU A 69 -4.666 4.018 -12.154 1.00 51.30 H new ATOM 0 HD13 LEU A 69 -5.115 2.397 -11.572 1.00 51.30 H new ATOM 0 HD21 LEU A 69 -4.579 2.786 -8.660 1.00 14.45 H new ATOM 0 HD22 LEU A 69 -3.952 1.406 -9.592 1.00 14.45 H new ATOM 0 HD23 LEU A 69 -2.840 2.410 -8.631 1.00 14.45 H new ATOM 1000 N ASP A 70 -2.548 1.121 -13.760 1.00 15.33 N ATOM 1001 CA ASP A 70 -3.333 0.152 -14.521 1.00 3.15 C ATOM 1002 C ASP A 70 -4.574 -0.226 -13.706 1.00 75.43 C ATOM 1003 O ASP A 70 -4.584 -0.078 -12.476 1.00 72.12 O ATOM 1004 CB ASP A 70 -2.496 -1.111 -14.763 1.00 73.42 C ATOM 1005 CG ASP A 70 -1.459 -0.946 -15.873 1.00 33.11 C ATOM 1006 OD1 ASP A 70 -0.378 -0.365 -15.611 1.00 61.10 O ATOM 1007 OD2 ASP A 70 -1.685 -1.510 -16.969 1.00 73.12 O ATOM 0 H ASP A 70 -1.750 0.692 -13.292 1.00 15.33 H new ATOM 0 HA ASP A 70 -3.624 0.586 -15.477 1.00 3.15 H new ATOM 0 HB2 ASP A 70 -1.988 -1.384 -13.838 1.00 73.42 H new ATOM 0 HB3 ASP A 70 -3.161 -1.936 -15.017 1.00 73.42 H new ATOM 1011 N ASN A 71 -5.609 -0.766 -14.360 1.00 71.20 N ATOM 1012 CA ASN A 71 -6.738 -1.370 -13.655 1.00 24.14 C ATOM 1013 C ASN A 71 -6.428 -2.828 -13.360 1.00 3.11 C ATOM 1014 O ASN A 71 -5.894 -3.520 -14.226 1.00 31.25 O ATOM 1015 CB ASN A 71 -8.040 -1.298 -14.465 1.00 14.25 C ATOM 1016 CG ASN A 71 -9.210 -1.176 -13.503 1.00 64.13 C ATOM 1017 OD1 ASN A 71 -9.940 -2.118 -13.216 1.00 4.43 O ATOM 1018 ND2 ASN A 71 -9.374 0.005 -12.936 1.00 12.43 N ATOM 0 H ASN A 71 -5.685 -0.795 -15.377 1.00 71.20 H new ATOM 0 HA ASN A 71 -6.883 -0.806 -12.734 1.00 24.14 H new ATOM 0 HB2 ASN A 71 -8.017 -0.443 -15.141 1.00 14.25 H new ATOM 0 HB3 ASN A 71 -8.150 -2.190 -15.082 1.00 14.25 H new ATOM 0 HD21 ASN A 71 -10.116 0.143 -12.249 1.00 12.43 H new ATOM 0 HD22 ASN A 71 -8.759 0.780 -13.185 1.00 12.43 H new ATOM 1024 N ILE A 72 -6.762 -3.287 -12.156 1.00 60.40 N ATOM 1025 CA ILE A 72 -6.514 -4.659 -11.711 1.00 40.41 C ATOM 1026 C ILE A 72 -7.718 -5.087 -10.860 1.00 73.03 C ATOM 1027 O ILE A 72 -8.432 -4.249 -10.293 1.00 34.01 O ATOM 1028 CB ILE A 72 -5.158 -4.763 -10.960 1.00 23.35 C ATOM 1029 CG1 ILE A 72 -3.969 -4.258 -11.816 1.00 41.41 C ATOM 1030 CG2 ILE A 72 -4.872 -6.195 -10.457 1.00 12.35 C ATOM 1031 CD1 ILE A 72 -2.629 -4.174 -11.084 1.00 54.33 C ATOM 0 H ILE A 72 -7.219 -2.709 -11.451 1.00 60.40 H new ATOM 0 HA ILE A 72 -6.421 -5.341 -12.556 1.00 40.41 H new ATOM 0 HB ILE A 72 -5.255 -4.110 -10.093 1.00 23.35 H new ATOM 0 HG12 ILE A 72 -3.854 -4.919 -12.675 1.00 41.41 H new ATOM 0 HG13 ILE A 72 -4.215 -3.270 -12.204 1.00 41.41 H new ATOM 0 HG21 ILE A 72 -3.913 -6.214 -9.939 1.00 12.35 H new ATOM 0 HG22 ILE A 72 -5.661 -6.504 -9.771 1.00 12.35 H new ATOM 0 HG23 ILE A 72 -4.840 -6.879 -11.305 1.00 12.35 H new ATOM 0 HD11 ILE A 72 -1.863 -3.811 -11.769 1.00 54.33 H new ATOM 0 HD12 ILE A 72 -2.717 -3.489 -10.241 1.00 54.33 H new ATOM 0 HD13 ILE A 72 -2.351 -5.163 -10.720 1.00 54.33 H new ATOM 1042 N ASP A 73 -7.940 -6.389 -10.755 1.00 2.22 N ATOM 1043 CA ASP A 73 -9.025 -7.078 -10.086 1.00 43.11 C ATOM 1044 C ASP A 73 -8.615 -7.441 -8.658 1.00 4.32 C ATOM 1045 O ASP A 73 -8.465 -8.609 -8.299 1.00 13.45 O ATOM 1046 CB ASP A 73 -9.460 -8.264 -10.968 1.00 72.32 C ATOM 1047 CG ASP A 73 -8.407 -9.346 -11.239 1.00 22.41 C ATOM 1048 OD1 ASP A 73 -7.197 -9.027 -11.259 1.00 15.32 O ATOM 1049 OD2 ASP A 73 -8.808 -10.491 -11.550 1.00 40.33 O ATOM 0 H ASP A 73 -7.295 -7.054 -11.182 1.00 2.22 H new ATOM 0 HA ASP A 73 -9.903 -6.443 -9.966 1.00 43.11 H new ATOM 0 HB2 ASP A 73 -10.322 -8.738 -10.499 1.00 72.32 H new ATOM 0 HB3 ASP A 73 -9.796 -7.869 -11.927 1.00 72.32 H new ATOM 1053 N TYR A 74 -8.449 -6.405 -7.822 1.00 14.52 N ATOM 1054 CA TYR A 74 -7.974 -6.495 -6.439 1.00 64.33 C ATOM 1055 C TYR A 74 -8.809 -7.428 -5.544 1.00 23.13 C ATOM 1056 O TYR A 74 -8.323 -7.811 -4.481 1.00 61.04 O ATOM 1057 CB TYR A 74 -7.955 -5.102 -5.777 1.00 53.44 C ATOM 1058 CG TYR A 74 -7.122 -3.980 -6.387 1.00 35.12 C ATOM 1059 CD1 TYR A 74 -5.989 -4.233 -7.183 1.00 3.43 C ATOM 1060 CD2 TYR A 74 -7.461 -2.645 -6.089 1.00 51.20 C ATOM 1061 CE1 TYR A 74 -5.241 -3.159 -7.698 1.00 61.12 C ATOM 1062 CE2 TYR A 74 -6.739 -1.565 -6.628 1.00 51.32 C ATOM 1063 CZ TYR A 74 -5.621 -1.823 -7.453 1.00 42.11 C ATOM 1064 OH TYR A 74 -4.917 -0.812 -8.028 1.00 44.10 O ATOM 0 H TYR A 74 -8.651 -5.446 -8.105 1.00 14.52 H new ATOM 0 HA TYR A 74 -6.971 -6.915 -6.517 1.00 64.33 H new ATOM 0 HB2 TYR A 74 -8.986 -4.751 -5.730 1.00 53.44 H new ATOM 0 HB3 TYR A 74 -7.616 -5.236 -4.750 1.00 53.44 H new ATOM 0 HD1 TYR A 74 -5.695 -5.250 -7.398 1.00 3.43 H new ATOM 0 HD2 TYR A 74 -8.295 -2.447 -5.432 1.00 51.20 H new ATOM 0 HE1 TYR A 74 -4.361 -3.361 -8.291 1.00 61.12 H new ATOM 0 HE2 TYR A 74 -7.036 -0.549 -6.414 1.00 51.32 H new ATOM 0 HH TYR A 74 -5.304 0.048 -7.763 1.00 44.10 H new ATOM 1073 N ASN A 75 -10.037 -7.806 -5.918 1.00 41.42 N ATOM 1074 CA ASN A 75 -10.877 -8.700 -5.116 1.00 72.30 C ATOM 1075 C ASN A 75 -10.195 -10.043 -4.865 1.00 71.31 C ATOM 1076 O ASN A 75 -10.337 -10.621 -3.791 1.00 75.32 O ATOM 1077 CB ASN A 75 -12.199 -8.966 -5.846 1.00 12.41 C ATOM 1078 CG ASN A 75 -13.123 -9.890 -5.073 1.00 12.43 C ATOM 1079 OD1 ASN A 75 -13.402 -11.007 -5.492 1.00 74.21 O ATOM 1080 ND2 ASN A 75 -13.618 -9.430 -3.940 1.00 74.00 N ATOM 0 H ASN A 75 -10.476 -7.500 -6.786 1.00 41.42 H new ATOM 0 HA ASN A 75 -11.052 -8.207 -4.160 1.00 72.30 H new ATOM 0 HB2 ASN A 75 -12.707 -8.018 -6.025 1.00 12.41 H new ATOM 0 HB3 ASN A 75 -11.988 -9.404 -6.822 1.00 12.41 H new ATOM 0 HD21 ASN A 75 -14.251 -10.009 -3.388 1.00 74.00 H new ATOM 0 HD22 ASN A 75 -13.368 -8.496 -3.616 1.00 74.00 H new ATOM 1086 N ASN A 76 -9.460 -10.531 -5.863 1.00 64.10 N ATOM 1087 CA ASN A 76 -8.928 -11.888 -5.913 1.00 41.42 C ATOM 1088 C ASN A 76 -7.651 -12.062 -5.083 1.00 74.12 C ATOM 1089 O ASN A 76 -7.033 -13.125 -5.160 1.00 15.13 O ATOM 1090 CB ASN A 76 -8.617 -12.269 -7.373 1.00 24.35 C ATOM 1091 CG ASN A 76 -9.788 -12.107 -8.321 1.00 42.12 C ATOM 1092 OD1 ASN A 76 -10.549 -13.036 -8.575 1.00 73.11 O ATOM 1093 ND2 ASN A 76 -9.925 -10.929 -8.893 1.00 72.54 N ATOM 0 H ASN A 76 -9.212 -9.976 -6.682 1.00 64.10 H new ATOM 0 HA ASN A 76 -9.693 -12.538 -5.488 1.00 41.42 H new ATOM 0 HB2 ASN A 76 -7.789 -11.655 -7.728 1.00 24.35 H new ATOM 0 HB3 ASN A 76 -8.281 -13.306 -7.402 1.00 24.35 H new ATOM 0 HD21 ASN A 76 -10.677 -10.772 -9.564 1.00 72.54 H new ATOM 0 HD22 ASN A 76 -9.279 -10.173 -8.665 1.00 72.54 H new ATOM 1099 N TYR A 77 -7.184 -11.036 -4.375 1.00 64.32 N ATOM 1100 CA TYR A 77 -5.819 -10.922 -3.873 1.00 1.35 C ATOM 1101 C TYR A 77 -5.854 -10.974 -2.346 1.00 22.23 C ATOM 1102 O TYR A 77 -6.357 -10.066 -1.679 1.00 15.43 O ATOM 1103 CB TYR A 77 -5.224 -9.616 -4.412 1.00 12.11 C ATOM 1104 CG TYR A 77 -4.815 -9.735 -5.868 1.00 24.22 C ATOM 1105 CD1 TYR A 77 -5.738 -9.502 -6.900 1.00 33.23 C ATOM 1106 CD2 TYR A 77 -3.505 -10.123 -6.190 1.00 61.21 C ATOM 1107 CE1 TYR A 77 -5.345 -9.602 -8.247 1.00 61.30 C ATOM 1108 CE2 TYR A 77 -3.079 -10.163 -7.526 1.00 42.30 C ATOM 1109 CZ TYR A 77 -3.998 -9.894 -8.564 1.00 31.41 C ATOM 1110 OH TYR A 77 -3.591 -9.953 -9.860 1.00 34.35 O ATOM 0 H TYR A 77 -7.766 -10.235 -4.127 1.00 64.32 H new ATOM 0 HA TYR A 77 -5.186 -11.743 -4.210 1.00 1.35 H new ATOM 0 HB2 TYR A 77 -5.954 -8.814 -4.305 1.00 12.11 H new ATOM 0 HB3 TYR A 77 -4.356 -9.339 -3.813 1.00 12.11 H new ATOM 0 HD1 TYR A 77 -6.758 -9.244 -6.658 1.00 33.23 H new ATOM 0 HD2 TYR A 77 -2.818 -10.393 -5.401 1.00 61.21 H new ATOM 0 HE1 TYR A 77 -6.069 -9.456 -9.035 1.00 61.30 H new ATOM 0 HE2 TYR A 77 -2.051 -10.399 -7.760 1.00 42.30 H new ATOM 0 HH TYR A 77 -2.612 -9.953 -9.896 1.00 34.35 H new ATOM 1119 N ASP A 78 -5.306 -12.064 -1.809 1.00 20.15 N ATOM 1120 CA ASP A 78 -5.330 -12.453 -0.394 1.00 14.13 C ATOM 1121 C ASP A 78 -4.793 -11.343 0.513 1.00 42.03 C ATOM 1122 O ASP A 78 -5.326 -11.094 1.594 1.00 32.32 O ATOM 1123 CB ASP A 78 -4.475 -13.725 -0.221 1.00 20.41 C ATOM 1124 CG ASP A 78 -4.966 -14.682 0.866 1.00 42.22 C ATOM 1125 OD1 ASP A 78 -6.180 -14.998 0.873 1.00 64.50 O ATOM 1126 OD2 ASP A 78 -4.115 -15.232 1.600 1.00 40.30 O ATOM 0 H ASP A 78 -4.803 -12.741 -2.382 1.00 20.15 H new ATOM 0 HA ASP A 78 -6.364 -12.639 -0.103 1.00 14.13 H new ATOM 0 HB2 ASP A 78 -4.447 -14.259 -1.171 1.00 20.41 H new ATOM 0 HB3 ASP A 78 -3.451 -13.430 0.009 1.00 20.41 H new ATOM 1130 N LEU A 79 -3.738 -10.679 0.037 1.00 22.23 N ATOM 1131 CA LEU A 79 -2.931 -9.678 0.737 1.00 23.14 C ATOM 1132 C LEU A 79 -2.483 -8.619 -0.282 1.00 60.04 C ATOM 1133 O LEU A 79 -2.131 -8.991 -1.407 1.00 12.35 O ATOM 1134 CB LEU A 79 -1.683 -10.376 1.318 1.00 52.11 C ATOM 1135 CG LEU A 79 -1.278 -9.953 2.740 1.00 0.55 C ATOM 1136 CD1 LEU A 79 0.126 -10.457 3.012 1.00 53.41 C ATOM 1137 CD2 LEU A 79 -1.325 -8.450 3.041 1.00 15.14 C ATOM 0 H LEU A 79 -3.402 -10.837 -0.913 1.00 22.23 H new ATOM 0 HA LEU A 79 -3.505 -9.211 1.537 1.00 23.14 H new ATOM 0 HB2 LEU A 79 -1.858 -11.452 1.316 1.00 52.11 H new ATOM 0 HB3 LEU A 79 -0.842 -10.189 0.651 1.00 52.11 H new ATOM 0 HG LEU A 79 -2.030 -10.396 3.393 1.00 0.55 H new ATOM 0 HD11 LEU A 79 0.429 -10.165 4.018 1.00 53.41 H new ATOM 0 HD12 LEU A 79 0.145 -11.544 2.928 1.00 53.41 H new ATOM 0 HD13 LEU A 79 0.815 -10.025 2.286 1.00 53.41 H new ATOM 0 HD21 LEU A 79 -1.019 -8.276 4.072 1.00 15.14 H new ATOM 0 HD22 LEU A 79 -0.649 -7.923 2.368 1.00 15.14 H new ATOM 0 HD23 LEU A 79 -2.341 -8.082 2.897 1.00 15.14 H new ATOM 1148 N ILE A 80 -2.446 -7.329 0.052 1.00 24.11 N ATOM 1149 CA ILE A 80 -1.999 -6.275 -0.864 1.00 63.21 C ATOM 1150 C ILE A 80 -1.041 -5.342 -0.112 1.00 11.41 C ATOM 1151 O ILE A 80 -1.447 -4.632 0.800 1.00 20.25 O ATOM 1152 CB ILE A 80 -3.200 -5.543 -1.517 1.00 34.11 C ATOM 1153 CG1 ILE A 80 -4.164 -6.525 -2.228 1.00 42.34 C ATOM 1154 CG2 ILE A 80 -2.682 -4.477 -2.503 1.00 33.43 C ATOM 1155 CD1 ILE A 80 -5.361 -5.852 -2.909 1.00 20.01 C ATOM 0 H ILE A 80 -2.726 -6.982 0.969 1.00 24.11 H new ATOM 0 HA ILE A 80 -1.451 -6.710 -1.700 1.00 63.21 H new ATOM 0 HB ILE A 80 -3.771 -5.058 -0.725 1.00 34.11 H new ATOM 0 HG12 ILE A 80 -3.605 -7.087 -2.976 1.00 42.34 H new ATOM 0 HG13 ILE A 80 -4.534 -7.245 -1.498 1.00 42.34 H new ATOM 0 HG21 ILE A 80 -3.527 -3.964 -2.961 1.00 33.43 H new ATOM 0 HG22 ILE A 80 -2.066 -3.755 -1.967 1.00 33.43 H new ATOM 0 HG23 ILE A 80 -2.086 -4.958 -3.279 1.00 33.43 H new ATOM 0 HD11 ILE A 80 -5.984 -6.611 -3.382 1.00 20.01 H new ATOM 0 HD12 ILE A 80 -5.947 -5.313 -2.165 1.00 20.01 H new ATOM 0 HD13 ILE A 80 -5.004 -5.153 -3.665 1.00 20.01 H new ATOM 1166 N LEU A 81 0.245 -5.348 -0.448 1.00 34.24 N ATOM 1167 CA LEU A 81 1.217 -4.433 0.148 1.00 35.21 C ATOM 1168 C LEU A 81 1.181 -3.105 -0.606 1.00 23.44 C ATOM 1169 O LEU A 81 1.060 -3.097 -1.835 1.00 64.40 O ATOM 1170 CB LEU A 81 2.639 -5.028 0.049 1.00 2.15 C ATOM 1171 CG LEU A 81 3.074 -5.971 1.187 1.00 63.20 C ATOM 1172 CD1 LEU A 81 3.380 -5.181 2.460 1.00 41.44 C ATOM 1173 CD2 LEU A 81 2.045 -7.062 1.491 1.00 32.31 C ATOM 0 H LEU A 81 0.643 -5.984 -1.139 1.00 34.24 H new ATOM 0 HA LEU A 81 0.965 -4.279 1.197 1.00 35.21 H new ATOM 0 HB2 LEU A 81 2.716 -5.572 -0.892 1.00 2.15 H new ATOM 0 HB3 LEU A 81 3.350 -4.204 -0.001 1.00 2.15 H new ATOM 0 HG LEU A 81 3.978 -6.469 0.837 1.00 63.20 H new ATOM 0 HD11 LEU A 81 3.685 -5.868 3.250 1.00 41.44 H new ATOM 0 HD12 LEU A 81 4.185 -4.473 2.264 1.00 41.44 H new ATOM 0 HD13 LEU A 81 2.488 -4.639 2.775 1.00 41.44 H new ATOM 0 HD21 LEU A 81 2.411 -7.692 2.301 1.00 32.31 H new ATOM 0 HD22 LEU A 81 1.103 -6.601 1.787 1.00 32.31 H new ATOM 0 HD23 LEU A 81 1.887 -7.671 0.601 1.00 32.31 H new ATOM 1184 N ILE A 82 1.375 -1.992 0.106 1.00 40.50 N ATOM 1185 CA ILE A 82 1.511 -0.657 -0.460 1.00 33.14 C ATOM 1186 C ILE A 82 2.726 0.030 0.165 1.00 33.32 C ATOM 1187 O ILE A 82 2.958 -0.052 1.371 1.00 41.13 O ATOM 1188 CB ILE A 82 0.189 0.140 -0.289 1.00 40.14 C ATOM 1189 CG1 ILE A 82 -0.913 -0.367 -1.254 1.00 53.50 C ATOM 1190 CG2 ILE A 82 0.370 1.650 -0.533 1.00 3.21 C ATOM 1191 CD1 ILE A 82 -1.936 -1.269 -0.568 1.00 22.32 C ATOM 0 H ILE A 82 1.443 -2.001 1.124 1.00 40.50 H new ATOM 0 HA ILE A 82 1.689 -0.711 -1.534 1.00 33.14 H new ATOM 0 HB ILE A 82 -0.110 -0.023 0.746 1.00 40.14 H new ATOM 0 HG12 ILE A 82 -1.427 0.489 -1.692 1.00 53.50 H new ATOM 0 HG13 ILE A 82 -0.447 -0.913 -2.074 1.00 53.50 H new ATOM 0 HG21 ILE A 82 -0.586 2.157 -0.400 1.00 3.21 H new ATOM 0 HG22 ILE A 82 1.094 2.049 0.177 1.00 3.21 H new ATOM 0 HG23 ILE A 82 0.729 1.814 -1.549 1.00 3.21 H new ATOM 0 HD11 ILE A 82 -2.682 -1.592 -1.295 1.00 22.32 H new ATOM 0 HD12 ILE A 82 -1.431 -2.142 -0.154 1.00 22.32 H new ATOM 0 HD13 ILE A 82 -2.426 -0.718 0.235 1.00 22.32 H new ATOM 1202 N GLY A 83 3.467 0.767 -0.664 1.00 64.03 N ATOM 1203 CA GLY A 83 4.573 1.631 -0.276 1.00 43.24 C ATOM 1204 C GLY A 83 4.261 3.054 -0.731 1.00 23.41 C ATOM 1205 O GLY A 83 3.869 3.237 -1.883 1.00 13.35 O ATOM 0 H GLY A 83 3.301 0.775 -1.670 1.00 64.03 H new ATOM 0 HA2 GLY A 83 4.715 1.602 0.804 1.00 43.24 H new ATOM 0 HA3 GLY A 83 5.502 1.284 -0.729 1.00 43.24 H new ATOM 1209 N SER A 84 4.471 4.069 0.106 1.00 11.52 N ATOM 1210 CA SER A 84 4.345 5.473 -0.301 1.00 54.31 C ATOM 1211 C SER A 84 5.501 6.314 0.265 1.00 20.25 C ATOM 1212 O SER A 84 6.023 5.982 1.330 1.00 4.53 O ATOM 1213 CB SER A 84 2.972 6.032 0.106 1.00 62.30 C ATOM 1214 OG SER A 84 2.389 5.401 1.237 1.00 24.35 O ATOM 0 H SER A 84 4.733 3.945 1.084 1.00 11.52 H new ATOM 0 HA SER A 84 4.411 5.528 -1.388 1.00 54.31 H new ATOM 0 HB2 SER A 84 3.075 7.097 0.313 1.00 62.30 H new ATOM 0 HB3 SER A 84 2.290 5.936 -0.739 1.00 62.30 H new ATOM 0 HG SER A 84 2.840 5.707 2.051 1.00 24.35 H new ATOM 1219 N PRO A 85 5.890 7.415 -0.398 1.00 54.53 N ATOM 1220 CA PRO A 85 6.906 8.335 0.098 1.00 63.21 C ATOM 1221 C PRO A 85 6.376 9.183 1.256 1.00 22.23 C ATOM 1222 O PRO A 85 5.165 9.279 1.481 1.00 31.31 O ATOM 1223 CB PRO A 85 7.247 9.227 -1.091 1.00 1.54 C ATOM 1224 CG PRO A 85 5.932 9.294 -1.849 1.00 20.45 C ATOM 1225 CD PRO A 85 5.366 7.890 -1.667 1.00 60.33 C ATOM 0 HA PRO A 85 7.773 7.798 0.482 1.00 63.21 H new ATOM 0 HB2 PRO A 85 7.581 10.215 -0.773 1.00 1.54 H new ATOM 0 HB3 PRO A 85 8.044 8.801 -1.701 1.00 1.54 H new ATOM 0 HG2 PRO A 85 5.267 10.054 -1.439 1.00 20.45 H new ATOM 0 HG3 PRO A 85 6.083 9.536 -2.901 1.00 20.45 H new ATOM 0 HD2 PRO A 85 4.276 7.905 -1.659 1.00 60.33 H new ATOM 0 HD3 PRO A 85 5.670 7.237 -2.485 1.00 60.33 H new ATOM 1230 N VAL A 86 7.294 9.878 1.923 1.00 75.00 N ATOM 1231 CA VAL A 86 7.022 10.840 2.978 1.00 31.21 C ATOM 1232 C VAL A 86 7.600 12.210 2.587 1.00 74.33 C ATOM 1233 O VAL A 86 8.674 12.285 1.989 1.00 4.55 O ATOM 1234 CB VAL A 86 7.669 10.306 4.261 1.00 12.11 C ATOM 1235 CG1 VAL A 86 7.457 11.241 5.437 1.00 13.22 C ATOM 1236 CG2 VAL A 86 7.112 8.937 4.681 1.00 63.24 C ATOM 0 H VAL A 86 8.291 9.779 1.731 1.00 75.00 H new ATOM 0 HA VAL A 86 5.951 10.970 3.134 1.00 31.21 H new ATOM 0 HB VAL A 86 8.728 10.222 4.019 1.00 12.11 H new ATOM 0 HG11 VAL A 86 7.932 10.823 6.324 1.00 13.22 H new ATOM 0 HG12 VAL A 86 7.897 12.213 5.213 1.00 13.22 H new ATOM 0 HG13 VAL A 86 6.389 11.360 5.619 1.00 13.22 H new ATOM 0 HG21 VAL A 86 7.606 8.608 5.595 1.00 63.24 H new ATOM 0 HG22 VAL A 86 6.040 9.019 4.858 1.00 63.24 H new ATOM 0 HG23 VAL A 86 7.295 8.211 3.889 1.00 63.24 H new ATOM 1246 N TRP A 87 6.922 13.281 2.993 1.00 61.03 N ATOM 1247 CA TRP A 87 7.243 14.687 2.774 1.00 2.43 C ATOM 1248 C TRP A 87 7.515 15.375 4.125 1.00 14.14 C ATOM 1249 O TRP A 87 7.732 14.715 5.147 1.00 55.32 O ATOM 1250 CB TRP A 87 6.066 15.333 2.015 1.00 55.32 C ATOM 1251 CG TRP A 87 6.363 15.806 0.622 1.00 15.23 C ATOM 1252 CD1 TRP A 87 6.757 17.039 0.232 1.00 52.44 C ATOM 1253 CD2 TRP A 87 6.241 15.025 -0.600 1.00 12.45 C ATOM 1254 NE1 TRP A 87 6.855 17.074 -1.151 1.00 60.15 N ATOM 1255 CE2 TRP A 87 6.543 15.857 -1.714 1.00 33.23 C ATOM 1256 CE3 TRP A 87 5.852 13.699 -0.869 1.00 31.32 C ATOM 1257 CZ2 TRP A 87 6.458 15.396 -3.036 1.00 53.51 C ATOM 1258 CZ3 TRP A 87 5.730 13.236 -2.190 1.00 63.00 C ATOM 1259 CH2 TRP A 87 6.026 14.080 -3.274 1.00 61.20 C ATOM 0 H TRP A 87 6.061 13.177 3.529 1.00 61.03 H new ATOM 0 HA TRP A 87 8.147 14.797 2.175 1.00 2.43 H new ATOM 0 HB2 TRP A 87 5.251 14.611 1.966 1.00 55.32 H new ATOM 0 HB3 TRP A 87 5.706 16.182 2.597 1.00 55.32 H new ATOM 0 HD1 TRP A 87 6.963 17.867 0.894 1.00 52.44 H new ATOM 0 HE1 TRP A 87 7.125 17.900 -1.685 1.00 60.15 H new ATOM 0 HE3 TRP A 87 5.644 13.028 -0.048 1.00 31.32 H new ATOM 0 HZ2 TRP A 87 6.721 16.043 -3.860 1.00 53.51 H new ATOM 0 HZ3 TRP A 87 5.406 12.222 -2.374 1.00 63.00 H new ATOM 0 HH2 TRP A 87 5.922 13.719 -4.286 1.00 61.20 H new ATOM 1269 N SER A 88 7.509 16.708 4.131 1.00 71.10 N ATOM 1270 CA SER A 88 7.385 17.631 5.244 1.00 41.12 C ATOM 1271 C SER A 88 6.269 17.184 6.191 1.00 3.21 C ATOM 1272 O SER A 88 5.121 17.583 6.052 1.00 11.11 O ATOM 1273 CB SER A 88 7.071 19.023 4.657 1.00 21.23 C ATOM 1274 OG SER A 88 7.942 19.348 3.584 1.00 64.33 O ATOM 0 H SER A 88 7.602 17.218 3.253 1.00 71.10 H new ATOM 0 HA SER A 88 8.309 17.659 5.821 1.00 41.12 H new ATOM 0 HB2 SER A 88 6.039 19.047 4.308 1.00 21.23 H new ATOM 0 HB3 SER A 88 7.160 19.777 5.439 1.00 21.23 H new ATOM 0 HG SER A 88 7.714 20.235 3.235 1.00 64.33 H new ATOM 1279 N GLY A 89 6.604 16.302 7.124 1.00 24.02 N ATOM 1280 CA GLY A 89 5.728 15.838 8.191 1.00 52.20 C ATOM 1281 C GLY A 89 4.749 14.745 7.769 1.00 63.01 C ATOM 1282 O GLY A 89 4.514 13.836 8.566 1.00 74.23 O ATOM 0 H GLY A 89 7.529 15.874 7.159 1.00 24.02 H new ATOM 0 HA2 GLY A 89 6.341 15.464 9.011 1.00 52.20 H new ATOM 0 HA3 GLY A 89 5.163 16.687 8.576 1.00 52.20 H new ATOM 1286 N TYR A 90 4.216 14.774 6.544 1.00 43.22 N ATOM 1287 CA TYR A 90 3.164 13.858 6.105 1.00 61.34 C ATOM 1288 C TYR A 90 3.475 13.295 4.718 1.00 0.53 C ATOM 1289 O TYR A 90 4.361 13.811 4.046 1.00 34.15 O ATOM 1290 CB TYR A 90 1.778 14.537 6.159 1.00 11.31 C ATOM 1291 CG TYR A 90 1.669 16.052 6.067 1.00 52.12 C ATOM 1292 CD1 TYR A 90 2.331 16.792 5.065 1.00 14.43 C ATOM 1293 CD2 TYR A 90 0.836 16.723 6.981 1.00 42.44 C ATOM 1294 CE1 