USER MOD reduce.3.24.130724 H: found=0, std=0, add=1073, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1069 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 108 ASN : amide:sc= -0.232 X(o=-1.2,f=-1.4) USER MOD Set 1.2: A 127 MET CE :methyl 170:sc= -1.02 (180deg=-1.54) USER MOD Set 2.1: A 67 LYS NZ :NH3+ -111:sc= 0.045 (180deg=-0.171) USER MOD Set 2.2: A 70 THR OG1 : rot 180:sc= 0.056 USER MOD Set 3.1: A 60 CYS SG : rot -170:sc= -1.34 USER MOD Set 3.2: A 90 ASN : amide:sc= -2.22 K(o=-3.6,f=-5) USER MOD Set 4.1: A 32 MET CE :methyl -150:sc= -2.25! (180deg=-3.37!) USER MOD Set 4.2: A 114 ASN : amide:sc= -0.323 X(o=-2.6,f=-2.3) USER MOD Set 5.1: A 17 LYS NZ :NH3+ -171:sc= 0.2 (180deg=-0.49) USER MOD Set 5.2: A 106 SER OG : rot 180:sc= 0.649 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 133:sc= -0.125 (180deg=-0.825) USER MOD Single : A 2 LYS NZ :NH3+ 158:sc= -0.123 (180deg=-0.56) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 ASN : amide:sc= -0.0115 K(o=-0.012,f=-0.64) USER MOD Single : A 14 SER OG : rot 45:sc= 0.446 USER MOD Single : A 16 ASN : amide:sc= -0.126 X(o=-0.13,f=-0.13) USER MOD Single : A 20 CYS SG : rot 12:sc= 0.00392 USER MOD Single : A 22 GLN : amide:sc= -0.671 K(o=-0.67,f=-2.4!) USER MOD Single : A 24 SER OG : rot 180:sc= 0.0461 USER MOD Single : A 26 LYS NZ :NH3+ -165:sc=-0.00702 (180deg=-0.11) USER MOD Single : A 27 MET CE :methyl -166:sc= -0.527 (180deg=-1.31) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= -0.628 K(o=-0.63,f=-3.6!) USER MOD Single : A 45 THR OG1 : rot 108:sc= 0.736 USER MOD Single : A 47 LYS NZ :NH3+ -108:sc= -4.5! (180deg=-7.88!) USER MOD Single : A 58 MET CE :methyl -172:sc= -0.401 (180deg=-0.482) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot -173:sc= 1.09 USER MOD Single : A 73 HIS : no HE2:sc= -1.31 K(o=-1.3,f=-0.58) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot -140:sc= -0.261 USER MOD Single : A 84 THR OG1 : rot -110:sc= -0.336 USER MOD Single : A 85 TYR OH : rot 180:sc= -0.619 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 CYS SG : rot -110:sc= -3.02! USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 THR OG1 : rot -170:sc= -1.5 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 HIS : no HD1:sc= -0.1 X(o=-0.1,f=-0.27) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 SER OG : rot 180:sc= -0.688 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 ASN : amide:sc= -0.0672 K(o=-0.067,f=-0.79) USER MOD Single : A 125 LYS NZ :NH3+ 148:sc= 0 (180deg=-0.132) USER MOD Single : A 128 THR OG1 : rot 180:sc= 0.00369 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.613 0.942 0.520 1.00 1.53 N ATOM 2 CA MET A 1 2.999 0.502 0.407 1.00 34.42 C ATOM 3 C MET A 1 3.072 -0.999 0.144 1.00 73.14 C ATOM 4 O MET A 1 2.049 -1.684 0.106 1.00 42.14 O ATOM 5 CB MET A 1 3.771 0.846 1.682 1.00 23.50 C ATOM 6 CG MET A 1 3.167 0.243 2.940 1.00 64.40 C ATOM 7 SD MET A 1 3.605 1.161 4.429 1.00 35.30 S ATOM 8 CE MET A 1 2.423 0.493 5.598 1.00 55.15 C ATOM 0 H1 MET A 1 1.509 1.551 1.357 1.00 1.53 H new ATOM 0 H2 MET A 1 1.348 1.476 -0.332 1.00 1.53 H new ATOM 0 H3 MET A 1 0.992 0.113 0.616 1.00 1.53 H new ATOM 0 HA MET A 1 3.453 1.024 -0.436 1.00 34.42 H new ATOM 0 HB2 MET A 1 4.799 0.498 1.580 1.00 23.50 H new ATOM 0 HB3 MET A 1 3.811 1.930 1.792 1.00 23.50 H new ATOM 0 HG2 MET A 1 2.082 0.216 2.840 1.00 64.40 H new ATOM 0 HG3 MET A 1 3.504 -0.789 3.042 1.00 64.40 H new ATOM 0 HE1 MET A 1 2.567 0.964 6.571 1.00 55.15 H new ATOM 0 HE2 MET A 1 1.411 0.691 5.246 1.00 55.15 H new ATOM 0 HE3 MET A 1 2.571 -0.583 5.690 1.00 55.15 H new ATOM 18 N LYS A 2 4.287 -1.505 -0.038 1.00 52.24 N ATOM 19 CA LYS A 2 4.494 -2.925 -0.298 1.00 3.54 C ATOM 20 C LYS A 2 4.397 -3.733 0.992 1.00 32.01 C ATOM 21 O LYS A 2 3.983 -3.217 2.031 1.00 74.54 O ATOM 22 CB LYS A 2 5.859 -3.150 -0.952 1.00 23.43 C ATOM 23 CG LYS A 2 6.162 -2.178 -2.079 1.00 22.15 C ATOM 24 CD LYS A 2 5.253 -2.409 -3.274 1.00 10.01 C ATOM 25 CE LYS A 2 5.759 -1.679 -4.508 1.00 41.24 C ATOM 26 NZ LYS A 2 7.097 -2.174 -4.937 1.00 35.34 N ATOM 0 H LYS A 2 5.144 -0.952 -0.010 1.00 52.24 H new ATOM 0 HA LYS A 2 3.712 -3.263 -0.978 1.00 3.54 H new ATOM 0 HB2 LYS A 2 6.635 -3.065 -0.192 1.00 23.43 H new ATOM 0 HB3 LYS A 2 5.903 -4.168 -1.340 1.00 23.43 H new ATOM 0 HG2 LYS A 2 6.041 -1.156 -1.721 1.00 22.15 H new ATOM 0 HG3 LYS A 2 7.202 -2.288 -2.385 1.00 22.15 H new ATOM 0 HD2 LYS A 2 5.189 -3.477 -3.483 1.00 10.01 H new ATOM 0 HD3 LYS A 2 4.245 -2.069 -3.037 1.00 10.01 H new ATOM 0 HE2 LYS A 2 5.046 -1.807 -5.323 1.00 41.24 H new ATOM 0 HE3 LYS A 2 5.817 -0.611 -4.300 1.00 41.24 H new ATOM 0 HZ1 LYS A 2 7.245 -1.948 -5.941 1.00 35.34 H new ATOM 0 HZ2 LYS A 2 7.836 -1.716 -4.366 1.00 35.34 H new ATOM 0 HZ3 LYS A 2 7.145 -3.204 -4.803 1.00 35.34 H new ATOM 40 N LYS A 3 4.782 -5.003 0.920 1.00 42.43 N ATOM 41 CA LYS A 3 4.741 -5.883 2.082 1.00 42.54 C ATOM 42 C LYS A 3 6.014 -5.747 2.912 1.00 74.12 C ATOM 43 O LYS A 3 7.049 -6.323 2.578 1.00 61.03 O ATOM 44 CB LYS A 3 4.560 -7.336 1.640 1.00 62.52 C ATOM 45 CG LYS A 3 3.747 -8.171 2.614 1.00 61.42 C ATOM 46 CD LYS A 3 3.236 -9.447 1.964 1.00 5.41 C ATOM 47 CE LYS A 3 2.759 -10.449 3.004 1.00 64.35 C ATOM 48 NZ LYS A 3 1.571 -9.951 3.750 1.00 31.40 N ATOM 0 H LYS A 3 5.126 -5.446 0.068 1.00 42.43 H new ATOM 0 HA LYS A 3 3.892 -5.589 2.700 1.00 42.54 H new ATOM 0 HB2 LYS A 3 4.072 -7.352 0.665 1.00 62.52 H new ATOM 0 HB3 LYS A 3 5.541 -7.793 1.513 1.00 62.52 H new ATOM 0 HG2 LYS A 3 4.361 -8.423 3.479 1.00 61.42 H new ATOM 0 HG3 LYS A 3 2.904 -7.586 2.981 1.00 61.42 H new ATOM 0 HD2 LYS A 3 2.418 -9.208 1.285 1.00 5.41 H new ATOM 0 HD3 LYS A 3 4.029 -9.893 1.364 1.00 5.41 H new ATOM 0 HE2 LYS A 3 2.512 -11.391 2.514 1.00 64.35 H new ATOM 0 HE3 LYS A 3 3.567 -10.657 3.705 1.00 64.35 H new ATOM 0 HZ1 LYS A 3 1.277 -10.663 4.449 1.00 31.40 H new ATOM 0 HZ2 LYS A 3 1.814 -9.066 4.238 1.00 31.40 H new ATOM 0 HZ3 LYS A 3 0.791 -9.777 3.084 1.00 31.40 H new ATOM 62 N VAL A 4 5.929 -4.983 3.996 1.00 32.35 N ATOM 63 CA VAL A 4 7.073 -4.775 4.876 1.00 13.30 C ATOM 64 C VAL A 4 7.436 -6.056 5.618 1.00 44.11 C ATOM 65 O VAL A 4 6.801 -6.412 6.611 1.00 3.51 O ATOM 66 CB VAL A 4 6.795 -3.661 5.903 1.00 2.11 C ATOM 67 CG1 VAL A 4 8.027 -3.402 6.757 1.00 64.34 C ATOM 68 CG2 VAL A 4 6.347 -2.388 5.200 1.00 34.54 C ATOM 0 H VAL A 4 5.080 -4.498 4.286 1.00 32.35 H new ATOM 0 HA VAL A 4 7.909 -4.476 4.243 1.00 13.30 H new ATOM 0 HB VAL A 4 5.989 -3.989 6.560 1.00 2.11 H new ATOM 0 HG11 VAL A 4 7.811 -2.612 7.476 1.00 64.34 H new ATOM 0 HG12 VAL A 4 8.299 -4.313 7.289 1.00 64.34 H new ATOM 0 HG13 VAL A 4 8.855 -3.095 6.118 1.00 64.34 H new ATOM 0 HG21 VAL A 4 6.155 -1.612 5.941 1.00 34.54 H new ATOM 0 HG22 VAL A 4 7.130 -2.054 4.519 1.00 34.54 H new ATOM 0 HG23 VAL A 4 5.435 -2.585 4.636 1.00 34.54 H new ATOM 78 N ILE A 5 8.462 -6.745 5.130 1.00 43.25 N ATOM 79 CA ILE A 5 8.912 -7.986 5.748 1.00 74.15 C ATOM 80 C ILE A 5 9.843 -7.709 6.923 1.00 63.34 C ATOM 81 O ILE A 5 11.017 -7.391 6.736 1.00 53.13 O ATOM 82 CB ILE A 5 9.638 -8.889 4.733 1.00 34.41 C ATOM 83 CG1 ILE A 5 8.914 -8.864 3.385 1.00 33.24 C ATOM 84 CG2 ILE A 5 9.732 -10.312 5.263 1.00 33.34 C ATOM 85 CD1 ILE A 5 7.458 -9.266 3.474 1.00 61.13 C ATOM 0 H ILE A 5 8.997 -6.465 4.308 1.00 43.25 H new ATOM 0 HA ILE A 5 8.021 -8.501 6.108 1.00 74.15 H new ATOM 0 HB ILE A 5 10.649 -8.508 4.588 1.00 34.41 H new ATOM 0 HG12 ILE A 5 8.981 -7.861 2.964 1.00 33.24 H new ATOM 0 HG13 ILE A 5 9.426 -9.534 2.694 1.00 33.24 H new ATOM 0 HG21 ILE A 5 10.247 -10.938 4.535 1.00 33.34 H new ATOM 0 HG22 ILE A 5 10.287 -10.315 6.201 1.00 33.34 H new ATOM 0 HG23 ILE A 5 8.729 -10.704 5.433 1.00 33.34 H new ATOM 0 HD11 ILE A 5 7.008 -9.226 2.482 1.00 61.13 H new ATOM 0 HD12 ILE A 5 7.384 -10.281 3.865 1.00 61.13 H new ATOM 0 HD13 ILE A 5 6.932 -8.582 4.139 1.00 61.13 H new ATOM 97 N ASN A 6 9.312 -7.835 8.134 1.00 12.03 N ATOM 98 CA ASN A 6 10.096 -7.600 9.341 1.00 2.41 C ATOM 99 C ASN A 6 10.733 -8.894 9.837 1.00 65.22 C ATOM 100 O ASN A 6 10.067 -9.736 10.439 1.00 70.21 O ATOM 101 CB ASN A 6 9.215 -6.999 10.438 1.00 31.22 C ATOM 102 CG ASN A 6 9.341 -5.490 10.520 1.00 23.11 C ATOM 103 OD1 ASN A 6 9.431 -4.807 9.500 1.00 73.34 O ATOM 104 ND2 ASN A 6 9.350 -4.963 11.739 1.00 55.53 N ATOM 0 H ASN A 6 8.342 -8.099 8.306 1.00 12.03 H new ATOM 0 HA ASN A 6 10.891 -6.895 9.096 1.00 2.41 H new ATOM 0 HB2 ASN A 6 8.175 -7.264 10.250 1.00 31.22 H new ATOM 0 HB3 ASN A 6 9.487 -7.436 11.399 1.00 31.22 H new ATOM 0 HD21 ASN A 6 9.434 -3.953 11.858 1.00 55.53 H new ATOM 0 HD22 ASN A 6 9.273 -5.568 12.557 1.00 55.53 H new ATOM 111 N VAL A 7 12.029 -9.046 9.580 1.00 72.02 N ATOM 112 CA VAL A 7 12.757 -10.237 10.001 1.00 43.30 C ATOM 113 C VAL A 7 13.936 -9.872 10.896 1.00 43.40 C ATOM 114 O VAL A 7 14.478 -8.769 10.809 