USER MOD reduce.3.24.130724 H: found=0, std=0, add=828, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 828 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: B 6 LYS NZ :NH3+ 170:sc= 0 (180deg=0) USER MOD Set 1.2: B 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 2.1: B 1 MET CE :methyl -165:sc= -0.483 (180deg=-0.887) USER MOD Set 2.2: B 19 SER OG : rot 180:sc= 0 USER MOD Set 3.1: B 7 THR OG1 : rot 111:sc= 1.05 USER MOD Set 3.2: B 9 THR OG1 : rot 180:sc= 0.904 USER MOD Set 4.1: A 33 SER OG : rot -61:sc= 0.157 USER MOD Set 4.2: B 55 THR OG1 : rot 117:sc= 0.776 USER MOD Set 4.3: B 57 SER OG : rot 180:sc= 0.688 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 111:sc= 0.0804 USER MOD Single : A 18 THR OG1 : rot -77:sc= 1.26 USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= -0.141 K(o=-0.14,f=-0.88) USER MOD Single : A 28 THR OG1 : rot -16:sc= 1.1 USER MOD Single : A 29 ASN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 31 MET CE :methyl 167:sc= 0 (180deg=-0.285) USER MOD Single : A 32 CYS SG : rot -140:sc= 0.353 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 HIS : no HD1:sc= -4.02 K(o=-4,f=-1.8) USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 GLN : amide:sc= -0.134 K(o=-0.13,f=-1.9!) USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 ASN : amide:sc= -0.459 K(o=-0.46,f=-1.5!) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : B 1 MET N :NH3+ 179:sc= 1.6 (180deg=1.6) USER MOD Single : B 2 GLN : amide:sc= -2.12 K(o=-2.1,f=0) USER MOD Single : B 11 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00367) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 THR OG1 : rot -77:sc= 0.0776 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0.236 USER MOD Single : B 25 ASN : amide:sc= -4.17! K(o=-4.2!,f=-0.14) USER MOD Single : B 27 LYS NZ :NH3+ -168:sc= 0.631 (180deg=0.573) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 GLN : amide:sc= -0.712 X(o=-0.71,f=-1) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 GLN : amide:sc= -1.7! K(o=-1.7!,f=-0.1) USER MOD Single : B 41 GLN : amide:sc= -2.1! C(o=-2.1!,f=-4!) USER MOD Single : B 48 LYS NZ :NH3+ -155:sc= -1.27 (180deg=-1.77!) USER MOD Single : B 49 GLN : amide:sc= -0.141 K(o=-0.14,f=-3.8!) USER MOD Single : B 59 TYR OH : rot 130:sc= 0.132 USER MOD Single : B 60 ASN : amide:sc= -0.119 K(o=-0.12,f=-1.4!) USER MOD Single : B 62 GLN : amide:sc= -0.764 K(o=-0.76,f=0) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 SER OG : rot 89:sc= 0.571 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 12 7.226 -11.210 -0.548 1.00 10.00 N ATOM 2 CA GLY A 12 8.658 -11.064 -0.780 1.00 10.00 C ATOM 3 C GLY A 12 8.987 -9.857 -1.649 1.00 10.00 C ATOM 4 O GLY A 12 9.060 -8.742 -1.132 1.00 10.00 O ATOM 0 HA2 GLY A 12 9.170 -10.969 0.177 1.00 10.00 H new ATOM 0 HA3 GLY A 12 9.040 -11.967 -1.258 1.00 10.00 H new ATOM 8 N PRO A 13 9.191 -10.040 -2.976 1.00 10.00 N ATOM 9 CA PRO A 13 9.512 -8.924 -3.871 1.00 10.00 C ATOM 10 C PRO A 13 8.322 -7.985 -4.068 1.00 10.00 C ATOM 11 O PRO A 13 7.640 -8.034 -5.096 1.00 10.00 O ATOM 12 CB PRO A 13 9.914 -9.607 -5.187 1.00 10.00 C ATOM 13 CG PRO A 13 9.269 -10.955 -5.149 1.00 10.00 C ATOM 14 CD PRO A 13 9.132 -11.334 -3.690 1.00 10.00 C ATOM 0 HA PRO A 13 10.301 -8.289 -3.469 1.00 10.00 H new ATOM 0 HB2 PRO A 13 9.572 -9.032 -6.048 1.00 10.00 H new ATOM 0 HB3 PRO A 13 10.997 -9.692 -5.270 1.00 10.00 H new ATOM 0 HG2 PRO A 13 8.294 -10.931 -5.635 1.00 10.00 H new ATOM 0 HG3 PRO A 13 9.873 -11.688 -5.684 1.00 10.00 H new ATOM 0 HD2 PRO A 13 8.192 -11.853 -3.499 1.00 10.00 H new ATOM 0 HD3 PRO A 13 9.934 -12.001 -3.374 1.00 10.00 H new ATOM 22 N MET A 14 8.086 -7.123 -3.073 1.00 10.00 N ATOM 23 CA MET A 14 6.980 -6.170 -3.130 1.00 10.00 C ATOM 24 C MET A 14 7.281 -5.065 -4.144 1.00 10.00 C ATOM 25 O MET A 14 7.742 -3.979 -3.784 1.00 10.00 O ATOM 26 CB MET A 14 6.728 -5.567 -1.739 1.00 10.00 C ATOM 27 CG MET A 14 5.934 -6.561 -0.887 1.00 10.00 C ATOM 28 SD MET A 14 4.217 -6.618 -1.464 1.00 10.00 S ATOM 29 CE MET A 14 3.432 -6.831 0.150 1.00 10.00 C ATOM 0 H MET A 14 8.646 -7.068 -2.222 1.00 10.00 H new ATOM 0 HA MET A 14 6.081 -6.696 -3.450 1.00 10.00 H new ATOM 0 HB2 MET A 14 7.676 -5.333 -1.255 1.00 10.00 H new ATOM 0 HB3 MET A 14 6.178 -4.630 -1.831 1.00 10.00 H new ATOM 0 HG2 MET A 14 6.383 -7.552 -0.952 1.00 10.00 H new ATOM 0 HG3 MET A 14 5.967 -6.264 0.161 1.00 10.00 H new ATOM 0 HE1 MET A 14 2.351 -6.890 0.024 1.00 10.00 H new ATOM 0 HE2 MET A 14 3.794 -7.749 0.613 1.00 10.00 H new ATOM 0 HE3 MET A 14 3.677 -5.982 0.788 1.00 10.00 H new ATOM 39 N LEU A 15 7.023 -5.362 -5.423 1.00 10.00 N ATOM 40 CA LEU A 15 7.272 -4.403 -6.498 1.00 10.00 C ATOM 41 C LEU A 15 6.201 -3.310 -6.494 1.00 10.00 C ATOM 42 O LEU A 15 5.043 -3.573 -6.172 1.00 10.00 O ATOM 43 CB LEU A 15 7.285 -5.143 -7.857 1.00 10.00 C ATOM 44 CG LEU A 15 8.615 -4.908 -8.595 1.00 10.00 C ATOM 45 CD1 LEU A 15 9.772 -5.533 -7.808 1.00 10.00 C ATOM 46 CD2 LEU A 15 8.539 -5.555 -9.980 1.00 10.00 C ATOM 0 H LEU A 15 6.643 -6.256 -5.735 1.00 10.00 H new ATOM 0 HA LEU A 15 8.242 -3.931 -6.340 1.00 10.00 H new ATOM 0 HB2 LEU A 15 7.137 -6.211 -7.696 1.00 10.00 H new ATOM 0 HB3 LEU A 15 6.456 -4.796 -8.473 1.00 10.00 H new ATOM 0 HG LEU A 15 8.788 -3.836 -8.691 1.00 10.00 H new ATOM 0 HD11 LEU A 15 10.708 -5.361 -8.339 1.00 10.00 H new ATOM 0 HD12 LEU A 15 9.827 -5.078 -6.819 1.00 10.00 H new ATOM 0 HD13 LEU A 15 9.605 -6.605 -7.705 1.00 10.00 H new ATOM 0 HD21 LEU A 15 9.478 -5.393 -10.509 1.00 10.00 H new ATOM 0 HD22 LEU A 15 8.363 -6.625 -9.872 1.00 10.00 H new ATOM 0 HD23 LEU A 15 7.722 -5.108 -10.546 1.00 10.00 H new ATOM 58 N CYS A 16 6.607 -2.078 -6.832 1.00 10.00 N ATOM 59 CA CYS A 16 5.695 -0.917 -6.847 1.00 10.00 C ATOM 60 C CYS A 16 4.330 -1.212 -7.493 1.00 10.00 C ATOM 61 O CYS A 16 4.248 -1.797 -8.573 1.00 10.00 O ATOM 62 CB CYS A 16 6.355 0.249 -7.585 1.00 10.00 C ATOM 63 SG CYS A 16 5.521 1.790 -7.130 1.00 10.00 S ATOM 0 H CYS A 16 7.566 -1.855 -7.101 1.00 10.00 H new ATOM 0 HA CYS A 16 5.505 -0.665 -5.804 1.00 10.00 H new ATOM 0 HB2 CYS A 16 7.413 0.305 -7.329 1.00 10.00 H new ATOM 0 HB3 CYS A 16 6.295 0.094 -8.662 1.00 10.00 H new ATOM 68 N SER A 17 3.270 -0.797 -6.793 1.00 10.00 N ATOM 69 CA SER A 17 1.901 -1.008 -7.264 1.00 10.00 C ATOM 70 C SER A 17 1.623 -0.220 -8.546 1.00 10.00 C ATOM 71 O SER A 17 0.848 -0.667 -9.395 1.00 10.00 O ATOM 72 CB SER A 17 0.906 -0.587 -6.179 1.00 10.00 C ATOM 73 OG SER A 17 1.166 -1.326 -4.995 1.00 10.00 O ATOM 0 H SER A 17 3.335 -0.313 -5.898 1.00 10.00 H new ATOM 0 HA SER A 17 1.783 -2.069 -7.483 1.00 10.00 H new ATOM 0 HB2 SER A 17 0.995 0.481 -5.982 1.00 10.00 H new ATOM 0 HB3 SER A 17 -0.115 -0.765 -6.516 1.00 10.00 H new ATOM 0 HG SER A 17 1.522 -0.726 -4.306 1.00 10.00 H new ATOM 79 N THR A 18 2.251 0.952 -8.681 1.00 10.00 N ATOM 80 CA THR A 18 2.048 1.789 -9.866 1.00 10.00 C ATOM 81 C THR A 18 2.733 1.207 -11.117 1.00 10.00 C ATOM 82 O THR A 18 2.441 1.646 -12.231 1.00 10.00 O ATOM 83 CB THR A 18 2.562 3.207 -9.607 1.00 10.00 C ATOM 84 OG1 THR A 18 3.936 3.157 -9.261 1.00 10.00 O ATOM 85 CG2 THR A 18 1.766 3.846 -8.465 1.00 10.00 C ATOM 0 H THR A 18 2.897 1.339 -7.993 1.00 10.00 H new ATOM 0 HA THR A 18 0.976 1.815 -10.060 1.00 10.00 H new ATOM 0 HB THR A 18 2.437 3.806 -10.509 1.00 10.00 H new ATOM 0 HG1 THR A 18 4.028 2.867 -8.329 1.00 10.00 H new ATOM 0 HG21 THR A 18 2.136 4.855 -8.284 1.00 10.00 H new ATOM 0 HG22 THR A 18 0.711 3.889 -8.736 1.00 10.00 H new ATOM 0 HG23 THR A 18 1.884 3.249 -7.561 1.00 10.00 H new ATOM 93 N GLY A 19 3.625 0.219 -10.940 1.00 10.00 N ATOM 94 CA GLY A 19 4.310 -0.400 -12.078 1.00 10.00 C ATOM 95 C GLY A 19 5.399 0.506 -12.643 1.00 10.00 C ATOM 96 O GLY A 19 5.521 0.644 -13.862 1.00 10.00 O ATOM 0 H GLY A 19 3.884 -0.162 -10.030 1.00 10.00 H new ATOM 0 HA2 GLY A 19 4.750 -1.347 -11.766 1.00 10.00 H new ATOM 0 HA3 GLY A 19 3.585 -0.628 -12.859 1.00 10.00 H new ATOM 100 N CYS A 20 6.191 1.116 -11.764 1.00 10.00 N ATOM 101 CA CYS A 20 7.261 2.013 -12.200 1.00 10.00 C ATOM 102 C CYS A 20 8.546 1.241 -12.568 1.00 10.00 C ATOM 103 O CYS A 20 9.453 1.808 -13.176 1.00 10.00 O ATOM 104 CB CYS A 20 7.545 3.066 -11.115 1.00 10.00 C ATOM 105 SG CYS A 20 8.308 2.379 -9.635 1.00 10.00 S ATOM 0 H CYS A 20 6.114 1.008 -10.753 1.00 10.00 H new ATOM 0 HA CYS A 20 6.923 2.520 -13.104 1.00 10.00 H new ATOM 0 HB2 CYS A 20 8.198 3.835 -11.528 1.00 10.00 H new ATOM 0 HB3 CYS A 20 6.610 3.555 -10.840 1.00 10.00 H new ATOM 110 N GLY A 21 8.623 -0.053 -12.200 1.00 10.00 N ATOM 111 CA GLY A 21 9.802 -0.867 -12.527 1.00 10.00 C ATOM 112 C GLY A 21 10.827 -0.938 -11.385 1.00 10.00 C ATOM 113 O GLY A 21 11.899 -1.517 -11.561 1.00 10.00 O ATOM 0 H GLY A 21 7.894 -0.547 -11.685 1.00 10.00 H new ATOM 0 HA2 GLY A 21 9.479 -1.877 -12.779 1.00 10.00 H new ATOM 0 HA3 GLY A 21 10.284 -0.456 -13.414 1.00 10.00 H new ATOM 117 N PHE A 22 10.500 -0.357 -10.227 1.00 10.00 N ATOM 118 CA PHE A 22 11.408 -0.364 -9.079 1.00 10.00 C ATOM 119 C PHE A 22 10.815 -1.140 -7.915 1.00 10.00 C ATOM 120 O PHE A 22 9.655 -1.543 -7.964 1.00 10.00 O ATOM 121 CB PHE A 22 11.729 1.076 -8.678 1.00 10.00 C ATOM 122 CG PHE A 22 12.618 1.728 -9.702 1.00 10.00 C ATOM 123 CD1 PHE A 22 13.999 1.611 -9.599 1.00 10.00 C ATOM 124 CD2 PHE A 22 12.081 2.414 -10.783 1.00 10.00 C ATOM 125 CE1 PHE A 22 14.832 2.171 -10.553 1.00 10.00 C ATOM 126 CE2 PHE A 22 12.910 2.982 -11.740 1.00 10.00 C ATOM 127 CZ PHE A 22 14.289 2.859 -11.625 1.00 10.00 C ATOM 0 H PHE A 22 9.615 0.123 -10.061 1.00 10.00 H new ATOM 0 HA PHE A 22 12.333 -0.868 -9.361 1.00 10.00 H new ATOM 0 HB2 PHE A 22 10.805 1.645 -8.576 1.00 10.00 H new ATOM 0 HB3 PHE A 22 12.219 1.087 -7.704 1.00 10.00 H new ATOM 0 HD1 PHE A 22 14.428 1.077 -8.764 1.00 10.00 H new ATOM 0 HD2 PHE A 22 11.009 2.506 -10.880 1.00 10.00 H new ATOM 0 HE1 PHE A 22 15.903 2.071 -10.461 1.00 10.00 H new ATOM 0 HE2 PHE A 22 12.483 3.519 -12.574 1.00 10.00 H new ATOM 0 HZ PHE A 22 14.936 3.299 -12.370 1.00 10.00 H new ATOM 137 N TYR A 23 11.618 -1.351 -6.874 1.00 10.00 N ATOM 138 CA TYR A 23 11.168 -2.089 -5.703 1.00 10.00 C ATOM 139 C TYR A 23 10.408 -1.186 -4.732 1.00 10.00 C ATOM 140 O TYR A 23 10.497 0.033 -4.813 1.00 10.00 O ATOM 141 CB TYR A 23 12.358 -2.730 -4.990 1.00 10.00 C ATOM 142 CG TYR A 23 12.583 -4.158 -5.421 1.00 10.00 C ATOM 143 CD1 TYR A 23 12.888 -4.443 -6.743 1.00 10.00 C ATOM 144 CD2 TYR A 23 12.467 -5.214 -4.523 1.00 10.00 C ATOM 145 CE1 TYR A 23 13.080 -5.744 -7.169 1.00 10.00 C ATOM 146 CE2 TYR A 23 12.655 -6.522 -4.939 1.00 10.00 C ATOM 147 CZ TYR A 23 12.963 -6.782 -6.266 1.00 10.00 C ATOM 148 OH TYR A 23 13.156 -8.085 -6.682 1.00 10.00 O ATOM 0 H TYR A 23 12.582 -1.021 -6.821 1.00 10.00 H new ATOM 0 HA TYR A 23 10.488 -2.870 -6.045 1.00 10.00 H new ATOM 0 HB2 TYR A 23 13.256 -2.146 -5.191 1.00 10.00 H new ATOM 0 HB3 TYR A 23 12.193 -2.700 -3.913 1.00 10.00 H new ATOM 0 HD1 TYR A 23 12.977 -3.634 -7.453 1.00 10.00 H new ATOM 0 HD2 TYR A 23 12.228 -5.012 -3.489 1.00 10.00 H new ATOM 0 HE1 TYR A 23 13.320 -5.947 -8.202 1.00 10.00 H new ATOM 0 HE2 TYR A 23 12.562 -7.335 -4.234 1.00 10.00 H new ATOM 0 HH TYR A 23 13.038 -8.692 -5.922 1.00 10.00 H new ATOM 158 N GLY A 24 9.656 -1.805 -3.815 1.00 10.00 N ATOM 159 CA GLY A 24 8.889 -1.056 -2.828 1.00 10.00 C ATOM 160 C GLY A 24 9.139 -1.560 -1.420 1.00 10.00 C ATOM 161 O GLY A 24 9.231 -2.768 -1.197 1.00 10.00 O ATOM 0 H GLY A 24 9.566 -2.818 -3.740 1.00 10.00 H new ATOM 0 HA2 GLY A 24 9.152 0.000 -2.888 1.00 10.00 H new ATOM 0 HA3 GLY A 24 7.826 -1.133 -3.058 1.00 10.00 H new ATOM 165 N ASN A 25 9.253 -0.640 -0.464 1.00 10.00 N ATOM 166 CA ASN A 25 9.495 -1.009 0.926 1.00 10.00 C ATOM 167 C ASN A 25 8.241 -1.622 1.551 1.00 10.00 C ATOM 168 O ASN A 25 7.187 -1.007 1.555 1.00 10.00 O ATOM 169 CB ASN A 25 9.895 0.217 1.745 1.00 10.00 C ATOM 170 CG ASN A 25 11.307 0.082 2.307 1.00 10.00 C ATOM 171 OD1 