TYR A 90 2.205 18.194 5.025 1.00 31.40 C ATOM 1295 CE2 TYR A 90 0.677 18.116 6.923 1.00 55.35 C ATOM 1296 CZ TYR A 90 1.364 18.864 5.943 1.00 72.42 C ATOM 1297 OH TYR A 90 1.190 20.216 5.895 1.00 41.35 O ATOM 0 H TYR A 90 4.505 15.438 5.826 1.00 43.22 H new ATOM 0 HA TYR A 90 3.133 13.015 6.796 1.00 61.34 H new ATOM 0 HB2 TYR A 90 1.181 14.119 5.349 1.00 11.31 H new ATOM 0 HB3 TYR A 90 1.305 14.234 7.093 1.00 11.31 H new ATOM 0 HD1 TYR A 90 2.935 16.283 4.328 1.00 14.43 H new ATOM 0 HD2 TYR A 90 0.312 16.158 7.738 1.00 42.44 H new ATOM 0 HE1 TYR A 90 2.754 18.761 4.288 1.00 31.40 H new ATOM 0 HE2 TYR A 90 0.029 18.616 7.628 1.00 55.35 H new ATOM 0 HH TYR A 90 1.372 20.537 4.987 1.00 41.35 H new ATOM 1306 N PRO A 91 2.802 12.220 4.269 1.00 75.30 N ATOM 1307 CA PRO A 91 2.832 11.801 2.875 1.00 3.11 C ATOM 1308 C PRO A 91 2.032 12.777 2.012 1.00 15.14 C ATOM 1309 O PRO A 91 1.062 13.381 2.471 1.00 34.05 O ATOM 1310 CB PRO A 91 2.181 10.415 2.855 1.00 40.52 C ATOM 1311 CG PRO A 91 1.201 10.476 4.027 1.00 23.12 C ATOM 1312 CD PRO A 91 1.969 11.319 5.050 1.00 54.13 C ATOM 0 HA PRO A 91 3.847 11.779 2.477 1.00 3.11 H new ATOM 0 HB2 PRO A 91 1.670 10.223 1.912 1.00 40.52 H new ATOM 0 HB3 PRO A 91 2.917 9.622 2.986 1.00 40.52 H new ATOM 0 HG2 PRO A 91 0.257 10.941 3.744 1.00 23.12 H new ATOM 0 HG3 PRO A 91 0.965 9.484 4.412 1.00 23.12 H new ATOM 0 HD2 PRO A 91 1.286 11.875 5.692 1.00 54.13 H new ATOM 0 HD3 PRO A 91 2.576 10.689 5.700 1.00 54.13 H new ATOM 1317 N ALA A 92 2.345 12.784 0.718 1.00 11.54 N ATOM 1318 CA ALA A 92 1.718 13.588 -0.333 1.00 63.02 C ATOM 1319 C ALA A 92 0.318 13.078 -0.740 1.00 64.42 C ATOM 1320 O ALA A 92 -0.054 13.127 -1.912 1.00 60.34 O ATOM 1321 CB ALA A 92 2.686 13.601 -1.513 1.00 11.53 C ATOM 0 H ALA A 92 3.090 12.192 0.351 1.00 11.54 H new ATOM 0 HA ALA A 92 1.537 14.597 0.037 1.00 63.02 H new ATOM 0 HB1 ALA A 92 2.261 14.191 -2.326 1.00 11.53 H new ATOM 0 HB2 ALA A 92 3.633 14.041 -1.202 1.00 11.53 H new ATOM 0 HB3 ALA A 92 2.856 12.580 -1.856 1.00 11.53 H new ATOM 1327 N THR A 93 -0.380 12.428 0.190 1.00 44.34 N ATOM 1328 CA THR A 93 -1.682 11.780 0.029 1.00 33.14 C ATOM 1329 C THR A 93 -1.809 10.937 -1.276 1.00 13.44 C ATOM 1330 O THR A 93 -2.756 11.125 -2.039 1.00 61.01 O ATOM 1331 CB THR A 93 -2.796 12.838 0.265 1.00 0.13 C ATOM 1332 OG1 THR A 93 -2.789 13.914 -0.654 1.00 62.05 O ATOM 1333 CG2 THR A 93 -2.689 13.496 1.653 1.00 20.00 C ATOM 0 H THR A 93 -0.027 12.333 1.142 1.00 44.34 H new ATOM 0 HA THR A 93 -1.803 11.009 0.790 1.00 33.14 H new ATOM 0 HB THR A 93 -3.709 12.253 0.149 1.00 0.13 H new ATOM 0 HG1 THR A 93 -3.518 14.532 -0.439 1.00 62.05 H new ATOM 0 HG21 THR A 93 -3.488 14.228 1.771 1.00 20.00 H new ATOM 0 HG22 THR A 93 -2.779 12.732 2.426 1.00 20.00 H new ATOM 0 HG23 THR A 93 -1.724 13.994 1.746 1.00 20.00 H new ATOM 1341 N PRO A 94 -0.901 9.975 -1.575 1.00 14.45 N ATOM 1342 CA PRO A 94 -0.955 9.171 -2.808 1.00 63.24 C ATOM 1343 C PRO A 94 -1.872 7.956 -2.744 1.00 60.44 C ATOM 1344 O PRO A 94 -2.186 7.381 -3.781 1.00 61.34 O ATOM 1345 CB PRO A 94 0.491 8.704 -3.038 1.00 22.15 C ATOM 1346 CG PRO A 94 1.042 8.581 -1.623 1.00 64.42 C ATOM 1347 CD PRO A 94 0.384 9.759 -0.921 1.00 4.43 C ATOM 0 HA PRO A 94 -1.368 9.782 -3.610 1.00 63.24 H new ATOM 0 HB2 PRO A 94 0.528 7.753 -3.569 1.00 22.15 H new ATOM 0 HB3 PRO A 94 1.058 9.422 -3.630 1.00 22.15 H new ATOM 0 HG2 PRO A 94 0.774 7.630 -1.162 1.00 64.42 H new ATOM 0 HG3 PRO A 94 2.130 8.650 -1.602 1.00 64.42 H new ATOM 0 HD2 PRO A 94 0.247 9.550 0.140 1.00 4.43 H new ATOM 0 HD3 PRO A 94 1.009 10.649 -0.992 1.00 4.43 H new ATOM 1352 N ILE A 95 -2.303 7.541 -1.554 1.00 64.34 N ATOM 1353 CA ILE A 95 -3.138 6.356 -1.400 1.00 40.40 C ATOM 1354 C ILE A 95 -4.586 6.799 -1.071 1.00 32.33 C ATOM 1355 O ILE A 95 -5.467 5.963 -0.887 1.00 32.35 O ATOM 1356 CB ILE A 95 -2.450 5.355 -0.427 1.00 3.13 C ATOM 1357 CG1 ILE A 95 -0.911 5.209 -0.617 1.00 41.23 C ATOM 1358 CG2 ILE A 95 -3.062 3.953 -0.535 1.00 33.02 C ATOM 1359 CD1 ILE A 95 -0.329 4.838 -1.999 1.00 74.41 C ATOM 0 H ILE A 95 -2.084 8.014 -0.677 1.00 64.34 H new ATOM 0 HA ILE A 95 -3.239 5.782 -2.321 1.00 40.40 H new ATOM 0 HB ILE A 95 -2.627 5.793 0.555 1.00 3.13 H new ATOM 0 HG12 ILE A 95 -0.458 6.154 -0.319 1.00 41.23 H new ATOM 0 HG13 ILE A 95 -0.568 4.454 0.091 1.00 41.23 H new ATOM 0 HG21 ILE A 95 -2.557 3.281 0.159 1.00 33.02 H new ATOM 0 HG22 ILE A 95 -4.123 3.999 -0.288 1.00 33.02 H new ATOM 0 HG23 ILE A 95 -2.942 3.581 -1.553 1.00 33.02 H new ATOM 0 HD11 ILE A 95 0.758 4.783 -1.933 1.00 74.41 H new ATOM 0 HD12 ILE A 95 -0.723 3.871 -2.312 1.00 74.41 H new ATOM 0 HD13 ILE A 95 -0.610 5.598 -2.728 1.00 74.41 H new ATOM 1370 N LYS A 96 -4.873 8.112 -1.052 1.00 13.15 N ATOM 1371 CA LYS A 96 -6.195 8.689 -0.801 1.00 13.45 C ATOM 1372 C LYS A 96 -7.187 8.222 -1.864 1.00 42.14 C ATOM 1373 O LYS A 96 -8.271 7.755 -1.519 1.00 62.01 O ATOM 1374 CB LYS A 96 -6.067 10.227 -0.718 1.00 71.14 C ATOM 1375 CG LYS A 96 -7.371 11.025 -0.533 1.00 42.32 C ATOM 1376 CD LYS A 96 -8.162 10.645 0.728 1.00 64.34 C ATOM 1377 CE LYS A 96 -9.153 11.734 1.183 1.00 75.11 C ATOM 1378 NZ LYS A 96 -10.291 11.952 0.265 1.00 60.03 N ATOM 0 H LYS A 96 -4.161 8.823 -1.218 1.00 13.15 H new ATOM 0 HA LYS A 96 -6.590 8.343 0.154 1.00 13.45 H new ATOM 0 HB2 LYS A 96 -5.401 10.468 0.111 1.00 71.14 H new ATOM 0 HB3 LYS A 96 -5.581 10.577 -1.629 1.00 71.14 H new ATOM 0 HG2 LYS A 96 -7.132 12.088 -0.493 1.00 42.32 H new ATOM 0 HG3 LYS A 96 -8.005 10.873 -1.407 1.00 42.32 H new ATOM 0 HD2 LYS A 96 -8.710 9.722 0.539 1.00 64.34 H new ATOM 0 HD3 LYS A 96 -7.462 10.440 1.538 1.00 64.34 H new ATOM 0 HE2 LYS A 96 -9.542 11.466 2.165 1.00 75.11 H new ATOM 0 HE3 LYS A 96 -8.612 12.673 1.300 1.00 75.11 H new ATOM 0 HZ1 LYS A 96 -11.088 12.364 0.791 1.00 60.03 H new ATOM 0 HZ2 LYS A 96 -10.005 12.602 -0.495 1.00 60.03 H new ATOM 0 HZ3 LYS A 96 -10.582 11.043 -0.149 1.00 60.03 H new ATOM 1388 N THR A 97 -6.839 8.329 -3.147 1.00 13.41 N ATOM 1389 CA THR A 97 -7.752 7.938 -4.220 1.00 4.52 C ATOM 1390 C THR A 97 -7.893 6.410 -4.256 1.00 74.41 C ATOM 1391 O THR A 97 -8.986 5.892 -4.467 1.00 32.21 O ATOM 1392 CB THR A 97 -7.258 8.471 -5.582 1.00 75.15 C ATOM 1393 OG1 THR A 97 -6.365 9.570 -5.468 1.00 51.41 O ATOM 1394 CG2 THR A 97 -8.415 8.854 -6.505 1.00 15.53 C ATOM 0 H THR A 97 -5.937 8.681 -3.467 1.00 13.41 H new ATOM 0 HA THR A 97 -8.730 8.377 -4.023 1.00 4.52 H new ATOM 0 HB THR A 97 -6.708 7.639 -6.022 1.00 75.15 H new ATOM 0 HG1 THR A 97 -6.825 10.394 -5.731 1.00 51.41 H new ATOM 0 HG21 THR A 97 -8.019 9.223 -7.451 1.00 15.53 H new ATOM 0 HG22 THR A 97 -9.038 7.979 -6.690 1.00 15.53 H new ATOM 0 HG23 THR A 97 -9.014 9.633 -6.034 1.00 15.53 H new ATOM 1402 N LEU A 98 -6.789 5.675 -4.045 1.00 0.51 N ATOM 1403 CA LEU A 98 -6.772 4.211 -4.090 1.00 64.32 C ATOM 1404 C LEU A 98 -7.766 3.639 -3.101 1.00 71.10 C ATOM 1405 O LEU A 98 -8.589 2.811 -3.475 1.00 63.43 O ATOM 1406 CB LEU A 98 -5.373 3.666 -3.729 1.00 75.23 C ATOM 1407 CG LEU A 98 -4.473 3.444 -4.947 1.00 53.41 C ATOM 1408 CD1 LEU A 98 -3.012 3.284 -4.524 1.00 60.42 C ATOM 1409 CD2 LEU A 98 -4.921 2.205 -5.740 1.00 63.32 C ATOM 0 H LEU A 98 -5.879 6.087 -3.837 1.00 0.51 H new ATOM 0 HA LEU A 98 -7.035 3.914 -5.105 1.00 64.32 H new ATOM 0 HB2 LEU A 98 -4.885 4.363 -3.048 1.00 75.23 H new ATOM 0 HB3 LEU A 98 -5.486 2.723 -3.193 1.00 75.23 H new ATOM 0 HG LEU A 98 -4.560 4.323 -5.586 1.00 53.41 H new ATOM 0 HD11 LEU A 98 -2.393 3.127 -5.407 1.00 60.42 H new ATOM 0 HD12 LEU A 98 -2.683 4.184 -4.005 1.00 60.42 H new ATOM 0 HD13 LEU A 98 -2.918 2.426 -3.858 1.00 60.42 H new ATOM 0 HD21 LEU A 98 -4.267 2.068 -6.601 1.00 63.32 H new ATOM 0 HD22 LEU A 98 -4.868 1.324 -5.100 1.00 63.32 H new ATOM 0 HD23 LEU A 98 -5.947 2.343 -6.082 1.00 63.32 H new ATOM 1420 N LEU A 99 -7.674 4.061 -1.843 1.00 75.43 N ATOM 1421 CA LEU A 99 -8.425 3.480 -0.745 1.00 20.45 C ATOM 1422 C LEU A 99 -9.933 3.522 -1.000 1.00 14.12 C ATOM 1423 O LEU A 99 -10.644 2.579 -0.654 1.00 11.51 O ATOM 1424 CB LEU A 99 -7.960 4.146 0.553 1.00 22.23 C ATOM 1425 CG LEU A 99 -8.789 5.360 1.003 1.00 24.04 C ATOM 1426 CD1 LEU A 99 -9.805 4.819 1.999 1.00 54.23 C ATOM 1427 CD2 LEU A 99 -7.973 6.462 1.661 1.00 43.14 C ATOM 0 H LEU A 99 -7.065 4.828 -1.558 1.00 75.43 H new ATOM 0 HA LEU A 99 -8.221 2.413 -0.652 1.00 20.45 H new ATOM 0 HB2 LEU A 99 -7.975 3.402 1.349 1.00 22.23 H new ATOM 0 HB3 LEU A 99 -6.924 4.460 0.430 1.00 22.23 H new ATOM 0 HG LEU A 99 -9.240 5.824 0.126 1.00 24.04 H new ATOM 0 HD11 LEU A 99 -10.430 5.635 2.360 1.00 54.23 H new ATOM 0 HD12 LEU A 99 -10.430 4.071 1.511 1.00 54.23 H new ATOM 0 HD13 LEU A 99 -9.283 4.362 2.840 1.00 54.23 H new ATOM 0 HD21 LEU A 99 -8.633 7.281 1.949 1.00 43.14 H new ATOM 0 HD22 LEU A 99 -7.477 6.067 2.548 1.00 43.14 H new ATOM 0 HD23 LEU A 99 -7.224 6.829 0.959 1.00 43.14 H new ATOM 1438 N ASP A 100 -10.409 4.580 -1.656 1.00 52.52 N ATOM 1439 CA ASP A 100 -11.820 4.792 -1.931 1.00 41.32 C ATOM 1440 C ASP A 100 -12.301 3.727 -2.917 