1.00 32.51 O ATOM 115 CB VAL A 7 13.274 -11.036 8.790 1.00 3.01 C ATOM 116 CG1 VAL A 7 12.129 -11.761 8.100 1.00 11.02 C ATOM 117 CG2 VAL A 7 13.999 -10.119 7.817 1.00 52.43 C ATOM 0 H VAL A 7 12.596 -8.359 9.082 1.00 72.02 H new ATOM 0 HA VAL A 7 12.056 -10.855 10.562 1.00 43.30 H new ATOM 0 HB VAL A 7 13.983 -11.783 9.146 1.00 3.01 H new ATOM 0 HG11 VAL A 7 12.514 -12.320 7.247 1.00 11.02 H new ATOM 0 HG12 VAL A 7 11.658 -12.449 8.802 1.00 11.02 H new ATOM 0 HG13 VAL A 7 11.393 -11.034 7.756 1.00 11.02 H new ATOM 0 HG21 VAL A 7 14.358 -10.700 6.968 1.00 52.43 H new ATOM 0 HG22 VAL A 7 13.314 -9.347 7.465 1.00 52.43 H new ATOM 0 HG23 VAL A 7 14.846 -9.651 8.320 1.00 52.43 H new ATOM 127 N VAL A 8 14.330 -10.805 11.757 1.00 62.04 N ATOM 128 CA VAL A 8 15.447 -10.583 12.667 1.00 12.24 C ATOM 129 C VAL A 8 16.342 -11.814 12.750 1.00 31.13 C ATOM 130 O VAL A 8 15.964 -12.900 12.313 1.00 51.13 O ATOM 131 CB VAL A 8 14.954 -10.224 14.082 1.00 43.51 C ATOM 132 CG1 VAL A 8 14.260 -8.870 14.078 1.00 21.11 C ATOM 133 CG2 VAL A 8 14.027 -11.306 14.614 1.00 41.13 C ATOM 0 H VAL A 8 13.892 -11.722 11.843 1.00 62.04 H new ATOM 0 HA VAL A 8 16.021 -9.747 12.266 1.00 12.24 H new ATOM 0 HB VAL A 8 15.818 -10.161 14.744 1.00 43.51 H new ATOM 0 HG11 VAL A 8 13.919 -8.633 15.086 1.00 21.11 H new ATOM 0 HG12 VAL A 8 14.959 -8.104 13.742 1.00 21.11 H new ATOM 0 HG13 VAL A 8 13.405 -8.902 13.403 1.00 21.11 H new ATOM 0 HG21 VAL A 8 13.689 -11.036 15.614 1.00 41.13 H new ATOM 0 HG22 VAL A 8 13.165 -11.404 13.954 1.00 41.13 H new ATOM 0 HG23 VAL A 8 14.562 -12.255 14.656 1.00 41.13 H new ATOM 143 N GLY A 9 17.532 -11.637 13.316 1.00 42.11 N ATOM 144 CA GLY A 9 18.463 -12.742 13.447 1.00 63.44 C ATOM 145 C GLY A 9 19.213 -12.717 14.764 1.00 15.30 C ATOM 146 O GLY A 9 18.811 -12.028 15.701 1.00 54.40 O ATOM 0 H GLY A 9 17.868 -10.748 13.686 1.00 42.11 H new ATOM 0 HA2 GLY A 9 17.920 -13.683 13.360 1.00 63.44 H new ATOM 0 HA3 GLY A 9 19.178 -12.710 12.625 1.00 63.44 H new ATOM 150 N ALA A 10 20.304 -13.471 14.837 1.00 62.21 N ATOM 151 CA ALA A 10 21.111 -13.532 16.049 1.00 3.22 C ATOM 152 C ALA A 10 22.488 -14.123 15.763 1.00 35.14 C ATOM 153 O ALA A 10 22.613 -15.096 15.019 1.00 51.23 O ATOM 154 CB ALA A 10 20.397 -14.345 17.119 1.00 40.14 C ATOM 0 H ALA A 10 20.650 -14.049 14.071 1.00 62.21 H new ATOM 0 HA ALA A 10 21.250 -12.515 16.414 1.00 3.22 H new ATOM 0 HB1 ALA A 10 21.012 -14.382 18.018 1.00 40.14 H new ATOM 0 HB2 ALA A 10 19.440 -13.878 17.352 1.00 40.14 H new ATOM 0 HB3 ALA A 10 20.227 -15.358 16.754 1.00 40.14 H new ATOM 160 N ILE A 11 23.517 -13.530 16.359 1.00 55.32 N ATOM 161 CA ILE A 11 24.883 -13.999 16.168 1.00 43.22 C ATOM 162 C ILE A 11 25.531 -14.363 17.500 1.00 74.25 C ATOM 163 O ILE A 11 25.868 -13.488 18.297 1.00 45.11 O ATOM 164 CB ILE A 11 25.749 -12.938 15.462 1.00 20.32 C ATOM 165 CG1 ILE A 11 25.449 -11.547 16.025 1.00 65.32 C ATOM 166 CG2 ILE A 11 25.508 -12.971 13.960 1.00 30.44 C ATOM 167 CD1 ILE A 11 26.282 -10.450 15.398 1.00 35.25 C ATOM 0 H ILE A 11 23.430 -12.724 16.978 1.00 55.32 H new ATOM 0 HA ILE A 11 24.826 -14.888 15.539 1.00 43.22 H new ATOM 0 HB ILE A 11 26.799 -13.166 15.646 1.00 20.32 H new ATOM 0 HG12 ILE A 11 24.393 -11.322 15.874 1.00 65.32 H new ATOM 0 HG13 ILE A 11 25.622 -11.554 17.101 1.00 65.32 H new ATOM 0 HG21 ILE A 11 26.127 -12.216 13.476 1.00 30.44 H new ATOM 0 HG22 ILE A 11 25.767 -13.956 13.572 1.00 30.44 H new ATOM 0 HG23 ILE A 11 24.457 -12.765 13.755 1.00 30.44 H new ATOM 0 HD11 ILE A 11 26.017 -9.492 15.844 1.00 35.25 H new ATOM 0 HD12 ILE A 11 27.339 -10.651 15.572 1.00 35.25 H new ATOM 0 HD13 ILE A 11 26.091 -10.416 14.325 1.00 35.25 H new ATOM 179 N ILE A 12 25.702 -15.660 17.733 1.00 72.15 N ATOM 180 CA ILE A 12 26.312 -16.140 18.966 1.00 35.14 C ATOM 181 C ILE A 12 27.833 -16.127 18.869 1.00 43.11 C ATOM 182 O ILE A 12 28.413 -16.723 17.961 1.00 21.20 O ATOM 183 CB ILE A 12 25.843 -17.567 19.308 1.00 15.43 C ATOM 184 CG1 ILE A 12 24.330 -17.589 19.537 1.00 11.52 C ATOM 185 CG2 ILE A 12 26.577 -18.086 20.535 1.00 10.23 C ATOM 186 CD1 ILE A 12 23.535 -17.916 18.292 1.00 1.24 C ATOM 0 H ILE A 12 25.427 -16.397 17.084 1.00 72.15 H new ATOM 0 HA ILE A 12 25.995 -15.462 19.759 1.00 35.14 H new ATOM 0 HB ILE A 12 26.074 -18.221 18.467 1.00 15.43 H new ATOM 0 HG12 ILE A 12 24.098 -18.322 20.309 1.00 11.52 H new ATOM 0 HG13 ILE A 12 24.014 -16.617 19.915 1.00 11.52 H new ATOM 0 HG21 ILE A 12 26.235 -19.095 20.764 1.00 10.23 H new ATOM 0 HG22 ILE A 12 27.649 -18.102 20.338 1.00 10.23 H new ATOM 0 HG23 ILE A 12 26.374 -17.433 21.384 1.00 10.23 H new ATOM 0 HD11 ILE A 12 22.471 -17.914 18.529 1.00 1.24 H new ATOM 0 HD12 ILE A 12 23.737 -17.169 17.524 1.00 1.24 H new ATOM 0 HD13 ILE A 12 23.823 -18.901 17.925 1.00 1.24 H new ATOM 198 N PHE A 13 28.475 -15.444 19.811 1.00 22.42 N ATOM 199 CA PHE A 13 29.930 -15.354 19.833 1.00 65.14 C ATOM 200 C PHE A 13 30.514 -16.237 20.932 1.00 62.14 C ATOM 201 O PHE A 13 29.878 -16.468 21.960 1.00 25.50 O ATOM 202 CB PHE A 13 30.370 -13.903 20.041 1.00 34.34 C ATOM 203 CG PHE A 13 30.350 -13.084 18.783 1.00 51.04 C ATOM 204 CD1 PHE A 13 29.152 -12.785 18.154 1.00 41.13 C ATOM 205 CD2 PHE A 13 31.529 -12.612 18.229 1.00 61.43 C ATOM 206 CE1 PHE A 13 29.131 -12.032 16.995 1.00 44.11 C ATOM 207 CE2 PHE A 13 31.515 -11.859 17.070 1.00 14.53 C ATOM 208 CZ PHE A 13 30.314 -11.567 16.453 1.00 31.13 C ATOM 0 H PHE A 13 28.010 -14.945 20.569 1.00 22.42 H new ATOM 0 HA PHE A 13 30.305 -15.706 18.872 1.00 65.14 H new ATOM 0 HB2 PHE A 13 29.718 -13.436 20.779 1.00 34.34 H new ATOM 0 HB3 PHE A 13 31.378 -13.893 20.455 1.00 34.34 H new ATOM 0 HD1 PHE A 13 28.224 -13.144 18.574 1.00 41.13 H new ATOM 0 HD2 PHE A 13 32.471 -12.835 18.709 1.00 61.43 H new ATOM 0 HE1 PHE A 13 28.191 -11.807 16.513 1.00 44.11 H new ATOM 0 HE2 PHE A 13 32.442 -11.499 16.647 1.00 14.53 H new ATOM 0 HZ PHE A 13 30.300 -10.976 15.549 1.00 31.13 H new ATOM 218 N SER A 14 31.729 -16.728 20.706 1.00 75.04 N ATOM 219 CA SER A 14 32.397 -17.589 21.674 1.00 62.43 C ATOM 220 C SER A 14 33.810 -17.932 21.211 1.00 2.13 C ATOM 221 O SER A 14 33.997 -18.620 20.208 1.00 60.22 O ATOM 222 CB SER A 14 31.593 -18.873 21.887 1.00 71.20 C ATOM 223 OG SER A 14 31.386 -19.555 20.662 1.00 41.21 O ATOM 0 H SER A 14 32.270 -16.544 19.861 1.00 75.04 H new ATOM 0 HA SER A 14 32.463 -17.049 22.619 1.00 62.43 H new ATOM 0 HB2 SER A 14 32.120 -19.524 22.585 1.00 71.20 H new ATOM 0 HB3 SER A 14 30.631 -18.632 22.340 1.00 71.20 H new ATOM 0 HG SER A 14 32.225 -19.580 20.156 1.00 41.21 H new ATOM 229 N ASP A 15 34.802 -17.446 21.950 1.00 35.54 N ATOM 230 CA ASP A 15 36.198 -17.701 21.618 1.00 25.11 C ATOM 231 C ASP A 15 36.529 -17.180 20.223 1.00 0.31 C ATOM 232 O ASP A 15 37.283 -17.805 19.479 1.00 74.14 O ATOM 233 CB ASP A 15 36.500 -19.198 21.701 1.00 31.32 C ATOM 234 CG ASP A 15 36.448 -19.721 23.123 1.00 31.32 C ATOM 235 OD1 ASP A 15 37.180 -20.686 23.427 1.00 5.54 O ATOM 236 OD2 ASP A 15 35.674 -19.167 23.932 1.00 51.13 O ATOM 0 H ASP A 15 34.664 -16.873 22.783 1.00 35.54 H new ATOM 0 HA ASP A 15 36.819 -17.172 22.341 1.00 25.11 H new ATOM 0 HB2 ASP A 15 35.782 -19.745 21.089 1.00 31.32 H new ATOM 0 HB3 ASP A 15 37.488 -19.390 21.282 1.00 31.32 H new ATOM 241 N ASN A 16 35.959 -16.030 19.876 1.00 72.40 N ATOM 242 CA ASN A 16 36.192 -15.426 18.569 1.00 14.45 C ATOM 243 C ASN A 16 35.696 -16.338 17.452 1.00 55.34 C ATOM 244 O ASN A 16 36.330 -16.455 16.403 1.00 22.31 O ATOM 245 CB ASN A 16 37.681 -15.130 18.379 1.00 33.41 C ATOM 246 CG ASN A 16 38.326 -14.579 19.636 1.00 41.13 C ATOM 247 OD1 ASN A 16 37.870 -13.581 20.195 1.00 71.43 O ATOM 248 ND2 ASN A 16 39.394 -15.228 20.086 1.00 51.52 N ATOM 0 H ASN A 16 35.333 -15.498 20.481 1.00 72.40 H new ATOM 0 HA ASN A 16 35.634 -14.491 18.524 1.00 14.45 H new ATOM 0 HB2 ASN A 16 38.195 -16.044 18.081 1.00 33.41 H new ATOM 0 HB3 ASN A 16 37.806 -14.414 17.566 1.00 33.41 H new ATOM 0 HD21 ASN A 16 39.871 -14.904 20.927 1.00 51.52 H new ATOM 0 HD22 ASN A 16 39.737 -16.051 19.590 1.00 51.52 H new ATOM 255 N LYS A 17 34.556 -16.982 17.683 1.00 44.55 N ATOM 256 CA LYS A 17 33.972 -17.882 16.696 1.00 63.13 C ATOM 257 C LYS A 17 32.476 -17.628 16.546 1.00 73.31 C ATOM 258 O LYS A 17 31.819 -17.167 17.480 1.00 53.14 O ATOM 259 CB LYS A 17 34.216 -19.339 17.097 1.00 13.30 C ATOM 260 CG LYS A 17 35.252 -20.041 16.238 1.00 63.44 C ATOM 261 CD LYS A 17 36.641 -19.940 16.845 1.00 24.50 C ATOM 262 CE LYS A 17 37.609 -20.913 16.188 1.00 41.31 C ATOM 263 NZ LYS A 17 37.647 -20.743 14.709 1.00 72.21 N ATOM 0 H LYS A 17 34.019 -16.897 18.546 1.00 44.55 H new ATOM 0 HA LYS A 17 34.453 -17.690 15.737 1.00 63.13 H new ATOM 0 HB2 LYS A 17 34.537 -19.372 18.138 1.00 13.30 H new ATOM 0 HB3 LYS A 17 33.275 -19.886 17.036 1.00 13.30 H new ATOM 0 HG2 LYS A 17 34.980 -21.090 16.123 1.00 63.44 H new ATOM 0 HG3 LYS A 17 35.257 -19.602 15.241 1.00 63.44 H new ATOM 0 HD2 LYS A 17 37.015 -18.922 16.733 1.00 24.50 H new ATOM 0 HD3 LYS A 17 36.588 -20.145 17.914 1.00 24.50 H new ATOM 0 HE2 LYS A 17 38.608 -20.763 16.597 1.00 41.31 H new ATOM 0 HE3 LYS A 17 37.316 -21.935 16.429 1.00 41.31 H new ATOM 0 HZ1 LYS A 17 38.196 -21.517 14.285 1.00 72.21 H new ATOM 0 HZ2 LYS A 17 36.678 -20.759 14.333 1.00 72.21 H new ATOM 0 HZ3 LYS A 17 38.094 -19.833 14.475 1.00 72.21 H new ATOM 277 N ILE A 18 31.944 -17.934 15.367 1.00 14.53 N ATOM 278 CA ILE A 18 30.524 -17.741 15.098 1.00 42.44 C ATOM 279 C ILE A 18 29.868 -19.042 14.647 1.00 3.54 C ATOM 280 O ILE A 18 30.499 -19.874 13.994 1.00 52.22 O ATOM 281 CB ILE A 18 30.297 -16.664 14.019 1.00 22.45 C ATOM 282 CG1 ILE A 18 30.991 -15.360 14.416 1.00 13.43 C ATOM 283 CG2 ILE A 18 28.809 -16.435 13.805 1.00 74.42 C ATOM 284 CD1 ILE A 18 31.972 -14.858 13.380 1.00 0.54 C ATOM 0 H ILE A 18 32.474 -18.316 14.584 1.00 14.53 H new ATOM 0 HA ILE A 18 30.068 -17.411 16.031 1.00 42.44 H new ATOM 0 HB ILE A 18 30.729 -17.013 13.081 1.00 22.45 H new ATOM 0 HG12 ILE A 18 30.235 -14.594 14.590 1.00 13.43 H new ATOM 0 HG13 ILE A 18 31.516 -15.510 15.359 1.00 13.43 H new ATOM 0 HG21 ILE A 18 28.665 -15.672 13.040 1.00 74.42 H new ATOM 0 HG22 ILE A 18 28.340 -17.365 13.483 1.00 74.42 H new ATOM 0 HG23 ILE A 18 28.354 -16.104 14.738 1.00 74.42 H new ATOM 0 HD11 ILE A 18 32.426 -13.930 13.728 1.00 0.54 H new ATOM 0 HD12 ILE A 18 32.749 -15.606 13.223 1.00 0.54 H new ATOM 0 HD13 ILE A 18 31.449 -14.676 12.441 1.00 0.54 H new ATOM 296 N LEU A 19 28.599 -19.210 14.999 1.00 34.15 N ATOM 297 CA LEU A 19 27.855 -20.410 14.630 1.00 10.41 C ATOM 298 C LEU A 19 27.262 -20.274 13.231 1.00 1.43 C ATOM 299 O LEU A 19 27.145 -19.168 12.701 1.00 60.32 O ATOM 300 CB LEU A 19 26.742 -20.676 15.645 1.00 54.14 C ATOM 301 CG LEU A 19 25.414 -19.961 15.388 1.00 64.34 C ATOM 302 CD1 LEU A 19 24.375 -20.379 16.416 1.00 3.05 C ATOM 303 CD2 LEU A 19 25.609 -18.452 15.406 1.00 71.23 C ATOM 0 H LEU A 19 28.063 -18.531 15.539 1.00 34.15 H new ATOM 0 HA LEU A 19 28.547 -21.252 14.631 1.00 10.41 H new ATOM 0 HB2 LEU A 19 26.554 -21.749 15.675 1.00 54.14 H new ATOM 0 HB3 LEU A 19 27.102 -20.388 16.633 1.00 54.14 H new ATOM 0 HG LEU A 19 25.053 -20.249 14.400 1.00 64.34 H new ATOM 0 HD11 LEU A 19 23.437 -19.860 16.217 1.00 3.05 H new ATOM 0 HD12 LEU A 19 24.214 -21.455 16.354 1.00 3.05 H new ATOM 0 HD13 LEU A 19 24.727 -20.122 17.415 1.00 3.05 H new ATOM 0 HD21 LEU A 19 24.654 -17.960 15.221 1.00 71.23 H new ATOM 0 HD22 LEU A 19 25.993 -18.146 16.379 1.00 71.23 H new ATOM 0 HD23 LEU A 19 26.320 -18.168 14.630 1.00 71.23 H new ATOM 315 N CYS A 20 26.888 -21.403 12.641 1.00 62.13 N ATOM 316 CA CYS A 20 26.306 -21.410 11.303 1.00 34.14 C ATOM 317 C CYS A 20 25.082 -22.318 11.248 1.00 34.44 C ATOM 318 O CYS A 20 25.039 -23.360 11.902 1.00 25.13 O ATOM 319 CB CYS A 20 27.342 -21.867 10.276 1.00 74.34 C ATOM 320 SG CYS A 20 27.620 -23.654 10.253 1.00 43.33 S ATOM 0 H CYS A 20 26.977 -22.325 13.067 1.00 62.13 H new ATOM 0 HA CYS A 20 25.993 -20.394 11.064 1.00 34.14 H new ATOM 0 HB2 CYS A 20 27.021 -21.547 9.285 1.00 74.34 H new ATOM 0 HB3 CYS A 20 28.288 -21.366 10.482 1.00 74.34 H new ATOM 0 HG CYS A 20 26.695 -24.246 10.948 1.00 43.33 H new ATOM 326 N ALA A 21 24.087 -21.915 10.465 1.00 34.10 N ATOM 327 CA ALA A 21 22.862 -22.693 10.324 1.00 12.45 C ATOM 328 C ALA A 21 22.190 -22.421 8.983 1.00 62.34 C ATOM 329 O ALA A 21 22.414 -21.380 8.367 1.00 54.44 O ATOM 330 CB ALA A 21 21.906 -22.383 11.467 1.00 21.13 C ATOM 0 H ALA A 21 24.105 -21.054 9.918 1.00 34.10 H new ATOM 0 HA ALA A 21 23.126 -23.750 10.361 1.00 12.45 H new ATOM 0 HB1 ALA A 21 20.996 -22.971 11.349 1.00 21.13 H new ATOM 0 HB2 ALA A 21 22.380 -22.634 12.416 1.00 21.13 H new ATOM 0 HB3 ALA A 21 21.657 -21.322 11.455 1.00 21.13 H new ATOM 336 N GLN A 22 21.368 -23.365 8.536 1.00 62.31 N ATOM 337 CA GLN A 22 20.666 -23.227 7.266 1.00 73.34 C ATOM 338 C GLN A 22 19.158 -23.344 7.462 1.00 72.41 C ATOM 339 O GLN A 22 18.626 -24.443 7.622 1.00 64.30 O ATOM 340 CB GLN A 22 21.147 -24.289 6.275 1.00 51.44 C ATOM 341 CG GLN A 22 20.531 -24.153 4.891 1.00 22.04 C ATOM 342 CD GLN A 22 21.160 -25.089 3.878 1.00 31.44 C ATOM 343 OE1 GLN A 22 21.774 -26.093 4.241 1.00 32.31 O ATOM 344 NE2 GLN A 22 21.010 -24.765 2.599 1.00 32.54 N ATOM 0 H GLN A 22 21.172 -24.233 9.034 1.00 62.31 H new ATOM 0 HA GLN A 22 20.886 -22.238 6.864 1.00 73.34 H new ATOM 0 HB2 GLN A 22 22.232 -24.228 6.188 1.00 51.44 H new ATOM 0 HB3 GLN A 22 20.914 -25.277 6.672 1.00 51.44 H new ATOM 0 HG2 GLN A 22 19.462 -24.355 4.952 1.00 22.04 H new ATOM 0 HG3 GLN A 22 20.642 -23.124 4.548 1.00 22.04 H new ATOM 0 HE21 GLN A 22 20.493 -23.924 2.343 1.00 32.54 H new ATOM 0 HE22 GLN A 22 21.411 -25.358 1.872 1.00 32.54 H new ATOM 353 N ARG A 23 18.474 -22.205 7.449 1.00 41.22 N ATOM 354 CA ARG A 23 17.027 -22.180 7.627 1.00 3.31 C ATOM 355 C ARG A 23 16.323 -22.857 6.455 1.00 63.11 C ATOM 356 O ARG A 23 15.844 -23.984 6.574 1.00 75.45 O ATOM 357 CB ARG A 23 16.534 -20.738 7.768 1.00 24.41 C ATOM 358 CG ARG A 23 15.029 -20.624 7.942 1.00 53.15 C ATOM 359 CD ARG A 23 14.537 -19.219 7.630 1.00 63.14 C ATOM 360 NE ARG A 23 15.107 -18.226 8.536 1.00 1.02 N ATOM 361 CZ ARG A 23 14.581 -17.022 8.731 1.00 4.24 C ATOM 362 NH1 ARG A 23 13.479 -16.664 8.087 1.00 3.43 N ATOM 363 NH2 ARG A 23 15.158 -16.173 9.573 1.00 61.21 N ATOM 0 H ARG A 23 18.899 -21.287 7.317 1.00 41.22 H new ATOM 0 HA ARG A 23 16.789 -22.729 8.538 1.00 3.31 H new ATOM 0 HB2 ARG A 23 17.026 -20.277 8.624 1.00 24.41 H new ATOM 0 HB3 ARG A 23 16.833 -20.173 6.885 1.00 24.41 H new ATOM 0 HG2 ARG A 23 14.531 -21.339 7.287 1.00 53.15 H new ATOM 0 HG3 ARG A 23 14.759 -20.887 8.965 1.00 53.15 H new ATOM 0 HD2 ARG A 23 14.797 -18.964 6.603 1.00 63.14 H new ATOM 0 HD3 ARG A 23 13.450 -19.192 7.700 1.00 63.14 H new ATOM 0 HE ARG A 23 15.955 -18.470 9.047 1.00 1.02 H new ATOM 0 HH11 ARG A 23 13.033 -17.314 7.440 1.00 3.43 H new ATOM 0 HH12 ARG A 23 13.077 -15.739 8.239 1.00 3.43 H new ATOM 0 HH21 ARG A 23 16.006 -16.445 10.071 1.00 61.21 H new ATOM 0 HH22 ARG A 23 14.754 -15.249 9.722 1.00 61.21 H new ATOM 377 N SER A 24 16.265 -22.161 5.324 1.00 62.10 N ATOM 378 CA SER A 24 15.616 -22.693 4.132 1.00 62.25 C ATOM 379 C SER A 24 16.004 -21.886 2.896 1.00 21.31 C ATOM 380 O SER A 24 16.792 -20.945 2.980 1.00 55.55 O ATOM 381 CB SER A 24 14.096 -22.683 4.305 1.00 42.22 C ATOM 382 OG SER A 24 13.474 -23.578 3.399 1.00 15.35 O ATOM 0 H SER A 24 16.660 -21.228 5.208 1.00 62.10 H new ATOM 0 HA SER A 24 15.952 -23.721 3.994 1.00 62.25 H new ATOM 0 HB2 SER A 24 13.841 -22.961 5.328 1.00 42.22 H new ATOM 0 HB3 SER A 24 13.715 -21.674 4.144 1.00 42.22 H new ATOM 0 HG SER A 24 12.503 -23.555 3.531 1.00 15.35 H new ATOM 388 N GLU A 25 15.445 -22.264 1.751 1.00 54.22 N ATOM 389 CA GLU A 25 15.733 -21.576 0.498 1.00 75.14 C ATOM 390 C GLU A 25 14.984 -20.249 0.421 1.00 53.31 C ATOM 391 O GLU A 25 15.072 -19.529 -0.574 1.00 61.12 O ATOM 392 CB GLU A 25 15.352 -22.458 -0.693 1.00 70.42 C ATOM 393 CG GLU A 25 16.044 -22.066 -1.987 1.00 44.25 C ATOM 394 CD GLU A 25 15.239 -22.440 -3.217 1.00 1.03 C ATOM 395 OE1 GLU A 25 15.331 -21.716 -4.230 1.00 12.12 O ATOM 396 OE2 GLU A 25 14.517 -23.458 -3.165 1.00 2.21 O ATOM 0 H GLU A 25 14.791 -23.042 1.665 1.00 54.22 H new ATOM 0 HA GLU A 25 16.803 -21.372 0.463 1.00 75.14 H new ATOM 0 HB2 GLU A 25 15.597 -23.494 -0.460 1.00 70.42 H new ATOM 0 HB3 GLU A 25 14.273 -22.410 -0.839 1.00 70.42 H new ATOM 0 HG2 GLU A 25 16.223 -20.991 -1.988 1.00 44.25 H new ATOM 0 HG3 GLU A 25 17.019 -22.551 -2.034 1.00 44.25 H new ATOM 403 N LYS A 26 14.245 -19.931 1.479 1.00 45.21 N ATOM 404 CA LYS A 26 13.481 -18.691 1.534 1.00 12.51 C ATOM 405 C LYS A 26 14.398 -17.496 1.774 1.00 44.24 C ATOM 406 O LYS A 26 14.251 -16.451 1.140 1.00 60.55 O ATOM 407 CB LYS A 26 12.426 -18.767 2.640 1.00 12.51 C ATOM 408 CG LYS A 26 11.471 -19.938 2.490 1.00 55.20 C ATOM 409 CD LYS A 26 10.086 -19.599 3.016 1.00 31.13 C ATOM 410 CE LYS A 26 9.970 -19.887 4.505 1.00 11.13 C ATOM 411 NZ LYS A 26 9.892 -21.348 4.783 1.00 15.24 N ATOM 0 H LYS A 26 14.159 -20.516 2.310 1.00 45.21 H new ATOM 0 HA LYS A 26 12.984 -18.558 0.573 1.00 12.51 H new ATOM 0 HB2 LYS A 26 12.928 -18.840 3.605 1.00 12.51 H new ATOM 0 HB3 LYS A 26 11.853 -17.840 2.648 1.00 12.51 H new ATOM 0 HG2 LYS A 26 11.403 -20.221 1.440 1.00 55.20 H new ATOM 0 HG3 LYS A 26 11.864 -20.801 3.028 1.00 55.20 H new ATOM 0 HD2 LYS A 26 9.873 -18.546 2.830 1.00 31.13 H new ATOM 0 HD3 LYS A 26 9.338 -20.177 2.473 1.00 31.13 H new ATOM 0 HE2 LYS A 26 10.830 -19.464 5.025 1.00 11.13 H new ATOM 0 HE3 LYS A 26 9.083 -19.394 4.902 1.00 11.13 H new ATOM 0 HZ1 LYS A 26 9.563 -21.499 5.758 1.00 