ASN A 25 12.170 -0.528 1.689 1.00 10.00 O ATOM 172 ND2 ASN A 25 11.567 0.654 3.478 1.00 10.00 N ATOM 0 H ASN A 25 9.182 0.364 -0.628 1.00 10.00 H new ATOM 0 HA ASN A 25 10.303 -1.740 0.935 1.00 10.00 H new ATOM 0 HB2 ASN A 25 9.835 1.108 1.120 1.00 10.00 H new ATOM 0 HB3 ASN A 25 9.189 0.354 2.564 1.00 10.00 H new ATOM 0 HD21 ASN A 25 12.502 0.590 3.880 1.00 10.00 H new ATOM 0 HD22 ASN A 25 10.831 1.157 3.974 1.00 10.00 H new ATOM 179 N PRO A 26 8.308 -2.852 2.096 1.00 10.00 N ATOM 180 CA PRO A 26 7.116 -3.497 2.735 1.00 10.00 C ATOM 181 C PRO A 26 6.684 -2.773 4.015 1.00 10.00 C ATOM 182 O PRO A 26 5.536 -2.910 4.446 1.00 10.00 O ATOM 183 CB PRO A 26 7.576 -4.920 3.025 1.00 10.00 C ATOM 184 CG PRO A 26 9.059 -4.833 3.134 1.00 10.00 C ATOM 185 CD PRO A 26 9.489 -3.742 2.159 1.00 10.00 C ATOM 0 HA PRO A 26 6.238 -3.463 2.090 1.00 10.00 H new ATOM 0 HB2 PRO A 26 7.134 -5.297 3.947 1.00 10.00 H new ATOM 0 HB3 PRO A 26 7.278 -5.601 2.228 1.00 10.00 H new ATOM 0 HG2 PRO A 26 9.362 -4.588 4.152 1.00 10.00 H new ATOM 0 HG3 PRO A 26 9.525 -5.786 2.884 1.00 10.00 H new ATOM 0 HD2 PRO A 26 10.373 -3.212 2.514 1.00 10.00 H new ATOM 0 HD3 PRO A 26 9.735 -4.153 1.180 1.00 10.00 H new ATOM 193 N ARG A 27 7.584 -1.968 4.598 1.00 10.00 N ATOM 194 CA ARG A 27 7.254 -1.194 5.798 1.00 10.00 C ATOM 195 C ARG A 27 6.374 0.004 5.416 1.00 10.00 C ATOM 196 O ARG A 27 5.506 0.418 6.187 1.00 10.00 O ATOM 197 CB ARG A 27 8.531 -0.681 6.468 1.00 10.00 C ATOM 198 CG ARG A 27 9.252 -1.837 7.164 1.00 10.00 C ATOM 199 CD ARG A 27 10.446 -1.294 7.960 1.00 10.00 C ATOM 200 NE ARG A 27 10.011 -0.834 9.288 1.00 10.00 N ATOM 201 CZ ARG A 27 10.848 -0.255 10.171 1.00 10.00 C ATOM 202 NH1 ARG A 27 12.128 -0.096 9.917 1.00 10.00 N ATOM 203 NH2 ARG A 27 10.377 0.156 11.317 1.00 10.00 N ATOM 0 H ARG A 27 8.537 -1.838 4.260 1.00 10.00 H new ATOM 0 HA ARG A 27 6.718 -1.842 6.492 1.00 10.00 H new ATOM 0 HB2 ARG A 27 9.186 -0.227 5.724 1.00 10.00 H new ATOM 0 HB3 ARG A 27 8.286 0.095 7.193 1.00 10.00 H new ATOM 0 HG2 ARG A 27 8.565 -2.359 7.830 1.00 10.00 H new ATOM 0 HG3 ARG A 27 9.594 -2.563 6.426 1.00 10.00 H new ATOM 0 HD2 ARG A 27 11.203 -2.071 8.067 1.00 10.00 H new ATOM 0 HD3 ARG A 27 10.909 -0.470 7.417 1.00 10.00 H new ATOM 0 HE ARG A 27 9.034 -0.959 9.552 1.00 10.00 H new ATOM 0 HH11 ARG A 27 12.515 -0.415 9.029 1.00 10.00 H new ATOM 0 HH12 ARG A 27 12.734 0.347 10.608 1.00 10.00 H new ATOM 0 HH21 ARG A 27 9.387 0.037 11.534 1.00 10.00 H new ATOM 0 HH22 ARG A 27 10.999 0.596 11.996 1.00 10.00 H new ATOM 217 N THR A 28 6.593 0.529 4.201 1.00 10.00 N ATOM 218 CA THR A 28 5.805 1.648 3.697 1.00 10.00 C ATOM 219 C THR A 28 4.453 1.099 3.196 1.00 10.00 C ATOM 220 O THR A 28 4.001 0.061 3.685 1.00 10.00 O ATOM 221 CB THR A 28 6.585 2.375 2.578 1.00 10.00 C ATOM 222 OG1 THR A 28 6.762 1.493 1.480 1.00 10.00 O ATOM 223 CG2 THR A 28 7.956 2.833 3.091 1.00 10.00 C ATOM 0 H THR A 28 7.308 0.193 3.556 1.00 10.00 H new ATOM 0 HA THR A 28 5.616 2.378 4.484 1.00 10.00 H new ATOM 0 HB THR A 28 6.017 3.251 2.263 1.00 10.00 H new ATOM 0 HG1 THR A 28 6.593 0.572 1.770 1.00 10.00 H new ATOM 0 HG21 THR A 28 8.492 3.343 2.291 1.00 10.00 H new ATOM 0 HG22 THR A 28 7.821 3.516 3.930 1.00 10.00 H new ATOM 0 HG23 THR A 28 8.530 1.966 3.418 1.00 10.00 H new ATOM 231 N ASN A 29 3.809 1.779 2.241 1.00 10.00 N ATOM 232 CA ASN A 29 2.520 1.329 1.713 1.00 10.00 C ATOM 233 C ASN A 29 2.687 0.387 0.507 1.00 10.00 C ATOM 234 O ASN A 29 1.801 0.315 -0.348 1.00 10.00 O ATOM 235 CB ASN A 29 1.695 2.554 1.304 1.00 10.00 C ATOM 236 CG ASN A 29 1.024 3.158 2.533 1.00 10.00 C ATOM 237 OD1 ASN A 29 1.685 3.409 3.539 1.00 10.00 O ATOM 238 ND2 ASN A 29 -0.254 3.405 2.515 1.00 10.00 N ATOM 0 H ASN A 29 4.159 2.640 1.820 1.00 10.00 H new ATOM 0 HA ASN A 29 2.009 0.768 2.495 1.00 10.00 H new ATOM 0 HB2 ASN A 29 2.338 3.295 0.828 1.00 10.00 H new ATOM 0 HB3 ASN A 29 0.941 2.268 0.570 1.00 10.00 H new ATOM 0 HD21 ASN A 29 -0.707 3.807 3.336 1.00 10.00 H new ATOM 0 HD22 ASN A 29 -0.802 3.197 1.680 1.00 10.00 H new ATOM 245 N GLY A 30 3.824 -0.321 0.428 1.00 10.00 N ATOM 246 CA GLY A 30 4.081 -1.224 -0.695 1.00 10.00 C ATOM 247 C GLY A 30 4.683 -0.469 -1.889 1.00 10.00 C ATOM 248 O GLY A 30 4.763 -1.019 -2.990 1.00 10.00 O ATOM 0 H GLY A 30 4.570 -0.284 1.122 1.00 10.00 H new ATOM 0 HA2 GLY A 30 4.762 -2.015 -0.381 1.00 10.00 H new ATOM 0 HA3 GLY A 30 3.151 -1.706 -0.998 1.00 10.00 H new ATOM 252 N MET A 31 5.086 0.800 -1.678 1.00 10.00 N ATOM 253 CA MET A 31 5.648 1.615 -2.747 1.00 10.00 C ATOM 254 C MET A 31 7.057 2.095 -2.395 1.00 10.00 C ATOM 255 O MET A 31 7.456 2.086 -1.229 1.00 10.00 O ATOM 256 CB MET A 31 4.747 2.830 -2.979 1.00 10.00 C ATOM 257 CG MET A 31 3.613 2.471 -3.938 1.00 10.00 C ATOM 258 SD MET A 31 2.371 1.469 -3.083 1.00 10.00 S ATOM 259 CE MET A 31 0.904 2.334 -3.705 1.00 10.00 C ATOM 0 H MET A 31 5.029 1.272 -0.776 1.00 10.00 H new ATOM 0 HA MET A 31 5.707 1.006 -3.649 1.00 10.00 H new ATOM 0 HB2 MET A 31 4.335 3.173 -2.030 1.00 10.00 H new ATOM 0 HB3 MET A 31 5.333 3.653 -3.389 1.00 10.00 H new ATOM 0 HG2 MET A 31 3.154 3.380 -4.327 1.00 10.00 H new ATOM 0 HG3 MET A 31 4.009 1.923 -4.793 1.00 10.00 H new ATOM 0 HE1 MET A 31 0.014 1.743 -3.489 1.00 10.00 H new ATOM 0 HE2 MET A 31 0.821 3.306 -3.218 1.00 10.00 H new ATOM 0 HE3 MET A 31 0.994 2.474 -4.782 1.00 10.00 H new ATOM 269 N CYS A 32 7.797 2.511 -3.418 1.00 10.00 N ATOM 270 CA CYS A 32 9.156 3.004 -3.237 1.00 10.00 C ATOM 271 C CYS A 32 9.126 4.376 -2.543 1.00 10.00 C ATOM 272 O CYS A 32 8.054 4.895 -2.250 1.00 10.00 O ATOM 273 CB CYS A 32 9.864 3.060 -4.603 1.00 10.00 C ATOM 274 SG CYS A 32 8.966 4.022 -5.832 1.00 10.00 S ATOM 0 H CYS A 32 7.475 2.516 -4.386 1.00 10.00 H new ATOM 0 HA CYS A 32 9.720 2.328 -2.595 1.00 10.00 H new ATOM 0 HB2 CYS A 32 10.858 3.488 -4.472 1.00 10.00 H new ATOM 0 HB3 CYS A 32 10.001 2.045 -4.975 1.00 10.00 H new ATOM 0 HG CYS A 32 9.038 3.427 -6.986 1.00 10.00 H new ATOM 279 N SER A 33 10.288 4.961 -2.272 1.00 10.00 N ATOM 280 CA SER A 33 10.352 6.261 -1.583 1.00 10.00 C ATOM 281 C SER A 33 9.847 7.421 -2.444 1.00 10.00 C ATOM 282 O SER A 33 9.359 8.425 -1.920 1.00 10.00 O ATOM 283 CB SER A 33 11.791 6.548 -1.145 1.00 10.00 C ATOM 284 OG SER A 33 12.591 6.836 -2.257 1.00 10.00 O ATOM 0 H SER A 33 11.197 4.565 -2.514 1.00 10.00 H new ATOM 0 HA SER A 33 9.694 6.188 -0.717 1.00 10.00 H new ATOM 0 HB2 SER A 33 11.806 7.388 -0.451 1.00 10.00 H new ATOM 0 HB3 SER A 33 12.194 5.687 -0.612 1.00 10.00 H new ATOM 0 HG SER A 33 12.600 6.065 -2.862 1.00 10.00 H new ATOM 290 N VAL A 34 9.956 7.276 -3.761 1.00 10.00 N ATOM 291 CA VAL A 34 9.545 8.323 -4.694 1.00 10.00 C ATOM 292 C VAL A 34 8.019 8.431 -4.830 1.00 10.00 C ATOM 293 O VAL A 34 7.465 9.530 -4.788 1.00 10.00 O ATOM 294 CB VAL A 34 10.168 8.090 -6.087 1.00 10.00 C ATOM 295 CG1 VAL A 34 9.820 9.244 -7.023 1.00 10.00 C ATOM 296 CG2 VAL A 34 11.686 7.937 -5.980 1.00 10.00 C ATOM 0 H VAL A 34 10.328 6.439 -4.210 1.00 10.00 H new ATOM 0 HA VAL A 34 9.909 9.263 -4.278 1.00 10.00 H new ATOM 0 HB VAL A 34 9.756 7.168 -6.497 1.00 10.00 H new ATOM 0 HG11 VAL A 34 10.266 9.066 -8.002 1.00 10.00 H new ATOM 0 HG12 VAL A 34 8.737 9.316 -7.125 1.00 10.00 H new ATOM 0 HG13 VAL A 34 10.208 10.176 -6.612 1.00 10.00 H new ATOM 0 HG21 VAL A 34 12.106 7.774 -6.972 1.00 10.00 H new ATOM 0 HG22 VAL A 34 12.114 8.843 -5.550 1.00 10.00 H new ATOM 0 HG23 VAL A 34 11.922 7.086 -5.342 1.00 10.00 H new ATOM 306 N CYS A 35 7.354 7.294 -4.979 1.00 10.00 N ATOM 307 CA CYS A 35 5.898 7.253 -5.134 1.00 10.00 C ATOM 308 C CYS A 35 5.161 7.382 -3.802 1.00 10.00 C ATOM 309 O CYS A 35 4.018 7.839 -3.768 1.00 10.00 O ATOM 310 CB CYS A 35 5.504 5.955 -5.826 1.00 10.00 C ATOM 311 SG CYS A 35 6.190 5.834 -7.488 1.00 10.00 S ATOM 0 H CYS A 35 7.800 6.377 -4.996 1.00 10.00 H new ATOM 0 HA CYS A 35 5.605 8.110 -5.740 1.00 10.00 H new ATOM 0 HB2 CYS A 35 5.848 5.109 -5.231 1.00 10.00 H new ATOM 0 HB3 CYS A 35 4.417 5.888 -5.878 1.00 10.00 H new ATOM 316 N TYR A 36 5.829 7.005 -2.713 1.00 10.00 N ATOM 317 CA TYR A 36 5.228 7.069 -1.372 1.00 10.00 C ATOM 318 C TYR A 36 4.808 8.498 -0.990 1.00 10.00 C ATOM 319 O TYR A 36 3.686 8.705 -0.528 1.00 10.00 O ATOM 320 CB TYR A 36 6.217 6.490 -0.333 1.00 10.00 C ATOM 321 CG TYR A 36 5.660 6.530 1.088 1.00 10.00 C ATOM 322 CD1 TYR A 36 4.323 6.182 1.352 1.00 10.00 C ATOM 323 CD2 TYR A 36 6.499 6.904 2.143 1.00 10.00 C ATOM 324 CE1 TYR A 36 3.836 6.212 2.664 1.00 10.00 C ATOM 325 CE2 TYR A 36 6.011 6.936 3.454 1.00 10.00 C ATOM 326 CZ TYR A 36 4.681 6.590 3.717 1.00 10.00 C ATOM 327 OH TYR A 36 4.202 6.617 5.009 1.00 10.00 O ATOM 0 H TYR A 36 6.786 6.652 -2.728 1.00 10.00 H new ATOM 0 HA TYR A 36 4.318 6.468 -1.382 1.00 10.00 H new ATOM 0 HB2 TYR A 36 6.456 5.460 -0.598 1.00 10.00 H new ATOM 0 HB3 TYR A 36 7.150 7.053 -0.370 1.00 10.00 H new ATOM 0 HD1 TYR A 36 3.671 5.891 0.541 1.00 10.00 H new ATOM 0 HD2 TYR A 36 7.527 7.169 1.945 1.00 10.00 H new ATOM 0 HE1 TYR A 36 2.809 5.944 2.865 1.00 10.00 H new ATOM 0 HE2 TYR A 36 6.662 7.228 4.264 1.00 10.00 H new ATOM 0 HH TYR A 36 4.917 6.899 5.617 1.00 10.00 H new ATOM 337 N LYS A 37 5.705 9.465 -1.181 1.00 10.00 N ATOM 338 CA LYS A 37 5.395 10.853 -0.836 1.00 10.00 C ATOM 339 C LYS A 37 4.399 11.431 -1.837 1.00 10.00 C ATOM 340 O LYS A 37 3.450 12.118 -1.456 1.00 10.00 O ATOM 341 CB LYS A 37 6.672 11.713 -0.774 1.00 10.00 C ATOM 342 CG LYS A 37 7.398 11.729 -2.124 1.00 10.00 C ATOM 343 CD LYS A 37 8.672 12.565 -2.010 1.00 10.00 C ATOM 344 CE LYS A 37 9.232 12.828 -3.408 1.00 10.00 C ATOM 345 NZ LYS A 37 10.620 13.357 -3.293 1.00 10.00 N ATOM 0 H LYS A 37 6.638 9.318 -1.566 1.00 10.00 H new ATOM 0 HA LYS A 37 4.943 10.866 0.156 1.00 10.00 H new ATOM 0 HB2 LYS A 37 6.413 12.732 -0.486 1.00 10.00 H new ATOM 0 HB3 LYS A 37 7.339 11.323 -0.005 1.00 10.00 H new ATOM 0 HG2 LYS A 37 7.644 10.712 -2.428 1.00 10.00 H new ATOM 0 HG3 LYS A 37 6.747 12.143 -2.894 1.00 10.00 H new ATOM 0 HD2 LYS A 37 8.457 13.509 -1.508 1.00 10.00 H new ATOM 0 HD3 LYS A 37 9.411 12.042 -1.403 1.00 10.00 H new ATOM 0 HE2 LYS A 37 9.229 11.908 -3.992 1.00 10.00 H new ATOM 0 HE3 LYS A 37 8.601 13.543 -3.936 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 11.003 13.537 -4.243 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 10.610 14.244 -2.750 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 11.218 12.660 -2.805 1.00 10.00 H new ATOM 359 N GLU A 38 4.641 11.161 -3.122 1.00 10.00 N ATOM 360 CA GLU A 38 3.781 11.666 -4.197 1.00 10.00 C ATOM 361 C GLU A 38 2.313 11.285 -3.989 1.00 10.00 C ATOM 362 O GLU A 38 1.421 12.094 -4.262 1.00 10.00 O ATOM 363 CB GLU A 38 4.260 11.115 -5.546 1.00 10.00 C ATOM 364 CG GLU A 38 5.458 11.931 -6.038 1.00 10.00 C ATOM 365 CD GLU A 38 4.978 13.253 -6.625 1.00 10.00 C ATOM 366 OE1 GLU A 38 4.049 13.224 -7.413 1.00 10.00 O ATOM 367 OE2 GLU A 38 5.549 14.272 -6.278 1.00 10.00 O ATOM 0 H GLU A 38 5.426 10.595 -3.444 1.00 10.00 H new ATOM 0 HA GLU A 38 3.850 12.754 -4.185 1.00 10.00 H new ATOM 0 HB2 GLU A 38 4.539 10.066 -5.443 1.00 10.00 H new ATOM 0 HB3 GLU A 38 3.452 11.160 -6.276 1.00 10.00 H new ATOM 0 HG2 GLU A 38 6.146 12.118 -5.213 1.00 10.00 H new ATOM 0 HG3 GLU A 38 6.009 11.367 -6.791 1.00 10.00 H new ATOM 374 N HIS A 39 2.061 10.056 -3.518 1.00 10.00 N ATOM 375 CA HIS A 39 0.681 9.609 -3.302 1.00 10.00 C ATOM 376 C HIS A 39 0.151 10.040 -1.926 1.00 10.00 C ATOM 377 O HIS A 39 -1.039 10.322 -1.773 1.00 10.00 O ATOM 378 CB HIS A 39 0.542 8.081 -3.546 1.00 10.00 C ATOM 379 CG HIS A 39 1.004 7.223 -2.380 1.00 10.00 C ATOM 380 ND1 HIS A 39 1.885 6.168 -2.558 1.00 10.00 N ATOM 381 CD2 HIS A 39 0.656 7.192 -1.049 1.00 10.00 C ATOM 382 CE1 HIS A 39 2.028 5.552 -1.370 1.00 10.00 C ATOM 383 NE2 HIS A 39 1.303 6.138 -0.416 1.00 10.00 N ATOM 0 H HIS A 39 2.777 9.368 -3.284 1.00 10.00 H new ATOM 0 HA HIS A 39 0.050 10.105 -4.039 1.00 10.00 H new ATOM 0 HB2 HIS A 39 -0.502 7.852 -3.761 1.00 10.00 H new ATOM 0 HB3 HIS A 39 1.117 7.811 -4.432 1.00 10.00 H new ATOM 0 HD2 HIS A 39 -0.019 7.884 -0.568 1.00 10.00 H new ATOM 0 HE1 HIS A 39 2.654 4.687 -1.209 1.00 10.00 H new ATOM 0 HE2 HIS A 39 1.238 5.870 0.566 1.00 10.00 H new ATOM 392 N LEU A 40 1.045 10.083 -0.934 1.00 10.00 N ATOM 393 CA LEU A 40 0.668 10.475 0.434 1.00 10.00 C ATOM 394 C LEU A 40 0.148 11.919 0.482 1.00 10.00 C ATOM 395 O LEU A 40 -0.692 12.252 1.319 1.00 10.00 O ATOM 396 CB LEU A 40 1.879 10.339 1.363 1.00 10.00 C ATOM 397 CG LEU A 40 1.429 10.406 2.824 1.00 10.00 C ATOM 398 CD1 LEU A 40 0.757 9.085 3.212 1.00 10.00 C ATOM 399 CD2 LEU A 40 2.648 10.647 3.725 1.00 10.00 C ATOM 0 H LEU A 40 2.032 9.853 -1.048 1.00 10.00 H new ATOM 0 HA LEU A 40 -0.133 9.813 0.764 1.00 10.00 H new ATOM 0 HB2 LEU A 40 2.388 9.394 1.174 1.00 10.00 H new ATOM 0 HB3 LEU A 40 2.596 11.134 1.158 1.00 10.00 H new ATOM 0 HG LEU A 40 0.720 11.224 2.949 1.00 10.00 H new ATOM 0 HD11 LEU A 40 0.436 9.132 4.253 1.00 10.00 H new ATOM 0 HD12 LEU A 40 -0.109 8.916 2.572 1.00 10.00 H new ATOM 0 HD13 LEU A 40 1.465 8.266 3.087 1.00 10.00 H new ATOM 0 HD21 LEU A 40 2.327 10.695 4.766 1.00 10.00 H new ATOM 0 HD22 LEU A 40 3.359 9.830 3.601 1.00 10.00 H new ATOM 0 HD23 LEU A 40 3.124 11.588 3.449 1.00 10.00 H new ATOM 411 N GLN A 41 0.659 12.761 -0.415 1.00 10.00 N ATOM 412 CA GLN A 41 0.253 14.168 -0.466 1.00 10.00 C ATOM 413 C GLN A 41 -1.219 14.311 -0.871 1.00 10.00 C ATOM 414 O GLN A 41 -1.935 15.159 -0.332 1.00 10.00 O ATOM 415 CB GLN A 41 1.147 14.920 -1.465 1.00 10.00 C ATOM 416 CG GLN A 41 2.384 15.464 -0.743 1.00 10.00 C ATOM 417 CD GLN A 41 3.326 16.122 -1.745 1.00 10.00 C ATOM 418 OE1 GLN A 41 4.166 15.448 -2.344 1.00 10.00 O ATOM 419 NE2 GLN A 41 3.236 17.405 -1.962 1.00 10.00 N ATOM 0 H GLN A 41 1.352 12.496 -1.115 1.00 10.00 H new ATOM 0 HA GLN A 41 0.368 14.596 0.530 1.00 10.00 H new ATOM 0 HB2 GLN A 41 1.449 14.252 -2.272 1.00 10.00 H new ATOM 0 HB3 GLN A 41 0.591 15.739 -1.921 1.00 10.00 H new ATOM 0 HG2 GLN A 41 2.084 16.187 0.015 1.00 10.00 H new ATOM 0 HG3 GLN A 41 2.898 14.654 -0.225 1.00 10.00 H new ATOM 0 HE21 GLN A 41 2.539 17.959 -1.464 1.00 10.00 H new ATOM 0 HE22 GLN A 41 3.862 17.854 -2.630 1.00 10.00 H new ATOM 428 N ARG A 42 -1.660 13.480 -1.818 1.00 10.00 N ATOM 429 CA ARG A 42 -3.049 13.522 -2.285 1.00 10.00 C ATOM 430 C ARG A 42 -3.985 12.809 -1.310 1.00 10.00 C ATOM 431 O ARG A 42 -5.153 13.182 -1.178 1.00 10.00 O ATOM 432 CB ARG A 42 -3.156 12.865 -3.660 1.00 10.00 C ATOM 433 CG ARG A 42 -2.503 13.769 -4.703 1.00 10.00 C ATOM 434 CD ARG A 42 -2.287 12.982 -5.996 1.00 10.00 C ATOM 435 NE ARG A 42 -1.448 13.749 -6.922 1.00 10.00 N ATOM 436 CZ ARG A 42 -1.883 14.852 -7.558 1.00 10.00 C ATOM 437 NH1 ARG A 42 -3.111 15.299 -7.418 1.00 10.00 N ATOM 438 NH2 ARG A 42 -1.067 15.490 -8.352 1.00 10.00 N ATOM 0 H ARG A 42 -1.081 12.775 -2.274 1.00 10.00 H new ATOM 0 HA ARG A 42 -3.348 14.568 -2.349 1.00 10.00 H new ATOM 0 HB2 ARG A 42 -2.667 11.891 -3.649 1.00 10.00 H new ATOM 0 HB3 ARG A 42 -4.202 12.694 -3.914 1.00 10.00 H new ATOM 0 HG2 ARG A 42 -3.134 14.637 -4.894 1.00 10.00 H new ATOM 0 HG3 ARG A 42 -1.550 14.144 -4.329 1.00 10.00 H new ATOM 0 HD2 ARG A 42 -1.815 12.025 -5.773 1.00 10.00 H new ATOM 0 HD3 ARG A 42 -3.248 12.762 -6.461 1.00 10.00 H new ATOM 0 HE ARG A 42 -0.493 13.433 -7.091 1.00 10.00 H new ATOM 0 HH11 ARG A 42 -3.767 14.806 -6.812 1.00 10.00 H new ATOM 0 HH12 ARG A 42 -3.408 16.139 -7.915 1.00 10.00 H new ATOM 0 HH21 ARG A 42 -0.114 15.151 -8.483 1.00 10.00 H new ATOM 0 HH22 ARG A 42 -1.382 16.328 -8.841 1.00 10.00 H new ATOM 452 N GLN A 43 -3.463 11.790 -0.626 1.00 10.00 N ATOM 453 CA GLN A 43 -4.251 11.036 0.341 1.00 10.00 C ATOM 454 C GLN A 43 -4.420 11.847 1.627 1.00 10.00 C ATOM 455 O GLN A 43 -5.483 11.821 2.252 1.00 10.00 O ATOM 456 CB GLN A 43 -3.552 9.708 0.650 1.00 10.00 C ATOM 457 CG GLN A 43 -4.573 8.682 1.148 1.00 10.00 C ATOM 458 CD GLN A 43 -5.213 7.947 -0.029 1.00 10.00 C ATOM 459 OE1 GLN A 43 -4.588 7.771 -1.076 1.00 10.00 O ATOM 460 NE2 GLN A 43 -6.436 7.504 0.085 1.00 10.00 N ATOM 0 H GLN A 43 -2.499 11.471 -0.726 1.00 10.00 H new ATOM 0 HA GLN A 43 -5.236 10.835 -0.080 1.00 10.00 H new ATOM 0 HB2 GLN A 43 -3.054 9.333 -0.244 1.00 10.00 H new ATOM 0 HB3 GLN A 43 -2.780 9.861 1.404 1.00 10.00 H new ATOM 0 HG2 GLN A 43 -4.085 7.966 1.809 1.00 10.00 H new ATOM 0 HG3 GLN A 43 -5.344 9.183 1.734 1.00 10.00 H new ATOM 0 HE21 GLN A 43 -6.953 7.650 0.952 1.00 10.00 H new ATOM 0 HE22 GLN A 43 -6.875 7.012 -0.693 1.00 10.00 H new ATOM 469 N GLN A 44 -3.364 12.566 2.010 1.00 10.00 N ATOM 470 CA GLN A 44 -3.389 13.386 3.223 1.00 10.00 C ATOM 471 C GLN A 44 -4.237 14.642 3.016 1.00 10.00 C ATOM 472 O GLN A 44 -4.981 15.048 3.912 1.00 10.00 O ATOM 473 CB GLN A 44 -1.967 13.794 3.608 1.00 10.00 C ATOM 474 CG GLN A 44 -1.938 14.192 5.084 1.00 10.00 C ATOM 475 CD GLN A 44 -0.499 14.331 5.561 1.00 10.00 C ATOM 476 OE1 GLN A 44 -0.068 13.607 6.460 1.00 10.00 O ATOM 477 NE2 GLN A 44 0.277 15.224 5.012 1.00 10.00 N ATOM 0 H GLN A 44 -2.482 12.598 1.499 1.00 10.00 H new ATOM 0 HA GLN A 44 -3.831 12.792 4.023 1.00 10.00 H new ATOM 0 HB2 GLN A 44 -1.278 12.969 3.428 1.00 10.00 H new ATOM 0 HB3 GLN A 44 -1.635 14.627 2.988 1.00 10.00 H new ATOM 0 HG2 GLN A 44 -2.468 15.134 5.225 1.00 10.00 H new ATOM 0 HG3 GLN A 44 -2.456 13.442 5.681 1.00 10.00 H new ATOM 0 HE21 GLN A 44 -0.081 15.823 4.268 1.00 10.00 H new ATOM 0 HE22 GLN A 44 1.242 15.324 5.327 1.00 10.00 H new ATOM 486 N ASN A 45 -4.110 15.253 1.836 1.00 10.00 N ATOM 487 CA ASN A 45 -4.865 16.470 1.522 1.00 10.00 C ATOM 488 C ASN A 45 -6.363 16.174 1.439 1.00 10.00 C ATOM 489 O ASN A 45 -7.184 16.950 1.935 1.00 10.00 O ATOM 490 CB ASN A 45 -4.384 17.057 0.188 1.00 10.00 C ATOM 491 CG ASN A 45 -3.127 17.899 0.406 1.00 10.00 C ATOM 492 OD1 ASN A 45 -2.988 18.554 1.439 1.00 10.00 O ATOM 493 ND2 ASN A 45 -2.198 17.920 -0.512 1.00 10.00 N ATOM 0 H ASN A 45 -3.497 14.929 1.087 1.00 10.00 H new ATOM 0 HA ASN A 45 -4.695 17.192 2.321 1.00 10.00 H new ATOM 0 HB2 ASN A 45 -4.174 16.253 -0.517 1.00 10.00 H new ATOM 0 HB3 ASN A 45 -5.170 17.670 -0.252 1.00 10.00 H new ATOM 0 HD21 ASN A 45 -1.356 18.479 -0.373 1.00 10.00 H new ATOM 0 HD22 ASN A 45 -2.314 17.377 -1.368 1.00 10.00 H new ATOM 500 N SER A 46 -6.707 15.050 0.805 1.00 10.00 N ATOM 501 CA SER A 46 -8.108 14.657 0.655 1.00 10.00 C ATOM 502 C SER A 46 -8.672 14.136 1.976 1.00 10.00 C ATOM 503 O SER A 46 -9.594 14.729 2.540 1.00 10.00 O ATOM 504 CB SER A 46 -8.236 13.575 -0.418 1.00 10.00 C ATOM 505 OG SER A 46 -9.560 13.582 -0.935 1.00 10.00 O ATOM 0 H SER A 46 -6.039 14.401 0.390 1.00 10.00 H new ATOM 0 HA SER A 46 -8.678 15.537 0.356 1.00 10.00 H new ATOM 0 HB2 SER A 46 -7.519 13.754 -1.219 1.00 10.00 H new ATOM 0 HB3 SER A 46 -8.003 12.598 0.005 1.00 10.00 H new ATOM 0 HG SER A 46 -9.646 12.891 -1.624 1.00 10.00 H new TER 511 SER A 46 ATOM 512 N MET B 1 23.635 1.003 9.578 1.00 10.00 N ATOM 513 CA MET B 1 23.776 -0.417 9.198 1.00 10.00 C ATOM 514 C MET B 1 24.965 -0.590 8.232 1.00 10.00 C ATOM 515 O MET B 1 25.274 0.283 7.429 1.00 10.00 O ATOM 516 CB MET B 1 22.478 -0.909 8.539 1.00 10.00 C ATOM 517 CG MET B 1 22.189 -0.266 7.174 1.00 10.00 C ATOM 518 SD MET B 1 20.650 -0.844 6.376 1.00 10.00 S ATOM 519 CE MET B 1 20.921 -0.215 4.734 1.00 10.00 C ATOM 0 H1 MET B 1 22.821 1.113 10.216 1.00 10.00 H new ATOM 0 H2 MET B 1 24.499 1.320 10.062 1.00 10.00 H new ATOM 0 H3 MET B 1 23.486 1.578 8.724 1.00 10.00 H new ATOM 0 HA MET B 1 23.965 -1.010 10.093 1.00 10.00 H new ATOM 0 HB2 MET B 1 22.532 -1.991 8.416 1.00 10.00 H new ATOM 0 HB3 MET B 1 21.643 -0.706 9.209 1.00 10.00 H new ATOM 0 HG2 MET B 1 22.134 0.815 7.300 1.00 10.00 H new ATOM 0 HG3 MET B 1 23.027 -0.467 6.507 1.00 10.00 H new ATOM 0 HE1 MET B 1 19.984 -0.235 4.177 1.00 10.00 H new ATOM 0 HE2 MET B 1 21.286 0.810 4.793 1.00 10.00 H new ATOM 0 HE3 MET B 1 21.659 -0.834 4.224 1.00 10.00 H new ATOM 531 N GLN B 2 25.621 -1.748 8.342 1.00 10.00 N ATOM 532 CA GLN B 2 26.699 -2.050 7.401 1.00 10.00 C ATOM 533 C GLN B 2 26.162 -2.916 6.259 1.00 10.00 C ATOM 534 O GLN B 2 25.252 -3.720 6.428 1.00 10.00 O ATOM 535 CB GLN B 2 27.859 -2.738 8.117 1.00 10.00 C ATOM 536 CG GLN B 2 27.634 -4.235 8.380 1.00 10.00 C ATOM 537 CD GLN B 2 28.834 -4.920 9.034 1.00 10.00 C ATOM 538 OE1 GLN B 2 28.724 -5.979 9.626 1.00 10.00 O ATOM 539 NE2 GLN B 2 30.006 -4.342 8.894 1.00 10.00 N ATOM 0 H GLN B 2 25.435 -2.465 9.043 1.00 10.00 H new ATOM 0 HA GLN B 2 27.077 -1.118 6.980 1.00 10.00 H new ATOM 0 HB2 GLN B 2 28.763 -2.617 7.521 1.00 10.00 H new ATOM 0 HB3 GLN B 2 28.034 -2.235 9.068 1.00 10.00 H new ATOM 0 HG2 GLN B 2 26.761 -4.357 9.021 1.00 10.00 H new ATOM 0 HG3 GLN B 2 27.409 -4.733 7.437 1.00 10.00 H new ATOM 0 HE21 GLN B 2 30.081 -3.455 8.395 1.00 10.00 H new ATOM 0 HE22 GLN B 2 30.841 -4.780 9.284 1.00 10.00 H new ATOM 548 N ILE B 3 26.747 -2.665 5.090 1.00 10.00 N ATOM 549 CA ILE B 3 26.500 -3.508 3.914 1.00 10.00 C ATOM 550 C ILE B 3 27.868 -3.754 3.253 1.00 10.00 C ATOM 551 O ILE B 3 28.806 -2.982 3.433 1.00 10.00 O ATOM 552 CB ILE B 3 25.444 -2.932 2.934 1.00 10.00 C ATOM 553 CG1 ILE B 3 25.963 -1.884 1.935 1.00 10.00 C ATOM 554 CG2 ILE B 3 24.161 -2.471 3.649 1.00 10.00 C ATOM 555 CD1 ILE B 3 26.475 -0.575 2.530 1.00 10.00 C ATOM 0 H ILE B 3 27.392 -1.891 4.928 1.00 10.00 H new ATOM 0 HA ILE B 3 26.049 -4.450 4.226 1.00 10.00 H new ATOM 0 HB ILE B 3 25.185 -3.786 2.308 1.00 10.00 H new ATOM 0 HG12 ILE B 3 26.769 -2.334 1.355 1.00 10.00 H new ATOM 0 HG13 ILE B 3 25.160 -1.651 1.236 1.00 10.00 H new ATOM 0 HG21 ILE B 3 23.457 -2.077 2.916 1.00 10.00 H new ATOM 0 HG22 ILE B 3 23.709 -3.317 4.167 1.00 10.00 H new ATOM 0 HG23 ILE B 3 24.407 -1.692 4.371 1.00 10.00 H new ATOM 0 HD11 ILE B 3 26.813 0.081 1.728 1.00 10.00 H new ATOM 0 HD12 ILE B 3 25.672 -0.088 3.083 1.00 10.00 H new ATOM 0 HD13 ILE B 3 27.306 -0.782 3.204 1.00 10.00 H new ATOM 567 N PHE B 4 27.910 -4.808 2.448 1.00 10.00 N ATOM 568 CA PHE B 4 29.164 -5.216 1.798 1.00 10.00 C ATOM 569 C PHE B 4 29.066 -4.998 0.288 1.00 10.00 C ATOM 570 O PHE B 4 28.004 -5.136 -0.304 1.00 10.00 O ATOM 571 CB PHE B 4 29.436 -6.690 2.111 1.00 10.00 C ATOM 572 CG PHE B 4 29.316 -6.972 3.612 1.00 10.00 C ATOM 573 CD1 PHE B 4 30.326 -6.581 4.483 1.00 10.00 C ATOM 574 CD2 PHE B 4 28.160 -7.564 4.101 1.00 10.00 C ATOM 575 CE1 PHE B 4 30.177 -6.794 5.846 1.00 10.00 C ATOM 576 CE2 PHE B 4 28.015 -7.784 5.464 1.00 10.00 C ATOM 577 CZ PHE B 4 29.025 -7.399 6.338 1.00 10.00 C ATOM 0 H PHE B 4 27.105 -5.394 2.227 1.00 10.00 H new ATOM 0 HA PHE B 4 29.988 -4.612 2.178 1.00 10.00 H new ATOM 0 HB2 PHE B 4 28.731 -7.316 1.564 1.00 10.00 H new ATOM 0 HB3 PHE B 4 30.435 -6.959 1.767 1.00 10.00 H new ATOM 0 HD1 PHE B 4 31.222 -6.114 4.101 1.00 10.00 H new ATOM 0 HD2 PHE B 4 27.373 -7.854 3.421 1.00 10.00 H new ATOM 0 HE1 PHE B 4 30.958 -6.489 6.527 1.00 10.00 H new ATOM 0 HE2 PHE B 4 27.120 -8.253 5.844 1.00 10.00 H new ATOM 0 HZ PHE B 4 28.915 -7.570 7.399 1.00 10.00 H new ATOM 587 N VAL B 5 30.164 -4.505 -0.273 1.00 10.00 N ATOM 588 CA VAL B 5 30.286 -4.272 -1.722 1.00 10.00 C ATOM 589 C VAL B 5 31.480 -5.091 -2.220 1.00 10.00 C ATOM 590 O VAL B 5 32.630 -4.774 -1.957 1.00 10.00 O ATOM 591 CB VAL B 5 30.462 -2.773 -2.051 1.00 10.00 C ATOM 592 CG1 VAL B 5 30.613 -2.537 -3.557 1.00 10.00 C ATOM 593 CG2 VAL B 5 29.273 -1.948 -1.550 1.00 10.00 C ATOM 0 H VAL B 5 30.999 -4.253 0.256 1.00 10.00 H new ATOM 0 HA VAL B 5 29.371 -4.585 -2.225 1.00 10.00 H new ATOM 0 HB VAL B 5 31.372 -2.454 -1.542 1.00 10.00 H new ATOM 0 HG11 VAL B 5 30.735 -1.471 -3.748 1.00 10.00 H new ATOM 0 HG12 VAL B 5 31.488 -3.073 -3.923 1.00 10.00 H new ATOM 0 HG13 VAL B 5 29.724 -2.899 -4.073 1.00 10.00 H new ATOM 0 HG21 VAL B 5 29.429 -0.898 -1.798 1.00 10.00 H new ATOM 0 HG22 VAL B 5 28.358 -2.301 -2.026 1.00 10.00 H new ATOM 0 HG23 VAL B 5 29.184 -2.057 -0.469 1.00 