1.00 12.21 C ATOM 1441 O ASP A 100 -13.345 3.103 -2.722 1.00 61.10 O ATOM 1442 CB ASP A 100 -12.020 6.204 -2.481 1.00 21.01 C ATOM 1443 CG ASP A 100 -13.475 6.652 -2.349 1.00 20.01 C ATOM 1444 OD1 ASP A 100 -14.311 6.192 -3.165 1.00 31.11 O ATOM 1445 OD2 ASP A 100 -13.782 7.447 -1.432 1.00 24.42 O ATOM 0 H ASP A 100 -9.810 5.324 -2.015 1.00 52.52 H new ATOM 0 HA ASP A 100 -12.408 4.701 -1.018 1.00 41.32 H new ATOM 0 HB2 ASP A 100 -11.373 6.900 -1.946 1.00 21.01 H new ATOM 0 HB3 ASP A 100 -11.722 6.234 -3.529 1.00 21.01 H new ATOM 1449 N GLN A 101 -11.497 3.449 -3.949 1.00 23.24 N ATOM 1450 CA GLN A 101 -11.708 2.350 -4.889 1.00 43.42 C ATOM 1451 C GLN A 101 -11.583 1.002 -4.170 1.00 75.03 C ATOM 1452 O GLN A 101 -12.316 0.055 -4.468 1.00 62.30 O ATOM 1453 CB GLN A 101 -10.684 2.432 -6.038 1.00 75.01 C ATOM 1454 CG GLN A 101 -10.706 3.781 -6.770 1.00 11.31 C ATOM 1455 CD GLN A 101 -9.734 3.862 -7.942 1.00 23.35 C ATOM 1456 OE1 GLN A 101 -9.296 2.861 -8.510 1.00 23.13 O ATOM 1457 NE2 GLN A 101 -9.367 5.071 -8.342 1.00 15.22 N ATOM 0 H GLN A 101 -10.662 3.997 -4.156 1.00 23.24 H new ATOM 0 HA GLN A 101 -12.713 2.434 -5.303 1.00 43.42 H new ATOM 0 HB2 GLN A 101 -9.685 2.258 -5.639 1.00 75.01 H new ATOM 0 HB3 GLN A 101 -10.885 1.634 -6.753 1.00 75.01 H new ATOM 0 HG2 GLN A 101 -11.716 3.970 -7.134 1.00 11.31 H new ATOM 0 HG3 GLN A 101 -10.470 4.573 -6.059 1.00 11.31 H new ATOM 0 HE21 GLN A 101 -9.732 5.897 -7.869 1.00 15.22 H new ATOM 0 HE22 GLN A 101 -8.719 5.175 -9.123 1.00 15.22 H new ATOM 1464 N MET A 102 -10.664 0.894 -3.208 1.00 62.10 N ATOM 1465 CA MET A 102 -10.394 -0.347 -2.497 1.00 73.24 C ATOM 1466 C MET A 102 -11.538 -0.765 -1.564 1.00 54.12 C ATOM 1467 O MET A 102 -11.602 -1.925 -1.161 1.00 73.02 O ATOM 1468 CB MET A 102 -9.037 -0.303 -1.779 1.00 1.31 C ATOM 1469 CG MET A 102 -7.889 -0.299 -2.796 1.00 22.33 C ATOM 1470 SD MET A 102 -6.214 -0.106 -2.135 1.00 43.32 S ATOM 1471 CE MET A 102 -5.999 -1.704 -1.309 1.00 44.54 C ATOM 0 H MET A 102 -10.084 1.675 -2.902 1.00 62.10 H new ATOM 0 HA MET A 102 -10.333 -1.130 -3.252 1.00 73.24 H new ATOM 0 HB2 MET A 102 -8.979 0.588 -1.153 1.00 1.31 H new ATOM 0 HB3 MET A 102 -8.941 -1.164 -1.117 1.00 1.31 H new ATOM 0 HG2 MET A 102 -7.928 -1.233 -3.356 1.00 22.33 H new ATOM 0 HG3 MET A 102 -8.068 0.507 -3.508 1.00 22.33 H new ATOM 0 HE1 MET A 102 -4.959 -1.819 -1.003 1.00 44.54 H new ATOM 0 HE2 MET A 102 -6.643 -1.749 -0.430 1.00 44.54 H new ATOM 0 HE3 MET A 102 -6.266 -2.507 -1.996 1.00 44.54 H new ATOM 1479 N LYS A 103 -12.501 0.115 -1.265 1.00 44.33 N ATOM 1480 CA LYS A 103 -13.647 -0.143 -0.401 1.00 31.33 C ATOM 1481 C LYS A 103 -14.457 -1.374 -0.834 1.00 74.24 C ATOM 1482 O LYS A 103 -15.126 -2.002 -0.015 1.00 15.11 O ATOM 1483 CB LYS A 103 -14.479 1.154 -0.434 1.00 31.43 C ATOM 1484 CG LYS A 103 -15.720 1.187 0.458 1.00 42.22 C ATOM 1485 CD LYS A 103 -15.456 1.196 1.971 1.00 21.35 C ATOM 1486 CE LYS A 103 -14.649 2.435 2.380 1.00 74.40 C ATOM 1487 NZ LYS A 103 -14.692 2.716 3.831 1.00 63.40 N ATOM 0 H LYS A 103 -12.498 1.065 -1.637 1.00 44.33 H new ATOM 0 HA LYS A 103 -13.329 -0.388 0.612 1.00 31.33 H new ATOM 0 HB2 LYS A 103 -13.831 1.983 -0.149 1.00 31.43 H new ATOM 0 HB3 LYS A 103 -14.792 1.333 -1.463 1.00 31.43 H new ATOM 0 HG2 LYS A 103 -16.303 2.073 0.205 1.00 42.22 H new ATOM 0 HG3 LYS A 103 -16.338 0.321 0.221 1.00 42.22 H new ATOM 0 HD2 LYS A 103 -16.404 1.181 2.509 1.00 21.35 H new ATOM 0 HD3 LYS A 103 -14.914 0.294 2.255 1.00 21.35 H new ATOM 0 HE2 LYS A 103 -13.611 2.300 2.075 1.00 74.40 H new ATOM 0 HE3 LYS A 103 -15.030 3.301 1.839 1.00 74.40 H new ATOM 0 HZ1 LYS A 103 -14.127 3.564 4.037 1.00 63.40 H new ATOM 0 HZ2 LYS A 103 -15.677 2.876 4.125 1.00 63.40 H new ATOM 0 HZ3 LYS A 103 -14.302 1.905 4.353 1.00 63.40 H new ATOM 1497 N ASN A 104 -14.366 -1.757 -2.108 1.00 1.33 N ATOM 1498 CA ASN A 104 -15.080 -2.887 -2.696 1.00 74.14 C ATOM 1499 C ASN A 104 -14.540 -4.243 -2.243 1.00 20.34 C ATOM 1500 O ASN A 104 -15.219 -5.251 -2.439 1.00 71.20 O ATOM 1501 CB ASN A 104 -14.977 -2.829 -4.228 1.00 1.34 C ATOM 1502 CG ASN A 104 -15.670 -1.602 -4.787 1.00 55.41 C ATOM 1503 OD1 ASN A 104 -16.887 -1.489 -4.726 1.00 22.24 O ATOM 1504 ND2 ASN A 104 -14.915 -0.631 -5.277 1.00 21.32 N ATOM 0 H ASN A 104 -13.772 -1.271 -2.781 1.00 1.33 H new ATOM 0 HA ASN A 104 -16.113 -2.801 -2.358 1.00 74.14 H new ATOM 0 HB2 ASN A 104 -13.928 -2.821 -4.523 1.00 1.34 H new ATOM 0 HB3 ASN A 104 -15.422 -3.727 -4.658 1.00 1.34 H new ATOM 0 HD21 ASN A 104 -15.346 0.231 -5.612 1.00 21.32 H new ATOM 0 HD22 ASN A 104 -13.902 -0.744 -5.319 1.00 21.32 H new ATOM 1510 N TYR A 105 -13.324 -4.315 -1.696 1.00 14.44 N ATOM 1511 CA TYR A 105 -12.588 -5.574 -1.590 1.00 32.45 C ATOM 1512 C TYR A 105 -12.453 -6.021 -0.133 1.00 64.04 C ATOM 1513 O TYR A 105 -12.713 -5.251 0.798 1.00 72.03 O ATOM 1514 CB TYR A 105 -11.227 -5.406 -2.271 1.00 40.20 C ATOM 1515 CG TYR A 105 -11.292 -4.770 -3.654 1.00 51.32 C ATOM 1516 CD1 TYR A 105 -12.032 -5.354 -4.702 1.00 43.14 C ATOM 1517 CD2 TYR A 105 -10.667 -3.532 -3.861 1.00 43.34 C ATOM 1518 CE1 TYR A 105 -12.118 -4.718 -5.956 1.00 42.20 C ATOM 1519 CE2 TYR A 105 -10.803 -2.856 -5.091 1.00 15.25 C ATOM 1520 CZ TYR A 105 -11.499 -3.462 -6.156 1.00 4.44 C ATOM 1521 OH TYR A 105 -11.601 -2.817 -7.354 1.00 51.30 O ATOM 0 H TYR A 105 -12.827 -3.509 -1.318 1.00 14.44 H new ATOM 0 HA TYR A 105 -13.140 -6.365 -2.097 1.00 32.45 H new ATOM 0 HB2 TYR A 105 -10.588 -4.796 -1.633 1.00 40.20 H new ATOM 0 HB3 TYR A 105 -10.753 -6.384 -2.356 1.00 40.20 H new ATOM 0 HD1 TYR A 105 -12.536 -6.296 -4.542 1.00 43.14 H new ATOM 0 HD2 TYR A 105 -10.076 -3.092 -3.071 1.00 43.34 H new ATOM 0 HE1 TYR A 105 -12.657 -5.189 -6.765 1.00 42.20 H new ATOM 0 HE2 TYR A 105 -10.373 -1.873 -5.217 1.00 15.25 H new ATOM 0 HH TYR A 105 -11.115 -1.967 -7.310 1.00 51.30 H new ATOM 1530 N ARG A 106 -12.086 -7.288 0.073 1.00 71.22 N ATOM 1531 CA ARG A 106 -12.100 -7.987 1.356 1.00 15.34 C ATOM 1532 C ARG A 106 -10.803 -8.789 1.462 1.00 32.12 C ATOM 1533 O ARG A 106 -10.611 -9.750 0.711 1.00 34.31 O ATOM 1534 CB ARG A 106 -13.329 -8.918 1.404 1.00 61.41 C ATOM 1535 CG ARG A 106 -14.697 -8.217 1.286 1.00 0.15 C ATOM 1536 CD ARG A 106 -15.185 -7.630 2.616 1.00 63.32 C ATOM 1537 NE ARG A 106 -15.697 -8.684 3.495 1.00 1.34 N ATOM 1538 CZ ARG A 106 -16.619 -8.594 4.454 1.00 51.22 C ATOM 1539 NH1 ARG A 106 -17.159 -7.430 4.802 1.00 40.10 N ATOM 1540 NH2 ARG A 106 -16.989 -9.712 5.061 1.00 32.15 N ATOM 0 H ARG A 106 -11.755 -7.881 -0.688 1.00 71.22 H new ATOM 0 HA ARG A 106 -12.166 -7.289 2.191 1.00 15.34 H new ATOM 0 HB2 ARG A 106 -13.243 -9.647 0.598 1.00 61.41 H new ATOM 0 HB3 ARG A 106 -13.305 -9.475 2.341 1.00 61.41 H new ATOM 0 HG2 ARG A 106 -14.628 -7.419 0.546 1.00 0.15 H new ATOM 0 HG3 ARG A 106 -15.434 -8.930 0.917 1.00 0.15 H new ATOM 0 HD2 ARG A 106 -14.366 -7.105 3.109 1.00 63.32 H new ATOM 0 HD3 ARG A 106 -15.968 -6.895 2.429 1.00 63.32 H new ATOM 0 HE ARG A 106 -15.294 -9.611 3.355 1.00 1.34 H new ATOM 0 HH11 ARG A 106 -16.870 -6.573 4.331 1.00 40.10 H new ATOM 0 HH12 ARG A 106 -17.862 -7.394 5.540 1.00 40.10 H new ATOM 0 HH21 ARG A 106 -16.571 -10.602 4.790 1.00 32.15 H new ATOM 0 HH22 ARG A 106 -17.692 -9.683 5.800 1.00 32.15 H new ATOM 1551 N GLY A 107 -9.885 -8.381 2.327 1.00 61.34 N ATOM 1552 CA GLY A 107 -8.576 -8.998 2.473 1.00 14.43 C ATOM 1553 C GLY A 107 -7.631 -8.009 3.140 1.00 52.13 C ATOM 1554 O GLY A 107 -8.016 -6.872 3.426 1.00 31.02 O ATOM 0 H GLY A 107 -10.034 -7.595 2.960 1.00 61.34 H new ATOM 0 HA2 GLY A 107 -8.653 -9.906 3.071 1.00 14.43 H new ATOM 0 HA3 GLY A 107 -8.187 -9.290 1.498 1.00 14.43 H new ATOM 1558 N GLU A 108 -6.406 -8.432 3.419 1.00 54.31 N ATOM 1559 CA GLU A 108 -5.399 -7.675 4.151 1.00 74.11 C ATOM 1560 C GLU A 108 -4.607 -6.754 3.246 1.00 22.33 C ATOM 1561 O GLU A 108 -4.411 -7.044 2.062 1.00 20.14 O ATOM 1562 CB GLU A 108 -4.525 -8.588 5.036 1.00 22.33 C ATOM 1563 CG GLU A 108 -4.452 -10.059 4.616 1.00 3.15 C ATOM 1564 CD GLU A 108 -3.739 -10.969 5.629 1.00 12.33 C ATOM 1565 OE1 GLU A 108 -2.580 -10.723 6.023 1.00 32.03 O ATOM 1566 OE2 GLU A 108 -4.379 -11.948 6.074 1.00 34.15 O ATOM 0 H GLU A 108 -6.072 -9.351 3.129 1.00 54.31 H new ATOM 0 HA GLU A 108 -5.922 -7.014 4.842 1.00 74.11 H new ATOM 0 HB2 GLU A 108 -3.513 -8.184 5.052 1.00 22.33 H new ATOM 0 HB3 GLU A 108 -4.903 -8.541 6.057 1.00 22.33 H new ATOM 0 HG2 GLU A 108 -5.464 -10.431 4.460 1.00 3.15 H new ATOM 0 HG3 GLU A 108 -3.936 -10.127 3.658 1.00 3.15 H new ATOM 1571 N VAL A 109 -4.172 -5.629 3.820 1.00 20.31 N ATOM 1572 CA VAL A 109 -3.587 -4.529 3.068 1.00 20.33 C ATOM 1573 C VAL A 109 -2.563 -3.772 3.932 1.00 72.31 C ATOM 1574 O VAL A 109 -2.984 -2.962 4.749 1.00 24.25 O ATOM 1575 CB VAL A 109 -4.716 -3.576 2.594 1.00 74.33 C ATOM 1576 CG1 VAL A 109 -4.149 -2.508 1.653 1.00 60.01 C ATOM 1577 CG2 VAL A 109 -5.874 -4.252 1.840 1.00 71.42 C ATOM 0 H VAL A 109 -4.219 -5.460 4.825 1.00 20.31 H new ATOM 0 HA VAL A 109 -3.064 -4.924 2.197 1.00 20.33 H