15.24 H new ATOM 0 HZ2 LYS A 26 9.225 -21.792 4.120 1.00 15.24 H new ATOM 0 HZ3 LYS A 26 10.833 -21.774 4.666 1.00 15.24 H new ATOM 425 N MET A 27 15.346 -17.658 2.691 1.00 10.23 N ATOM 426 CA MET A 27 16.289 -16.593 3.012 1.00 41.44 C ATOM 427 C MET A 27 17.119 -16.215 1.789 1.00 61.44 C ATOM 428 O MET A 27 16.893 -16.727 0.692 1.00 43.31 O ATOM 429 CB MET A 27 17.210 -17.024 4.154 1.00 23.52 C ATOM 430 CG MET A 27 16.517 -17.080 5.506 1.00 41.12 C ATOM 431 SD MET A 27 16.217 -15.443 6.200 1.00 25.13 S ATOM 432 CE MET A 27 17.892 -14.912 6.550 1.00 31.24 C ATOM 0 H MET A 27 15.482 -18.516 3.225 1.00 10.23 H new ATOM 0 HA MET A 27 15.718 -15.719 3.326 1.00 41.44 H new ATOM 0 HB2 MET A 27 17.623 -18.007 3.926 1.00 23.52 H new ATOM 0 HB3 MET A 27 18.050 -16.331 4.214 1.00 23.52 H new ATOM 0 HG2 MET A 27 15.568 -17.606 5.402 1.00 41.12 H new ATOM 0 HG3 MET A 27 17.128 -17.658 6.199 1.00 41.12 H new ATOM 0 HE1 MET A 27 17.868 -14.039 7.202 1.00 31.24 H new ATOM 0 HE2 MET A 27 18.434 -15.719 7.044 1.00 31.24 H new ATOM 0 HE3 MET A 27 18.395 -14.655 5.618 1.00 31.24 H new ATOM 442 N SER A 28 18.079 -15.318 1.985 1.00 45.33 N ATOM 443 CA SER A 28 18.940 -14.869 0.896 1.00 23.24 C ATOM 444 C SER A 28 20.166 -15.768 0.768 1.00 62.13 C ATOM 445 O SER A 28 20.894 -15.988 1.737 1.00 44.43 O ATOM 446 CB SER A 28 19.377 -13.421 1.127 1.00 24.43 C ATOM 447 OG SER A 28 18.283 -12.531 0.995 1.00 10.13 O ATOM 0 H SER A 28 18.281 -14.887 2.887 1.00 45.33 H new ATOM 0 HA SER A 28 18.371 -14.925 -0.032 1.00 23.24 H new ATOM 0 HB2 SER A 28 19.811 -13.323 2.122 1.00 24.43 H new ATOM 0 HB3 SER A 28 20.155 -13.154 0.412 1.00 24.43 H new ATOM 0 HG SER A 28 18.588 -11.613 1.149 1.00 10.13 H new ATOM 453 N LEU A 29 20.388 -16.286 -0.435 1.00 44.02 N ATOM 454 CA LEU A 29 21.526 -17.162 -0.693 1.00 2.10 C ATOM 455 C LEU A 29 21.815 -18.048 0.514 1.00 23.51 C ATOM 456 O LEU A 29 22.942 -18.124 1.004 1.00 63.21 O ATOM 457 CB LEU A 29 22.764 -16.333 -1.040 1.00 24.42 C ATOM 458 CG LEU A 29 22.573 -15.255 -2.107 1.00 1.12 C ATOM 459 CD1 LEU A 29 23.374 -14.010 -1.757 1.00 35.00 C ATOM 460 CD2 LEU A 29 22.975 -15.782 -3.476 1.00 63.44 C ATOM 0 H LEU A 29 19.795 -16.115 -1.247 1.00 44.02 H new ATOM 0 HA LEU A 29 21.276 -17.802 -1.539 1.00 2.10 H new ATOM 0 HB2 LEU A 29 23.123 -15.854 -0.129 1.00 24.42 H new ATOM 0 HB3 LEU A 29 23.549 -17.012 -1.374 1.00 24.42 H new ATOM 0 HG LEU A 29 21.517 -14.986 -2.139 1.00 1.12 H new ATOM 0 HD11 LEU A 29 23.226 -13.253 -2.528 1.00 35.00 H new ATOM 0 HD12 LEU A 29 23.039 -13.620 -0.796 1.00 35.00 H new ATOM 0 HD13 LEU A 29 24.432 -14.263 -1.696 1.00 35.00 H new ATOM 0 HD21 LEU A 29 22.832 -15.001 -4.223 1.00 63.44 H new ATOM 0 HD22 LEU A 29 24.023 -16.080 -3.458 1.00 63.44 H new ATOM 0 HD23 LEU A 29 22.358 -16.644 -3.730 1.00 63.44 H new ATOM 472 N PRO A 30 20.775 -18.738 1.005 1.00 13.32 N ATOM 473 CA PRO A 30 20.893 -19.634 2.159 1.00 15.01 C ATOM 474 C PRO A 30 21.698 -20.888 1.839 1.00 61.41 C ATOM 475 O PRO A 30 22.331 -21.474 2.719 1.00 42.42 O ATOM 476 CB PRO A 30 19.440 -19.998 2.476 1.00 53.34 C ATOM 477 CG PRO A 30 18.717 -19.828 1.184 1.00 12.12 C ATOM 478 CD PRO A 30 19.403 -18.696 0.471 1.00 10.43 C ATOM 0 HA PRO A 30 21.419 -19.162 2.989 1.00 15.01 H new ATOM 0 HB2 PRO A 30 19.359 -21.021 2.843 1.00 53.34 H new ATOM 0 HB3 PRO A 30 19.029 -19.348 3.249 1.00 53.34 H new ATOM 0 HG2 PRO A 30 18.756 -20.742 0.592 1.00 12.12 H new ATOM 0 HG3 PRO A 30 17.664 -19.602 1.353 1.00 12.12 H new ATOM 0 HD2 PRO A 30 19.388 -18.834 -0.610 1.00 10.43 H new ATOM 0 HD3 PRO A 30 18.921 -17.740 0.677 1.00 10.43 H new ATOM 486 N LEU A 31 21.671 -21.297 0.575 1.00 11.31 N ATOM 487 CA LEU A 31 22.400 -22.483 0.138 1.00 12.53 C ATOM 488 C LEU A 31 23.866 -22.403 0.551 1.00 21.20 C ATOM 489 O LEU A 31 24.388 -23.308 1.202 1.00 74.45 O ATOM 490 CB LEU A 31 22.293 -22.640 -1.379 1.00 62.55 C ATOM 491 CG LEU A 31 20.905 -22.421 -1.981 1.00 53.13 C ATOM 492 CD1 LEU A 31 20.953 -21.346 -3.056 1.00 73.21 C ATOM 493 CD2 LEU A 31 20.358 -23.722 -2.550 1.00 30.33 C ATOM 0 H LEU A 31 21.152 -20.825 -0.165 1.00 11.31 H new ATOM 0 HA LEU A 31 21.953 -23.353 0.619 1.00 12.53 H new ATOM 0 HB2 LEU A 31 22.984 -21.939 -1.846 1.00 62.55 H new ATOM 0 HB3 LEU A 31 22.628 -23.643 -1.645 1.00 62.55 H new ATOM 0 HG LEU A 31 20.236 -22.085 -1.189 1.00 53.13 H new ATOM 0 HD11 LEU A 31 19.956 -21.204 -3.473 1.00 73.21 H new ATOM 0 HD12 LEU A 31 21.300 -20.410 -2.619 1.00 73.21 H new ATOM 0 HD13 LEU A 31 21.637 -21.653 -3.847 1.00 73.21 H new ATOM 0 HD21 LEU A 31 19.369 -23.546 -2.974 1.00 30.33 H new ATOM 0 HD22 LEU A 31 21.027 -24.088 -3.329 1.00 30.33 H new ATOM 0 HD23 LEU A 31 20.285 -24.465 -1.755 1.00 30.33 H new ATOM 505 N MET A 32 24.525 -21.314 0.170 1.00 54.41 N ATOM 506 CA MET A 32 25.930 -21.115 0.504 1.00 42.23 C ATOM 507 C MET A 32 26.104 -20.861 1.998 1.00 74.51 C ATOM 508 O MET A 32 26.943 -21.483 2.649 1.00 65.24 O ATOM 509 CB MET A 32 26.505 -19.943 -0.294 1.00 41.12 C ATOM 510 CG MET A 32 25.712 -18.655 -0.140 1.00 31.41 C ATOM 511 SD MET A 32 26.281 -17.352 -1.249 1.00 35.23 S ATOM 512 CE MET A 32 26.147 -15.919 -0.183 1.00 40.21 C ATOM 0 H MET A 32 24.108 -20.556 -0.370 1.00 54.41 H new ATOM 0 HA MET A 32 26.471 -22.024 0.243 1.00 42.23 H new ATOM 0 HB2 MET A 32 27.533 -19.767 0.024 1.00 41.12 H new ATOM 0 HB3 MET A 32 26.540 -20.215 -1.349 1.00 41.12 H new ATOM 0 HG2 MET A 32 24.658 -18.856 -0.333 1.00 31.41 H new ATOM 0 HG3 MET A 32 25.787 -18.308 0.891 1.00 31.41 H new ATOM 0 HE1 MET A 32 25.936 -15.036 -0.786 1.00 40.21 H new ATOM 0 HE2 MET A 32 25.339 -16.072 0.532 1.00 40.21 H new ATOM 0 HE3 MET A 32 27.085 -15.776 0.354 1.00 40.21 H new ATOM 522 N TRP A 33 25.305 -19.946 2.534 1.00 3.15 N ATOM 523 CA TRP A 33 25.372 -19.611 3.953 1.00 55.15 C ATOM 524 C TRP A 33 24.071 -18.968 4.421 1.00 1.32 C ATOM 525 O TRP A 33 23.345 -18.369 3.629 1.00 14.52 O ATOM 526 CB TRP A 33 26.546 -18.669 4.221 1.00 44.14 C ATOM 527 CG TRP A 33 27.881 -19.345 4.137 1.00 62.35 C ATOM 528 CD1 TRP A 33 28.721 -19.370 3.060 1.00 3.30 C ATOM 529 CD2 TRP A 33 28.528 -20.097 5.170 1.00 51.53 C ATOM 530 NE1 TRP A 33 29.851 -20.091 3.362 1.00 43.12 N ATOM 531 CE2 TRP A 33 29.757 -20.547 4.650 1.00 5.41 C ATOM 532 CE3 TRP A 33 28.189 -20.431 6.483 1.00 2.15 C ATOM 533 CZ2 TRP A 33 30.646 -21.314 5.399 1.00 13.43 C ATOM 534 CZ3 TRP A 33 29.072 -21.193 7.226 1.00 54.44 C ATOM 535 CH2 TRP A 33 30.288 -21.626 6.683 1.00 63.54 C ATOM 0 H TRP A 33 24.604 -19.423 2.009 1.00 3.15 H new ATOM 0 HA TRP A 33 25.522 -20.534 4.513 1.00 55.15 H new ATOM 0 HB2 TRP A 33 26.516 -17.849 3.503 1.00 44.14 H new ATOM 0 HB3 TRP A 33 26.431 -18.229 5.212 1.00 44.14 H new ATOM 0 HD1 TRP A 33 28.526 -18.893 2.111 1.00 3.30 H new ATOM 0 HE1 TRP A 33 30.633 -20.259 2.729 1.00 43.12 H new ATOM 0 HE3 TRP A 33 27.254 -20.100 6.910 1.00 2.15 H new ATOM 0 HZ2 TRP A 33 31.584 -21.650 4.982 1.00 13.43 H new ATOM 0 HZ3 TRP A 33 28.820 -21.459 8.242 1.00 54.44 H new ATOM 0 HH2 TRP A 33 30.957 -22.218 7.290 1.00 63.54 H new ATOM 546 N GLU A 34 23.784 -19.096 5.713 1.00 62.00 N ATOM 547 CA GLU A 34 22.570 -18.527 6.285 1.00 12.33 C ATOM 548 C GLU A 34 22.662 -18.467 7.807 1.00 34.43 C ATOM 549 O GLU A 34 23.548 -19.072 8.411 1.00 31.30 O ATOM 550 CB GLU A 34 21.349 -19.350 5.869 1.00 52.53 C ATOM 551 CG GLU A 34 20.057 -18.550 5.838 1.00 3.45 C ATOM 552 CD GLU A 34 20.180 -17.274 5.028 1.00 41.01 C ATOM 553 OE1 GLU A 34 20.067 -17.346 3.786 1.00 12.15 O ATOM 554 OE2 GLU A 34 20.389 -16.203 5.636 1.00 63.30 O ATOM 0 H GLU A 34 24.375 -19.588 6.382 1.00 62.00 H new ATOM 0 HA GLU A 34 22.461 -17.511 5.904 1.00 12.33 H new ATOM 0 HB2 GLU A 34 21.527 -19.775 4.881 1.00 52.53 H new ATOM 0 HB3 GLU A 34 21.232 -20.186 6.559 1.00 52.53 H new ATOM 0 HG2 GLU A 34 19.262 -19.167 5.419 1.00 3.45 H new ATOM 0 HG3 GLU A 34 19.763 -18.302 6.858 1.00 3.45 H new ATOM 561 N PHE A 35 21.740 -17.734 8.422 1.00 53.54 N ATOM 562 CA PHE A 35 21.717 -17.593 9.873 1.00 74.01 C ATOM 563 C PHE A 35 20.360 -18.004 10.438 1.00 52.24 C ATOM 564 O PHE A 35 19.353 -18.048 9.731 1.00 75.00 O ATOM 565 CB PHE A 35 22.032 -16.150 10.272 1.00 51.11 C ATOM 566 CG PHE A 35 23.497 -15.892 10.480 1.00 51.03 C ATOM 567 CD1 PHE A 35 24.112 -14.799 9.890 1.00 70.54 C ATOM 568 CD2 PHE A 35 24.259 -16.742 11.265 1.00 11.54 C ATOM 569 CE1 PHE A 35 25.460 -14.560 10.079 1.00 60.44 C ATOM 570 CE2 PHE A 35 25.607 -16.507 11.458 1.00 24.24 C ATOM 571 CZ PHE A 35 26.208 -15.415 10.865 1.00 44.51 C ATOM 0 H PHE A 35 20.998 -17.228 7.938 1.00 53.54 H new ATOM 0 HA PHE A 35 22.479 -18.252 10.289 1.00 74.01 H new ATOM 0 HB2 PHE A 35 21.659 -15.478 9.499 1.00 51.11 H new ATOM 0 HB3 PHE A 35 21.495 -15.910 11.190 1.00 51.11 H new ATOM 0 HD1 PHE A 35 23.531 -14.127 9.276 1.00 70.54 H new ATOM 0 HD2 PHE A 35 23.794 -17.598 