10.00 H new ATOM 603 N LYS B 6 31.136 -6.227 -2.825 1.00 10.00 N ATOM 604 CA LYS B 6 32.139 -7.116 -3.413 1.00 10.00 C ATOM 605 C LYS B 6 32.610 -6.565 -4.760 1.00 10.00 C ATOM 606 O LYS B 6 31.832 -6.177 -5.621 1.00 10.00 O ATOM 607 CB LYS B 6 31.502 -8.475 -3.665 1.00 10.00 C ATOM 608 CG LYS B 6 31.131 -9.224 -2.381 1.00 10.00 C ATOM 609 CD LYS B 6 30.409 -10.529 -2.733 1.00 10.00 C ATOM 610 CE LYS B 6 31.283 -11.442 -3.604 1.00 10.00 C ATOM 611 NZ LYS B 6 30.500 -12.538 -4.182 1.00 10.00 N ATOM 0 H LYS B 6 30.174 -6.553 -2.921 1.00 10.00 H new ATOM 0 HA LYS B 6 32.984 -7.195 -2.729 1.00 10.00 H new ATOM 0 HB2 LYS B 6 30.605 -8.340 -4.270 1.00 10.00 H new ATOM 0 HB3 LYS B 6 32.190 -9.088 -4.247 1.00 10.00 H new ATOM 0 HG2 LYS B 6 32.029 -9.439 -1.802 1.00 10.00 H new ATOM 0 HG3 LYS B 6 30.491 -8.600 -1.757 1.00 10.00 H new ATOM 0 HD2 LYS B 6 30.135 -11.052 -1.817 1.00 10.00 H new ATOM 0 HD3 LYS B 6 29.482 -10.302 -3.259 1.00 10.00 H new ATOM 0 HE2 LYS B 6 31.739 -10.858 -4.403 1.00 10.00 H new ATOM 0 HE3 LYS B 6 32.096 -11.851 -3.004 1.00 10.00 H new ATOM 0 HZ1 LYS B 6 31.072 -13.035 -4.894 1.00 10.00 H new ATOM 0 HZ2 LYS B 6 30.227 -13.203 -3.431 1.00 10.00 H new ATOM 0 HZ3 LYS B 6 29.645 -12.154 -4.632 1.00 10.00 H new ATOM 625 N THR B 7 33.938 -6.584 -4.910 1.00 10.00 N ATOM 626 CA THR B 7 34.558 -6.240 -6.195 1.00 10.00 C ATOM 627 C THR B 7 34.996 -7.551 -6.858 1.00 10.00 C ATOM 628 O THR B 7 35.117 -8.596 -6.220 1.00 10.00 O ATOM 629 CB THR B 7 35.755 -5.289 -6.020 1.00 10.00 C ATOM 630 OG1 THR B 7 36.812 -6.003 -5.391 1.00 10.00 O ATOM 631 CG2 THR B 7 35.414 -4.047 -5.193 1.00 10.00 C ATOM 0 H THR B 7 34.596 -6.830 -4.171 1.00 10.00 H new ATOM 0 HA THR B 7 33.839 -5.711 -6.820 1.00 10.00 H new ATOM 0 HB THR B 7 36.048 -4.938 -7.009 1.00 10.00 H new ATOM 0 HG1 THR B 7 37.546 -6.130 -6.028 1.00 10.00 H new ATOM 0 HG21 THR B 7 36.298 -3.415 -5.104 1.00 10.00 H new ATOM 0 HG22 THR B 7 34.617 -3.490 -5.685 1.00 10.00 H new ATOM 0 HG23 THR B 7 35.084 -4.351 -4.200 1.00 10.00 H new ATOM 639 N LEU B 8 35.308 -7.457 -8.145 1.00 10.00 N ATOM 640 CA LEU B 8 35.623 -8.647 -8.957 1.00 10.00 C ATOM 641 C LEU B 8 37.037 -9.205 -8.744 1.00 10.00 C ATOM 642 O LEU B 8 37.336 -10.332 -9.126 1.00 10.00 O ATOM 643 CB LEU B 8 35.301 -8.363 -10.426 1.00 10.00 C ATOM 644 CG LEU B 8 33.852 -7.871 -10.596 1.00 10.00 C ATOM 645 CD1 LEU B 8 33.556 -7.619 -12.072 1.00 10.00 C ATOM 646 CD2 LEU B 8 32.809 -8.823 -9.992 1.00 10.00 C ATOM 0 H LEU B 8 35.352 -6.576 -8.656 1.00 10.00 H new ATOM 0 HA LEU B 8 34.983 -9.457 -8.609 1.00 10.00 H new ATOM 0 HB2 LEU B 8 35.990 -7.612 -10.813 1.00 10.00 H new ATOM 0 HB3 LEU B 8 35.452 -9.268 -11.015 1.00 10.00 H new ATOM 0 HG LEU B 8 33.770 -6.938 -10.038 1.00 10.00 H new ATOM 0 HD11 LEU B 8 32.529 -7.271 -12.183 1.00 10.00 H new ATOM 0 HD12 LEU B 8 34.239 -6.861 -12.456 1.00 10.00 H new ATOM 0 HD13 LEU B 8 33.688 -8.544 -12.633 1.00 10.00 H new ATOM 0 HD21 LEU B 8 31.810 -8.415 -10.148 1.00 10.00 H new ATOM 0 HD22 LEU B 8 32.882 -9.797 -10.476 1.00 10.00 H new ATOM 0 HD23 LEU B 8 32.993 -8.934 -8.923 1.00 10.00 H new ATOM 658 N THR B 9 37.884 -8.376 -8.142 1.00 10.00 N ATOM 659 CA THR B 9 39.192 -8.818 -7.611 1.00 10.00 C ATOM 660 C THR B 9 39.001 -9.874 -6.511 1.00 10.00 C ATOM 661 O THR B 9 39.802 -10.804 -6.402 1.00 10.00 O ATOM 662 CB THR B 9 40.004 -7.643 -7.052 1.00 10.00 C ATOM 663 OG1 THR B 9 39.217 -6.878 -6.133 1.00 10.00 O ATOM 664 CG2 THR B 9 40.543 -6.751 -8.172 1.00 10.00 C ATOM 0 H THR B 9 37.695 -7.383 -8.003 1.00 10.00 H new ATOM 0 HA THR B 9 39.745 -9.254 -8.443 1.00 10.00 H new ATOM 0 HB THR B 9 40.859 -8.056 -6.517 1.00 10.00 H new ATOM 0 HG1 THR B 9 39.751 -6.134 -5.786 1.00 10.00 H new ATOM 0 HG21 THR B 9 41.113 -5.929 -7.740 1.00 10.00 H new ATOM 0 HG22 THR B 9 41.190 -7.337 -8.825 1.00 10.00 H new ATOM 0 HG23 THR B 9 39.711 -6.350 -8.751 1.00 10.00 H new ATOM 672 N GLY B 10 37.911 -9.721 -5.752 1.00 10.00 N ATOM 673 CA GLY B 10 37.566 -10.626 -4.644 1.00 10.00 C ATOM 674 C GLY B 10 37.444 -9.873 -3.314 1.00 10.00 C ATOM 675 O GLY B 10 36.777 -10.346 -2.391 1.00 10.00 O ATOM 0 H GLY B 10 37.240 -8.965 -5.887 1.00 10.00 H new ATOM 0 HA2 GLY B 10 36.625 -11.129 -4.865 1.00 10.00 H new ATOM 0 HA3 GLY B 10 38.328 -11.400 -4.555 1.00 10.00 H new ATOM 679 N LYS B 11 38.118 -8.730 -3.223 1.00 10.00 N ATOM 680 CA LYS B 11 38.058 -7.863 -2.028 1.00 10.00 C ATOM 681 C LYS B 11 36.603 -7.410 -1.792 1.00 10.00 C ATOM 682 O LYS B 11 35.820 -7.229 -2.721 1.00 10.00 O ATOM 683 CB LYS B 11 38.964 -6.643 -2.217 1.00 10.00 C ATOM 684 CG LYS B 11 39.280 -5.985 -0.864 1.00 10.00 C ATOM 685 CD LYS B 11 39.121 -4.463 -0.892 1.00 10.00 C ATOM 686 CE LYS B 11 40.167 -3.735 -1.744 1.00 10.00 C ATOM 687 NZ LYS B 11 41.498 -3.761 -1.118 1.00 10.00 N ATOM 0 H LYS B 11 38.720 -8.372 -3.964 1.00 10.00 H new ATOM 0 HA LYS B 11 38.405 -8.424 -1.160 1.00 10.00 H new ATOM 0 HB2 LYS B 11 39.891 -6.944 -2.706 1.00 10.00 H new ATOM 0 HB3 LYS B 11 38.478 -5.921 -2.873 1.00 10.00 H new ATOM 0 HG2 LYS B 11 38.622 -6.400 -0.101 1.00 10.00 H new ATOM 0 HG3 LYS B 11 40.301 -6.234 -0.574 1.00 10.00 H new ATOM 0 HD2 LYS B 11 38.128 -4.220 -1.271 1.00 10.00 H new ATOM 0 HD3 LYS B 11 39.174 -4.085 0.129 1.00 10.00 H new ATOM 0 HE2 LYS B 11 40.220 -4.199 -2.729 1.00 10.00 H new ATOM 0 HE3 LYS B 11 39.857 -2.701 -1.895 1.00 10.00 H new ATOM 0 HZ1 LYS B 11 42.170 -3.230 -1.708 1.00 10.00 H new ATOM 0 HZ2 LYS B 11 41.447 -3.326 -0.175 1.00 10.00 H new ATOM 0 HZ3 LYS B 11 41.820 -4.746 -1.028 1.00 10.00 H new ATOM 701 N THR B 12 36.295 -7.219 -0.511 1.00 10.00 N ATOM 702 CA THR B 12 34.963 -6.762 -0.076 1.00 10.00 C ATOM 703 C THR B 12 35.125 -5.457 0.707 1.00 10.00 C ATOM 704 O THR B 12 35.845 -5.385 1.689 1.00 10.00 O ATOM 705 CB THR B 12 34.294 -7.838 0.797 1.00 10.00 C ATOM 706 OG1 THR B 12 34.116 -9.019 0.017 1.00 10.00 O ATOM 707 CG2 THR B 12 32.936 -7.402 1.363 1.00 10.00 C ATOM 0 H THR B 12 36.951 -7.373 0.255 1.00 10.00 H new ATOM 0 HA THR B 12 34.327 -6.589 -0.944 1.00 10.00 H new ATOM 0 HB THR B 12 34.951 -8.016 1.648 1.00 10.00 H new ATOM 0 HG1 THR B 12 33.692 -9.712 0.565 1.00 10.00 H new ATOM 0 HG21 THR B 12 32.519 -8.207 1.969 1.00 10.00 H new ATOM 0 HG22 THR B 12 33.068 -6.514 1.981 1.00 10.00 H new ATOM 0 HG23 THR B 12 32.255 -7.176 0.542 1.00 10.00 H new ATOM 715 N ILE B 13 34.323 -4.478 0.285 1.00 10.00 N ATOM 716 CA ILE B 13 34.263 -3.171 0.960 1.00 10.00 C ATOM 717 C ILE B 13 33.107 -3.248 1.967 1.00 10.00 C ATOM 718 O ILE B 13 32.005 -3.656 1.626 1.00 10.00 O ATOM 719 CB ILE B 13 33.959 -2.027 -0.035 1.00 10.00 C ATOM 720 CG1 ILE B 13 34.542 -2.216 -1.448 1.00 10.00 C ATOM 721 CG2 ILE B 13 34.391 -0.677 0.559 1.00 10.00 C ATOM 722 CD1 ILE B 13 36.049 -2.483 -1.526 1.00 10.00 C ATOM 0 H ILE B 13 33.704 -4.561 -0.521 1.00 10.00 H new ATOM 0 HA ILE B 13 35.223 -2.962 1.431 1.00 10.00 H new ATOM 0 HB ILE B 13 32.878 -2.047 -0.177 1.00 10.00 H new ATOM 0 HG12 ILE B 13 34.021 -3.046 -1.926 1.00 10.00 H new ATOM 0 HG13 ILE B 13 34.321 -1.323 -2.032 1.00 10.00 H new ATOM 0 HG21 ILE B 13 34.172 0.120 -0.151 1.00 10.00 H new ATOM 0 HG22 ILE B 13 33.847 -0.497 1.486 1.00 10.00 H new ATOM 0 HG23 ILE B 13 35.461 -0.696 0.764 1.00 10.00 H new ATOM 0 HD11 ILE B 13 36.344 -2.599 -2.569 1.00 10.00 H new ATOM 0 HD12 ILE B 13 36.590 -1.645 -1.087 1.00 10.00 H new ATOM 0 HD13 ILE B 13 36.286 -3.395 -0.978 1.00 10.00 H new ATOM 734 N THR B 14 33.396 -2.823 3.196 1.00 10.00 N ATOM 735 CA THR B 14 32.343 -2.666 4.215 1.00 10.00 C ATOM 736 C THR B 14 32.033 -1.172 4.329 1.00 10.00 C ATOM 737 O THR B 14 32.926 -0.348 4.497 1.00 10.00 O ATOM 738 CB THR B 14 32.799 -3.226 5.571 1.00 10.00 C ATOM 739 OG1 THR B 14 33.100 -4.616 5.432 1.00 10.00 O ATOM 740 CG2 THR B 14 31.729 -3.050 6.651 1.00 10.00 C ATOM 0 H THR B 14 34.335 -2.582 3.514 1.00 10.00 H new ATOM 0 HA THR B 14 31.453 -3.222 3.922 1.00 10.00 H new ATOM 0 HB THR B 14 33.684 -2.670 5.880 1.00 10.00 H new ATOM 0 HG1 THR B 14 32.266 -5.129 5.394 1.00 10.00 H new ATOM 0 HG21 THR B 14 32.093 -3.459 7.593 1.00 10.00 H new ATOM 0 HG22 THR B 14 31.510 -1.990 6.777 1.00 10.00 H new ATOM 0 HG23 THR B 14 30.822 -3.575 6.353 1.00 10.00 H new ATOM 748 N LEU B 15 30.737 -0.881 4.274 1.00 10.00 N ATOM 749 CA LEU B 15 30.247 0.501 4.411 1.00 10.00 C ATOM 750 C LEU B 15 29.224 0.623 5.542 1.00 10.00 C ATOM 751 O LEU B 15 28.431 -0.282 5.771 1.00 10.00 O ATOM 752 CB LEU B 15 29.609 0.958 3.096 1.00 10.00 C ATOM 753 CG LEU B 15 30.568 0.939 1.901 1.00 10.00 C ATOM 754 CD1 LEU B 15 29.779 1.202 0.620 1.00 10.00 C ATOM 755 CD2 LEU B 15 31.668 1.993 2.057 1.00 10.00 C ATOM 0 H LEU B 15 30.003 -1.576 4.136 1.00 10.00 H new ATOM 0 HA LEU B 15 31.100 1.136 4.652 1.00 10.00 H new ATOM 0 HB2 LEU B 15 28.756 0.316 2.875 1.00 10.00 H new ATOM 0 HB3 LEU B 15 29.223 1.969 3.223 1.00 10.00 H new ATOM 0 HG LEU B 15 31.044 -0.040 1.853 1.00 10.00 H new ATOM 0 HD11 LEU B 15 30.457 1.190 -0.234 1.00 10.00 H new ATOM 0 HD12 LEU B 15 29.022 0.428 0.494 1.00 10.00 H new ATOM 0 HD13 LEU B 15 29.295 2.176 0.685 1.00 10.00 H new ATOM 0 HD21 LEU B 15 32.333 1.955 1.194 1.00 10.00 H new ATOM 0 HD22 LEU B 15 31.217 2.983 2.125 1.00 10.00 H new ATOM 0 HD23 LEU B 15 32.239 1.792 2.964 1.00 10.00 H new ATOM 767 N GLU B 16 29.297 1.768 6.219 1.00 10.00 N ATOM 768 CA GLU B 16 28.298 2.187 7.218 1.00 10.00 C ATOM 769 C GLU B 16 27.353 3.188 6.547 1.00 10.00 C ATOM 770 O GLU B 16 27.746 4.285 6.175 1.00 10.00 O ATOM 771 CB GLU B 16 29.005 2.839 8.413 1.00 10.00 C ATOM 772 CG GLU B 16 28.025 3.350 9.479 1.00 10.00 C ATOM 773 CD GLU B 16 27.141 2.243 10.066 1.00 10.00 C ATOM 774 OE1 GLU B 16 27.666 1.135 10.311 1.00 10.00 O ATOM 775 OE2 GLU B 16 25.946 2.541 10.271 1.00 10.00 O ATOM 0 H GLU B 16 30.054 2.440 6.093 1.00 10.00 H new ATOM 0 HA GLU B 16 27.734 1.328 7.582 1.00 10.00 H new ATOM 0 HB2 GLU B 16 29.683 2.116 8.866 1.00 10.00 H new ATOM 0 HB3 GLU B 16 29.615 3.670 8.059 1.00 10.00 H new ATOM 0 HG2 GLU B 16 28.588 3.822 10.284 1.00 10.00 H new ATOM 0 HG3 GLU B 16 27.390 4.119 9.040 1.00 10.00 H new ATOM 782 N VAL B 17 26.117 2.723 6.343 1.00 10.00 N ATOM 783 CA VAL B 17 25.109 3.493 5.605 1.00 10.00 C ATOM 784 C VAL B 17 23.767 3.556 6.362 1.00 10.00 C ATOM 785 O VAL B 17 23.555 2.926 7.387 1.00 10.00 O ATOM 786 CB VAL B 17 24.902 2.901 4.194 1.00 10.00 C ATOM 787 CG1 VAL B 17 26.188 2.920 3.361 1.00 10.00 C ATOM 788 CG2 VAL B 17 24.294 1.497 4.251 1.00 10.00 C ATOM 0 H VAL B 17 25.789 1.817 6.678 1.00 10.00 H new ATOM 0 HA VAL B 17 25.482 4.513 5.511 1.00 10.00 H new ATOM 0 HB VAL B 17 24.186 3.549 3.688 1.00 10.00 H new ATOM 0 HG11 VAL B 17 25.991 2.493 2.377 1.00 10.00 H new ATOM 0 HG12 VAL B 17 26.533 3.948 3.248 1.00 10.00 H new ATOM 0 HG13 VAL B 17 26.956 2.332 3.864 1.00 10.00 H new ATOM 0 HG21 VAL B 17 24.164 1.115 3.238 1.00 10.00 H new ATOM 0 HG22 VAL B 17 24.959 0.835 4.806 1.00 10.00 H new ATOM 0 HG23 VAL B 17 23.326 1.540 4.750 1.00 10.00 H new ATOM 798 N GLU B 18 22.858 4.302 5.757 1.00 10.00 N ATOM 799 CA GLU B 18 21.438 4.358 6.128 1.00 10.00 C ATOM 800 C GLU B 18 20.609 3.959 4.903 1.00 10.00 C ATOM 801 O GLU B 18 20.988 4.269 3.779 1.00 10.00 O ATOM 802 CB GLU B 18 21.084 5.786 6.562 1.00 10.00 C ATOM 803 CG GLU B 18 21.847 6.231 7.817 1.00 10.00 C ATOM 804 CD GLU B 18 21.641 5.325 9.041 1.00 10.00 C ATOM 805 OE1 GLU B 18 20.588 4.650 9.100 1.00 10.00 O ATOM 806 OE2 GLU B 18 22.543 5.340 9.905 1.00 10.00 O ATOM 0 H GLU B 18 23.086 4.907 4.968 1.00 10.00 H new ATOM 0 HA GLU B 18 21.229 3.679 6.954 1.00 10.00 H new ATOM 0 HB2 GLU B 18 21.303 6.474 5.746 1.00 10.00 H new ATOM 0 HB3 GLU B 18 20.013 5.848 6.752 1.00 10.00 H new ATOM 0 HG2 GLU B 18 22.911 6.271 7.585 1.00 10.00 H new ATOM 0 HG3 GLU B 18 21.539 7.244 8.074 1.00 10.00 H new ATOM 813 N SER B 19 19.413 3.411 5.153 1.00 10.00 N ATOM 814 CA SER B 19 18.469 3.061 4.065 1.00 10.00 C ATOM 815 C SER B 19 18.065 4.278 3.220 1.00 