new ATOM 0 HB VAL A 109 -5.116 -3.163 3.520 1.00 74.33 H new ATOM 0 HG11 VAL A 109 -4.952 -1.846 1.328 1.00 60.01 H new ATOM 0 HG12 VAL A 109 -3.390 -1.927 2.177 1.00 60.01 H new ATOM 0 HG13 VAL A 109 -3.701 -2.990 0.784 1.00 60.01 H new ATOM 0 HG21 VAL A 109 -6.609 -3.500 1.553 1.00 71.42 H new ATOM 0 HG22 VAL A 109 -5.489 -4.743 0.946 1.00 71.42 H new ATOM 0 HG23 VAL A 109 -6.346 -4.992 2.486 1.00 71.42 H new ATOM 1587 N ALA A 110 -1.246 -3.983 3.823 1.00 21.34 N ATOM 1588 CA ALA A 110 -0.284 -3.333 4.737 1.00 44.54 C ATOM 1589 C ALA A 110 0.477 -2.178 4.077 1.00 0.31 C ATOM 1590 O ALA A 110 0.667 -2.180 2.860 1.00 24.22 O ATOM 1591 CB ALA A 110 0.672 -4.356 5.336 1.00 61.04 C ATOM 0 H ALA A 110 -0.821 -4.590 3.122 1.00 21.34 H new ATOM 0 HA ALA A 110 -0.867 -2.892 5.545 1.00 44.54 H new ATOM 0 HB1 ALA A 110 1.370 -3.853 6.005 1.00 61.04 H new ATOM 0 HB2 ALA A 110 0.105 -5.100 5.896 1.00 61.04 H new ATOM 0 HB3 ALA A 110 1.226 -4.848 4.537 1.00 61.04 H new ATOM 1597 N SER A 111 0.932 -1.211 4.882 1.00 63.21 N ATOM 1598 CA SER A 111 1.473 0.062 4.411 1.00 32.45 C ATOM 1599 C SER A 111 2.853 0.332 5.010 1.00 72.23 C ATOM 1600 O SER A 111 2.992 0.606 6.207 1.00 3.43 O ATOM 1601 CB SER A 111 0.487 1.215 4.668 1.00 55.30 C ATOM 1602 OG SER A 111 -0.316 1.012 5.818 1.00 35.01 O ATOM 0 H SER A 111 0.933 -1.297 5.898 1.00 63.21 H new ATOM 0 HA SER A 111 1.606 -0.005 3.331 1.00 32.45 H new ATOM 0 HB2 SER A 111 1.045 2.144 4.781 1.00 55.30 H new ATOM 0 HB3 SER A 111 -0.158 1.335 3.798 1.00 55.30 H new ATOM 0 HG SER A 111 -1.033 1.680 5.838 1.00 35.01 H new ATOM 1607 N PHE A 112 3.889 0.279 4.170 1.00 41.22 N ATOM 1608 CA PHE A 112 5.208 0.793 4.514 1.00 44.42 C ATOM 1609 C PHE A 112 5.404 2.176 3.889 1.00 13.41 C ATOM 1610 O PHE A 112 4.672 2.610 2.994 1.00 44.21 O ATOM 1611 CB PHE A 112 6.317 -0.195 4.113 1.00 13.51 C ATOM 1612 CG PHE A 112 6.475 -0.473 2.628 1.00 35.42 C ATOM 1613 CD1 PHE A 112 5.679 -1.453 2.003 1.00 44.34 C ATOM 1614 CD2 PHE A 112 7.453 0.209 1.880 1.00 64.22 C ATOM 1615 CE1 PHE A 112 5.844 -1.731 0.635 1.00 62.04 C ATOM 1616 CE2 PHE A 112 7.623 -0.079 0.514 1.00 32.23 C ATOM 1617 CZ PHE A 112 6.816 -1.044 -0.112 1.00 35.34 C ATOM 0 H PHE A 112 3.833 -0.122 3.234 1.00 41.22 H new ATOM 0 HA PHE A 112 5.276 0.902 5.596 1.00 44.42 H new ATOM 0 HB2 PHE A 112 7.266 0.186 4.491 1.00 13.51 H new ATOM 0 HB3 PHE A 112 6.129 -1.142 4.619 1.00 13.51 H new ATOM 0 HD1 PHE A 112 4.940 -1.992 2.577 1.00 44.34 H new ATOM 0 HD2 PHE A 112 8.073 0.954 2.356 1.00 64.22 H new ATOM 0 HE1 PHE A 112 5.223 -2.474 0.157 1.00 62.04 H new ATOM 0 HE2 PHE A 112 8.377 0.444 -0.056 1.00 32.23 H new ATOM 0 HZ PHE A 112 6.942 -1.257 -1.163 1.00 35.34 H new ATOM 1626 N PHE A 113 6.428 2.869 4.373 1.00 22.13 N ATOM 1627 CA PHE A 113 6.876 4.166 3.903 1.00 62.10 C ATOM 1628 C PHE A 113 8.401 4.161 3.925 1.00 60.02 C ATOM 1629 O PHE A 113 9.012 3.212 4.420 1.00 53.24 O ATOM 1630 CB PHE A 113 6.327 5.301 4.791 1.00 74.40 C ATOM 1631 CG PHE A 113 4.818 5.472 4.779 1.00 61.22 C ATOM 1632 CD1 PHE A 113 3.998 4.619 5.545 1.00 61.02 C ATOM 1633 CD2 PHE A 113 4.230 6.487 3.996 1.00 34.14 C ATOM 1634 CE1 PHE A 113 2.600 4.737 5.485 1.00 74.21 C ATOM 1635 CE2 PHE A 113 2.831 6.608 3.947 1.00 63.14 C ATOM 1636 CZ PHE A 113 2.017 5.720 4.670 1.00 31.25 C ATOM 0 H PHE A 113 6.995 2.519 5.145 1.00 22.13 H new ATOM 0 HA PHE A 113 6.506 4.344 2.893 1.00 62.10 H new ATOM 0 HB2 PHE A 113 6.646 5.122 5.818 1.00 74.40 H new ATOM 0 HB3 PHE A 113 6.784 6.239 4.475 1.00 74.40 H new ATOM 0 HD1 PHE A 113 4.447 3.871 6.181 1.00 61.02 H new ATOM 0 HD2 PHE A 113 4.853 7.169 3.436 1.00 34.14 H new ATOM 0 HE1 PHE A 113 1.975 4.073 6.064 1.00 74.21 H new ATOM 0 HE2 PHE A 113 2.379 7.387 3.351 1.00 63.14 H new ATOM 0 HZ PHE A 113 0.942 5.794 4.599 1.00 31.25 H new ATOM 1645 N THR A 114 9.012 5.232 3.438 1.00 72.14 N ATOM 1646 CA THR A 114 10.445 5.468 3.492 1.00 73.21 C ATOM 1647 C THR A 114 10.627 6.937 3.874 1.00 73.11 C ATOM 1648 O THR A 114 10.062 7.801 3.199 1.00 11.22 O ATOM 1649 CB THR A 114 11.083 5.122 2.132 1.00 64.22 C ATOM 1650 OG1 THR A 114 10.288 5.597 1.057 1.00 53.30 O ATOM 1651 CG2 THR A 114 11.251 3.612 1.946 1.00 35.05 C ATOM 0 H THR A 114 8.503 5.987 2.978 1.00 72.14 H new ATOM 0 HA THR A 114 10.943 4.837 4.228 1.00 73.21 H new ATOM 0 HB THR A 114 12.060 5.605 2.129 1.00 64.22 H new ATOM 0 HG1 THR A 114 9.889 6.458 1.301 1.00 53.30 H new ATOM 0 HG21 THR A 114 11.704 3.413 0.975 1.00 35.05 H new ATOM 0 HG22 THR A 114 11.893 3.218 2.733 1.00 35.05 H new ATOM 0 HG23 THR A 114 10.276 3.128 1.997 1.00 35.05 H new ATOM 1659 N SER A 115 11.366 7.217 4.950 1.00 4.43 N ATOM 1660 CA SER A 115 11.712 8.568 5.370 1.00 31.44 C ATOM 1661 C SER A 115 13.205 8.639 5.706 1.00 61.13 C ATOM 1662 O SER A 115 13.940 7.664 5.526 1.00 34.45 O ATOM 1663 CB SER A 115 10.799 9.019 6.525 1.00 5.13 C ATOM 1664 OG SER A 115 11.358 8.821 7.811 1.00 30.23 O ATOM 0 H SER A 115 11.745 6.495 5.562 1.00 4.43 H new ATOM 0 HA SER A 115 11.540 9.272 4.556 1.00 31.44 H new ATOM 0 HB2 SER A 115 10.567 10.077 6.400 1.00 5.13 H new ATOM 0 HB3 SER A 115 9.856 8.476 6.462 1.00 5.13 H new ATOM 0 HG SER A 115 10.988 9.481 8.434 1.00 30.23 H new ATOM 1669 N ALA A 116 13.652 9.774 6.239 1.00 62.34 N ATOM 1670 CA ALA A 116 14.998 10.046 6.705 1.00 21.31 C ATOM 1671 C ALA A 116 14.993 10.259 8.229 1.00 65.14 C ATOM 1672 O ALA A 116 15.589 11.226 8.720 1.00 74.12 O ATOM 1673 CB ALA A 116 15.525 11.255 5.926 1.00 12.33 C ATOM 0 H ALA A 116 13.037 10.578 6.362 1.00 62.34 H new ATOM 0 HA ALA A 116 15.666 9.204 6.523 1.00 21.31 H new ATOM 0 HB1 ALA A 116 16.538 11.486 6.254 1.00 12.33 H new ATOM 0 HB2 ALA A 116 15.532 11.026 4.860 1.00 12.33 H new ATOM 0 HB3 ALA A 116 14.880 12.115 6.108 1.00 12.33 H new ATOM 1679 N GLY A 117 14.330 9.378 8.984 1.00 12.43 N ATOM 1680 CA GLY A 117 14.526 9.261 10.426 1.00 34.13 C ATOM 1681 C GLY A 117 13.869 10.352 11.279 1.00 31.43 C ATOM 1682 O GLY A 117 14.405 10.688 12.344 1.00 61.23 O ATOM 0 H GLY A 117 13.641 8.726 8.608 1.00 12.43 H new ATOM 0 HA2 GLY A 117 14.142 8.293 10.749 1.00 34.13 H new ATOM 0 HA3 GLY A 117 15.597 9.263 10.629 1.00 34.13 H new ATOM 1686 N THR A 118 12.713 10.890 10.888 1.00 34.05 N ATOM 1687 CA THR A 118 11.914 11.818 11.704 1.00 31.44 C ATOM 1688 C THR A 118 10.435 11.396 11.671 1.00 33.31 C ATOM 1689 O THR A 118 10.123 10.383 11.048 1.00 13.35 O ATOM 1690 CB THR A 118 12.144 13.277 11.241 1.00 74.33 C ATOM 1691 OG1 THR A 118 11.993 13.424 9.844 1.00 70.04 O ATOM 1692 CG2 THR A 118 13.545 13.768 11.610 1.00 44.30 C ATOM 0 H THR A 118 12.294 10.692 9.979 1.00 34.05 H new ATOM 0 HA THR A 118 12.235 11.773 12.745 1.00 31.44 H new ATOM 0 HB THR A 118 11.387 13.870 11.755 1.00 74.33 H new ATOM 0 HG1 THR A 118 12.145 14.360 9.595 1.00 70.04 H new ATOM 0 HG21 THR A 118 13.672 14.796 11.270 1.00 44.30 H new ATOM 0 HG22 THR A 118 13.672 13.726 12.692 1.00 44.30 H new ATOM 0 HG23 THR A 118 14.291 13.133 11.132 1.00 44.30 H new ATOM 1700 N ASN A 119 9.540 12.132 12.358 1.00 4.34 N ATOM 1701 CA ASN A 119 8.102 12.310 12.074 1.00 14.45 C ATOM 1702 C ASN A 119 7.280 11.017 12.024 1.00 14.22 C ATOM 1703 O ASN A 119 6.136 11.013 11.586 1.00 2.41 O ATOM 1704 CB ASN A 119 7.898 13.236 10.851 1.00 42.31 C ATOM 1705 CG ASN A 119 8.359 14.660 11.067 1.00 32.15 C ATOM 1706 OD1 ASN A 119 8.341 15.152 12.194 1.00 24.41 O ATOM 1707 ND2 ASN A 119 8.797 15.328 10.014 1.00 21.31 N ATOM 0 H ASN A 119 9.823 12.656 13.186 1.00 4.34 H new ATOM 0 HA ASN A 119 7.680 12.814 12.944 1.00 14.45 H new ATOM 0 HB2 ASN A 119 8.434 12.818 9.999 1.00 42.31 H new ATOM 0 HB3 ASN A 119 6.840 13.244 10.588 1.00 42.31 H new ATOM 0 HD21 ASN A 119 9.135 16.284 10.121 1.00 21.31 H new ATOM 0 HD22 ASN A 119 8.797 14.887 9.094 1.00 21.31 H new ATOM 1713 N HIS A 120 7.831 9.931 12.554 1.00 62.30 N ATOM 1714 CA HIS A 120 7.294 8.583 12.569 1.00 30.11 C ATOM 1715 C HIS A 120 5.852 8.549 13.068 1.00 5.53 C ATOM 1716 O HIS A 120 4.999 7.895 12.460 1.00 21.04 O ATOM 1717 CB HIS A 120 8.217 7.699 13.422 1.00 44.22 C ATOM 1718 CG HIS A 120 8.427 8.187 14.836 1.00 54.30 C ATOM 1719 ND1 HIS A 120 9.258 9.198 15.235 1.00 63.01 N flip ATOM 1720 CD2 HIS A 120 7.791 7.701 15.955 1.00 34.33 C flip ATOM 1721 CE1 HIS A 120 9.081 9.376 16.616 1.00 34.24 C flip ATOM 1722 NE2 HIS A 120 8.195 8.434 17.003 1.00 63.04 N flip ATOM 0 H HIS A 120 8.737 9.979 13.020 1.00 62.30 H new ATOM 0 HA HIS A 120 7.264 8.196 11.551 1.00 30.11 H new ATOM 0 HB2 HIS A 120 7.802 6.692 13.457 1.00 44.22 H new ATOM 0 HB3 HIS A 120 9.186 7.627 12.929 1.00 44.22 H new ATOM 0 HD2 HIS A 120 7.092 6.878 15.984 1.00 34.33 H new ATOM 0 HE1 HIS A 120 9.557 10.116 17.242 1.00 34.24 H new ATOM 0 HE2 HIS A 120 7.876 8.298 17.962 1.00 63.04 H new ATOM 1729 N LYS A 121 5.546 9.238 14.174 1.00 25.22 N ATOM 1730 CA LYS A 121 4.193 9.258 14.696 1.00 14.15 C ATOM 1731 C LYS A 121 3.261 9.989 13.742 1.00 71.13 C ATOM 1732 O LYS A 121 2.135 9.526 13.542 1.00 4.25 O ATOM 1733 CB LYS A 121 4.197 9.910 16.087 