11.731 1.00 11.54 H new ATOM 0 HE1 PHE A 35 25.928 -13.706 9.613 1.00 60.44 H new ATOM 0 HE2 PHE A 35 26.190 -17.177 12.072 1.00 24.24 H new ATOM 0 HZ PHE A 35 27.261 -15.229 11.015 1.00 44.51 H new ATOM 581 N PRO A 36 20.332 -18.312 11.743 1.00 75.54 N ATOM 582 CA PRO A 36 19.105 -18.725 12.432 1.00 65.30 C ATOM 583 C PRO A 36 18.110 -17.580 12.581 1.00 5.52 C ATOM 584 O PRO A 36 18.428 -16.427 12.290 1.00 32.13 O ATOM 585 CB PRO A 36 19.607 -19.180 13.805 1.00 74.51 C ATOM 586 CG PRO A 36 20.880 -18.435 14.010 1.00 50.23 C ATOM 587 CD PRO A 36 21.494 -18.282 12.646 1.00 42.33 C ATOM 0 HA PRO A 36 18.568 -19.497 11.881 1.00 65.30 H new ATOM 0 HB2 PRO A 36 18.883 -18.950 14.587 1.00 74.51 H new ATOM 0 HB3 PRO A 36 19.771 -20.257 13.829 1.00 74.51 H new ATOM 0 HG2 PRO A 36 20.694 -17.462 14.466 1.00 50.23 H new ATOM 0 HG3 PRO A 36 21.547 -18.978 14.679 1.00 50.23 H new ATOM 0 HD2 PRO A 36 22.048 -17.347 12.557 1.00 42.33 H new ATOM 0 HD3 PRO A 36 22.194 -19.089 12.428 1.00 42.33 H new ATOM 595 N GLY A 37 16.904 -17.904 13.037 1.00 24.51 N ATOM 596 CA GLY A 37 15.882 -16.891 13.217 1.00 15.12 C ATOM 597 C GLY A 37 14.656 -17.146 12.363 1.00 35.21 C ATOM 598 O GLY A 37 14.512 -18.217 11.775 1.00 20.32 O ATOM 0 H GLY A 37 16.617 -18.851 13.285 1.00 24.51 H new ATOM 0 HA2 GLY A 37 15.589 -16.857 14.266 1.00 15.12 H new ATOM 0 HA3 GLY A 37 16.296 -15.914 12.970 1.00 15.12 H new ATOM 602 N GLY A 38 13.767 -16.159 12.295 1.00 20.35 N ATOM 603 CA GLY A 38 12.558 -16.303 11.506 1.00 14.34 C ATOM 604 C GLY A 38 11.962 -14.966 11.110 1.00 62.42 C ATOM 605 O GLY A 38 12.534 -14.239 10.298 1.00 64.34 O ATOM 0 H GLY A 38 13.863 -15.263 12.772 1.00 20.35 H new ATOM 0 HA2 GLY A 38 12.780 -16.879 10.608 1.00 14.34 H new ATOM 0 HA3 GLY A 38 11.822 -16.871 12.075 1.00 14.34 H new ATOM 609 N LYS A 39 10.808 -14.641 11.683 1.00 62.33 N ATOM 610 CA LYS A 39 10.133 -13.384 11.385 1.00 42.41 C ATOM 611 C LYS A 39 9.705 -12.679 12.668 1.00 11.11 C ATOM 612 O LYS A 39 9.838 -13.226 13.763 1.00 72.21 O ATOM 613 CB LYS A 39 8.913 -13.634 10.496 1.00 33.13 C ATOM 614 CG LYS A 39 9.263 -14.170 9.119 1.00 52.21 C ATOM 615 CD LYS A 39 8.102 -14.935 8.506 1.00 15.42 C ATOM 616 CE LYS A 39 8.146 -16.408 8.880 1.00 35.33 C ATOM 617 NZ LYS A 39 7.090 -17.190 8.179 1.00 32.22 N ATOM 0 H LYS A 39 10.321 -15.232 12.357 1.00 62.33 H new ATOM 0 HA LYS A 39 10.835 -12.741 10.855 1.00 42.41 H new ATOM 0 HB2 LYS A 39 8.250 -14.341 10.994 1.00 33.13 H new ATOM 0 HB3 LYS A 39 8.359 -12.702 10.384 1.00 33.13 H new ATOM 0 HG2 LYS A 39 9.540 -13.343 8.465 1.00 52.21 H new ATOM 0 HG3 LYS A 39 10.132 -14.824 9.192 1.00 52.21 H new ATOM 0 HD2 LYS A 39 7.161 -14.501 8.843 1.00 15.42 H new ATOM 0 HD3 LYS A 39 8.130 -14.833 7.421 1.00 15.42 H new ATOM 0 HE2 LYS A 39 9.126 -16.817 8.632 1.00 35.33 H new ATOM 0 HE3 LYS A 39 8.021 -16.513 9.958 1.00 35.33 H new ATOM 0 HZ1 LYS A 39 7.153 -18.189 8.461 1.00 32.22 H new ATOM 0 HZ2 LYS A 39 6.154 -16.817 8.435 1.00 32.22 H new ATOM 0 HZ3 LYS A 39 7.224 -17.111 7.151 1.00 32.22 H new ATOM 631 N VAL A 40 9.189 -11.462 12.526 1.00 61.11 N ATOM 632 CA VAL A 40 8.739 -10.684 13.674 1.00 53.35 C ATOM 633 C VAL A 40 7.230 -10.467 13.633 1.00 62.22 C ATOM 634 O VAL A 40 6.643 -10.321 12.561 1.00 24.42 O ATOM 635 CB VAL A 40 9.441 -9.314 13.734 1.00 64.44 C ATOM 636 CG1 VAL A 40 8.959 -8.519 14.937 1.00 53.33 C ATOM 637 CG2 VAL A 40 10.952 -9.492 13.773 1.00 73.42 C ATOM 0 H VAL A 40 9.072 -10.994 11.627 1.00 61.11 H new ATOM 0 HA VAL A 40 8.998 -11.256 14.565 1.00 53.35 H new ATOM 0 HB VAL A 40 9.186 -8.755 12.834 1.00 64.44 H new ATOM 0 HG11 VAL A 40 9.466 -7.554 14.963 1.00 53.33 H new ATOM 0 HG12 VAL A 40 7.883 -8.362 14.862 1.00 53.33 H new ATOM 0 HG13 VAL A 40 9.182 -9.070 15.850 1.00 53.33 H new ATOM 0 HG21 VAL A 40 11.433 -8.515 13.815 1.00 73.42 H new ATOM 0 HG22 VAL A 40 11.228 -10.070 14.655 1.00 73.42 H new ATOM 0 HG23 VAL A 40 11.280 -10.019 12.877 1.00 73.42 H new ATOM 647 N GLU A 41 6.609 -10.447 14.808 1.00 53.11 N ATOM 648 CA GLU A 41 5.167 -10.248 14.906 1.00 65.33 C ATOM 649 C GLU A 41 4.799 -8.794 14.629 1.00 53.40 C ATOM 650 O GLU A 41 5.603 -7.886 14.841 1.00 11.24 O ATOM 651 CB GLU A 41 4.667 -10.658 16.292 1.00 12.13 C ATOM 652 CG GLU A 41 5.247 -11.973 16.785 1.00 2.21 C ATOM 653 CD GLU A 41 5.260 -13.044 15.712 1.00 51.33 C ATOM 654 OE1 GLU A 41 4.167 -13.482 15.297 1.00 54.31 O ATOM 655 OE2 GLU A 41 6.364 -13.443 15.286 1.00 20.54 O ATOM 0 H GLU A 41 7.081 -10.566 15.705 1.00 53.11 H new ATOM 0 HA GLU A 41 4.687 -10.875 14.155 1.00 65.33 H new ATOM 0 HB2 GLU A 41 4.914 -9.872 17.005 1.00 12.13 H new ATOM 0 HB3 GLU A 41 3.580 -10.736 16.268 1.00 12.13 H new ATOM 0 HG2 GLU A 41 6.264 -11.807 17.139 1.00 2.21 H new ATOM 0 HG3 GLU A 41 4.666 -12.325 17.637 1.00 2.21 H new ATOM 662 N LYS A 42 3.577 -8.579 14.153 1.00 71.51 N ATOM 663 CA LYS A 42 3.099 -7.236 13.847 1.00 71.41 C ATOM 664 C LYS A 42 2.918 -6.420 15.122 1.00 11.53 C ATOM 665 O LYS A 42 3.133 -5.208 15.130 1.00 30.33 O ATOM 666 CB LYS A 42 1.776 -7.306 13.081 1.00 52.20 C ATOM 667 CG LYS A 42 0.735 -8.191 13.744 1.00 12.13 C ATOM 668 CD LYS A 42 0.466 -9.444 12.928 1.00 42.23 C ATOM 669 CE LYS A 42 -0.784 -10.165 13.408 1.00 2.03 C ATOM 670 NZ LYS A 42 -0.465 -11.223 14.407 1.00 43.32 N ATOM 0 H LYS A 42 2.899 -9.319 13.971 1.00 71.51 H new ATOM 0 HA LYS A 42 3.846 -6.744 13.225 1.00 71.41 H new ATOM 0 HB2 LYS A 42 1.372 -6.299 12.978 1.00 52.20 H new ATOM 0 HB3 LYS A 42 1.968 -7.677 12.074 1.00 52.20 H new ATOM 0 HG2 LYS A 42 1.076 -8.471 14.741 1.00 12.13 H new ATOM 0 HG3 LYS A 42 -0.192 -7.632 13.870 1.00 12.13 H new ATOM 0 HD2 LYS A 42 0.353 -9.178 11.877 1.00 42.23 H new ATOM 0 HD3 LYS A 42 1.323 -10.115 12.996 1.00 42.23 H new ATOM 0 HE2 LYS A 42 -1.472 -9.444 13.850 1.00 2.03 H new ATOM 0 HE3 LYS A 42 -1.295 -10.613 12.556 1.00 2.03 H new ATOM 0 HZ1 LYS A 42 -1.343 -11.691 14.709 1.00 43.32 H new ATOM 0 HZ2 LYS A 42 0.171 -11.925 13.978 1.00 43.32 H new ATOM 0 HZ3 LYS A 42 -0.000 -10.793 15.232 1.00 43.32 H new ATOM 684 N ASN A 43 2.523 -7.091 16.199 1.00 74.42 N ATOM 685 CA ASN A 43 2.314 -6.427 17.480 1.00 31.13 C ATOM 686 C ASN A 43 3.477 -6.700 18.430 1.00 54.51 C ATOM 687 O ASN A 43 3.278 -6.904 19.627 1.00 53.41 O ATOM 688 CB ASN A 43 1.003 -6.896 18.114 1.00 74.31 C ATOM 689 CG ASN A 43 0.928 -8.406 18.238 1.00 1.11 C ATOM 690 OD1 ASN A 43 1.934 -9.069 18.491 1.00 72.40 O ATOM 691 ND2 ASN A 43 -0.267 -8.956 18.060 1.00 54.31 N ATOM 0 H ASN A 43 2.341 -8.095 16.210 1.00 74.42 H new ATOM 0 HA ASN A 43 2.259 -5.353 17.300 1.00 31.13 H new ATOM 0 HB2 ASN A 43 0.900 -6.448 19.102 1.00 74.31 H new ATOM 0 HB3 ASN A 43 0.165 -6.541 17.514 1.00 74.31 H new ATOM 0 HD21 ASN A 43 -0.379 -9.967 18.131 1.00 54.31 H new ATOM 0 HD22 ASN A 43 -1.074 -8.367 17.852 1.00 54.31 H new ATOM 698 N GLU A 44 4.690 -6.700 17.886 1.00 32.15 N ATOM 699 CA GLU A 44 5.884 -6.948 18.686 1.00 50.52 C ATOM 700 C GLU A 44 7.123 -6.372 18.006 1.00 52.32 C ATOM 701 O GLU A 44 7.318 -6.537 16.801 1.00 22.32 O ATOM 702 CB GLU A 44 6.067 -8.449 18.918 1.00 44.22 C ATOM 703 CG GLU A 44 7.112 -8.779 19.971 1.00 14.21 C ATOM 704 CD GLU A 44 6.569 -8.673 21.383 1.00 24.13 C ATOM 705 OE1 GLU A 44 7.312 -9.003 22.331 1.00 64.00 O ATOM 706 OE2 GLU A 44 5.401 -8.260 21.540 1.00 3.22 O ATOM 0 H GLU A 44 4.872 -6.531 16.897 1.00 32.15 H new ATOM 0 HA GLU A 44 5.755 -6.453 19.648 1.00 50.52 H new ATOM 0 HB2 GLU A 44 5.112 -8.881 19.218 1.00 44.22 H new ATOM 0 HB3 GLU A 44 6.349 -8.922 17.977 1.00 44.22 H new ATOM 0 HG2 GLU A 44 7.485 -9.790 19.804 1.00 14.21 H new ATOM 0 HG3 GLU A 44 7.960 -8.104 19.860 1.00 14.21 H new ATOM 713 N THR A 45 7.958 -5.693 18.787 1.00 60.33 N ATOM 714 CA THR A 45 9.177 -5.091 18.261 1.00 32.13 C ATOM 715 C THR A 45 10.206 -6.157 17.902 1.00 52.32 C ATOM 716 O THR A 45 10.102 -7.304 18.335 1.00 13.42 O ATOM 717 CB THR A 45 9.801 -4.112 19.273 1.00 12.32 C ATOM 718 OG1 THR A 45 8.774 -3.512 20.071 1.00 3.41 O ATOM 719 CG2 THR A 45 10.594 -3.028 18.559 1.00 55.43 C ATOM 0 H THR A 45 7.812 -5.546 19.786 1.00 60.33 H new ATOM 0 HA THR A 45 8.897 -4.543 17.361 1.00 32.13 H new ATOM 0 HB THR A 45 10.480 -4.672 19.916 1.00 12.32 H new ATOM 0 HG1 THR A 45 8.811 -3.877 20.980 1.00 3.41 H new ATOM 0 HG21 THR A 45 11.025 -2.349 19.294 1.00 55.43 H new ATOM 0 HG22 THR A 45 11.393 -3.486 17.976 1.00 55.43 H new ATOM 0 HG23 THR A 45 9.933 -2.472 17.895 1.00 55.43 H new ATOM 727 N GLU A 46 11.199 -5.770 17.108 1.00 42.44 N ATOM 728 CA GLU A 46 12.247 -6.694 16.690 1.00 2.35 C ATOM 729 C GLU A 46 12.943 -7.310 17.901 1.00 40.50 C ATOM 730 O GLU A 46 13.034 -8.531 18.025 1.00 74.11 O ATOM 731 CB GLU A 46 13.272 -5.974 15.811 1.00 72.32 C ATOM 732 CG GLU A 46 12.705 -5.493 14.486 1.00 61.14 C ATOM 733 CD GLU A 46 12.093 -4.109 14.581 1.00 30.11 C ATOM 