10.00 C ATOM 816 O SER B 19 17.860 4.177 2.011 1.00 10.00 O ATOM 817 CB SER B 19 17.191 2.430 4.621 1.00 10.00 C ATOM 818 OG SER B 19 17.517 1.259 5.367 1.00 10.00 O ATOM 0 H SER B 19 19.071 3.199 6.090 1.00 10.00 H new ATOM 0 HA SER B 19 19.002 2.350 3.434 1.00 10.00 H new ATOM 0 HB2 SER B 19 16.669 3.144 5.257 1.00 10.00 H new ATOM 0 HB3 SER B 19 16.515 2.176 3.805 1.00 10.00 H new ATOM 0 HG SER B 19 16.696 0.859 5.723 1.00 10.00 H new ATOM 824 N SER B 20 18.030 5.435 3.884 1.00 10.00 N ATOM 825 CA SER B 20 17.738 6.740 3.263 1.00 10.00 C ATOM 826 C SER B 20 18.855 7.296 2.363 1.00 10.00 C ATOM 827 O SER B 20 18.617 8.234 1.605 1.00 10.00 O ATOM 828 CB SER B 20 17.371 7.769 4.335 1.00 10.00 C ATOM 829 OG SER B 20 18.432 7.899 5.289 1.00 10.00 O ATOM 0 H SER B 20 18.206 5.498 4.887 1.00 10.00 H new ATOM 0 HA SER B 20 16.892 6.556 2.600 1.00 10.00 H new ATOM 0 HB2 SER B 20 17.173 8.734 3.869 1.00 10.00 H new ATOM 0 HB3 SER B 20 16.454 7.465 4.841 1.00 10.00 H new ATOM 0 HG SER B 20 18.183 8.562 5.967 1.00 10.00 H new ATOM 835 N ASP B 21 20.042 6.695 2.416 1.00 10.00 N ATOM 836 CA ASP B 21 21.170 7.134 1.568 1.00 10.00 C ATOM 837 C ASP B 21 20.868 6.913 0.089 1.00 10.00 C ATOM 838 O ASP B 21 20.415 5.851 -0.322 1.00 10.00 O ATOM 839 CB ASP B 21 22.463 6.402 1.933 1.00 10.00 C ATOM 840 CG ASP B 21 23.004 6.813 3.305 1.00 10.00 C ATOM 841 OD1 ASP B 21 22.657 7.915 3.785 1.00 10.00 O ATOM 842 OD2 ASP B 21 23.840 6.046 3.819 1.00 10.00 O ATOM 0 H ASP B 21 20.256 5.908 3.029 1.00 10.00 H new ATOM 0 HA ASP B 21 21.305 8.200 1.750 1.00 10.00 H new ATOM 0 HB2 ASP B 21 22.283 5.327 1.925 1.00 10.00 H new ATOM 0 HB3 ASP B 21 23.218 6.604 1.173 1.00 10.00 H new ATOM 847 N THR B 22 21.119 7.982 -0.671 1.00 10.00 N ATOM 848 CA THR B 22 21.027 7.930 -2.140 1.00 10.00 C ATOM 849 C THR B 22 22.187 7.065 -2.659 1.00 10.00 C ATOM 850 O THR B 22 23.237 6.970 -2.041 1.00 10.00 O ATOM 851 CB THR B 22 21.098 9.332 -2.771 1.00 10.00 C ATOM 852 OG1 THR B 22 22.395 9.901 -2.561 1.00 10.00 O ATOM 853 CG2 THR B 22 19.996 10.255 -2.240 1.00 10.00 C ATOM 0 H THR B 22 21.387 8.893 -0.299 1.00 10.00 H new ATOM 0 HA THR B 22 20.064 7.502 -2.419 1.00 10.00 H new ATOM 0 HB THR B 22 20.931 9.227 -3.843 1.00 10.00 H new ATOM 0 HG1 THR B 22 22.431 10.792 -2.967 1.00 10.00 H new ATOM 0 HG21 THR B 22 20.083 11.234 -2.711 1.00 10.00 H new ATOM 0 HG22 THR B 22 19.020 9.827 -2.470 1.00 10.00 H new ATOM 0 HG23 THR B 22 20.100 10.362 -1.160 1.00 10.00 H new ATOM 861 N ILE B 23 21.976 6.465 -3.833 1.00 10.00 N ATOM 862 CA ILE B 23 23.027 5.661 -4.495 1.00 10.00 C ATOM 863 C ILE B 23 24.282 6.500 -4.773 1.00 10.00 C ATOM 864 O ILE B 23 25.401 6.071 -4.489 1.00 10.00 O ATOM 865 CB ILE B 23 22.472 5.024 -5.784 1.00 10.00 C ATOM 866 CG1 ILE B 23 21.290 4.089 -5.475 1.00 10.00 C ATOM 867 CG2 ILE B 23 23.541 4.318 -6.633 1.00 10.00 C ATOM 868 CD1 ILE B 23 21.586 2.957 -4.482 1.00 10.00 C ATOM 0 H ILE B 23 21.097 6.515 -4.348 1.00 10.00 H new ATOM 0 HA ILE B 23 23.326 4.859 -3.820 1.00 10.00 H new ATOM 0 HB ILE B 23 22.109 5.850 -6.396 1.00 10.00 H new ATOM 0 HG12 ILE B 23 20.468 4.688 -5.082 1.00 10.00 H new ATOM 0 HG13 ILE B 23 20.944 3.648 -6.410 1.00 10.00 H new ATOM 0 HG21 ILE B 23 23.077 3.894 -7.523 1.00 10.00 H new ATOM 0 HG22 ILE B 23 24.304 5.038 -6.929 1.00 10.00 H new ATOM 0 HG23 ILE B 23 24.001 3.521 -6.049 1.00 10.00 H new ATOM 0 HD11 ILE B 23 20.687 2.358 -4.335 1.00 10.00 H new ATOM 0 HD12 ILE B 23 22.382 2.326 -4.877 1.00 10.00 H new ATOM 0 HD13 ILE B 23 21.899 3.382 -3.528 1.00 10.00 H new ATOM 880 N ASP B 24 24.044 7.743 -5.186 1.00 10.00 N ATOM 881 CA ASP B 24 25.124 8.722 -5.412 1.00 10.00 C ATOM 882 C ASP B 24 25.952 8.946 -4.134 1.00 10.00 C ATOM 883 O ASP B 24 27.180 8.986 -4.183 1.00 10.00 O ATOM 884 CB ASP B 24 24.515 10.042 -5.897 1.00 10.00 C ATOM 885 CG ASP B 24 25.595 11.100 -6.144 1.00 10.00 C ATOM 886 OD1 ASP B 24 26.439 10.854 -7.026 1.00 10.00 O ATOM 887 OD2 ASP B 24 25.544 12.112 -5.415 1.00 10.00 O ATOM 0 H ASP B 24 23.109 8.105 -5.374 1.00 10.00 H new ATOM 0 HA ASP B 24 25.799 8.330 -6.173 1.00 10.00 H new ATOM 0 HB2 ASP B 24 23.955 9.870 -6.816 1.00 10.00 H new ATOM 0 HB3 ASP B 24 23.805 10.411 -5.156 1.00 10.00 H new ATOM 892 N ASN B 25 25.249 9.015 -3.004 1.00 10.00 N ATOM 893 CA ASN B 25 25.866 9.169 -1.676 1.00 10.00 C ATOM 894 C ASN B 25 26.736 7.958 -1.299 1.00 10.00 C ATOM 895 O ASN B 25 27.835 8.120 -0.775 1.00 10.00 O ATOM 896 CB ASN B 25 24.755 9.378 -0.646 1.00 10.00 C ATOM 897 CG ASN B 25 25.280 9.470 0.778 1.00 10.00 C ATOM 898 OD1 ASN B 25 26.158 10.249 1.121 1.00 10.00 O ATOM 899 ND2 ASN B 25 24.737 8.630 1.618 1.00 10.00 N ATOM 0 H ASN B 25 24.231 8.966 -2.978 1.00 10.00 H new ATOM 0 HA ASN B 25 26.530 10.033 -1.695 1.00 10.00 H new ATOM 0 HB2 ASN B 25 24.210 10.291 -0.887 1.00 10.00 H new ATOM 0 HB3 ASN B 25 24.044 8.555 -0.714 1.00 10.00 H new ATOM 0 HD21 ASN B 25 25.043 8.612 2.591 1.00 10.00 H new ATOM 0 HD22 ASN B 25 24.006 7.993 1.301 1.00 10.00 H new ATOM 906 N VAL B 26 26.261 6.762 -1.648 1.00 10.00 N ATOM 907 CA VAL B 26 27.015 5.504 -1.445 1.00 10.00 C ATOM 908 C VAL B 26 28.309 5.510 -2.273 1.00 10.00 C ATOM 909 O VAL B 26 29.385 5.233 -1.753 1.00 10.00 O ATOM 910 CB VAL B 26 26.141 4.281 -1.787 1.00 10.00 C ATOM 911 CG1 VAL B 26 26.923 2.957 -1.783 1.00 10.00 C ATOM 912 CG2 VAL B 26 25.000 4.153 -0.777 1.00 10.00 C ATOM 0 H VAL B 26 25.346 6.628 -2.079 1.00 10.00 H new ATOM 0 HA VAL B 26 27.289 5.433 -0.392 1.00 10.00 H new ATOM 0 HB VAL B 26 25.766 4.454 -2.796 1.00 10.00 H new ATOM 0 HG11 VAL B 26 26.250 2.136 -2.031 1.00 10.00 H new ATOM 0 HG12 VAL B 26 27.724 3.005 -2.521 1.00 10.00 H new ATOM 0 HG13 VAL B 26 27.350 2.790 -0.794 1.00 10.00 H new ATOM 0 HG21 VAL B 26 24.388 3.286 -1.027 1.00 10.00 H new ATOM 0 HG22 VAL B 26 25.413 4.029 0.224 1.00 10.00 H new ATOM 0 HG23 VAL B 26 24.385 5.052 -0.807 1.00 10.00 H new ATOM 922 N LYS B 27 28.182 5.842 -3.556 1.00 10.00 N ATOM 923 CA LYS B 27 29.330 5.894 -4.482 1.00 10.00 C ATOM 924 C LYS B 27 30.411 6.881 -4.013 1.00 10.00 C ATOM 925 O LYS B 27 31.603 6.581 -4.072 1.00 10.00 O ATOM 926 CB LYS B 27 28.861 6.271 -5.889 1.00 10.00 C ATOM 927 CG LYS B 27 27.997 5.166 -6.492 1.00 10.00 C ATOM 928 CD LYS B 27 27.546 5.543 -7.901 1.00 10.00 C ATOM 929 CE LYS B 27 26.737 4.398 -8.514 1.00 10.00 C ATOM 930 NZ LYS B 27 26.255 4.759 -9.851 1.00 10.00 N ATOM 0 H LYS B 27 27.290 6.082 -3.989 1.00 10.00 H new ATOM 0 HA LYS B 27 29.774 4.899 -4.497 1.00 10.00 H new ATOM 0 HB2 LYS B 27 28.294 7.201 -5.850 1.00 10.00 H new ATOM 0 HB3 LYS B 27 29.725 6.451 -6.528 1.00 10.00 H new ATOM 0 HG2 LYS B 27 28.560 4.233 -6.522 1.00 10.00 H new ATOM 0 HG3 LYS B 27 27.126 4.993 -5.860 1.00 10.00 H new ATOM 0 HD2 LYS B 27 26.942 6.450 -7.868 1.00 10.00 H new ATOM 0 HD3 LYS B 27 28.414 5.761 -8.524 1.00 10.00 H new ATOM 0 HE2 LYS B 27 27.355 3.502 -8.575 1.00 10.00 H new ATOM 0 HE3 LYS B 27 25.891 4.159 -7.870 1.00 10.00 H new ATOM 0 HZ1 LYS B 27 25.548 4.064 -10.165 1.00 10.00 H new ATOM 0 HZ2 LYS B 27 25.822 5.704 -9.820 1.00 10.00 H new ATOM 0 HZ3 LYS B 27 27.053 4.766 -10.518 1.00 10.00 H new ATOM 944 N SER B 28 29.950 7.987 -3.424 1.00 10.00 N ATOM 945 CA SER B 28 30.824 8.974 -2.757 1.00 10.00 C ATOM 946 C SER B 28 31.547 8.380 -1.533 1.00 10.00 C ATOM 947 O SER B 28 32.758 8.522 -1.384 1.00 10.00 O ATOM 948 CB SER B 28 30.010 10.198 -2.330 1.00 10.00 C ATOM 949 OG SER B 28 30.899 11.178 -1.796 1.00 10.00 O ATOM 0 H SER B 28 28.960 8.230 -3.392 1.00 10.00 H new ATOM 0 HA SER B 28 31.584 9.269 -3.480 1.00 10.00 H new ATOM 0 HB2 SER B 28 29.467 10.606 -3.182 1.00 10.00 H new ATOM 0 HB3 SER B 28 29.267 9.916 -1.584 1.00 10.00 H new ATOM 0 HG SER B 28 30.388 11.968 -1.520 1.00 10.00 H new ATOM 955 N LYS B 29 30.829 7.541 -0.783 1.00 10.00 N ATOM 956 CA LYS B 29 31.401 6.772 0.346 1.00 10.00 C ATOM 957 C LYS B 29 32.467 5.762 -0.121 1.00 10.00 C ATOM 958 O LYS B 29 33.475 5.563 0.552 1.00 10.00 O ATOM 959 CB LYS B 29 30.321 6.009 1.120 1.00 10.00 C ATOM 960 CG LYS B 29 29.335 6.922 1.850 1.00 10.00 C ATOM 961 CD LYS B 29 28.292 6.070 2.573 1.00 10.00 C ATOM 962 CE LYS B 29 27.221 6.905 3.279 1.00 10.00 C ATOM 963 NZ LYS B 29 27.749 7.641 4.438 1.00 10.00 N ATOM 0 H LYS B 29 29.835 7.369 -0.934 1.00 10.00 H new ATOM 0 HA LYS B 29 31.866 7.511 0.999 1.00 10.00 H new ATOM 0 HB2 LYS B 29 29.770 5.372 0.428 1.00 10.00 H new ATOM 0 HB3 LYS B 29 30.801 5.352 1.845 1.00 10.00 H new ATOM 0 HG2 LYS B 29 29.866 7.551 2.565 1.00 10.00 H new ATOM 0 HG3 LYS B 29 28.846 7.589 1.140 1.00 10.00 H new ATOM 0 HD2 LYS B 29 27.812 5.406 1.854 1.00 10.00 H new ATOM 0 HD3 LYS B 29 28.793 5.437 3.306 1.00 10.00 H new ATOM 0 HE2 LYS B 29 26.791 7.612 2.570 1.00 10.00 H new ATOM 0 HE3 LYS B 29 26.413 6.251 3.606 1.00 10.00 H new ATOM 0 HZ1 LYS B 29 26.983 8.189 4.879 1.00 10.00 H new ATOM 0 HZ2 LYS B 29 28.136 6.968 5.130 1.00 10.00 H new ATOM 0 HZ3 LYS B 29 28.502 8.287 4.125 1.00 10.00 H new ATOM 977 N ILE B 30 32.269 5.207 -1.319 1.00 10.00 N ATOM 978 CA ILE B 30 33.242 4.302 -1.975 1.00 10.00 C ATOM 979 C ILE B 30 34.504 5.084 -2.372 1.00 10.00 C ATOM 980 O ILE B 30 35.621 4.615 -2.179 1.00 10.00 O ATOM 981 CB ILE B 30 32.609 3.578 -3.181 1.00 10.00 C ATOM 982 CG1 ILE B 30 31.541 2.597 -2.677 1.00 10.00 C ATOM 983 CG2 ILE B 30 33.657 2.869 -4.067 1.00 10.00 C ATOM 984 CD1 ILE B 30 30.713 1.909 -3.772 1.00 10.00 C ATOM 0 H ILE B 30 31.427 5.368 -1.872 1.00 10.00 H new ATOM 0 HA ILE B 30 33.534 3.529 -1.264 1.00 10.00 H new ATOM 0 HB ILE B 30 32.141 4.327 -3.820 1.00 10.00 H new ATOM 0 HG12 ILE B 30 32.030 1.829 -2.078 1.00 10.00 H new ATOM 0 HG13 ILE B 30 30.862 3.134 -2.014 1.00 10.00 H new ATOM 0 HG21 ILE B 30 33.156 2.376 -4.900 1.00 10.00 H new ATOM 0 HG22 ILE B 30 34.364 3.603 -4.452 1.00 10.00 H new ATOM 0 HG23 ILE B 30 34.191 2.126 -3.475 1.00 10.00 H new ATOM 0 HD11 ILE B 30 29.988 1.237 -3.312 1.00 10.00 H new ATOM 0 HD12 ILE B 30 30.188 2.663 -4.359 1.00 10.00 H new ATOM 0 HD13 ILE B 30 31.374 1.338 -4.423 1.00 10.00 H new ATOM 996 N GLN B 31 34.293 6.264 -2.953 1.00 10.00 N ATOM 997 CA GLN B 31 35.393 7.177 -3.304 1.00 10.00 C ATOM 998 C GLN B 31 36.205 7.559 -2.057 1.00 10.00 C ATOM 999 O GLN B 31 37.432 7.547 -2.100 1.00 10.00 O ATOM 1000 CB GLN B 31 34.804 8.427 -3.955 1.00 10.00 C ATOM 1001 CG GLN B 31 35.903 9.381 -4.430 1.00 10.00 C ATOM 1002 CD GLN B 31 35.327 10.641 -5.066 1.00 10.00 C ATOM 1003 OE1 GLN B 31 34.249 11.132 -4.753 1.00 10.00 O ATOM 1004 NE2 GLN B 31 36.048 11.162 -6.029 1.00 10.00 N ATOM 0 H GLN B 31 33.367 6.617 -3.194 1.00 10.00 H new ATOM 0 HA GLN B 31 36.067 6.678 -4.000 1.00 10.00 H new ATOM 0 HB2 GLN B 31 34.180 8.139 -4.801 1.00 10.00 H new ATOM 0 HB3 GLN B 31 34.158 8.940 -3.243 1.00 10.00 H new ATOM 0 HG2 GLN B 31 36.534 9.657 -3.585 1.00 10.00 H new ATOM 0 HG3 GLN B 31 36.541 8.870 -5.151 1.00 10.00 H new ATOM 0 HE21 GLN B 31 36.944 10.743 -6.279 1.00 10.00 H new ATOM 0 HE22 GLN B 31 35.713 11.986 -6.528 1.00 10.00 H new ATOM 1013 N ASP B 32 35.501 7.706 -0.938 1.00 10.00 N ATOM 1014 CA ASP B 32 36.116 8.004 0.366 1.00 10.00 C ATOM 1015 C ASP B 32 36.981 6.880 0.946 1.00 10.00 C ATOM 1016 O ASP B 32 37.881 7.159 1.741 1.00 10.00 O ATOM 1017 CB ASP B 32 35.053 8.463 1.370 1.00 10.00 C ATOM 1018 CG ASP B 32 34.565 9.886 1.073 1.00 10.00 C ATOM 1019 OD1 ASP B 32 35.392 10.704 0.610 1.00 10.00 O ATOM 1020 OD2 ASP B 32 33.375 10.135 1.362 1.00 10.00 O ATOM 0 H ASP B 32 34.485 7.623 -0.903 1.00 10.00 H new ATOM 0 HA ASP B 32 36.816 8.818 0.177 1.00 10.00 H new ATOM 0 HB2 ASP B 32 34.207 7.776 1.343 1.00 10.00 H new ATOM 0 HB3 ASP B 32 35.464 8.423 2.379 1.00 10.00 H new ATOM 1025 N LYS B 33 36.713 5.640 0.550 1.00 10.00 N ATOM 1026 CA LYS B 33 37.522 4.493 1.002 1.00 10.00 C ATOM 1027 C LYS B 33 38.538 3.984 -0.027 1.00 10.00 C ATOM 1028 O LYS B 33 39.672 3.670 0.315 1.00 10.00 O ATOM 1029 CB LYS B 33 36.643 3.321 1.445 1.00 10.00 C ATOM 1030 