1.00 41.40 C ATOM 1734 CG LYS A 121 3.112 9.255 16.925 1.00 43.50 C ATOM 1735 CD LYS A 121 3.101 9.775 18.363 1.00 73.22 C ATOM 1736 CE LYS A 121 2.060 9.035 19.210 1.00 63.13 C ATOM 1737 NZ LYS A 121 0.740 9.693 19.198 1.00 23.05 N ATOM 0 H LYS A 121 6.218 9.782 14.715 1.00 25.22 H new ATOM 0 HA LYS A 121 3.823 8.237 14.790 1.00 14.15 H new ATOM 0 HB2 LYS A 121 5.170 9.785 16.562 1.00 41.40 H new ATOM 0 HB3 LYS A 121 4.017 10.982 16.004 1.00 41.40 H new ATOM 0 HG2 LYS A 121 2.140 9.439 16.466 1.00 43.50 H new ATOM 0 HG3 LYS A 121 3.262 8.175 16.932 1.00 43.50 H new ATOM 0 HD2 LYS A 121 4.089 9.650 18.805 1.00 73.22 H new ATOM 0 HD3 LYS A 121 2.883 10.843 18.365 1.00 73.22 H new ATOM 0 HE2 LYS A 121 1.956 8.015 18.840 1.00 63.13 H new ATOM 0 HE3 LYS A 121 2.417 8.966 20.238 1.00 63.13 H new ATOM 0 HZ1 LYS A 121 0.076 9.150 19.786 1.00 23.05 H new ATOM 0 HZ2 LYS A 121 0.829 10.657 19.577 1.00 23.05 H new ATOM 0 HZ3 LYS A 121 0.382 9.736 18.222 1.00 23.05 H new ATOM 1747 N ALA A 122 3.735 11.089 13.144 1.00 1.25 N ATOM 1748 CA ALA A 122 2.933 11.879 12.230 1.00 25.42 C ATOM 1749 C ALA A 122 2.512 11.027 11.039 1.00 33.45 C ATOM 1750 O ALA A 122 1.332 11.027 10.707 1.00 71.14 O ATOM 1751 CB ALA A 122 3.651 13.155 11.771 1.00 51.53 C ATOM 0 H ALA A 122 4.680 11.446 13.285 1.00 1.25 H new ATOM 0 HA ALA A 122 2.043 12.205 12.768 1.00 25.42 H new ATOM 0 HB1 ALA A 122 3.007 13.709 11.088 1.00 51.53 H new ATOM 0 HB2 ALA A 122 3.881 13.775 12.638 1.00 51.53 H new ATOM 0 HB3 ALA A 122 4.576 12.888 11.260 1.00 51.53 H new ATOM 1757 N TYR A 123 3.433 10.267 10.433 1.00 25.33 N ATOM 1758 CA TYR A 123 3.161 9.437 9.260 1.00 31.11 C ATOM 1759 C TYR A 123 2.019 8.465 9.530 1.00 42.32 C ATOM 1760 O TYR A 123 1.059 8.391 8.762 1.00 35.15 O ATOM 1761 CB TYR A 123 4.412 8.646 8.848 1.00 3.13 C ATOM 1762 CG TYR A 123 5.705 9.412 8.773 1.00 54.23 C ATOM 1763 CD1 TYR A 123 5.723 10.786 8.486 1.00 62.31 C ATOM 1764 CD2 TYR A 123 6.905 8.711 8.961 1.00 61.23 C ATOM 1765 CE1 TYR A 123 6.943 11.465 8.420 1.00 1.21 C ATOM 1766 CE2 TYR A 123 8.130 9.381 8.872 1.00 64.00 C ATOM 1767 CZ TYR A 123 8.155 10.761 8.597 1.00 33.45 C ATOM 1768 OH TYR A 123 9.337 11.389 8.357 1.00 62.14 O ATOM 0 H TYR A 123 4.401 10.213 10.751 1.00 25.33 H new ATOM 0 HA TYR A 123 2.875 10.105 8.448 1.00 31.11 H new ATOM 0 HB2 TYR A 123 4.543 7.826 9.554 1.00 3.13 H new ATOM 0 HB3 TYR A 123 4.225 8.199 7.872 1.00 3.13 H new ATOM 0 HD1 TYR A 123 4.798 11.317 8.317 1.00 62.31 H new ATOM 0 HD2 TYR A 123 6.883 7.653 9.175 1.00 61.23 H new ATOM 0 HE1 TYR A 123 6.959 12.529 8.234 1.00 1.21 H new ATOM 0 HE2 TYR A 123 9.054 8.841 9.014 1.00 64.00 H new ATOM 0 HH TYR A 123 9.957 11.211 9.095 1.00 62.14 H new ATOM 1777 N VAL A 124 2.125 7.696 10.610 1.00 32.45 N ATOM 1778 CA VAL A 124 1.172 6.643 10.922 1.00 54.51 C ATOM 1779 C VAL A 124 -0.195 7.260 11.251 1.00 40.10 C ATOM 1780 O VAL A 124 -1.220 6.743 10.807 1.00 0.12 O ATOM 1781 CB VAL A 124 1.759 5.774 12.047 1.00 5.15 C ATOM 1782 CG1 VAL A 124 0.799 4.670 12.482 1.00 13.35 C ATOM 1783 CG2 VAL A 124 3.077 5.116 11.602 1.00 31.05 C ATOM 0 H VAL A 124 2.877 7.788 11.293 1.00 32.45 H new ATOM 0 HA VAL A 124 1.001 5.988 10.068 1.00 54.51 H new ATOM 0 HB VAL A 124 1.935 6.444 12.888 1.00 5.15 H new ATOM 0 HG11 VAL A 124 1.257 4.083 13.278 1.00 13.35 H new ATOM 0 HG12 VAL A 124 -0.127 5.115 12.846 1.00 13.35 H new ATOM 0 HG13 VAL A 124 0.580 4.022 11.633 1.00 13.35 H new ATOM 0 HG21 VAL A 124 3.472 4.507 12.415 1.00 31.05 H new ATOM 0 HG22 VAL A 124 2.893 4.485 10.732 1.00 31.05 H new ATOM 0 HG23 VAL A 124 3.800 5.889 11.343 1.00 31.05 H new ATOM 1793 N SER A 125 -0.222 8.391 11.963 1.00 14.52 N ATOM 1794 CA SER A 125 -1.442 9.148 12.202 1.00 40.41 C ATOM 1795 C SER A 125 -2.048 9.660 10.894 1.00 43.23 C ATOM 1796 O SER A 125 -3.258 9.557 10.701 1.00 53.30 O ATOM 1797 CB SER A 125 -1.123 10.306 13.154 1.00 74.33 C ATOM 1798 OG SER A 125 -1.252 9.846 14.482 1.00 23.13 O ATOM 0 H SER A 125 0.608 8.804 12.389 1.00 14.52 H new ATOM 0 HA SER A 125 -2.186 8.495 12.658 1.00 40.41 H new ATOM 0 HB2 SER A 125 -0.112 10.673 12.977 1.00 74.33 H new ATOM 0 HB3 SER A 125 -1.801 11.140 12.975 1.00 74.33 H new ATOM 0 HG SER A 125 -1.049 10.577 15.103 1.00 23.13 H new ATOM 1803 N HIS A 126 -1.230 10.207 9.994 1.00 51.10 N ATOM 1804 CA HIS A 126 -1.709 10.792 8.754 1.00 22.11 C ATOM 1805 C HIS A 126 -2.288 9.711 7.849 1.00 15.14 C ATOM 1806 O HIS A 126 -3.358 9.893 7.278 1.00 32.42 O ATOM 1807 CB HIS A 126 -0.579 11.559 8.049 1.00 15.15 C ATOM 1808 CG HIS A 126 -1.126 12.697 7.241 1.00 31.04 C ATOM 1809 ND1 HIS A 126 -1.141 12.833 5.870 1.00 40.52 N ATOM 1810 CD2 HIS A 126 -1.718 13.800 7.787 1.00 52.53 C ATOM 1811 CE1 HIS A 126 -1.727 14.011 5.596 1.00 14.50 C ATOM 1812 NE2 HIS A 126 -2.145 14.599 6.730 1.00 44.35 N ATOM 0 H HIS A 126 -0.218 10.254 10.110 1.00 51.10 H new ATOM 0 HA HIS A 126 -2.503 11.502 8.984 1.00 22.11 H new ATOM 0 HB2 HIS A 126 0.125 11.939 8.790 1.00 15.15 H new ATOM 0 HB3 HIS A 126 -0.024 10.881 7.400 1.00 15.15 H new ATOM 0 HD1 HIS A 126 -0.776 12.165 5.191 1.00 40.52 H new ATOM 0 HD2 HIS A 126 -1.833 14.012 8.840 1.00 52.53 H new ATOM 0 HE1 HIS A 126 -1.845 14.426 4.606 1.00 14.50 H new ATOM 1819 N PHE A 127 -1.594 8.574 7.736 1.00 24.31 N ATOM 1820 CA PHE A 127 -2.108 7.426 7.014 1.00 13.21 C ATOM 1821 C PHE A 127 -3.448 7.007 7.604 1.00 3.13 C ATOM 1822 O PHE A 127 -4.369 6.809 6.834 1.00 72.44 O ATOM 1823 CB PHE A 127 -1.101 6.269 7.014 1.00 40.30 C ATOM 1824 CG PHE A 127 -1.657 4.987 6.415 1.00 75.44 C ATOM 1825 CD1 PHE A 127 -1.781 4.823 5.017 1.00 1.12 C ATOM 1826 CD2 PHE A 127 -2.141 3.980 7.274 1.00 74.00 C ATOM 1827 CE1 PHE A 127 -2.350 3.645 4.498 1.00 1.23 C ATOM 1828 CE2 PHE A 127 -2.721 2.813 6.749 1.00 24.41 C ATOM 1829 CZ PHE A 127 -2.816 2.640 5.360 1.00 51.41 C ATOM 0 H PHE A 127 -0.669 8.433 8.142 1.00 24.31 H new ATOM 0 HA PHE A 127 -2.262 7.706 5.972 1.00 13.21 H new ATOM 0 HB2 PHE A 127 -0.214 6.568 6.455 1.00 40.30 H new ATOM 0 HB3 PHE A 127 -0.782 6.075 8.038 1.00 40.30 H new ATOM 0 HD1 PHE A 127 -1.440 5.600 4.348 1.00 1.12 H new ATOM 0 HD2 PHE A 127 -2.065 4.106 8.344 1.00 74.00 H new ATOM 0 HE1 PHE A 127 -2.429 3.513 3.429 1.00 1.23 H new ATOM 0 HE2 PHE A 127 -3.094 2.049 7.415 1.00 24.41 H new ATOM 0 HZ PHE A 127 -3.246 1.736 4.955 1.00 51.41 H new ATOM 1838 N ASN A 128 -3.577 6.911 8.934 1.00 40.20 N ATOM 1839 CA ASN A 128 -4.786 6.384 9.567 1.00 11.21 C ATOM 1840 C ASN A 128 -6.058 7.077 9.087 1.00 43.54 C ATOM 1841 O ASN A 128 -7.019 6.375 8.778 1.00 33.11 O ATOM 1842 CB ASN A 128 -4.693 6.422 11.105 1.00 63.31 C ATOM 1843 CG ASN A 128 -4.343 5.055 11.668 1.00 11.54 C ATOM 1844 OD1 ASN A 128 -5.222 4.235 11.906 1.00 1.11 O ATOM 1845 ND2 ASN A 128 -3.068 4.744 11.826 1.00 13.31 N ATOM 0 H ASN A 128 -2.852 7.194 9.593 1.00 40.20 H new ATOM 0 HA ASN A 128 -4.852 5.342 9.256 1.00 11.21 H new ATOM 0 HB2 ASN A 128 -3.938 7.147 11.409 1.00 63.31 H new ATOM 0 HB3 ASN A 128 -5.643 6.757 11.521 1.00 63.31 H new ATOM 0 HD21 ASN A 128 -2.807 3.813 12.149 1.00 13.31 H new ATOM 0 HD22 ASN A 128 -2.346 5.435 11.625 1.00 13.31 H new ATOM 1851 N GLU A 129 -6.049 8.412 8.997 1.00 0.11 N ATOM 1852 CA GLU A 129 -7.133 9.217 8.430 1.00 4.11 C ATOM 1853 C GLU A 129 -7.337 8.872 6.959 1.00 42.40 C ATOM 1854 O GLU A 129 -8.422 8.456 6.548 1.00 64.10 O ATOM 1855 CB GLU A 129 -6.798 10.716 8.575 1.00 42.51 C ATOM 1856 CG GLU A 129 -7.494 11.358 9.782 1.00 1.52 C ATOM 1857 CD GLU A 129 -8.544 12.401 9.386 1.00 40.33 C ATOM 1858 OE1 GLU A 129 -9.663 12.003 8.985 1.00 53.35 O ATOM 1859 OE2 GLU A 129 -8.286 13.613 9.586 1.00 3.20 O ATOM 0 H GLU A 129 -5.265 8.976 9.326 1.00 0.11 H new ATOM 0 HA GLU A 129 -8.054 8.998 8.971 1.00 4.11 H new ATOM 0 HB2 GLU A 129 -5.719 10.836 8.675 1.00 42.51 H new ATOM 0 HB3 GLU A 129 -7.094 11.241 7.667 1.00 42.51 H new ATOM 0 HG2 GLU A 129 -7.971 10.578 10.376 1.00 1.52 H new ATOM 0 HG3 GLU A 129 -6.744 11.829 10.418 1.00 1.52 H new ATOM 1864 N TRP A 130 -6.289 9.032 6.153 1.00 31.11 N ATOM 1865 CA TRP A 130 -6.326 8.810 4.715 1.00 54.44 C ATOM 1866 C TRP A 130 -6.152 7.321 4.382 1.00 51.42 C ATOM 1867 O TRP A 130 -5.496 6.978 3.390 1.00 53.24 O ATOM 1868 CB TRP A 130 -5.285 9.714 4.045 1.00 2.41 C ATOM 1869 CG TRP A 130 -5.296 11.148 4.501 1.00 60.32 C ATOM 1870 CD1 TRP A 130 -4.248 11.770 5.078 1.00 42.14 C ATOM 1871 CD2 TRP A 130 -6.391 12.119 4.538 1.00 13.50 C ATOM 1872 NE1 TRP A 130 -4.589 13.058 5.425 1.00 73.32 N ATOM 1873 CE2 TRP A 130 -5.892 13.335 5.094 1.00 4.30 C ATOM 1874 CE3 TRP A 130 -7.763 12.095 4.206 1.00 52.35 C ATOM 1875 CZ2 TRP A 130 -6.682 14.479 5.253 1.00 51.53 C ATOM 1876 CZ3 TRP A 130 -8.575 13.234 4.376 1.00 53.43 C ATOM 1877 CH2 TRP A 130 -8.037 14.429 4.888 1.00 51.24 C ATOM 0 H TRP A 130 -5.373 9.326 6.492 1.00 31.11 H new ATOM 0 HA TRP A 130 -7.303 9.082 4.316 1.00 54.44 H new ATOM 0 HB2 TRP A 130 -4.294 9.298 4.228 1.00 2.41 H new ATOM 0 HB3 TRP A 130 -5.446 9.691 2.967 1.00 2.41 H new ATOM 0 HD1 TRP A 130 -3.280 11.322 5.244 1.00 42.14 H new ATOM 0 HE1 TRP A 130 -3.955 13.721 5.871 1.00 73.32 H new ATOM 0 HE3 TRP A 130 -8.198 11.187 3.815 1.00 52.35 H new ATOM 0 HZ2 TRP A 130 -6.255 15.388 5.651 1.00 51.53 H new ATOM 0 HZ3 TRP A 130 -9.621 13.189 4.111 1.00 53.43 H new ATOM 0 HH2 TRP A 130 -8.662 15.302 5.000 1.00 51.24 H new ATOM 1887 N ALA A 131 -6.718 6.437 5.210 1.00 14.23 N ATOM 1888 CA ALA A 131 -6.789 4.997 5.018 1.00 43.52 C ATOM 1889 C ALA A 131 -7.902 4.362 5.854 1.00 31.44 C ATOM 1890 O ALA A 131 -7.816 3.169 6.178 1.00 43.32 O ATOM 1891 CB ALA A 131 -5.452 4.391 5.425 1.00 72.44 C ATOM 0 H ALA A 131 -7.162 6.731 6.080 1.00 14.23 H new ATOM 0 HA ALA A 131 -7.010 4.800 3.969 1.00 43.52 H new ATOM 0 HB1 ALA A 131 -5.486 3.310 5.288 1.00 72.44 H new ATOM 0 HB2 ALA A 131 -4.659 4.811 4.806 1.00 72.44 H new ATOM 0 HB3 ALA A 131 -5.253 4.618 6.472 1.00 72.44 H new ATOM 1897 N ASP A 132 -8.858 5.145 6.348 1.00 62.13 N ATOM 1898 CA ASP A 132 -9.746 4.701 7.412 1.00 40.44 C ATOM 1899 C ASP A 132 -10.860 3.845 6.828 1.00 32.24 C ATOM 1900 O ASP A 132 -11.829 4.364 6.273 1.00 3.15 O ATOM 1901 CB ASP A 132 -10.302 5.867 8.233 1.00 75.23 C ATOM 1902 CG ASP A 132 -10.712 5.387 9.624 1.00 41.21 C ATOM 1903 OD1 ASP A 132 -10.899 4.173 9.841 1.00 44.31 O ATOM 1904 OD2 ASP A 132 -10.782 6.223 10.554 1.00 22.15 O ATOM 0 H ASP A 132 -9.036 6.096 6.024 1.00 62.13 H new ATOM 0 HA ASP A 132 -9.164 4.096 8.107 1.00 40.44 H new ATOM 0 HB2 ASP A 132 -9.550 6.652 8.318 1.00 75.23 H new ATOM 0 HB3 ASP A 132 -11.161 6.303 7.723 1.00 75.23 H new ATOM 1908 N GLY A 133 -10.688 2.528 6.871 1.00 61.24 N ATOM 1909 CA GLY A 133 -11.719 1.572 6.504 1.00 55.14 C ATOM 1910 C GLY A 133 -11.205 0.290 5.852 1.00 74.40 C ATOM 1911 O GLY A 133 -11.890 -0.730 5.915 1.00 63.32 O ATOM 0 H GLY A 133 -9.815 2.091 7.166 1.00 61.24 H new ATOM 0 HA2 GLY A 133 -12.283 1.307 7.398 1.00 55.14 H new ATOM 0 HA3 GLY A 133 -12.416 2.056 5.820 1.00 55.14 H new ATOM 1915 N LEU A 134 -10.035 0.305 5.200 1.00 0.22 N ATOM 1916 CA LEU A 134 -9.481 -0.921 4.618 1.00 13.54 C ATOM 1917 C LEU A 134 -8.760 -1.697 5.716 1.00 21.03 C ATOM 1918 O LEU A 134 -8.039 -1.103 6.523 1.00 34.44 O ATOM 1919 CB LEU A 134 -8.541 -0.626 3.433 1.00 21.33 C ATOM 1920 CG LEU A 134 -9.193 -0.713 2.041 1.00 1.21 C ATOM 1921 CD1 LEU A 134 -9.589 -2.153 1.674 1.00 40.23 C ATOM 1922 CD2 LEU A 134 -10.387 0.241 1.910 1.00 62.30 C ATOM 0 H LEU A 134 -9.463 1.139 5.064 1.00 0.22 H new ATOM 0 HA LEU A 134 -10.297 -1.522 4.215 1.00 13.54 H new ATOM 0 HB2 LEU A 134 -8.125 0.374 3.560 1.00 21.33 H new ATOM 0 HB3 LEU A 134 -7.706 -1.326 3.470 1.00 21.33 H new ATOM 0 HG LEU A 134 -8.436 -0.394 1.324 1.00 1.21 H new ATOM 0 HD11 LEU A 134 -10.045 -2.164 0.684 1.00 40.23 H new ATOM 0 HD12 LEU A 134 -8.701 -2.785 1.672 1.00 40.23 H new ATOM 0 HD13 LEU A 134 -10.302 -2.532 2.406 1.00 40.23 H new ATOM 0 HD21 LEU A 134 -10.819 0.149 0.913 1.00 62.30 H new ATOM 0 HD22 LEU A 134 -11.140 -0.013 2.656 1.00 62.30 H new ATOM 0 HD23 LEU A 134 -10.052 1.266 2.067 1.00 62.30 H new ATOM 1933 N ASN A 135 -8.941 -3.019 5.709 1.00 52.54 N ATOM 1934 CA ASN A 135 -8.390 -3.986 6.658 1.00 43.10 C ATOM 1935 C ASN A 135 -6.860 -4.029 6.569 1.00 61.00 C ATOM 1936 O ASN A 135 -6.284 -4.809 5.809 1.00 33.02 O ATOM 1937 CB ASN A 135 -9.030 -5.358 6.389 1.00 72.03 C ATOM 1938 CG ASN A 135 -8.416 -6.476 7.226 1.00 13.11 C ATOM 1939 OD1 ASN A 135 -7.715 -7.405 6.593 1.00 2.42 O flip ATOM 1940 ND2 ASN A 135 -8.568 -6.496 8.445 1.00 53.41 N flip ATOM 0 H ASN A 135 -9.513 -3.470 4.995 1.00 52.54 H new ATOM 0 HA ASN A 135 -8.627 -3.686 7.679 1.00 43.10 H new ATOM 0 HB2 ASN A 135 -10.099 -5.301 6.596 1.00 72.03 H new ATOM 0 HB3 ASN A 135 -8.923 -5.602 5.332 1.00 72.03 H new ATOM 0 HD21 ASN A 135 -9.114 -5.766 8.903 1.00 53.41 H new ATOM 0 HD22 ASN A 135 -8.149 -7.243 8.999 1.00 53.41 H new ATOM 1946 N VAL A 136 -6.195 -3.166 7.331 1.00 4.34 N ATOM 1947 CA VAL A 136 -4.749 -2.990 7.307 1.00 54.22 C ATOM 1948 C VAL A 136 -4.104 -3.768 8.439 1.00 20.12 C ATOM 1949 O VAL A 136 -4.442 -3.586 9.608 1.00 52.42 O ATOM 1950 CB VAL A 136 -4.356 -1.497 7.266 1.00 62.44 C ATOM 1951 CG1 VAL A 136 -5.032 -0.690 8.369 1.00 73.43 C ATOM 1952 CG2 VAL A 136 -2.849 -1.245 7.426 1.00 64.24 C ATOM 0 H VAL A 136 -6.661 -2.553 8.000 1.00 4.34 H new ATOM 0 HA VAL A 136 -4.355 -3.409 6.381 1.00 54.22 H new ATOM 0 HB VAL A 136 -4.684 -1.180 6.276 1.00 62.44 H new ATOM 0 HG11 VAL A 136 -4.724 0.353 8.298 1.00 73.43 H new ATOM 0 HG12 VAL A 136 -6.114 -0.757 8.258 1.00 73.43 H new ATOM 0 HG13 VAL A 136 -4.742 -1.088 9.341 1.00 73.43 H new ATOM 0 HG21 VAL A 136 -2.653 -0.173 7.387 1.00 64.24 H new ATOM 0 HG22 VAL A 136 -2.514 -1.640 8.385 1.00 64.24 H new ATOM 0 HG23 VAL A 136 -2.309 -1.742 6.620 1.00 64.24 H new ATOM 1962 N ILE A 137 -3.187 -4.663 8.090 1.00 72.44 N ATOM 1963 CA ILE A 137 -2.518 -5.515 9.070 1.00 72.14 C ATOM 1964 C ILE A 137 -1.321 -4.830 9.737 1.00 22.22 C ATOM 1965 O ILE A 137 -0.863 -5.303 10.779 1.00 64.13 O ATOM 1966 CB ILE A 137 -2.129 -6.863 8.445 1.00 75.40 C ATOM 1967 CG1 ILE A 137 -1.298 -6.667 7.169 1.00 62.32 C ATOM 1968 CG2 ILE A 137 -3.408 -7.662 8.169 1.00 61.40 C ATOM 1969 CD1 ILE A 137 -0.469 -7.896 6.820 1.00 22.21 C ATOM 0 H ILE A 137 -2.887 -4.819 7.128 1.00 72.44 H new ATOM 0 HA ILE A 137 -3.235 -5.705 9.869 1.00 72.14 H new ATOM 0 HB ILE A 137 -1.501 -7.420 9.140 1.00 75.40 H new ATOM 0 HG12 ILE A 137 -1.963 -6.433 6.338 1.00 62.32 H new ATOM 0 HG13 ILE A 137 -0.636 -5.811 7.298 1.00 62.32 H new ATOM 0 HG21 ILE A 137 -3.148 -8.623 7.725 1.00 61.40 H new ATOM 0 HG22 ILE A 137 -3.943 -7.828 9.104 1.00 61.40 H new ATOM 0 HG23 ILE A 137 -4.044 -7.104 7.481 1.00 61.40 H new ATOM 0 HD11 ILE A 137 0.100 -7.705 5.910 1.00 22.21 H new ATOM 0 HD12 ILE A 137 0.218 -8.116 7.637 1.00 22.21 H new ATOM 0 HD13 ILE A 137 -1.130 -8.748 6.662 1.00 22.21 H new ATOM 1980 N GLY A 138 -0.838 -3.704 9.215 1.00 24.44 N ATOM 1981 CA GLY A 138 0.169 -2.922 9.900 1.00 54.22 C ATOM 1982 C GLY A 138 0.529 -1.679 9.107 1.00 64.01 C ATOM 1983 O GLY A 138 0.281 -1.596 7.901 1.00 11.13 O ATOM 0 H GLY A 138 -1.133 -3.319 8.318 1.00 24.44 H new ATOM 0 HA2 GLY A 138 -0.197 -2.635 10.886 1.00 54.22 H new ATOM 0 HA3 GLY A 138 1.061 -3.529 10.056 1.00 54.22 H new ATOM 1987 N VAL A 139 1.131 -0.731 9.820 1.00 52.13 N ATOM 1988 CA VAL A 139 1.511 0.592 9.354 1.00 0.23 C ATOM 1989 C VAL A 139 2.868 0.876 9.993 1.00 34.04 C ATOM 1990 O VAL A 139 2.973 1.157 11.193 1.00 13.15 O ATOM 1991 CB VAL A 139 0.456 1.663 9.712 1.00 44.13 C ATOM 1992 CG1 VAL A 139 0.765 2.963 8.948 1.00 43.33 C ATOM 1993 CG2 VAL A 139 -0.974 1.238 9.366 1.00 24.03 C ATOM 0 H VAL A 139 1.380 -0.879 10.798 1.00 52.13 H new ATOM 0 HA VAL A 139 1.573 0.627 8.266 1.00 0.23 H new ATOM 0 HB VAL A 139 0.513 1.805 10.791 1.00 44.13 H new ATOM 0 HG11 VAL A 139 0.021 3.719 9.200 1.00 43.33 H new ATOM 0 HG12 VAL A 139 1.756 3.322 9.226 1.00 43.33 H new ATOM 0 HG13 VAL A 139 0.737 2.770 7.876 1.00 43.33 H new ATOM 0 HG21 VAL A 139 -1.667 2.033 9.642 1.00 24.03 H new ATOM 0 HG22 VAL A 139 -1.048 1.047 8.295 1.00 24.03 H new ATOM 0 HG23 VAL A 139 -1.227 0.330 9.914 1.00 24.03 H new ATOM 2003 N ALA A 140 3.925 0.729 9.203 1.00 73.10 N ATOM 2004 CA ALA A 140 5.314 0.773 9.651 1.00 3.44 C ATOM 2005 C ALA A 140 6.118 1.641 8.685 1.00 13.54 C ATOM 2006 O ALA A 140 5.557 2.506 8.007 1.00 65.33 O ATOM 2007 CB ALA A 140 5.867 -0.655 9.799 1.00 72.42 C ATOM 0 H ALA A 140 3.837 0.571 8.199 1.00 73.10 H new ATOM 0 HA ALA A 140 5.391 1.230 10.638 1.00 3.44 H new ATOM 0 HB1 ALA A 140 6.903 -0.611 10.134 1.00 72.42 H new ATOM 0 HB2 ALA A 140 5.272 -1.201 10.531 1.00 72.42 H new ATOM 0 HB3 ALA A 140 5.818 -1.166 8.837 1.00 72.42 H new ATOM 2013 N ARG A 141 7.436 1.470 8.644 1.00 32.25 N ATOM 2014 CA ARG A 141 8.266 1.956 7.561 1.00 44.21 C ATOM 2015 C ARG A 141 9.255 0.869 7.175 1.00 70.41 C ATOM 2016 O ARG A 141 9.431 -0.086 7.939 1.00 71.24 O ATOM 2017 CB ARG A 141 8.955 3.271 7.942 1.00 44.52 C ATOM 2018 CG ARG A 141 10.046 3.190 9.025 1.00 11.24 C ATOM 2019 CD ARG A 141 9.556 3.491 10.442 1.00 71.01 C ATOM 2020 NE ARG A 141 10.712 3.674 11.335 1.00 10.33 N ATOM 2021 CZ ARG A 141 10.725 4.354 12.487 1.00 13.32 C ATOM 2022 NH1 ARG A 141 9.610 4.825 13.034 1.00 54.52 N ATOM 2023 NH2 ARG A 141 11.869 4.574 13.114 1.00 23.45 N ATOM 0 H ARG A 141 7.958 0.984 9.373 1.00 32.25 H new ATOM 0 HA ARG A 141 7.648 2.182 6.692 1.00 44.21 H new ATOM 0 HB2 ARG A 141 9.400 3.696 7.042 1.00 44.52 H new ATOM 0 HB3 ARG A 141 8.191 3.970 8.280 1.00 44.52 H new ATOM 0 HG2 ARG A 141 10.482 2.191 9.009 1.00 11.24 H new ATOM 0 HG3 ARG A 141 10.843 3.890 8.773 1.00 11.24 H new ATOM 0 HD2 ARG A 141 8.938 4.389 10.441 1.00 71.01 H new ATOM 0 HD3 ARG A 141 8.931 2.674 10.803 1.00 71.01 H new ATOM 0 HE ARG A 141 11.589 3.240 11.047 1.00 10.33 H new ATOM 0 HH11 ARG A 141 8.712 4.672 12.575 1.00 54.52 H new ATOM 0 HH12 ARG A 141 9.651 5.340 13.913 1.00 54.52 H new ATOM 0 HH21 ARG A 141 12.742 4.225 12.719 1.00 