734 OE1 GLU A 46 12.819 -3.122 14.339 1.00 30.01 O ATOM 735 OE2 GLU A 46 10.889 -4.013 14.898 1.00 50.33 O ATOM 0 H GLU A 46 11.300 -4.824 16.741 1.00 42.44 H new ATOM 0 HA GLU A 46 11.782 -7.494 16.113 1.00 2.35 H new ATOM 0 HB2 GLU A 46 13.671 -5.120 16.358 1.00 72.32 H new ATOM 0 HB3 GLU A 46 14.108 -6.646 15.617 1.00 72.32 H new ATOM 0 HG2 GLU A 46 13.497 -5.485 13.738 1.00 61.14 H new ATOM 0 HG3 GLU A 46 11.948 -6.198 14.142 1.00 61.14 H new ATOM 742 N LYS A 47 13.434 -6.455 18.792 1.00 50.21 N ATOM 743 CA LYS A 47 14.121 -6.912 19.994 1.00 65.14 C ATOM 744 C LYS A 47 13.233 -7.848 20.806 1.00 74.51 C ATOM 745 O LYS A 47 13.572 -9.013 21.019 1.00 42.51 O ATOM 746 CB LYS A 47 14.541 -5.717 20.852 1.00 15.25 C ATOM 747 CG LYS A 47 16.009 -5.731 21.239 1.00 3.13 C ATOM 748 CD LYS A 47 16.236 -6.485 22.539 1.00 44.21 C ATOM 749 CE LYS A 47 16.398 -7.978 22.296 1.00 4.44 C ATOM 750 NZ LYS A 47 17.773 -8.319 21.835 1.00 13.43 N ATOM 0 H LYS A 47 13.369 -5.441 18.704 1.00 50.21 H new ATOM 0 HA LYS A 47 15.011 -7.461 19.687 1.00 65.14 H new ATOM 0 HB2 LYS A 47 14.326 -4.797 20.308 1.00 15.25 H new ATOM 0 HB3 LYS A 47 13.935 -5.701 21.758 1.00 15.25 H new ATOM 0 HG2 LYS A 47 16.592 -6.194 20.442 1.00 3.13 H new ATOM 0 HG3 LYS A 47 16.368 -4.707 21.344 1.00 3.13 H new ATOM 0 HD2 LYS A 47 17.126 -6.097 23.035 1.00 44.21 H new ATOM 0 HD3 LYS A 47 15.396 -6.314 23.212 1.00 44.21 H new ATOM 0 HE2 LYS A 47 16.178 -8.522 23.215 1.00 4.44 H new ATOM 0 HE3 LYS A 47 15.673 -8.305 21.550 1.00 4.44 H new ATOM 0 HZ1 LYS A 47 17.748 -8.576 20.828 1.00 13.43 H new ATOM 0 HZ2 LYS A 47 18.397 -7.498 21.967 1.00 13.43 H new ATOM 0 HZ3 LYS A 47 18.135 -9.122 22.388 1.00 13.43 H new ATOM 764 N ASP A 48 12.094 -7.333 21.255 1.00 34.44 N ATOM 765 CA ASP A 48 11.155 -8.125 22.042 1.00 14.31 C ATOM 766 C ASP A 48 10.782 -9.411 21.311 1.00 1.23 C ATOM 767 O ASP A 48 10.440 -10.414 21.936 1.00 60.42 O ATOM 768 CB ASP A 48 9.895 -7.311 22.342 1.00 11.40 C ATOM 769 CG ASP A 48 10.210 -5.886 22.752 1.00 45.52 C ATOM 770 OD1 ASP A 48 11.268 -5.669 23.379 1.00 63.41 O ATOM 771 OD2 ASP A 48 9.399 -4.986 22.446 1.00 21.42 O ATOM 0 H ASP A 48 11.798 -6.371 21.088 1.00 34.44 H new ATOM 0 HA ASP A 48 11.640 -8.390 22.982 1.00 14.31 H new ATOM 0 HB2 ASP A 48 9.255 -7.299 21.460 1.00 11.40 H new ATOM 0 HB3 ASP A 48 9.332 -7.799 23.138 1.00 11.40 H new ATOM 776 N ALA A 49 10.850 -9.372 19.985 1.00 60.45 N ATOM 777 CA ALA A 49 10.521 -10.535 19.169 1.00 51.32 C ATOM 778 C ALA A 49 11.613 -11.596 19.259 1.00 54.40 C ATOM 779 O ALA A 49 11.337 -12.793 19.173 1.00 25.22 O ATOM 780 CB ALA A 49 10.304 -10.119 17.721 1.00 23.32 C ATOM 0 H ALA A 49 11.130 -8.548 19.452 1.00 60.45 H new ATOM 0 HA ALA A 49 9.598 -10.968 19.553 1.00 51.32 H new ATOM 0 HB1 ALA A 49 10.059 -10.997 17.123 1.00 23.32 H new ATOM 0 HB2 ALA A 49 9.484 -9.403 17.667 1.00 23.32 H new ATOM 0 HB3 ALA A 49 11.213 -9.659 17.334 1.00 23.32 H new ATOM 786 N LEU A 50 12.852 -11.149 19.432 1.00 72.24 N ATOM 787 CA LEU A 50 13.986 -12.061 19.533 1.00 42.22 C ATOM 788 C LEU A 50 14.083 -12.656 20.934 1.00 71.53 C ATOM 789 O LEU A 50 14.336 -13.851 21.095 1.00 41.33 O ATOM 790 CB LEU A 50 15.285 -11.331 19.186 1.00 51.30 C ATOM 791 CG LEU A 50 15.506 -11.021 17.705 1.00 14.40 C ATOM 792 CD1 LEU A 50 16.518 -9.898 17.540 1.00 40.21 C ATOM 793 CD2 LEU A 50 15.963 -12.267 16.961 1.00 32.14 C ATOM 0 H LEU A 50 13.097 -10.162 19.505 1.00 72.24 H new ATOM 0 HA LEU A 50 13.832 -12.873 18.823 1.00 42.22 H new ATOM 0 HB2 LEU A 50 15.310 -10.393 19.741 1.00 51.30 H new ATOM 0 HB3 LEU A 50 16.122 -11.933 19.539 1.00 51.30 H new ATOM 0 HG LEU A 50 14.558 -10.694 17.277 1.00 14.40 H new ATOM 0 HD11 LEU A 50 16.662 -9.691 16.480 1.00 40.21 H new ATOM 0 HD12 LEU A 50 16.150 -9.001 18.038 1.00 40.21 H new ATOM 0 HD13 LEU A 50 17.468 -10.196 17.984 1.00 40.21 H new ATOM 0 HD21 LEU A 50 16.115 -12.027 15.909 1.00 32.14 H new ATOM 0 HD22 LEU A 50 16.899 -12.625 17.391 1.00 32.14 H new ATOM 0 HD23 LEU A 50 15.203 -13.043 17.050 1.00 32.14 H new ATOM 805 N ILE A 51 13.878 -11.817 21.943 1.00 34.32 N ATOM 806 CA ILE A 51 13.938 -12.262 23.330 1.00 64.00 C ATOM 807 C ILE A 51 12.792 -13.215 23.652 1.00 25.14 C ATOM 808 O ILE A 51 12.933 -14.113 24.483 1.00 3.30 O ATOM 809 CB ILE A 51 13.891 -11.071 24.306 1.00 73.34 C ATOM 810 CG1 ILE A 51 14.361 -11.504 25.696 1.00 44.22 C ATOM 811 CG2 ILE A 51 12.484 -10.497 24.372 1.00 55.22 C ATOM 812 CD1 ILE A 51 15.013 -10.391 26.486 1.00 1.14 C ATOM 0 H ILE A 51 13.669 -10.825 21.827 1.00 34.32 H new ATOM 0 HA ILE A 51 14.887 -12.784 23.453 1.00 64.00 H new ATOM 0 HB ILE A 51 14.563 -10.294 23.942 1.00 73.34 H new ATOM 0 HG12 ILE A 51 13.508 -11.885 26.257 1.00 44.22 H new ATOM 0 HG13 ILE A 51 15.068 -12.327 25.592 1.00 44.22 H new ATOM 0 HG21 ILE A 51 12.466 -9.656 25.065 1.00 55.22 H new ATOM 0 HG22 ILE A 51 12.183 -10.157 23.381 1.00 55.22 H new ATOM 0 HG23 ILE A 51 11.793 -11.266 24.717 1.00 55.22 H new ATOM 0 HD11 ILE A 51 15.321 -10.769 27.461 1.00 1.14 H new ATOM 0 HD12 ILE A 51 15.886 -10.025 25.946 1.00 1.14 H new ATOM 0 HD13 ILE A 51 14.302 -9.576 26.621 1.00 1.14 H new ATOM 824 N ARG A 52 11.659 -13.015 22.988 1.00 12.33 N ATOM 825 CA ARG A 52 10.488 -13.857 23.204 1.00 43.34 C ATOM 826 C ARG A 52 10.585 -15.142 22.387 1.00 43.24 C ATOM 827 O ARG A 52 10.221 -16.218 22.860 1.00 41.33 O ATOM 828 CB ARG A 52 9.213 -13.098 22.832 1.00 72.43 C ATOM 829 CG ARG A 52 8.833 -12.018 23.831 1.00 4.20 C ATOM 830 CD ARG A 52 8.587 -12.600 25.214 1.00 5.22 C ATOM 831 NE ARG A 52 7.729 -13.781 25.167 1.00 44.34 N ATOM 832 CZ ARG A 52 7.615 -14.647 26.167 1.00 14.54 C ATOM 833 NH1 ARG A 52 8.299 -14.464 27.288 1.00 24.20 N ATOM 834 NH2 ARG A 52 6.813 -15.697 26.049 1.00 61.34 N ATOM 0 H ARG A 52 11.526 -12.277 22.296 1.00 12.33 H new ATOM 0 HA ARG A 52 10.450 -14.121 24.261 1.00 43.34 H new ATOM 0 HB2 ARG A 52 9.345 -12.643 21.850 1.00 72.43 H new ATOM 0 HB3 ARG A 52 8.390 -13.808 22.746 1.00 72.43 H new ATOM 0 HG2 ARG A 52 9.628 -11.274 23.884 1.00 4.20 H new ATOM 0 HG3 ARG A 52 7.936 -11.502 23.487 1.00 4.20 H new ATOM 0 HD2 ARG A 52 9.541 -12.863 25.671 1.00 5.22 H new ATOM 0 HD3 ARG A 52 8.127 -11.843 25.849 1.00 5.22 H new ATOM 0 HE ARG A 52 7.188 -13.950 24.319 1.00 44.34 H new ATOM 0 HH11 ARG A 52 8.915 -13.656 27.384 1.00 24.20 H new ATOM 0 HH12 ARG A 52 8.210 -15.131 28.055 1.00 24.20 H new ATOM 0 HH21 ARG A 52 6.283 -15.840 25.189 1.00 61.34 H new ATOM 0 HH22 ARG A 52 6.726 -16.362 26.818 1.00 61.34 H new ATOM 848 N GLU A 53 11.078 -15.020 21.158 1.00 63.20 N ATOM 849 CA GLU A 53 11.221 -16.172 20.276 1.00 64.24 C ATOM 850 C GLU A 53 12.398 -17.044 20.705 1.00 2.30 C ATOM 851 O GLU A 53 12.227 -18.218 21.034 1.00 52.10 O ATOM 852 CB GLU A 53 11.414 -15.713 18.829 1.00 73.55 C ATOM 853 CG GLU A 53 10.135 -15.224 18.170 1.00 11.43 C ATOM 854 CD GLU A 53 10.395 -14.463 16.885 1.00 50.43 C ATOM 855 OE1 GLU A 53 11.324 -14.849 16.145 1.00 3.11 O ATOM 856 OE2 GLU A 53 9.670 -13.481 16.618 1.00 22.44 O ATOM 0 H GLU A 53 11.385 -14.136 20.751 1.00 63.20 H new ATOM 0 HA GLU A 53 10.309 -16.764 20.344 1.00 64.24 H new ATOM 0 HB2 GLU A 53 12.154 -14.913 18.806 1.00 73.55 H new ATOM 0 HB3 GLU A 53 11.820 -16.539 18.246 1.00 73.55 H new ATOM 0 HG2 GLU A 53 9.491 -16.077 17.958 1.00 11.43 H new ATOM 0 HG3 GLU A 53 9.595 -14.581 18.865 1.00 11.43 H new ATOM 863 N ILE A 54 13.592 -16.460 20.699 1.00 70.44 N ATOM 864 CA ILE A 54 14.797 -17.183 21.088 1.00 53.23 C ATOM 865 C ILE A 54 14.604 -17.895 22.422 1.00 12.02 C ATOM 866 O ILE A 54 15.270 -18.890 22.709 1.00 42.35 O ATOM 867 CB ILE A 54 16.010 -16.239 21.193 1.00 74.53 C ATOM 868 CG1 ILE A 54 16.305 -15.600 19.834 1.00 13.35 C ATOM 869 CG2 ILE A 54 17.227 -16.996 21.703 1.00 35.34 C ATOM 870 CD1 ILE A 54 17.373 -14.530 19.890 1.00 72.02 C ATOM 0 H ILE A 54 13.751 -15.489 20.429 1.00 70.44 H new ATOM 0 HA ILE A 54 14.988 -17.921 20.309 1.00 53.23 H new ATOM 0 HB ILE A 54 15.775 -15.446 21.903 1.00 74.53 H new ATOM 0 HG12 ILE A 54 16.616 -16.377 19.136 1.00 13.35 H new ATOM 0 HG13 ILE A 54 15.387 -15.166 19.439 1.00 13.35 H new ATOM 0 HG21 ILE A 54 18.076 -16.316 21.772 1.00 35.34 H new ATOM 0 HG22 ILE A 54 17.012 -17.409 22.689 1.00 35.34 H new ATOM 0 HG23 ILE A 54 17.466 -17.806 21.014 1.00 35.34 H new ATOM 0 HD11 ILE A 54 17.531 -14.121 18.892 1.00 72.02 H new ATOM 0 HD12 ILE A 54 17.055 -13.734 20.563 1.00 72.02 H new ATOM 0 HD13 ILE A 54 18.304 -14.964 20.255 1.00 72.02 H new ATOM 882 N ARG A 55 13.686 -17.380 23.234 1.00 24.03 N ATOM 883 CA ARG A 55 13.405 -17.967 24.539 1.00 72.13 C ATOM 884 C ARG A 55 12.993 -19.430 24.399 1.00 3.22 C ATOM 885 O ARG A 55 13.673 -20.326 24.899 1.00 42.54 O ATOM 886 CB ARG A 55 12.301 -17.181 25.248 1.00 55.12 C ATOM 887 CG ARG A 55 11.848 -17.811 26.555 1.00 11.40 C ATOM 888 