CG LYS B 33 35.962 3.584 2.793 1.00 10.00 C ATOM 1031 CD LYS B 33 35.542 2.275 3.475 1.00 10.00 C ATOM 1032 CE LYS B 33 36.766 1.455 3.903 1.00 10.00 C ATOM 1033 NZ LYS B 33 36.395 0.206 4.579 1.00 10.00 N ATOM 0 H LYS B 33 35.948 5.395 -0.079 1.00 10.00 H new ATOM 0 HA LYS B 33 38.087 4.886 1.847 1.00 10.00 H new ATOM 0 HB2 LYS B 33 35.883 3.132 0.687 1.00 10.00 H new ATOM 0 HB3 LYS B 33 37.252 2.420 1.517 1.00 10.00 H new ATOM 0 HG2 LYS B 33 36.642 4.133 3.444 1.00 10.00 H new ATOM 0 HG3 LYS B 33 35.086 4.215 2.642 1.00 10.00 H new ATOM 0 HD2 LYS B 33 34.927 2.497 4.347 1.00 10.00 H new ATOM 0 HD3 LYS B 33 34.928 1.687 2.793 1.00 10.00 H new ATOM 0 HE2 LYS B 33 37.370 1.224 3.026 1.00 10.00 H new ATOM 0 HE3 LYS B 33 37.387 2.055 4.569 1.00 10.00 H new ATOM 0 HZ1 LYS B 33 37.256 -0.312 4.848 1.00 10.00 H new ATOM 0 HZ2 LYS B 33 35.841 0.424 5.432 1.00 10.00 H new ATOM 0 HZ3 LYS B 33 35.825 -0.380 3.936 1.00 10.00 H new ATOM 1047 N GLU B 34 38.136 3.971 -1.293 1.00 10.00 N ATOM 1048 CA GLU B 34 38.945 3.371 -2.368 1.00 10.00 C ATOM 1049 C GLU B 34 39.661 4.383 -3.267 1.00 10.00 C ATOM 1050 O GLU B 34 40.702 4.067 -3.844 1.00 10.00 O ATOM 1051 CB GLU B 34 38.065 2.438 -3.203 1.00 10.00 C ATOM 1052 CG GLU B 34 37.644 1.197 -2.410 1.00 10.00 C ATOM 1053 CD GLU B 34 38.830 0.337 -1.949 1.00 10.00 C ATOM 1054 OE1 GLU B 34 39.790 0.197 -2.741 1.00 10.00 O ATOM 1055 OE2 GLU B 34 38.711 -0.231 -0.842 1.00 10.00 O ATOM 0 H GLU B 34 37.252 4.369 -1.609 1.00 10.00 H new ATOM 0 HA GLU B 34 39.743 2.814 -1.878 1.00 10.00 H new ATOM 0 HB2 GLU B 34 37.177 2.976 -3.536 1.00 10.00 H new ATOM 0 HB3 GLU B 34 38.606 2.132 -4.098 1.00 10.00 H new ATOM 0 HG2 GLU B 34 37.071 1.510 -1.537 1.00 10.00 H new ATOM 0 HG3 GLU B 34 36.981 0.589 -3.026 1.00 10.00 H new ATOM 1062 N GLY B 35 39.040 5.554 -3.432 1.00 10.00 N ATOM 1063 CA GLY B 35 39.553 6.610 -4.325 1.00 10.00 C ATOM 1064 C GLY B 35 38.937 6.539 -5.733 1.00 10.00 C ATOM 1065 O GLY B 35 39.255 7.347 -6.597 1.00 10.00 O ATOM 0 H GLY B 35 38.172 5.801 -2.956 1.00 10.00 H new ATOM 0 HA2 GLY B 35 39.342 7.586 -3.888 1.00 10.00 H new ATOM 0 HA3 GLY B 35 40.637 6.523 -4.401 1.00 10.00 H new ATOM 1069 N ILE B 36 38.018 5.591 -5.912 1.00 10.00 N ATOM 1070 CA ILE B 36 37.308 5.373 -7.190 1.00 10.00 C ATOM 1071 C ILE B 36 36.336 6.538 -7.441 1.00 10.00 C ATOM 1072 O ILE B 36 35.422 6.758 -6.644 1.00 10.00 O ATOM 1073 CB ILE B 36 36.580 4.014 -7.226 1.00 10.00 C ATOM 1074 CG1 ILE B 36 37.564 2.870 -6.931 1.00 10.00 C ATOM 1075 CG2 ILE B 36 35.915 3.802 -8.600 1.00 10.00 C ATOM 1076 CD1 ILE B 36 36.902 1.500 -6.726 1.00 10.00 C ATOM 0 H ILE B 36 37.737 4.944 -5.175 1.00 10.00 H new ATOM 0 HA ILE B 36 38.046 5.345 -7.992 1.00 10.00 H new ATOM 0 HB ILE B 36 35.807 4.014 -6.458 1.00 10.00 H new ATOM 0 HG12 ILE B 36 38.274 2.797 -7.754 1.00 10.00 H new ATOM 0 HG13 ILE B 36 38.136 3.121 -6.038 1.00 10.00 H new ATOM 0 HG21 ILE B 36 35.404 2.839 -8.612 1.00 10.00 H new ATOM 0 HG22 ILE B 36 35.193 4.598 -8.781 1.00 10.00 H new ATOM 0 HG23 ILE B 36 36.677 3.819 -9.379 1.00 10.00 H new ATOM 0 HD11 ILE B 36 37.669 0.752 -6.523 1.00 10.00 H new ATOM 0 HD12 ILE B 36 36.213 1.551 -5.883 1.00 10.00 H new ATOM 0 HD13 ILE B 36 36.354 1.223 -7.626 1.00 10.00 H new ATOM 1088 N PRO B 37 36.467 7.180 -8.613 1.00 10.00 N ATOM 1089 CA PRO B 37 35.534 8.225 -9.067 1.00 10.00 C ATOM 1090 C PRO B 37 34.106 7.655 -9.168 1.00 10.00 C ATOM 1091 O PRO B 37 33.899 6.618 -9.799 1.00 10.00 O ATOM 1092 CB PRO B 37 36.053 8.637 -10.444 1.00 10.00 C ATOM 1093 CG PRO B 37 37.553 8.382 -10.335 1.00 10.00 C ATOM 1094 CD PRO B 37 37.625 7.091 -9.521 1.00 10.00 C ATOM 0 HA PRO B 37 35.486 9.070 -8.380 1.00 10.00 H new ATOM 0 HB2 PRO B 37 35.600 8.046 -11.240 1.00 10.00 H new ATOM 0 HB3 PRO B 37 35.836 9.683 -10.661 1.00 10.00 H new ATOM 0 HG2 PRO B 37 38.015 8.267 -11.316 1.00 10.00 H new ATOM 0 HG3 PRO B 37 38.067 9.203 -9.835 1.00 10.00 H new ATOM 0 HD2 PRO B 37 37.564 6.211 -10.161 1.00 10.00 H new ATOM 0 HD3 PRO B 37 38.562 7.019 -8.968 1.00 10.00 H new ATOM 1102 N PRO B 38 33.128 8.339 -8.546 1.00 10.00 N ATOM 1103 CA PRO B 38 31.707 7.927 -8.521 1.00 10.00 C ATOM 1104 C PRO B 38 31.084 7.739 -9.907 1.00 10.00 C ATOM 1105 O PRO B 38 30.407 6.765 -10.168 1.00 10.00 O ATOM 1106 CB PRO B 38 30.986 9.056 -7.784 1.00 10.00 C ATOM 1107 CG PRO B 38 32.058 9.590 -6.841 1.00 10.00 C ATOM 1108 CD PRO B 38 33.326 9.521 -7.693 1.00 10.00 C ATOM 0 HA PRO B 38 31.618 6.952 -8.041 1.00 10.00 H new ATOM 0 HB2 PRO B 38 30.633 9.825 -8.471 1.00 10.00 H new ATOM 0 HB3 PRO B 38 30.115 8.691 -7.240 1.00 10.00 H new ATOM 0 HG2 PRO B 38 31.842 10.609 -6.519 1.00 10.00 H new ATOM 0 HG3 PRO B 38 32.143 8.982 -5.940 1.00 10.00 H new ATOM 0 HD2 PRO B 38 33.454 10.425 -8.289 1.00 10.00 H new ATOM 0 HD3 PRO B 38 34.217 9.419 -7.073 1.00 10.00 H new ATOM 1116 N ASP B 39 31.500 8.615 -10.839 1.00 10.00 N ATOM 1117 CA ASP B 39 31.040 8.593 -12.238 1.00 10.00 C ATOM 1118 C ASP B 39 31.705 7.509 -13.108 1.00 10.00 C ATOM 1119 O ASP B 39 31.703 7.589 -14.333 1.00 10.00 O ATOM 1120 CB ASP B 39 31.234 9.999 -12.844 1.00 10.00 C ATOM 1121 CG ASP B 39 32.678 10.529 -12.828 1.00 10.00 C ATOM 1122 OD1 ASP B 39 33.430 10.173 -11.890 1.00 10.00 O ATOM 1123 OD2 ASP B 39 32.978 11.365 -13.702 1.00 10.00 O ATOM 0 H ASP B 39 32.167 9.361 -10.642 1.00 10.00 H new ATOM 0 HA ASP B 39 29.984 8.323 -12.229 1.00 10.00 H new ATOM 0 HB2 ASP B 39 30.882 9.984 -13.875 1.00 10.00 H new ATOM 0 HB3 ASP B 39 30.601 10.701 -12.301 1.00 10.00 H new ATOM 1128 N GLN B 40 32.343 6.545 -12.447 1.00 10.00 N ATOM 1129 CA GLN B 40 32.911 5.354 -13.104 1.00 10.00 C ATOM 1130 C GLN B 40 32.460 4.050 -12.409 1.00 10.00 C ATOM 1131 O GLN B 40 32.910 2.951 -12.721 1.00 10.00 O ATOM 1132 CB GLN B 40 34.434 5.494 -13.083 1.00 10.00 C ATOM 1133 CG GLN B 40 35.102 4.488 -14.027 1.00 10.00 C ATOM 1134 CD GLN B 40 36.587 4.269 -13.726 1.00 10.00 C ATOM 1135 OE1 GLN B 40 37.385 3.958 -14.599 1.00 10.00 O ATOM 1136 NE2 GLN B 40 36.976 4.409 -12.475 1.00 10.00 N ATOM 0 H GLN B 40 32.485 6.562 -11.437 1.00 10.00 H new ATOM 0 HA GLN B 40 32.551 5.291 -14.131 1.00 10.00 H new ATOM 0 HB2 GLN B 40 34.712 6.507 -13.373 1.00 10.00 H new ATOM 0 HB3 GLN B 40 34.801 5.342 -12.068 1.00 10.00 H new ATOM 0 HG2 GLN B 40 34.580 3.534 -13.958 1.00 10.00 H new ATOM 0 HG3 GLN B 40 34.994 4.837 -15.054 1.00 10.00 H new ATOM 0 HE21 GLN B 40 36.300 4.669 -11.757 1.00 10.00 H new ATOM 0 HE22 GLN B 40 37.953 4.258 -12.225 1.00 10.00 H new ATOM 1145 N GLN B 41 31.549 4.199 -11.451 1.00 10.00 N ATOM 1146 CA GLN B 41 31.023 3.072 -10.669 1.00 10.00 C ATOM 1147 C GLN B 41 29.637 2.690 -11.198 1.00 10.00 C ATOM 1148 O GLN B 41 28.791 3.540 -11.450 1.00 10.00 O ATOM 1149 CB GLN B 41 30.862 3.512 -9.214 1.00 10.00 C ATOM 1150 CG GLN B 41 32.164 3.987 -8.569 1.00 10.00 C ATOM 1151 CD GLN B 41 31.918 4.426 -7.126 1.00 10.00 C ATOM 1152 OE1 GLN B 41 31.185 3.822 -6.357 1.00 10.00 O ATOM 1153 NE2 GLN B 41 32.582 5.485 -6.722 1.00 10.00 N ATOM 0 H GLN B 41 31.152 5.102 -11.191 1.00 10.00 H new ATOM 0 HA GLN B 41 31.707 2.227 -10.747 1.00 10.00 H new ATOM 0 HB2 GLN B 41 30.128 4.317 -9.166 1.00 10.00 H new ATOM 0 HB3 GLN B 41 30.462 2.680 -8.634 1.00 10.00 H new ATOM 0 HG2 GLN B 41 32.901 3.184 -8.590 1.00 10.00 H new ATOM 0 HG3 GLN B 41 32.579 4.816 -9.142 1.00 10.00 H new ATOM 0 HE21 GLN B 41 33.192 5.983 -7.371 1.00 10.00 H new ATOM 0 HE22 GLN B 41 32.488 5.809 -5.760 1.00 10.00 H new ATOM 1162 N ARG B 42 29.466 1.379 -11.373 1.00 10.00 N ATOM 1163 CA ARG B 42 28.162 0.775 -11.698 1.00 10.00 C ATOM 1164 C ARG B 42 27.838 -0.269 -10.626 1.00 10.00 C ATOM 1165 O ARG B 42 28.538 -1.268 -10.494 1.00 10.00 O ATOM 1166 CB ARG B 42 28.193 0.113 -13.081 1.00 10.00 C ATOM 1167 CG ARG B 42 28.364 1.146 -14.198 1.00 10.00 C ATOM 1168 CD ARG B 42 28.607 0.483 -15.554 1.00 10.00 C ATOM 1169 NE ARG B 42 27.410 -0.193 -16.087 1.00 10.00 N ATOM 1170 CZ ARG B 42 27.384 -0.898 -17.228 1.00 10.00 C ATOM 1171 NH1 ARG B 42 28.476 -1.059 -17.958 1.00 10.00 N ATOM 1172 NH2 ARG B 42 26.251 -1.403 -17.670 1.00 10.00 N ATOM 0 H ARG B 42 30.224 0.701 -11.295 1.00 10.00 H new ATOM 0 HA ARG B 42 27.397 1.551 -11.719 1.00 10.00 H new ATOM 0 HB2 ARG B 42 29.011 -0.607 -13.122 1.00 10.00 H new ATOM 0 HB3 ARG B 42 27.270 -0.444 -13.239 1.00 10.00 H new ATOM 0 HG2 ARG B 42 27.473 1.771 -14.254 1.00 10.00 H new ATOM 0 HG3 ARG B 42 29.200 1.803 -13.960 1.00 10.00 H new ATOM 0 HD2 ARG B 42 28.939 1.238 -16.267 1.00 10.00 H new ATOM 0 HD3 ARG B 42 29.415 -0.242 -15.458 1.00 10.00 H new ATOM 0 HE ARG B 42 26.544 -0.120 -15.553 1.00 10.00 H new ATOM 0 HH11 ARG B 42 29.357 -0.644 -17.656 1.00 10.00 H new ATOM 0 HH12 ARG B 42 28.436 -1.599 -18.823 1.00 10.00 H new ATOM 0 HH21 ARG B 42 25.389 -1.259 -17.144 1.00 10.00 H new ATOM 0 HH22 ARG B 42 26.236 -1.938 -18.538 1.00 10.00 H new ATOM 1186 N LEU B 43 26.862 0.074 -9.787 1.00 10.00 N ATOM 1187 CA LEU B 43 26.467 -0.785 -8.655 1.00 10.00 C ATOM 1188 C LEU B 43 25.264 -1.662 -9.003 1.00 10.00 C ATOM 1189 O LEU B 43 24.300 -1.204 -9.600 1.00 10.00 O ATOM 1190 CB LEU B 43 26.127 0.047 -7.415 1.00 10.00 C ATOM 1191 CG LEU B 43 27.302 0.861 -6.861 1.00 10.00 C ATOM 1192 CD1 LEU B 43 26.835 1.630 -5.627 1.00 10.00 C ATOM 1193 CD2 LEU B 43 28.488 -0.032 -6.486 1.00 10.00 C ATOM 0 H LEU B 43 26.326 0.939 -9.864 1.00 10.00 H new ATOM 0 HA LEU B 43 27.324 -1.423 -8.441 1.00 10.00 H new ATOM 0 HB2 LEU B 43 25.312 0.728 -7.661 1.00 10.00 H new ATOM 0 HB3 LEU B 43 25.761 -0.619 -6.634 1.00 10.00 H new ATOM 0 HG LEU B 43 27.637 1.548 -7.639 1.00 10.00 H new ATOM 0 HD11 LEU B 43 27.664 2.212 -5.226 1.00 10.00 H new ATOM 0 HD12 LEU B 43 26.021 2.300 -5.903 1.00 10.00 H new ATOM 0 HD13 LEU B 43 26.486 0.927 -4.871 1.00 10.00 H new ATOM 0 HD21 LEU B 43 29.299 0.584 -6.098 1.00 10.00 H new ATOM 0 HD22 LEU B 43 28.178 -0.747 -5.724 1.00 10.00 H new ATOM 0 HD23 LEU B 43 28.832 -0.570 -7.369 1.00 10.00 H new ATOM 1205 N ILE B 44 25.376 -2.924 -8.593 1.00 10.00 N ATOM 1206 CA ILE B 44 24.345 -3.945 -8.856 1.00 10.00 C ATOM 1207 C ILE B 44 23.841 -4.489 -7.516 1.00 10.00 C ATOM 1208 O ILE B 44 24.630 -4.799 -6.624 1.00 10.00 O ATOM 1209 CB ILE B 44 24.897 -5.080 -9.761 1.00 10.00 C ATOM 1210 CG1 ILE B 44 25.159 -4.611 -11.200 1.00 10.00 C ATOM 1211 CG2 ILE B 44 23.975 -6.308 -9.852 1.00 10.00 C ATOM 1212 CD1 ILE B 44 26.390 -3.720 -11.393 1.00 10.00 C ATOM 0 H ILE B 44 26.179 -3.274 -8.070 1.00 10.00 H new ATOM 0 HA ILE B 44 23.513 -3.493 -9.396 1.00 10.00 H new ATOM 0 HB ILE B 44 25.828 -5.362 -9.270 1.00 10.00 H new ATOM 0 HG12 ILE B 44 25.266 -5.490 -11.836 1.00 10.00 H new ATOM 0 HG13 ILE B 44 24.281 -4.068 -11.551 1.00 10.00 H new ATOM 0 HG21 ILE B 44 24.429 -7.056 -10.501 1.00 10.00 H new ATOM 0 HG22 ILE B 44 23.831 -6.730 -8.857 1.00 10.00 H new ATOM 0 HG23 ILE B 44 23.010 -6.009 -10.262 1.00 10.00 H new ATOM 0 HD11 ILE B 44 26.480 -3.447 -12.444 1.00 10.00 H new ATOM 0 HD12 ILE B 44 26.283 -2.817 -10.792 1.00 10.00 H new ATOM 0 HD13 ILE B 44 27.283 -4.261 -11.080 1.00 10.00 H new ATOM 1224 N PHE B 45 22.533 -4.707 -7.493 1.00 10.00 N ATOM 1225 CA PHE B 45 21.860 -5.440 -6.410 1.00 10.00 C ATOM 1226 C PHE B 45 20.549 -6.029 -6.937 1.00 10.00 C ATOM 1227 O PHE B 45 19.784 -5.343 -7.610 1.00 10.00 O ATOM 1228 CB PHE B 45 21.587 -4.507 -5.228 1.00 10.00 C ATOM 1229 CG PHE B 45 20.927 -5.264 -4.076 1.00 10.00 C ATOM 1230 CD1 PHE B 45 21.691 -6.101 -3.272 1.00 10.00 C ATOM 1231 CD2 PHE B 45 19.563 -5.126 -3.851 1.00 10.00 C ATOM 1232 CE1 PHE B 45 21.087 -6.806 -2.242 1.00 10.00 C ATOM 1233 CE2 PHE B 45 18.960 -5.824 -2.812 1.00 10.00 C ATOM 1234 CZ PHE B 45 19.723 -6.665 -2.008 1.00 10.00 C ATOM 0 H PHE B 45 21.900 -4.382 -8.224 1.00 10.00 H new ATOM 0 HA PHE B 45 22.505 -6.248 -6.065 1.00 10.00 H new ATOM 0 HB2 PHE B 45 22.522 -4.062 -4.887 1.00 10.00 H new ATOM 0 HB3 PHE B 45 20.942 -3.688 -5.547 1.00 10.00 H new ATOM 0 HD1 PHE B 