23.45 H new ATOM 0 HH22 ARG A 141 11.878 5.093 13.992 1.00 23.45 H new ATOM 2034 N ASP A 142 9.922 1.075 6.045 1.00 12.45 N ATOM 2035 CA ASP A 142 10.967 0.229 5.491 1.00 63.21 C ATOM 2036 C ASP A 142 10.484 -1.224 5.388 1.00 12.12 C ATOM 2037 O ASP A 142 9.283 -1.506 5.407 1.00 11.54 O ATOM 2038 CB ASP A 142 12.293 0.414 6.266 1.00 52.13 C ATOM 2039 CG ASP A 142 12.709 1.881 6.397 1.00 51.51 C ATOM 2040 OD1 ASP A 142 13.040 2.533 5.377 1.00 63.32 O ATOM 2041 OD2 ASP A 142 12.648 2.436 7.520 1.00 52.50 O ATOM 0 H ASP A 142 9.734 1.887 5.457 1.00 12.45 H new ATOM 0 HA ASP A 142 11.188 0.537 4.469 1.00 63.21 H new ATOM 0 HB2 ASP A 142 12.189 -0.019 7.261 1.00 52.13 H new ATOM 0 HB3 ASP A 142 13.084 -0.138 5.759 1.00 52.13 H new ATOM 2045 N ASP A 143 11.413 -2.159 5.233 1.00 22.32 N ATOM 2046 CA ASP A 143 11.220 -3.604 5.168 1.00 44.43 C ATOM 2047 C ASP A 143 11.113 -4.228 6.563 1.00 25.41 C ATOM 2048 O ASP A 143 11.147 -5.450 6.685 1.00 25.21 O ATOM 2049 CB ASP A 143 12.352 -4.240 4.338 1.00 31.44 C ATOM 2050 CG ASP A 143 13.744 -4.074 4.957 1.00 21.31 C ATOM 2051 OD1 ASP A 143 14.136 -2.926 5.280 1.00 43.34 O ATOM 2052 OD2 ASP A 143 14.486 -5.075 5.065 1.00 51.52 O ATOM 0 H ASP A 143 12.398 -1.908 5.142 1.00 22.32 H new ATOM 0 HA ASP A 143 10.271 -3.807 4.672 1.00 44.43 H new ATOM 0 HB2 ASP A 143 12.145 -5.303 4.213 1.00 31.44 H new ATOM 0 HB3 ASP A 143 12.353 -3.796 3.342 1.00 31.44 H new ATOM 2056 N SER A 144 10.947 -3.418 7.616 1.00 73.31 N ATOM 2057 CA SER A 144 10.922 -3.830 9.006 1.00 21.34 C ATOM 2058 C SER A 144 9.987 -5.013 9.294 1.00 22.04 C ATOM 2059 O SER A 144 10.324 -5.840 10.142 1.00 72.41 O ATOM 2060 CB SER A 144 10.505 -2.625 9.859 1.00 10.13 C ATOM 2061 OG SER A 144 11.127 -1.412 9.466 1.00 41.10 O ATOM 0 H SER A 144 10.821 -2.412 7.506 1.00 73.31 H new ATOM 0 HA SER A 144 11.925 -4.177 9.256 1.00 21.34 H new ATOM 0 HB2 SER A 144 9.423 -2.505 9.800 1.00 10.13 H new ATOM 0 HB3 SER A 144 10.747 -2.827 10.902 1.00 10.13 H new ATOM 0 HG SER A 144 10.522 -0.908 8.882 1.00 41.10 H new ATOM 2066 N GLU A 145 8.833 -5.099 8.618 1.00 44.32 N ATOM 2067 CA GLU A 145 7.735 -5.995 8.972 1.00 50.43 C ATOM 2068 C GLU A 145 7.336 -6.947 7.829 1.00 62.10 C ATOM 2069 O GLU A 145 6.380 -7.696 8.003 1.00 22.43 O ATOM 2070 CB GLU A 145 6.522 -5.191 9.505 1.00 12.21 C ATOM 2071 CG GLU A 145 6.836 -4.352 10.760 1.00 54.23 C ATOM 2072 CD GLU A 145 5.728 -4.277 11.831 1.00 45.30 C ATOM 2073 OE1 GLU A 145 4.508 -4.401 11.578 1.00 64.24 O ATOM 2074 OE2 GLU A 145 6.091 -4.082 13.015 1.00 32.42 O ATOM 0 H GLU A 145 8.637 -4.533 7.792 1.00 44.32 H new ATOM 0 HA GLU A 145 8.098 -6.638 9.774 1.00 50.43 H new ATOM 0 HB2 GLU A 145 6.162 -4.529 8.717 1.00 12.21 H new ATOM 0 HB3 GLU A 145 5.712 -5.883 9.735 1.00 12.21 H new ATOM 0 HG2 GLU A 145 7.734 -4.757 11.226 1.00 54.23 H new ATOM 0 HG3 GLU A 145 7.072 -3.337 10.442 1.00 54.23 H new ATOM 2079 N VAL A 146 8.041 -7.013 6.688 1.00 53.13 N ATOM 2080 CA VAL A 146 7.670 -7.967 5.627 1.00 32.24 C ATOM 2081 C VAL A 146 7.692 -9.424 6.122 1.00 22.34 C ATOM 2082 O VAL A 146 6.902 -10.247 5.670 1.00 32.12 O ATOM 2083 CB VAL A 146 8.512 -7.740 4.357 1.00 55.11 C ATOM 2084 CG1 VAL A 146 10.020 -7.918 4.557 1.00 30.11 C ATOM 2085 CG2 VAL A 146 8.075 -8.678 3.229 1.00 33.02 C ATOM 0 H VAL A 146 8.853 -6.432 6.478 1.00 53.13 H new ATOM 0 HA VAL A 146 6.634 -7.773 5.350 1.00 32.24 H new ATOM 0 HB VAL A 146 8.330 -6.697 4.097 1.00 55.11 H new ATOM 0 HG11 VAL A 146 10.536 -7.740 3.613 1.00 30.11 H new ATOM 0 HG12 VAL A 146 10.374 -7.208 5.304 1.00 30.11 H new ATOM 0 HG13 VAL A 146 10.225 -8.933 4.896 1.00 30.11 H new ATOM 0 HG21 VAL A 146 8.687 -8.495 2.346 1.00 33.02 H new ATOM 0 HG22 VAL A 146 8.199 -9.713 3.548 1.00 33.02 H new ATOM 0 HG23 VAL A 146 7.028 -8.495 2.989 1.00 33.02 H new ATOM 2095 N ASP A 147 8.544 -9.729 7.103 1.00 24.45 N ATOM 2096 CA ASP A 147 8.636 -11.034 7.767 1.00 43.23 C ATOM 2097 C ASP A 147 7.290 -11.464 8.355 1.00 52.43 C ATOM 2098 O ASP A 147 6.976 -12.648 8.367 1.00 4.45 O ATOM 2099 CB ASP A 147 9.699 -10.935 8.869 1.00 3.22 C ATOM 2100 CG ASP A 147 9.596 -12.019 9.950 1.00 12.44 C ATOM 2101 OD1 ASP A 147 10.157 -13.124 9.786 1.00 44.43 O ATOM 2102 OD2 ASP A 147 9.117 -11.671 11.054 1.00 13.35 O ATOM 0 H ASP A 147 9.212 -9.052 7.471 1.00 24.45 H new ATOM 0 HA ASP A 147 8.917 -11.792 7.035 1.00 43.23 H new ATOM 0 HB2 ASP A 147 10.686 -10.990 8.410 1.00 3.22 H new ATOM 0 HB3 ASP A 147 9.622 -9.957 9.344 1.00 3.22 H new ATOM 2106 N LYS A 148 6.465 -10.514 8.799 1.00 14.52 N ATOM 2107 CA LYS A 148 5.155 -10.760 9.382 1.00 51.13 C ATOM 2108 C LYS A 148 4.049 -10.495 8.365 1.00 62.42 C ATOM 2109 O LYS A 148 3.085 -11.260 8.328 1.00 13.15 O ATOM 2110 CB LYS A 148 5.003 -10.012 10.723 1.00 44.52 C ATOM 2111 CG LYS A 148 5.577 -8.589 10.760 1.00 25.41 C ATOM 2112 CD LYS A 148 5.622 -7.955 12.153 1.00 41.54 C ATOM 2113 CE LYS A 148 4.267 -7.361 12.538 1.00 14.53 C ATOM 2114 NZ LYS A 148 4.385 -6.541 13.759 1.00 43.10 N ATOM 0 H LYS A 148 6.702 -9.523 8.759 1.00 14.52 H new ATOM 0 HA LYS A 148 5.057 -11.816 9.635 1.00 51.13 H new ATOM 0 HB2 LYS A 148 3.943 -9.963 10.973 1.00 44.52 H new ATOM 0 HB3 LYS A 148 5.487 -10.600 11.503 1.00 44.52 H new ATOM 0 HG2 LYS A 148 6.587 -8.608 10.351 1.00 25.41 H new ATOM 0 HG3 LYS A 148 4.980 -7.954 10.105 1.00 25.41 H new ATOM 0 HD2 LYS A 148 5.914 -8.706 12.887 1.00 41.54 H new ATOM 0 HD3 LYS A 148 6.383 -7.175 12.175 1.00 41.54 H new ATOM 0 HE2 LYS A 148 3.886 -6.750 11.719 1.00 14.53 H new ATOM 0 HE3 LYS A 148 3.546 -8.162 12.700 1.00 14.53 H new ATOM 0 HZ1 LYS A 148 3.615 -5.843 13.784 1.00 43.10 H new ATOM 0 HZ2 LYS A 148 4.324 -7.155 14.596 1.00 43.10 H new ATOM 0 HZ3 LYS A 148 5.300 -6.047 13.758 1.00 43.10 H new ATOM 2124 N TRP A 149 4.178 -9.486 7.500 1.00 74.40 N ATOM 2125 CA TRP A 149 3.125 -9.084 6.574 1.00 71.10 C ATOM 2126 C TRP A 149 3.022 -9.976 5.319 1.00 53.24 C ATOM 2127 O TRP A 149 2.645 -9.465 4.267 1.00 34.31 O ATOM 2128 CB TRP A 149 3.294 -7.615 6.172 1.00 62.20 C ATOM 2129 CG TRP A 149 3.249 -6.594 7.265 1.00 11.43 C ATOM 2130 CD1 TRP A 149 2.814 -6.780 8.530 1.00 40.13 C ATOM 2131 CD2 TRP A 149 3.553 -5.179 7.160 1.00 24.25 C ATOM 2132 NE1 TRP A 149 2.845 -5.584 9.208 1.00 13.43 N ATOM 2133 CE2 TRP A 149 3.277 -4.551 8.406 1.00 32.02 C ATOM 2134 CE3 TRP A 149 4.003 -4.358 6.113 1.00 71.22 C ATOM 2135 CZ2 TRP A 149 3.450 -3.173 8.601 1.00 4.54 C ATOM 2136 CZ3 TRP A 149 4.122 -2.969 6.271 1.00 60.34 C ATOM 2137 CH2 TRP A 149 3.844 -2.376 7.512 1.00 73.01 C ATOM 0 H TRP A 149 5.025 -8.922 7.425 1.00 74.40 H new ATOM 0 HA TRP A 149 2.187 -9.213 7.114 1.00 71.10 H new ATOM 0 HB2 TRP A 149 4.249 -7.514 5.656 1.00 62.20 H new ATOM 0 HB3 TRP A 149 2.514 -7.371 5.450 1.00 62.20 H new ATOM 0 HD1 TRP A 149 2.491 -7.723 8.945 1.00 40.13 H new ATOM 0 HE1 TRP A 149 2.580 -5.475 10.187 1.00 13.43 H new ATOM 0 HE3 TRP A 149 4.263 -4.806 5.165 1.00 71.22 H new ATOM 0 HZ2 TRP A 149 3.283 -2.731 9.572 1.00 4.54 H new ATOM 0 HZ3 TRP A 149 4.428 -2.355 5.436 1.00 60.34 H new ATOM 0 HH2 TRP A 149 3.933 -1.306 7.631 1.00 73.01 H new ATOM 2147 N SER A 150 3.374 -11.267 5.360 1.00 14.34 N ATOM 2148 CA SER A 150 2.907 -12.238 4.355 1.00 43.14 C ATOM 2149 C SER A 150 2.896 -13.686 4.875 1.00 20.25 C ATOM 2150 O SER A 150 2.851 -14.629 4.074 1.00 0.04 O ATOM 2151 CB SER A 150 3.701 -12.091 3.039 1.00 31.11 C ATOM 2152 OG SER A 150 3.003 -12.591 1.895 1.00 61.54 O ATOM 0 H SER A 150 3.980 -11.666 6.077 1.00 14.34 H new ATOM 0 HA SER A 150 1.864 -12.002 4.143 1.00 43.14 H new ATOM 0 HB2 SER A 150 3.936 -11.038 2.881 1.00 31.11 H new ATOM 0 HB3 SER A 150 4.650 -12.618 3.135 1.00 31.11 H new ATOM 0 HG SER A 150 2.656 -13.487 2.089 1.00 61.54 H new ATOM 2157 N LYS A 151 2.956 -13.891 6.196 1.00 62.51 N ATOM 2158 CA LYS A 151 2.907 -15.227 6.782 1.00 34.34 C ATOM 2159 C LYS A 151 1.551 -15.873 6.547 1.00 53.30 C ATOM 2160 O LYS A 151 1.543 -17.124 6.495 1.00 15.13 O ATOM 2161 CB LYS A 151 3.344 -15.197 8.253 1.00 33.41 C ATOM 2162 CG LYS A 151 4.883 -15.269 8.300 1.00 23.15 C ATOM 2163 CD LYS A 151 5.500 -14.881 9.646 1.00 45.32 C ATOM 2164 CE LYS A 151 5.179 -15.851 10.771 1.00 43.01 C ATOM 2165 NZ LYS A 151 5.882 -15.473 12.011 1.00 25.14 N ATOM 0 H LYS A 151 3.039 -13.139 6.880 1.00 62.51 H new ATOM 0 HA LYS A 151 3.629 -15.868 6.276 1.00 34.34 H new ATOM 0 HB2 LYS A 151 2.991 -14.286 8.736 1.00 33.41 H new ATOM 0 HB3 LYS A 151 2.908 -16.035 8.796 1.00 33.41 H new ATOM 0 HG2 LYS A 151 5.194 -16.284 8.052 1.00 23.15 H new ATOM 0 HG3 LYS A 151 5.288 -14.615 7.528 1.00 23.15 H new ATOM 0 HD2 LYS A 151 6.582 -14.815 9.533 1.00 45.32 H new ATOM 0 HD3 LYS A 151 5.147 -13.888 9.924 1.00 45.32 H new ATOM 0 HE2 LYS A 151 4.104 -15.865 10.948 1.00 43.01 H new ATOM 0 HE3 LYS A 151 5.467 -16.861 10.479 1.00 43.01 H new ATOM 0 HZ1 LYS A 151 5.646 -16.151 12.764 1.00 25.14 H new ATOM 0 HZ2 LYS A 151 6.909 -15.483 11.845 1.00 25.14 H new ATOM 0 HZ3 LYS A 151 5.587 -14.518 12.300 1.00 25.14 H new TER 2175 LYS A 151