CD ARG A 55 11.179 -16.790 27.463 1.00 74.35 C ATOM 889 NE ARG A 55 10.919 -17.330 28.795 1.00 43.42 N ATOM 890 CZ ARG A 55 10.707 -16.573 29.866 1.00 43.45 C ATOM 891 NH1 ARG A 55 10.723 -15.251 29.761 1.00 63.01 N ATOM 892 NH2 ARG A 55 10.478 -17.138 31.044 1.00 1.41 N ATOM 0 H ARG A 55 13.125 -16.558 23.011 1.00 24.03 H new ATOM 0 HA ARG A 55 14.316 -17.919 25.135 1.00 72.13 H new ATOM 0 HB2 ARG A 55 12.656 -16.170 25.446 1.00 55.12 H new ATOM 0 HB3 ARG A 55 11.444 -17.093 24.581 1.00 55.12 H new ATOM 0 HG2 ARG A 55 11.153 -18.625 26.346 1.00 11.40 H new ATOM 0 HG3 ARG A 55 12.706 -18.248 27.066 1.00 11.40 H new ATOM 0 HD2 ARG A 55 11.814 -15.908 27.547 1.00 74.35 H new ATOM 0 HD3 ARG A 55 10.240 -16.465 27.014 1.00 74.35 H new ATOM 0 HE ARG A 55 10.899 -18.343 28.909 1.00 43.42 H new ATOM 0 HH11 ARG A 55 10.898 -14.813 28.857 1.00 63.01 H new ATOM 0 HH12 ARG A 55 10.560 -14.672 30.585 1.00 63.01 H new ATOM 0 HH21 ARG A 55 10.465 -18.154 31.128 1.00 1.41 H new ATOM 0 HH22 ARG A 55 10.315 -16.556 31.866 1.00 1.41 H new ATOM 906 N GLU A 56 11.876 -19.663 23.718 1.00 51.53 N ATOM 907 CA GLU A 56 11.374 -21.016 23.514 1.00 31.44 C ATOM 908 C GLU A 56 11.935 -21.617 22.229 1.00 61.51 C ATOM 909 O GLU A 56 12.333 -22.782 22.198 1.00 14.44 O ATOM 910 CB GLU A 56 9.845 -21.015 23.464 1.00 34.04 C ATOM 911 CG GLU A 56 9.205 -22.054 24.371 1.00 40.45 C ATOM 912 CD GLU A 56 9.560 -21.852 25.831 1.00 43.22 C ATOM 913 OE1 GLU A 56 9.754 -20.687 26.238 1.00 65.10 O ATOM 914 OE2 GLU A 56 9.644 -22.858 26.566 1.00 45.50 O ATOM 0 H GLU A 56 11.302 -18.932 23.298 1.00 51.53 H new ATOM 0 HA GLU A 56 11.702 -21.628 24.354 1.00 31.44 H new ATOM 0 HB2 GLU A 56 9.481 -20.027 23.745 1.00 34.04 H new ATOM 0 HB3 GLU A 56 9.523 -21.193 22.438 1.00 34.04 H new ATOM 0 HG2 GLU A 56 8.122 -22.014 24.255 1.00 40.45 H new ATOM 0 HG3 GLU A 56 9.522 -23.049 24.058 1.00 40.45 H new ATOM 921 N GLU A 57 11.963 -20.814 21.170 1.00 61.31 N ATOM 922 CA GLU A 57 12.474 -21.267 19.882 1.00 60.54 C ATOM 923 C GLU A 57 13.845 -21.919 20.039 1.00 40.13 C ATOM 924 O GLU A 57 14.029 -23.089 19.706 1.00 23.44 O ATOM 925 CB GLU A 57 12.563 -20.095 18.902 1.00 25.14 C ATOM 926 CG GLU A 57 12.435 -20.508 17.446 1.00 53.43 C ATOM 927 CD GLU A 57 13.759 -20.929 16.839 1.00 2.33 C ATOM 928 OE1 GLU A 57 14.745 -20.176 16.985 1.00 60.40 O ATOM 929 OE2 GLU A 57 13.809 -22.012 16.219 1.00 4.41 O ATOM 0 H GLU A 57 11.638 -19.847 21.179 1.00 61.31 H new ATOM 0 HA GLU A 57 11.781 -22.010 19.486 1.00 60.54 H new ATOM 0 HB2 GLU A 57 11.779 -19.376 19.137 1.00 25.14 H new ATOM 0 HB3 GLU A 57 13.516 -19.585 19.044 1.00 25.14 H new ATOM 0 HG2 GLU A 57 11.726 -21.332 17.367 1.00 53.43 H new ATOM 0 HG3 GLU A 57 12.024 -19.678 16.872 1.00 53.43 H new ATOM 936 N MET A 58 14.804 -21.151 20.547 1.00 35.40 N ATOM 937 CA MET A 58 16.158 -21.654 20.749 1.00 53.41 C ATOM 938 C MET A 58 16.280 -22.361 22.095 1.00 61.34 C ATOM 939 O MET A 58 17.283 -23.020 22.373 1.00 53.53 O ATOM 940 CB MET A 58 17.167 -20.507 20.669 1.00 41.31 C ATOM 941 CG MET A 58 17.144 -19.768 19.341 1.00 55.13 C ATOM 942 SD MET A 58 18.733 -19.020 18.934 1.00 71.04 S ATOM 943 CE MET A 58 18.487 -18.622 17.205 1.00 52.13 C ATOM 0 H MET A 58 14.669 -20.179 20.826 1.00 35.40 H new ATOM 0 HA MET A 58 16.373 -22.374 19.960 1.00 53.41 H new ATOM 0 HB2 MET A 58 16.964 -19.799 21.473 1.00 41.31 H new ATOM 0 HB3 MET A 58 18.169 -20.903 20.838 1.00 41.31 H new ATOM 0 HG2 MET A 58 16.860 -20.461 18.549 1.00 55.13 H new ATOM 0 HG3 MET A 58 16.380 -18.992 19.375 1.00 55.13 H new ATOM 0 HE1 MET A 58 19.428 -18.283 16.772 1.00 52.13 H new ATOM 0 HE2 MET A 58 18.141 -19.508 16.673 1.00 52.13 H new ATOM 0 HE3 MET A 58 17.742 -17.832 17.116 1.00 52.13 H new ATOM 953 N LYS A 59 15.254 -22.221 22.927 1.00 30.41 N ATOM 954 CA LYS A 59 15.245 -22.848 24.244 1.00 44.33 C ATOM 955 C LYS A 59 16.520 -22.515 25.013 1.00 51.11 C ATOM 956 O LYS A 59 16.991 -23.311 25.827 1.00 54.44 O ATOM 957 CB LYS A 59 15.100 -24.365 24.108 1.00 23.24 C ATOM 958 CG LYS A 59 13.668 -24.823 23.895 1.00 53.42 C ATOM 959 CD LYS A 59 13.403 -26.159 24.567 1.00 61.41 C ATOM 960 CE LYS A 59 13.272 -26.009 26.075 1.00 42.22 C ATOM 961 NZ LYS A 59 12.680 -27.222 26.704 1.00 52.41 N ATOM 0 H LYS A 59 14.417 -21.679 22.713 1.00 30.41 H new ATOM 0 HA LYS A 59 14.393 -22.456 24.800 1.00 44.33 H new ATOM 0 HB2 LYS A 59 15.710 -24.706 23.271 1.00 23.24 H new ATOM 0 HB3 LYS A 59 15.495 -24.841 25.005 1.00 23.24 H new ATOM 0 HG2 LYS A 59 12.983 -24.073 24.291 1.00 53.42 H new ATOM 0 HG3 LYS A 59 13.467 -24.906 22.827 1.00 53.42 H new ATOM 0 HD2 LYS A 59 12.490 -26.596 24.163 1.00 61.41 H new ATOM 0 HD3 LYS A 59 14.215 -26.850 24.338 1.00 61.41 H new ATOM 0 HE2 LYS A 59 14.254 -25.818 26.508 1.00 42.22 H new ATOM 0 HE3 LYS A 59 12.650 -25.143 26.301 1.00 42.22 H new ATOM 0 HZ1 LYS A 59 12.608 -27.080 27.732 1.00 52.41 H new ATOM 0 HZ2 LYS A 59 11.732 -27.390 26.310 1.00 52.41 H new ATOM 0 HZ3 LYS A 59 13.286 -28.045 26.510 1.00 52.41 H new ATOM 975 N CYS A 60 17.072 -21.336 24.751 1.00 2.42 N ATOM 976 CA CYS A 60 18.292 -20.898 25.420 1.00 44.51 C ATOM 977 C CYS A 60 18.115 -19.506 26.018 1.00 12.12 C ATOM 978 O CYS A 60 17.105 -18.842 25.783 1.00 33.41 O ATOM 979 CB CYS A 60 19.465 -20.898 24.438 1.00 20.12 C ATOM 980 SG CYS A 60 21.055 -21.324 25.187 1.00 13.33 S ATOM 0 H CYS A 60 16.695 -20.666 24.081 1.00 2.42 H new ATOM 0 HA CYS A 60 18.504 -21.597 26.229 1.00 44.51 H new ATOM 0 HB2 CYS A 60 19.253 -21.604 23.635 1.00 20.12 H new ATOM 0 HB3 CYS A 60 19.543 -19.911 23.982 1.00 20.12 H new ATOM 0 HG CYS A 60 22.011 -21.095 24.336 1.00 13.33 H new ATOM 986 N ASP A 61 19.102 -19.071 26.794 1.00 52.25 N ATOM 987 CA ASP A 61 19.055 -17.758 27.427 1.00 52.13 C ATOM 988 C ASP A 61 19.929 -16.760 26.674 1.00 52.24 C ATOM 989 O ASP A 61 20.481 -15.832 27.266 1.00 42.42 O ATOM 990 CB ASP A 61 19.509 -17.854 28.884 1.00 32.30 C ATOM 991 CG ASP A 61 18.629 -18.777 29.705 1.00 41.14 C ATOM 992 OD1 ASP A 61 19.167 -19.484 30.582 1.00 42.02 O ATOM 993 OD2 ASP A 61 17.403 -18.793 29.469 1.00 55.40 O ATOM 0 H ASP A 61 19.944 -19.608 27.000 1.00 52.25 H new ATOM 0 HA ASP A 61 18.024 -17.405 27.398 1.00 52.13 H new ATOM 0 HB2 ASP A 61 20.538 -18.212 28.918 1.00 32.30 H new ATOM 0 HB3 ASP A 61 19.503 -16.859 29.330 1.00 32.30 H new ATOM 998 N LEU A 62 20.051 -16.957 25.366 1.00 73.23 N ATOM 999 CA LEU A 62 20.859 -16.075 24.531 1.00 53.12 C ATOM 1000 C LEU A 62 20.812 -14.641 25.049 1.00 75.02 C ATOM 1001 O LEU A 62 19.741 -14.040 25.144 1.00 71.11 O ATOM 1002 CB LEU A 62 20.370 -16.122 23.082 1.00 32.31 C ATOM 1003 CG LEU A 62 21.184 -16.995 22.127 1.00 24.40 C ATOM 1004 CD1 LEU A 62 20.735 -18.446 22.215 1.00 52.41 C ATOM 1005 CD2 LEU A 62 21.062 -16.483 20.700 1.00 54.44 C ATOM 0 H LEU A 62 19.601 -17.720 24.861 1.00 73.23 H new ATOM 0 HA LEU A 62 21.891 -16.423 24.571 1.00 53.12 H new ATOM 0 HB2 LEU A 62 19.340 -16.478 23.079 1.00 32.31 H new ATOM 0 HB3 LEU A 62 20.357 -15.105 22.691 1.00 32.31 H new ATOM 0 HG LEU A 62 22.232 -16.942 22.422 1.00 24.40 H new ATOM 0 HD11 LEU A 62 21.326 -19.052 21.528 1.00 52.41 H new ATOM 0 HD12 LEU A 62 20.876 -18.809 23.233 1.00 52.41 H new ATOM 0 HD13 LEU A 62 19.681 -18.518 21.947 1.00 52.41 H new ATOM 0 HD21 LEU A 62 21.648 -17.117 20.035 1.00 54.44 H new ATOM 0 HD22 LEU A 62 20.016 -16.505 20.394 1.00 54.44 H new ATOM 0 HD23 LEU A 62 21.434 -15.460 20.647 1.00 54.44 H new ATOM 1017 N ILE A 63 21.978 -14.099 25.380 1.00 3.53 N ATOM 1018 CA ILE A 63 22.070 -12.734 25.885 1.00 32.21 C ATOM 1019 C ILE A 63 22.467 -11.764 24.778 1.00 54.22 C ATOM 1020 O ILE A 63 23.488 -11.946 24.114 1.00 13.45 O ATOM 1021 CB ILE A 63 23.088 -12.627 27.036 1.00 40.24 C ATOM 1022 CG1 ILE A 63 22.695 -13.560 28.183 1.00 72.15 C ATOM 1023 CG2 ILE A 63 23.185 -11.189 27.525 1.00 70.53 C ATOM 1024 CD1 ILE A 63 23.870 -14.022 29.016 1.00 52.40 C ATOM 0 H ILE A 63 22.873 -14.583 25.308 1.00 3.53 H new ATOM 0 HA ILE A 63 21.081 -12.469 26.260 1.00 32.21 H new ATOM 0 HB ILE A 63 24.067 -12.931 26.665 1.00 40.24 H new ATOM 0 HG12 ILE A 63 21.981 -13.048 28.829 1.00 72.15 H new ATOM 0 HG13 ILE A 63 22.186 -14.432 27.773 1.00 72.15 H new ATOM 0 HG21 ILE A 63 23.908 -11.129 28.338 1.00 70.53 H new ATOM 0 HG22 ILE A 63 23.507 -10.547 26.705 1.00 70.53 H new ATOM 0 HG23 ILE A 63 22.209 -10.860 27.882 1.00 70.53 H new ATOM 0 HD11 ILE A 63 23.517 -14.680 29.810 1.00 52.40 H new ATOM 0 HD12 ILE A 63 24.574 -14.562 28.384 1.00 52.40 H new ATOM 0 HD13 ILE A 63 24.367 -13.157 29.456 1.00 52.40 H new ATOM 1036 N VAL A 64 21.653 -10.731 24.584 1.00 10.42 N ATOM 1037 CA VAL A 64 21.920 -9.729 23.559 1.00 1.32 C ATOM 1038 C VAL A 64 22.804 -8.611 24.101 1.00 53.53 C ATOM 1039 O VAL A 64 22.769 -8.299 25.290 1.00 5.04 O ATOM 1040 CB VAL A 64 20.614 -9.119 23.017 1.00 