45 22.752 -6.202 -3.449 1.00 10.00 H new ATOM 0 HD2 PHE B 45 18.973 -4.478 -4.482 1.00 10.00 H new ATOM 0 HE1 PHE B 45 21.676 -7.465 -1.621 1.00 10.00 H new ATOM 0 HE2 PHE B 45 17.901 -5.714 -2.629 1.00 10.00 H new ATOM 0 HZ PHE B 45 19.255 -7.209 -1.201 1.00 10.00 H new ATOM 1244 N ALA B 46 20.396 -7.334 -6.714 1.00 10.00 N ATOM 1245 CA ALA B 46 19.189 -8.099 -7.120 1.00 10.00 C ATOM 1246 C ALA B 46 18.967 -8.073 -8.648 1.00 10.00 C ATOM 1247 O ALA B 46 17.842 -7.951 -9.158 1.00 10.00 O ATOM 1248 CB ALA B 46 17.977 -7.607 -6.309 1.00 10.00 C ATOM 0 H ALA B 46 21.101 -7.904 -6.246 1.00 10.00 H new ATOM 0 HA ALA B 46 19.336 -9.153 -6.886 1.00 10.00 H new ATOM 0 HB1 ALA B 46 17.090 -8.167 -6.605 1.00 10.00 H new ATOM 0 HB2 ALA B 46 18.164 -7.759 -5.246 1.00 10.00 H new ATOM 0 HB3 ALA B 46 17.817 -6.546 -6.501 1.00 10.00 H new ATOM 1254 N GLY B 47 20.076 -8.168 -9.377 1.00 10.00 N ATOM 1255 CA GLY B 47 20.098 -8.177 -10.861 1.00 10.00 C ATOM 1256 C GLY B 47 19.621 -6.861 -11.496 1.00 10.00 C ATOM 1257 O GLY B 47 19.097 -6.851 -12.609 1.00 10.00 O ATOM 0 H GLY B 47 21.004 -8.243 -8.960 1.00 10.00 H new ATOM 0 HA2 GLY B 47 21.113 -8.386 -11.199 1.00 10.00 H new ATOM 0 HA3 GLY B 47 19.469 -8.992 -11.220 1.00 10.00 H new ATOM 1261 N LYS B 48 19.869 -5.763 -10.793 1.00 10.00 N ATOM 1262 CA LYS B 48 19.483 -4.409 -11.228 1.00 10.00 C ATOM 1263 C LYS B 48 20.684 -3.466 -11.102 1.00 10.00 C ATOM 1264 O LYS B 48 21.477 -3.580 -10.173 1.00 10.00 O ATOM 1265 CB LYS B 48 18.348 -3.891 -10.340 1.00 10.00 C ATOM 1266 CG LYS B 48 16.982 -4.455 -10.749 1.00 10.00 C ATOM 1267 CD LYS B 48 15.853 -3.888 -9.883 1.00 10.00 C ATOM 1268 CE LYS B 48 16.121 -4.007 -8.377 1.00 10.00 C ATOM 1269 NZ LYS B 48 16.380 -5.401 -7.992 1.00 10.00 N ATOM 0 H LYS B 48 20.349 -5.778 -9.893 1.00 10.00 H new ATOM 0 HA LYS B 48 19.153 -4.447 -12.266 1.00 10.00 H new ATOM 0 HB2 LYS B 48 18.552 -4.157 -9.303 1.00 10.00 H new ATOM 0 HB3 LYS B 48 18.319 -2.803 -10.391 1.00 10.00 H new ATOM 0 HG2 LYS B 48 16.790 -4.221 -11.796 1.00 10.00 H new ATOM 0 HG3 LYS B 48 16.996 -5.541 -10.663 1.00 10.00 H new ATOM 0 HD2 LYS B 48 15.703 -2.838 -10.136 1.00 10.00 H new ATOM 0 HD3 LYS B 48 14.926 -4.409 -10.122 1.00 10.00 H new ATOM 0 HE2 LYS B 48 16.976 -3.388 -8.107 1.00 10.00 H new ATOM 0 HE3 LYS B 48 15.264 -3.627 -7.821 1.00 10.00 H new ATOM 0 HZ1 LYS B 48 16.142 -5.534 -6.988 1.00 10.00 H new ATOM 0 HZ2 LYS B 48 15.796 -6.036 -8.573 1.00 10.00 H new ATOM 0 HZ3 LYS B 48 17.385 -5.621 -8.141 1.00 10.00 H new ATOM 1283 N GLN B 49 20.820 -2.595 -12.105 1.00 10.00 N ATOM 1284 CA GLN B 49 21.807 -1.503 -12.051 1.00 10.00 C ATOM 1285 C GLN B 49 21.198 -0.341 -11.262 1.00 10.00 C ATOM 1286 O GLN B 49 20.069 0.074 -11.494 1.00 10.00 O ATOM 1287 CB GLN B 49 22.179 -1.014 -13.453 1.00 10.00 C ATOM 1288 CG GLN B 49 22.711 -2.152 -14.327 1.00 10.00 C ATOM 1289 CD GLN B 49 23.461 -1.628 -15.552 1.00 10.00 C ATOM 1290 OE1 GLN B 49 24.252 -0.694 -15.497 1.00 10.00 O ATOM 1291 NE2 GLN B 49 23.272 -2.292 -16.668 1.00 10.00 N ATOM 0 H GLN B 49 20.265 -2.620 -12.961 1.00 10.00 H new ATOM 0 HA GLN B 49 22.713 -1.873 -11.571 1.00 10.00 H new ATOM 0 HB2 GLN B 49 21.304 -0.569 -13.927 1.00 10.00 H new ATOM 0 HB3 GLN B 49 22.933 -0.231 -13.377 1.00 10.00 H new ATOM 0 HG2 GLN B 49 23.376 -2.783 -13.737 1.00 10.00 H new ATOM 0 HG3 GLN B 49 21.881 -2.780 -14.651 1.00 10.00 H new ATOM 0 HE21 GLN B 49 22.609 -3.067 -16.694 1.00 10.00 H new ATOM 0 HE22 GLN B 49 23.788 -2.033 -17.509 1.00 10.00 H new ATOM 1300 N LEU B 50 21.983 0.144 -10.304 1.00 10.00 N ATOM 1301 CA LEU B 50 21.502 1.177 -9.377 1.00 10.00 C ATOM 1302 C LEU B 50 21.591 2.572 -10.005 1.00 10.00 C ATOM 1303 O LEU B 50 22.578 2.952 -10.615 1.00 10.00 O ATOM 1304 CB LEU B 50 22.268 1.068 -8.056 1.00 10.00 C ATOM 1305 CG LEU B 50 22.250 -0.353 -7.470 1.00 10.00 C ATOM 1306 CD1 LEU B 50 22.938 -0.356 -6.109 1.00 10.00 C ATOM 1307 CD2 LEU B 50 20.844 -0.954 -7.349 1.00 10.00 C ATOM 0 H LEU B 50 22.945 -0.154 -10.146 1.00 10.00 H new ATOM 0 HA LEU B 50 20.445 1.015 -9.165 1.00 10.00 H new ATOM 0 HB2 LEU B 50 23.301 1.377 -8.214 1.00 10.00 H new ATOM 0 HB3 LEU B 50 21.835 1.759 -7.333 1.00 10.00 H new ATOM 0 HG LEU B 50 22.791 -0.986 -8.174 1.00 10.00 H new ATOM 0 HD11 LEU B 50 22.924 -1.365 -5.696 1.00 10.00 H new ATOM 0 HD12 LEU B 50 23.970 -0.025 -6.222 1.00 10.00 H new ATOM 0 HD13 LEU B 50 22.412 0.320 -5.434 1.00 10.00 H new ATOM 0 HD21 LEU B 50 20.912 -1.957 -6.928 1.00 10.00 H new ATOM 0 HD22 LEU B 50 20.235 -0.327 -6.697 1.00 10.00 H new ATOM 0 HD23 LEU B 50 20.384 -1.005 -8.336 1.00 10.00 H new ATOM 1319 N GLU B 51 20.503 3.318 -9.816 1.00 10.00 N ATOM 1320 CA GLU B 51 20.317 4.648 -10.399 1.00 10.00 C ATOM 1321 C GLU B 51 20.707 5.734 -9.403 1.00 10.00 C ATOM 1322 O GLU B 51 20.214 5.749 -8.282 1.00 10.00 O ATOM 1323 CB GLU B 51 18.852 4.802 -10.791 1.00 10.00 C ATOM 1324 CG GLU B 51 18.337 3.713 -11.729 1.00 10.00 C ATOM 1325 CD GLU B 51 19.079 3.690 -13.047 1.00 10.00 C ATOM 1326 OE1 GLU B 51 18.733 4.493 -13.938 1.00 10.00 O ATOM 1327 OE2 GLU B 51 19.993 2.856 -13.206 1.00 10.00 O ATOM 0 H GLU B 51 19.715 3.012 -9.246 1.00 10.00 H new ATOM 0 HA GLU B 51 20.955 4.753 -11.276 1.00 10.00 H new ATOM 0 HB2 GLU B 51 18.244 4.804 -9.886 1.00 10.00 H new ATOM 0 HB3 GLU B 51 18.716 5.772 -11.269 1.00 10.00 H new ATOM 0 HG2 GLU B 51 18.435 2.742 -11.243 1.00 10.00 H new ATOM 0 HG3 GLU B 51 17.275 3.870 -11.916 1.00 10.00 H new ATOM 1334 N ASP B 52 21.518 6.674 -9.864 1.00 10.00 N ATOM 1335 CA ASP B 52 22.105 7.719 -8.991 1.00 10.00 C ATOM 1336 C ASP B 52 21.092 8.482 -8.130 1.00 10.00 C ATOM 1337 O ASP B 52 21.299 8.604 -6.917 1.00 10.00 O ATOM 1338 CB ASP B 52 22.921 8.719 -9.819 1.00 10.00 C ATOM 1339 CG ASP B 52 24.242 8.132 -10.315 1.00 10.00 C ATOM 1340 OD1 ASP B 52 24.882 7.412 -9.516 1.00 10.00 O ATOM 1341 OD2 ASP B 52 24.544 8.377 -11.501 1.00 10.00 O ATOM 0 H ASP B 52 21.795 6.747 -10.843 1.00 10.00 H new ATOM 0 HA ASP B 52 22.746 7.175 -8.298 1.00 10.00 H new ATOM 0 HB2 ASP B 52 22.329 9.045 -10.674 1.00 10.00 H new ATOM 0 HB3 ASP B 52 23.125 9.604 -9.216 1.00 10.00 H new ATOM 1346 N GLY B 53 19.981 8.897 -8.776 1.00 10.00 N ATOM 1347 CA GLY B 53 18.910 9.658 -8.123 1.00 10.00 C ATOM 1348 C GLY B 53 17.928 8.827 -7.293 1.00 10.00 C ATOM 1349 O GLY B 53 16.894 9.346 -6.852 1.00 10.00 O ATOM 0 H GLY B 53 19.808 8.711 -9.764 1.00 10.00 H new ATOM 0 HA2 GLY B 53 19.363 10.408 -7.475 1.00 10.00 H new ATOM 0 HA3 GLY B 53 18.349 10.195 -8.889 1.00 10.00 H new ATOM 1353 N ARG B 54 18.215 7.536 -7.117 1.00 10.00 N ATOM 1354 CA ARG B 54 17.384 6.651 -6.286 1.00 10.00 C ATOM 1355 C ARG B 54 18.106 6.417 -4.962 1.00 10.00 C ATOM 1356 O ARG B 54 19.258 6.828 -4.798 1.00 10.00 O ATOM 1357 CB ARG B 54 17.111 5.305 -6.984 1.00 10.00 C ATOM 1358 CG ARG B 54 16.408 5.395 -8.350 1.00 10.00 C ATOM 1359 CD ARG B 54 15.007 6.018 -8.305 1.00 10.00 C ATOM 1360 NE ARG B 54 14.027 5.146 -7.663 1.00 10.00 N ATOM 1361 CZ ARG B 54 12.717 5.116 -7.935 1.00 10.00 C ATOM 1362 NH1 ARG B 54 12.192 5.804 -8.942 1.00 10.00 N ATOM 1363 NH2 ARG B 54 11.919 4.408 -7.157 1.00 10.00 N ATOM 0 H ARG B 54 19.020 7.074 -7.540 1.00 10.00 H new ATOM 0 HA ARG B 54 16.419 7.128 -6.117 1.00 10.00 H new ATOM 0 HB2 ARG B 54 18.060 4.786 -7.118 1.00 10.00 H new ATOM 0 HB3 ARG B 54 16.502 4.690 -6.322 1.00 10.00 H new ATOM 0 HG2 ARG B 54 17.030 5.980 -9.027 1.00 10.00 H new ATOM 0 HG3 ARG B 54 16.333 4.393 -8.772 1.00 10.00 H new ATOM 0 HD2 ARG B 54 15.052 6.966 -7.769 1.00 10.00 H new ATOM 0 HD3 ARG B 54 14.680 6.241 -9.320 1.00 10.00 H new ATOM 0 HE ARG B 54 14.370 4.506 -6.947 1.00 10.00 H new ATOM 0 HH11 ARG B 54 12.792 6.377 -9.535 1.00 10.00 H new ATOM 0 HH12 ARG B 54 11.189 5.759 -9.122 1.00 10.00 H new ATOM 0 HH21 ARG B 54 12.304 3.895 -6.364 1.00 10.00 H new ATOM 0 HH22 ARG B 54 10.918 4.374 -7.349 1.00 10.00 H new ATOM 1377 N THR B 55 17.440 5.744 -4.033 1.00 10.00 N ATOM 1378 CA THR B 55 18.007 5.480 -2.707 1.00 10.00 C ATOM 1379 C THR B 55 18.074 3.983 -2.416 1.00 10.00 C ATOM 1380 O THR B 55 17.549 3.172 -3.176 1.00 10.00 O ATOM 1381 CB THR B 55 17.170 6.136 -1.589 1.00 10.00 C ATOM 1382 OG1 THR B 55 15.815 5.689 -1.686 1.00 10.00 O ATOM 1383 CG2 THR B 55 17.224 7.667 -1.659 1.00 10.00 C ATOM 0 H THR B 55 16.502 5.367 -4.169 1.00 10.00 H new ATOM 0 HA THR B 55 19.010 5.906 -2.719 1.00 10.00 H new ATOM 0 HB THR B 55 17.593 5.838 -0.630 1.00 10.00 H new ATOM 0 HG1 THR B 55 15.575 5.193 -0.875 1.00 10.00 H new ATOM 0 HG21 THR B 55 16.622 8.089 -0.855 1.00 10.00 H new ATOM 0 HG22 THR B 55 18.256 8.000 -1.553 1.00 10.00 H new ATOM 0 HG23 THR B 55 16.832 8.001 -2.620 1.00 10.00 H new ATOM 1391 N LEU B 56 18.729 3.632 -1.309 1.00 10.00 N ATOM 1392 CA LEU B 56 18.867 2.218 -0.896 1.00 10.00 C ATOM 1393 C LEU B 56 17.518 1.527 -0.642 1.00 10.00 C ATOM 1394 O LEU B 56 17.266 0.428 -1.132 1.00 10.00 O ATOM 1395 CB LEU B 56 19.729 2.104 0.365 1.00 10.00 C ATOM 1396 CG LEU B 56 21.175 2.548 0.142 1.00 10.00 C ATOM 1397 CD1 LEU B 56 21.923 2.457 1.466 1.00 10.00 C ATOM 1398 CD2 LEU B 56 21.900 1.689 -0.894 1.00 10.00 C ATOM 0 H LEU B 56 19.174 4.298 -0.678 1.00 10.00 H new ATOM 0 HA LEU B 56 19.348 1.710 -1.732 1.00 10.00 H new ATOM 0 HB2 LEU B 56 19.287 2.709 1.157 1.00 10.00 H new ATOM 0 HB3 LEU B 56 19.721 1.071 0.712 1.00 10.00 H new ATOM 0 HG LEU B 56 21.153 3.570 -0.236 1.00 10.00 H new ATOM 0 HD11 LEU B 56 22.957 2.771 1.322 1.00 10.00 H new ATOM 0 HD12 LEU B 56 21.445 3.107 2.199 1.00 10.00 H new ATOM 0 HD13 LEU B 56 21.903 1.428 1.825 1.00 10.00 H new ATOM 0 HD21 LEU B 56 22.922 2.048 -1.013 1.00 10.00 H new ATOM 0 HD22 LEU B 56 21.916 0.652 -0.559 1.00 10.00 H new ATOM 0 HD23 LEU B 56 21.379 1.754 -1.849 1.00 10.00 H new ATOM 1410 N SER B 57 16.599 2.303 -0.047 1.00 10.00 N ATOM 1411 CA SER B 57 15.231 1.848 0.238 1.00 10.00 C ATOM 1412 C SER B 57 14.489 1.466 -1.046 1.00 10.00 C ATOM 1413 O SER B 57 13.583 0.634 -1.018 1.00 10.00 O ATOM 1414 CB SER B 57 14.449 2.948 0.989 1.00 10.00 C ATOM 1415 OG SER B 57 14.429 4.161 0.258 1.00 10.00 O ATOM 0 H SER B 57 16.783 3.261 0.249 1.00 10.00 H new ATOM 0 HA SER B 57 15.300 0.960 0.866 1.00 10.00 H new ATOM 0 HB2 SER B 57 13.427 2.612 1.167 1.00 10.00 H new ATOM 0 HB3 SER B 57 14.904 3.117 1.965 1.00 10.00 H new ATOM 0 HG SER B 57 13.926 4.836 0.759 1.00 10.00 H new ATOM 1421 N ASP B 58 14.873 2.091 -2.165 1.00 10.00 N ATOM 1422 CA ASP B 58 14.228 1.852 -3.471 1.00 10.00 C ATOM 1423 C ASP B 58 14.568 0.474 -4.050 1.00 10.00 C ATOM 1424 O ASP B 58 14.118 0.123 -5.144 1.00 10.00 O ATOM 1425 CB ASP B 58 14.631 2.938 -4.474 1.00 10.00 C ATOM 1426 CG ASP B 58 13.881 4.232 -4.280 1.00 10.00 C ATOM 1427 OD1 ASP B 58 12.663 4.197 -3.968 1.00 10.00 O ATOM 1428 OD2 ASP B 58 14.513 5.290 -4.447 1.00 10.00 O ATOM 0 H ASP B 58 15.632 2.772 -2.197 1.00 10.00 H new ATOM 0 HA ASP B 58 13.152 1.885 -3.299 1.00 10.00 H new ATOM 0 HB2 ASP B 58 15.701 3.128 -4.384 1.00 10.00 H new ATOM 0 HB3 ASP B 58 14.456 2.572 -5.486 1.00 10.00 H new ATOM 1433 N TYR B 59 15.376 -0.292 -3.322 1.00 10.00 N ATOM 1434 CA TYR B 59 15.785 -1.637 -3.745 1.00 10.00 C ATOM 1435 C TYR B 59 15.673 -2.644 -2.593 1.00 10.00 C ATOM 1436 O TYR B 59 15.866 -3.851 -2.783 1.00 10.00 O ATOM 1437 CB TYR B 59 17.227 -1.594 -4.240 1.00 10.00 C ATOM 1438 CG TYR B 59 17.455 -0.672 -5.403 1.00 10.00 C ATOM 1439 CD1 TYR B 59 17.039 -1.029 -6.680 1.00 10.00 C ATOM 1440 CD2 TYR B 59 18.135 0.527 -5.238 1.00 10.00 C ATOM 1441 CE1 TYR B 59 17.299 -0.215 -7.764 1.00 10.00 C ATOM 1442 CE2 TYR B 59 18.387 1.350 -6.317 1.00 10.00 C ATOM 1443 CZ TYR B 59 17.975 0.968 -7.578 1.00 10.00 C ATOM 1444 OH TYR B 59 18.249 1.771 -8.654 1.00 10.00 O ATOM 0 H TYR B 59 15.767 -0.003 -2.425 1.00 10.00 H new ATOM 0 HA TYR B 59 15.120 -1.960 -4.546 1.00 10.00 H new ATOM 0 HB2 TYR B 59 17.872 -1.287 -3.417 1.00 10.00 H new ATOM 0 HB3 TYR B 59 17.531 -2.601 -4.525 1.00 10.00 H new ATOM 0 HD1 TYR B 59 16.505 -1.956 -6.826 1.00 10.00 H new ATOM 0 HD2 TYR B 59 18.471 0.819 -4.254 1.00 10.00 H new ATOM 0 HE1 TYR B 59 16.974 -0.505 -8.752 1.00 10.00 H new ATOM 0 HE2 TYR B 59 18.904 2.288 -6.176 1.00 10.00 H new ATOM 0 HH TYR B 59 17.967 2.689 -8.458 1.00 10.00 H new ATOM 1454 N ASN B 60 15.349 -2.125 -1.403 1.00 10.00 N ATOM 1455 CA ASN B 60 15.203 -2.926 -0.176 1.00 10.00 C ATOM 1456 C ASN B 60 16.547 -3.526 0.288 1.00 10.00 C ATOM 1457 O ASN B 60 16.629 -4.663 0.756 1.00 10.00 O ATOM 1458 CB ASN B 60 14.117 -3.993 -0.351 1.00 10.00 C ATOM 1459 CG ASN B 60 13.408 -4.335 0.951 1.00 10.00 C ATOM 1460 OD1 ASN B 60 13.290 -3.502 1.854 1.00 10.00 O ATOM 1461 ND2 ASN B 60 12.944 -5.564 1.057 1.00 10.00 N ATOM 0 H ASN B 60 15.179 -1.129 -1.260 1.00 10.00 H new ATOM 0 HA ASN B 60 14.880 -2.258 0.623 1.00 10.00 H new ATOM 0 HB2 ASN B 60 13.384 -3.642 -1.077 1.00 10.00 H new ATOM 0 HB3 ASN B 60 14.566 -4.897 -0.763 1.00 10.00 H new ATOM 0 HD21 ASN B 60 12.466 -5.857 1.909 1.00 10.00 H new ATOM 0 HD22 ASN B 60 13.062 -6.222 0.287 1.00 10.00 H new ATOM 1468 N ILE B 61 17.597 -2.737 0.117 1.00 10.00 N ATOM 1469 CA ILE B 61 18.957 -3.069 0.593 1.00 10.00 C ATOM 1470 C ILE B 61 18.962 -2.884 2.112 1.00 10.00 C ATOM 1471 O ILE B 61 18.958 -1.764 2.618 1.00 10.00 O ATOM 1472 CB ILE B 61 20.017 -2.198 -0.108 1.00 10.00 C ATOM 1473 CG1 ILE B 61 19.942 -2.432 -1.625 1.00 10.00 C ATOM 1474 CG2 ILE B 61 21.428 -2.473 0.444 1.00 10.00 C ATOM 1475 CD1 ILE B 61 20.847 -1.543 -2.482 1.00 10.00 C ATOM 0 H ILE B 61 17.542 -1.837 -0.359 1.00 10.00 H new ATOM 0 HA ILE B 61 19.215 -4.099 0.349 1.00 10.00 H new ATOM 0 HB ILE B 61 19.807 -1.148 0.095 1.00 10.00 H new ATOM 0 HG12 ILE B 61 20.192 -3.474 -1.826 1.00 10.00 H new ATOM 0 HG13 ILE B 61 18.911 -2.285 -1.946 1.00 10.00 H new ATOM 0 HG21 ILE B 61 22.150 -1.841 -0.073 1.00 10.00 H new ATOM 0 HG22 ILE B 61 21.451 -2.252 1.511 1.00 10.00 H new ATOM 0 HG23 ILE B 61 21.683 -3.521 0.285 1.00 10.00 H new ATOM 0 HD11 ILE B 61 20.713 -1.794 -3.534 1.00 10.00 H new ATOM 0 HD12 ILE B 61 20.586 -0.497 -2.322 1.00 10.00 H new ATOM 0 HD13 ILE B 61 21.888 -1.704 -2.200 1.00 10.00 H new ATOM 1487 N GLN B 62 18.984 -4.004 2.819 1.00 10.00 N ATOM 1488 CA GLN B 62 18.964 -4.000 4.272 1.00 10.00 C ATOM 1489 C GLN B 62 20.336 -4.361 4.843 1.00 10.00 C ATOM 1490 O GLN B 62 21.324 -4.431 4.112 1.00 10.00 O ATOM 1491 CB GLN B 62 17.894 -4.985 4.765 1.00 10.00 C ATOM 1492 CG GLN B 62 16.482 -4.667 4.269 1.00 10.00 C ATOM 1493 CD GLN B 62 15.410 -5.531 4.925 1.00 10.00 C ATOM 1494 OE1 GLN B 62 14.246 -5.138 5.008 1.00 10.00 O ATOM 1495 NE2 GLN B 62 15.794 -6.700 5.416 1.00 10.00 N ATOM 0 H GLN B 62 19.016 -4.935 2.404 1.00 10.00 H new ATOM 0 HA GLN B 62 18.720 -2.996 4.620 1.00 10.00 H new ATOM 0 HB2 GLN B 62 18.164 -5.991 4.442 1.00 10.00 H new ATOM 0 HB3 GLN B 62 17.893 -4.989 5.855 1.00 10.00 H new ATOM 0 HG2 GLN B 62 16.263 -3.617 4.463 1.00 10.00 H new ATOM 0 HG3 GLN B 62 16.442 -4.807 3.189 1.00 10.00 H new ATOM 0 HE21 GLN B 62 16.767 -6.995 5.330 1.00 10.00 H new ATOM 0 HE22 GLN B 62 15.117 -7.305 5.880 1.00 10.00 H new ATOM 1504 N LYS B 63 20.394 -4.568 6.157 1.00 10.00 N ATOM 1505 CA LYS B 63 21.662 -4.930 6.823 1.00 10.00 C ATOM 1506 C LYS B 63 22.137 -6.288 6.292 1.00 10.00 C ATOM 1507 O LYS B 63 21.318 -7.152 5.995 1.00 10.00 O ATOM 1508 CB LYS B 63 21.487 -4.974 8.347 1.00 10.00 C ATOM 1509 CG LYS B 63 20.582 -6.105 8.852 1.00 10.00 C ATOM 1510 CD LYS B 63 20.424 -6.012 10.365 1.00 10.00 C ATOM 1511 CE LYS B 63 19.573 -7.166 10.888 1.00 10.00 C ATOM 1512 NZ LYS B 63 19.264 -6.944 12.307 1.00 10.00 N ATOM 0 H LYS B 63 19.592 -4.495 6.783 1.00 10.00 H new ATOM 0 HA LYS B 63 22.413 -4.172 6.601 1.00 10.00 H new ATOM 0 HB2 LYS B 63 22.468 -5.077 8.810 1.00 10.00 H new ATOM 0 HB3 LYS B 63 21.076 -4.021 8.680 1.00 10.00 H new ATOM 0 HG2 LYS B 63 19.605 -6.042 8.372 1.00 10.00 H new ATOM 0 HG3 LYS B 63 21.008 -7.071 8.582 1.00 10.00 H new ATOM 0 HD2 LYS B 63 21.405 -6.032 10.840 1.00 10.00 H new ATOM 0 HD3 LYS B 63 19.960 -5.062 10.630 1.00 10.00 H new ATOM 0 HE2 LYS B 63 18.651 -7.242 10.312 1.00 10.00 H new ATOM 0 HE3 LYS B 63 20.105 -8.109 10.764 1.00 10.00 H new ATOM 0 HZ1 LYS B 63 18.684 -7.730 12.663 1.00 10.00 H new ATOM 0 HZ2 LYS B 63 20.149 -6.892 12.851 1.00 10.00 H new ATOM 0 HZ3 LYS B 63 18.740 -6.052 12.413 1.00 10.00 H new ATOM 1526 N GLU B 64 23.459 -6.387 6.112 1.00 10.00 N ATOM 1527 CA GLU B 64 24.126 -7.632 5.663 1.00 10.00 C ATOM 1528 C GLU B 64 23.936 -7.944 4.168 1.00 10.00 C ATOM 1529 O GLU B 64 24.379 -8.991 3.697 1.00 10.00 O ATOM 1530 CB GLU B 64 23.635 -8.851 6.468 1.00 10.00 C ATOM 1531 CG GLU B 64 24.710 -9.490 7.342 1.00 10.00 C ATOM 1532 CD GLU B 64 25.377 -8.513 8.315 1.00 10.00 C ATOM 1533 OE1 GLU B 64 24.719 -7.540 8.753 1.00 10.00 O ATOM 1534 OE2 GLU B 64 26.568 -8.766 8.587 1.00 10.00 O ATOM 0 H GLU B 64 24.103 -5.612 6.271 1.00 10.00 H new ATOM 0 HA GLU B 64 25.186 -7.449 5.837 1.00 10.00 H new ATOM 0 HB2 GLU B 64 22.802 -8.544 7.100 1.00 10.00 H new ATOM 0 HB3 GLU B 64 23.251 -9.600 5.776 1.00 10.00 H new ATOM 0 HG2 GLU B 64 24.265 -10.307 7.910 1.00 10.00 H new ATOM 0 HG3 GLU B 64 25.474 -9.928 6.700 1.00 10.00 H new ATOM 1541 N SER B 65 23.343 -7.006 3.434 1.00 10.00 N ATOM 1542 CA SER B 65 23.182 -7.149 1.975 1.00 10.00 C ATOM 1543 C SER B 65 24.545 -6.986 1.306 1.00 10.00 C ATOM 1544 O SER B 65 25.398 -6.237 1.762 1.00 10.00 O ATOM 1545 CB SER B 65 22.264 -6.074 1.402 1.00 10.00 C ATOM 1546 OG SER B 65 20.932 -6.234 1.886 1.00 10.00 O ATOM 0 H SER B 65 22.965 -6.139 3.816 1.00 10.00 H new ATOM 0 HA SER B 65 22.750 -8.131 1.785 1.00 10.00 H new ATOM 0 HB2 SER B 65 22.638 -5.087 1.674 1.00 10.00 H new ATOM 0 HB3 SER B 65 22.269 -6.128 0.313 1.00 10.00 H new ATOM 0 HG SER B 65 20.827 -5.739 2.725 1.00 10.00 H new ATOM 1552 N THR B 66 24.752 -7.780 0.253 1.00 10.00 N ATOM 1553 CA THR B 66 25.983 -7.645 -0.539 1.00 10.00 C ATOM 1554 C THR B 66 25.620 -7.281 -1.985 1.00 10.00 C ATOM 1555 O THR B 66 24.669 -7.781 -2.566 1.00 10.00 O ATOM 1556 CB THR B 66 26.950 -8.853 -0.463 1.00 10.00 C ATOM 1557 OG1 THR B 66 26.875 -9.663 -1.633 1.00 10.00 O ATOM 1558 CG2 THR B 66 26.746 -9.755 0.763 1.00 10.00 C ATOM 0 H THR B 66 24.107 -8.503 -0.067 1.00 10.00 H new ATOM 0 HA THR B 66 26.557 -6.836 -0.087 1.00 10.00 H new ATOM 0 HB THR B 66 27.935 -8.395 -0.376 1.00 10.00 H new ATOM 0 HG1 THR B 66 27.499 -10.414 -1.551 1.00 10.00 H new ATOM 0 HG21 THR B 66 27.464 -10.574 0.736 1.00 10.00 H new ATOM 0 HG22 THR B 66 26.895 -9.172 1.672 1.00 10.00 H new ATOM 0 HG23 THR B 66 25.734 -10.159 0.753 1.00 10.00 H new ATOM 1566 N LEU B 67 26.330 -6.255 -2.437 1.00 10.00 N ATOM 1567 CA LEU B 67 26.212 -5.681 -3.781 1.00 10.00 C ATOM 1568 C LEU B 67 27.474 -6.068 -4.562 1.00 10.00 C ATOM 1569 O LEU B 67 28.471 -6.516 -4.006 1.00 10.00 O ATOM 1570 CB LEU B 67 26.129 -4.149 -3.663 1.00 10.00 C ATOM 1571 CG LEU B 67 24.802 -3.569 -3.141 1.00 10.00 C ATOM 1572 CD1 LEU B 67 24.406 -4.029 -1.735 1.00 10.00 C ATOM 1573 CD2 LEU B 67 24.935 -2.047 -3.105 1.00 10.00 C ATOM 0 H LEU B 67 27.028 -5.781 -1.864 1.00 10.00 H new ATOM 0 HA LEU B 67 25.321 -6.050 -4.289 1.00 10.00 H new ATOM 0 HB2 LEU B 67 26.930 -3.814 -3.004 1.00 10.00 H new ATOM 0 HB3 LEU B 67 26.325 -3.720 -4.646 1.00 10.00 H new ATOM 0 HG LEU B 67 24.026 -3.927 -3.818 1.00 10.00 H new ATOM 0 HD11 LEU B 67 23.459 -3.568 -1.455 1.00 10.00 H new ATOM 0 HD12 LEU B 67 24.299 -5.114 -1.724 1.00 10.00 H new ATOM 0 HD13 LEU B 67 25.178 -3.733 -1.024 1.00 10.00 H new ATOM 0 HD21 LEU B 67 24.007 -1.609 -2.738 1.00 10.00 H new ATOM 0 HD22 LEU B 67 25.754 -1.769 -2.442 1.00 10.00 H new ATOM 0 HD23 LEU B 67 25.139 -1.676 -4.109 1.00 10.00 H new ATOM 1585 N HIS B 68 27.376 -5.875 -5.873 1.00 10.00 N ATOM 1586 CA HIS B 68 28.522 -6.081 -6.769 1.00 10.00 C ATOM 1587 C HIS B 68 28.905 -4.771 -7.456 1.00 10.00 C ATOM 1588 O HIS B 68 28.076 -3.896 -7.677 1.00 10.00 O ATOM 1589 CB HIS B 68 28.207 -7.169 -7.798 1.00 10.00 C ATOM 1590 CG HIS B 68 28.282 -8.553 -7.151 1.00 10.00 C ATOM 1591 ND1 HIS B 68 27.307 -9.162 -6.482 1.00 10.00 N ATOM 1592 CD2 HIS B 68 29.328 -9.370 -7.200 1.00 10.00 C ATOM 1593 CE1 HIS B 68 27.755 -10.357 -6.110 1.00 10.00 C ATOM 1594 NE2 HIS B 68 29.002 -10.486 -6.561 1.00 10.00 N ATOM 0 H HIS B 68 26.521 -5.577 -6.343 1.00 10.00 H new ATOM 0 HA HIS B 68 29.374 -6.413 -6.176 1.00 10.00 H new ATOM 0 HB2 HIS B 68 27.212 -7.008 -8.214 1.00 10.00 H new ATOM 0 HB3 HIS B 68 28.912 -7.109 -8.627 1.00 10.00 H new ATOM 0 HD2 HIS B 68 30.275 -9.163 -7.675 1.00 10.00 H new ATOM 0 HE1 HIS B 68 27.205 -11.093 -5.542 1.00 10.00 H new ATOM 0 HE2 HIS B 68 29.602 -11.301 -6.437 1.00 10.00 H new ATOM 1603 N LEU B 69 30.208 -4.683 -7.714 1.00 10.00 N ATOM 1604 CA LEU B 69 30.810 -3.525 -8.382 1.00 10.00 C ATOM 1605 C LEU B 69 31.407 -3.958 -9.725 1.00 10.00 C ATOM 1606 O LEU B 69 32.191 -4.892 -9.809 1.00 10.00 O ATOM 1607 CB LEU B 69 31.902 -2.946 -7.473 1.00 10.00 C ATOM 1608 CG LEU B 69 32.690 -1.793 -8.114 1.00 10.00 C ATOM 1609 CD1 LEU B 69 31.798 -0.581 -8.386 1.00 10.00 C ATOM 1610 CD2 LEU B 69 33.867 -1.401 -7.226 1.00 10.00 C ATOM 0 H LEU B 69 30.879 -5.411 -7.467 1.00 10.00 H new ATOM 0 HA LEU B 69 30.053 -2.763 -8.570 1.00 10.00 H new ATOM 0 HB2 LEU B 69 31.444 -2.592 -6.549 1.00 10.00 H new ATOM 0 HB3 LEU B 69 32.596 -3.742 -7.201 1.00 10.00 H new ATOM 0 HG LEU B 69 33.069 -2.143 -9.074 1.00 10.00 H new ATOM 0 HD11 LEU B 69 32.391 0.213 -8.839 1.00 10.00 H new ATOM 0 HD12 LEU B 69 30.994 -0.866 -9.065 1.00 10.00 H new ATOM 0 HD13 LEU B 69 31.372 -0.225 -7.448 1.00 10.00 H new ATOM 0 HD21 LEU B 69 34.417 -0.583 -7.691 1.00 10.00 H new ATOM 0 HD22 LEU B 69 33.497 -1.082 -6.252 1.00 10.00 H new ATOM 0 HD23 LEU B 69 34.529 -2.258 -7.100 1.00 10.00 H new ATOM 1622 N VAL B 70 31.036 -3.186 -10.771 1.00 10.00 N ATOM 1623 CA VAL B 70 31.593 -3.344 -12.097 1.00 10.00 C ATOM 1624 C VAL B 70 32.341 -2.032 -12.383 1.00 10.00 C ATOM 1625 O VAL B 70 31.834 -0.936 -12.087 1.00 10.00 O ATOM 1626 CB VAL B 70 30.456 -3.594 -13.158 1.00 10.00 C ATOM 1627 CG1 VAL B 70 30.996 -3.552 -14.596 1.00 10.00 C ATOM 1628 CG2 VAL B 70 29.715 -4.907 -12.873 1.00 10.00 C ATOM 0 H VAL B 70 30.342 -2.442 -10.701 1.00 10.00 H new ATOM 0 HA VAL B 70 32.258 -4.206 -12.158 1.00 10.00 H new ATOM 0 HB VAL B 70 29.738 -2.779 -13.065 1.00 10.00 H new ATOM 0 HG11 VAL B 70 30.180 -3.729 -15.296 1.00 10.00 H new ATOM 0 HG12 VAL B 70 31.436 -2.574 -14.791 1.00 10.00 H new ATOM 0 HG13 VAL B 70 31.756 -4.323 -14.722 1.00 10.00 H new ATOM 0 HG21 VAL B 70 28.936 -5.055 -13.621 1.00 10.00 H new ATOM 0 HG22 VAL B 70 30.419 -5.738 -12.914 1.00 10.00 H new ATOM 0 HG23 VAL B 70 29.263 -4.862 -11.882 1.00 10.00 H new ATOM 1638 N LEU B 71 33.533 -2.143 -12.955 1.00 10.00 N ATOM 1639 CA LEU B 71 34.376 -0.985 -13.192 1.00 10.00 C ATOM 1640 C LEU B 71 34.149 -0.438 -14.606 1.00 10.00 C ATOM 1641 O LEU B 71 34.444 -1.113 -15.591 1.00 10.00 O ATOM 1642 CB LEU B 71 35.852 -1.358 -12.989 1.00 10.00 C ATOM 1643 CG LEU B 71 36.668 -0.307 -12.250 1.00 10.00 C ATOM 1644 CD1 LEU B 71 36.564 -0.553 -10.733 1.00 10.00 C ATOM 1645 CD2 LEU B 71 38.156 -0.220 -12.779 1.00 10.00 C ATOM 0 H LEU B 71 33.936 -3.028 -13.263 1.00 10.00 H new ATOM 0 HA LEU B 71 34.111 -0.206 -12.477 1.00 10.00 H new ATOM 0 HB2 LEU B 71 35.905 -2.296 -12.437 1.00 10.00 H new ATOM 0 HB3 LEU B 71 36.307 -1.535 -13.963 1.00 10.00 H new ATOM 0 HG LEU B 71 36.250 0.679 -12.454 1.00 10.00 H new ATOM 0 HD11 LEU B 71 37.148 0.199 -10.202 1.00 10.00 H new ATOM 0 HD12 LEU B 71 35.521 -0.487 -10.424 1.00 10.00 H new ATOM 0 HD13 LEU B 71 36.950 -1.545 -10.498 1.00 10.00 H new ATOM 0 HD21 LEU B 71 38.697 0.544 -12.220 1.00 10.00 H new ATOM 0 HD22 LEU B 71 38.647 -1.184 -12.644 1.00 10.00 H new ATOM 0 HD23 LEU B 71 38.151 0.040 -13.838 1.00 10.00 H new TER 1657 LEU B 71 HETATM 1658 ZN ZN A 63 7.041 3.375 -7.806 1.00 10.00 ZN