50.24 C ATOM 1041 CG1 VAL A 64 19.926 -8.289 24.090 1.00 50.35 C ATOM 1042 CG2 VAL A 64 20.892 -8.280 21.779 1.00 43.25 C ATOM 0 H VAL A 64 20.803 -10.566 25.123 1.00 10.42 H new ATOM 0 HA VAL A 64 22.439 -10.237 22.747 1.00 1.32 H new ATOM 0 HB VAL A 64 19.944 -9.931 22.735 1.00 50.24 H new ATOM 0 HG11 VAL A 64 19.005 -7.866 23.688 1.00 50.35 H new ATOM 0 HG12 VAL A 64 19.691 -8.923 24.945 1.00 50.35 H new ATOM 0 HG13 VAL A 64 20.588 -7.483 24.406 1.00 50.35 H new ATOM 0 HG21 VAL A 64 19.958 -7.857 21.409 1.00 43.25 H new ATOM 0 HG22 VAL A 64 21.581 -7.474 22.033 1.00 43.25 H new ATOM 0 HG23 VAL A 64 21.337 -8.907 21.007 1.00 43.25 H new ATOM 1052 N GLY A 65 23.595 -8.009 23.218 1.00 44.11 N ATOM 1053 CA GLY A 65 24.477 -6.931 23.626 1.00 23.11 C ATOM 1054 C GLY A 65 24.044 -5.587 23.075 1.00 32.21 C ATOM 1055 O GLY A 65 23.671 -4.690 23.831 1.00 53.21 O ATOM 0 H GLY A 65 23.641 -8.249 22.228 1.00 44.11 H new ATOM 0 HA2 GLY A 65 24.506 -6.882 24.715 1.00 23.11 H new ATOM 0 HA3 GLY A 65 25.491 -7.148 23.290 1.00 23.11 H new ATOM 1059 N ASP A 66 24.094 -5.447 21.755 1.00 3.31 N ATOM 1060 CA ASP A 66 23.704 -4.202 21.103 1.00 2.11 C ATOM 1061 C ASP A 66 23.410 -4.432 19.624 1.00 35.22 C ATOM 1062 O ASP A 66 23.824 -5.437 19.046 1.00 23.23 O ATOM 1063 CB ASP A 66 24.806 -3.153 21.259 1.00 11.40 C ATOM 1064 CG ASP A 66 24.393 -1.796 20.723 1.00 45.04 C ATOM 1065 OD1 ASP A 66 23.255 -1.368 21.004 1.00 32.25 O ATOM 1066 OD2 ASP A 66 25.209 -1.162 20.020 1.00 20.40 O ATOM 0 H ASP A 66 24.401 -6.180 21.115 1.00 3.31 H new ATOM 0 HA ASP A 66 22.796 -3.838 21.583 1.00 2.11 H new ATOM 0 HB2 ASP A 66 25.068 -3.060 22.313 1.00 11.40 H new ATOM 0 HB3 ASP A 66 25.701 -3.490 20.736 1.00 11.40 H new ATOM 1071 N LYS A 67 22.690 -3.495 19.017 1.00 74.13 N ATOM 1072 CA LYS A 67 22.339 -3.594 17.605 1.00 74.40 C ATOM 1073 C LYS A 67 23.590 -3.688 16.738 1.00 24.24 C ATOM 1074 O LYS A 67 24.587 -3.012 16.994 1.00 31.24 O ATOM 1075 CB LYS A 67 21.501 -2.386 17.180 1.00 32.24 C ATOM 1076 CG LYS A 67 20.949 -2.494 15.769 1.00 20.24 C ATOM 1077 CD LYS A 67 19.565 -3.122 15.758 1.00 3.14 C ATOM 1078 CE LYS A 67 18.754 -2.663 14.556 1.00 5.53 C ATOM 1079 NZ LYS A 67 18.323 -1.243 14.688 1.00 63.23 N ATOM 0 H LYS A 67 22.338 -2.658 19.481 1.00 74.13 H new ATOM 0 HA LYS A 67 21.753 -4.502 17.466 1.00 74.40 H new ATOM 0 HB2 LYS A 67 20.672 -2.266 17.877 1.00 32.24 H new ATOM 0 HB3 LYS A 67 22.112 -1.486 17.254 1.00 32.24 H new ATOM 0 HG2 LYS A 67 20.903 -1.503 15.318 1.00 20.24 H new ATOM 0 HG3 LYS A 67 21.625 -3.091 15.157 1.00 20.24 H new ATOM 0 HD2 LYS A 67 19.657 -4.208 15.743 1.00 3.14 H new ATOM 0 HD3 LYS A 67 19.038 -2.860 16.675 1.00 3.14 H new ATOM 0 HE2 LYS A 67 19.349 -2.779 13.650 1.00 5.53 H new ATOM 0 HE3 LYS A 67 17.877 -3.300 14.445 1.00 5.53 H new ATOM 0 HZ1 LYS A 67 17.292 -1.204 14.822 1.00 63.23 H new ATOM 0 HZ2 LYS A 67 18.796 -0.812 15.508 1.00 63.23 H new ATOM 0 HZ3 LYS A 67 18.580 -0.721 13.826 1.00 63.23 H new ATOM 1093 N VAL A 68 23.532 -4.530 15.711 1.00 53.51 N ATOM 1094 CA VAL A 68 24.660 -4.709 14.805 1.00 73.52 C ATOM 1095 C VAL A 68 24.556 -3.774 13.606 1.00 42.33 C ATOM 1096 O VAL A 68 25.450 -2.964 13.359 1.00 42.23 O ATOM 1097 CB VAL A 68 24.749 -6.163 14.302 1.00 44.52 C ATOM 1098 CG1 VAL A 68 25.895 -6.316 13.313 1.00 2.23 C ATOM 1099 CG2 VAL A 68 24.911 -7.122 15.471 1.00 5.44 C ATOM 0 H VAL A 68 22.716 -5.099 15.486 1.00 53.51 H new ATOM 0 HA VAL A 68 25.561 -4.471 15.370 1.00 73.52 H new ATOM 0 HB VAL A 68 23.820 -6.409 13.787 1.00 44.52 H new ATOM 0 HG11 VAL A 68 25.943 -7.349 12.968 1.00 2.23 H new ATOM 0 HG12 VAL A 68 25.731 -5.656 12.461 1.00 2.23 H new ATOM 0 HG13 VAL A 68 26.834 -6.052 13.800 1.00 2.23 H new ATOM 0 HG21 VAL A 68 24.972 -8.144 15.097 1.00 5.44 H new ATOM 0 HG22 VAL A 68 25.823 -6.880 16.017 1.00 5.44 H new ATOM 0 HG23 VAL A 68 24.054 -7.030 16.138 1.00 5.44 H new ATOM 1109 N ILE A 69 23.460 -3.890 12.864 1.00 32.32 N ATOM 1110 CA ILE A 69 23.239 -3.053 11.692 1.00 74.35 C ATOM 1111 C ILE A 69 21.848 -3.280 11.109 1.00 52.12 C ATOM 1112 O ILE A 69 21.264 -4.353 11.265 1.00 52.14 O ATOM 1113 CB ILE A 69 24.291 -3.324 10.600 1.00 72.40 C ATOM 1114 CG1 ILE A 69 24.254 -2.221 9.540 1.00 33.42 C ATOM 1115 CG2 ILE A 69 24.055 -4.686 9.964 1.00 40.04 C ATOM 1116 CD1 ILE A 69 25.621 -1.840 9.017 1.00 72.01 C ATOM 0 H ILE A 69 22.711 -4.556 13.054 1.00 32.32 H new ATOM 0 HA ILE A 69 23.328 -2.018 12.022 1.00 74.35 H new ATOM 0 HB ILE A 69 25.279 -3.326 11.060 1.00 72.40 H new ATOM 0 HG12 ILE A 69 23.634 -2.550 8.706 1.00 33.42 H new ATOM 0 HG13 ILE A 69 23.777 -1.337 9.963 1.00 33.42 H new ATOM 0 HG21 ILE A 69 24.806 -4.863 9.194 1.00 40.04 H new ATOM 0 HG22 ILE A 69 24.127 -5.461 10.727 1.00 40.04 H new ATOM 0 HG23 ILE A 69 23.062 -4.711 9.515 1.00 40.04 H new ATOM 0 HD11 ILE A 69 25.518 -1.053 8.270 1.00 72.01 H new ATOM 0 HD12 ILE A 69 26.238 -1.480 9.840 1.00 72.01 H new ATOM 0 HD13 ILE A 69 26.093 -2.712 8.564 1.00 72.01 H new ATOM 1128 N THR A 70 21.322 -2.262 10.434 1.00 34.23 N ATOM 1129 CA THR A 70 20.000 -2.350 9.827 1.00 53.31 C ATOM 1130 C THR A 70 20.095 -2.382 8.306 1.00 75.01 C ATOM 1131 O THR A 70 20.482 -1.397 7.676 1.00 71.21 O ATOM 1132 CB THR A 70 19.108 -1.167 10.249 1.00 10.14 C ATOM 1133 OG1 THR A 70 19.211 -0.955 11.662 1.00 64.42 O ATOM 1134 CG2 THR A 70 17.656 -1.423 9.875 1.00 70.12 C ATOM 0 H THR A 70 21.792 -1.367 10.294 1.00 34.23 H new ATOM 0 HA THR A 70 19.551 -3.278 10.180 1.00 53.31 H new ATOM 0 HB THR A 70 19.451 -0.277 9.722 1.00 10.14 H new ATOM 0 HG1 THR A 70 18.642 -0.200 11.922 1.00 64.42 H new ATOM 0 HG21 THR A 70 17.046 -0.574 10.183 1.00 70.12 H new ATOM 0 HG22 THR A 70 17.576 -1.555 8.796 1.00 70.12 H new ATOM 0 HG23 THR A 70 17.304 -2.324 10.378 1.00 70.12 H new ATOM 1142 N THR A 71 19.738 -3.520 7.719 1.00 33.52 N ATOM 1143 CA THR A 71 19.783 -3.681 6.271 1.00 20.24 C ATOM 1144 C THR A 71 18.379 -3.754 5.682 1.00 20.41 C ATOM 1145 O THR A 71 17.497 -4.409 6.237 1.00 1.32 O ATOM 1146 CB THR A 71 20.562 -4.948 5.871 1.00 63.11 C ATOM 1147 OG1 THR A 71 21.282 -5.458 6.999 1.00 13.12 O ATOM 1148 CG2 THR A 71 21.532 -4.651 4.737 1.00 72.21 C ATOM 0 H THR A 71 19.414 -4.344 8.225 1.00 33.52 H new ATOM 0 HA THR A 71 20.296 -2.806 5.871 1.00 20.24 H new ATOM 0 HB THR A 71 19.846 -5.695 5.530 1.00 63.11 H new ATOM 0 HG1 THR A 71 21.860 -6.196 6.712 1.00 13.12 H new ATOM 0 HG21 THR A 71 22.071 -5.561 4.472 1.00 72.21 H new ATOM 0 HG22 THR A 71 20.979 -4.291 3.870 1.00 72.21 H new ATOM 0 HG23 THR A 71 22.242 -3.888 5.056 1.00 72.21 H new ATOM 1156 N GLU A 72 18.179 -3.079 4.554 1.00 25.34 N ATOM 1157 CA GLU A 72 16.881 -3.069 3.891 1.00 42.13 C ATOM 1158 C GLU A 72 17.044 -3.157 2.376 1.00 72.20 C ATOM 1159 O GLU A 72 18.012 -2.645 1.813 1.00 21.13 O ATOM 1160 CB GLU A 72 16.106 -1.802 4.258 1.00 33.14 C ATOM 1161 CG GLU A 72 15.892 -1.631 5.753 1.00 24.41 C ATOM 1162 CD GLU A 72 15.535 -0.207 6.132 1.00 20.45 C ATOM 1163 OE1 GLU A 72 15.183 0.578 5.228 1.00 74.43 O ATOM 1164 OE2 GLU A 72 15.608 0.121 7.335 1.00 11.51 O ATOM 0 H GLU A 72 18.899 -2.533 4.081 1.00 25.34 H new ATOM 0 HA GLU A 72 16.321 -3.940 4.231 1.00 42.13 H new ATOM 0 HB2 GLU A 72 16.643 -0.934 3.875 1.00 33.14 H new ATOM 0 HB3 GLU A 72 15.136 -1.822 3.761 1.00 33.14 H new ATOM 0 HG2 GLU A 72 15.097 -2.301 6.081 1.00 24.41 H new ATOM 0 HG3 GLU A 72 16.798 -1.928 6.282 1.00 24.41 H new ATOM 1171 N HIS A 73 16.089 -3.811 1.721 1.00 23.13 N ATOM 1172 CA HIS A 73 16.126 -3.967 0.272 1.00 71.24 C ATOM 1173 C HIS A 73 14.748 -3.721 -0.336 1.00 62.12 C ATOM 1174 O HIS A 73 13.726 -3.930 0.316 1.00 21.30 O ATOM 1175 CB HIS A 73 16.617 -5.367 -0.100 1.00 3.44 C ATOM 1176 CG HIS A 73 17.922 -5.732 0.538 1.00 2.03 C ATOM 1177 ND1 HIS A 73 19.090 -5.893 -0.176 1.00 64.04 N ATOM 1178 CD2 HIS A 73 18.240 -5.966 1.833 1.00 33.21 C ATOM 1179 CE1 HIS A 73 20.070 -6.212 0.651 1.00 74.21 C ATOM 1180 NE2 HIS A 73 19.580 -6.263 1.877 1.00 52.34 N ATOM 0 H HIS A 73 15.281 -4.241 2.171 1.00 23.13 H new ATOM 0 HA HIS A 73 16.819 -3.228 -0.130 1.00 71.24 H new ATOM 0 HB2 HIS A 73 15.862 -6.097 0.192 1.00 3.44 H new ATOM 0 HB3 HIS A 73 16.721 -5.431 -1.183 1.00 3.44 H new ATOM 0 HD1 HIS A 73 19.183 -5.783 -1.186 1.00 64.04 H new ATOM 0 HD2 HIS A 73 17.565 -5.926 2.675 1.00 33.21 H new ATOM 0 HE1 HIS A 73 21.097 -6.399 0.372 1.00 74.21 H new ATOM 1188 N GLU A 74 14.730 -3.275 -1.588 1.00 62.15 N ATOM 1189 CA GLU A 74 13.478 -2.999 -2.282 1.00 73.34 C ATOM 1190 C GLU A 74 13.048 -4.196 -3.125 1.00 73.44 C ATOM 1191 O GLU A 74 13.658 -4.498 -4.152 1.00 14.23 O ATOM 1192 CB GLU A 74 13.623 -1.762 -3.171 1.00 12.24 C ATOM 1193 CG GLU A 74 12.377 -1.445 -3.981 1.00 1.44 C ATOM 1194 CD GLU A 74 12.496 -0.142 -4.748 1.00 21.10 C ATOM 1195 OE1 GLU A 74 12.801 -0.191 -5.958 1.00 23.33 O ATOM 1196 OE2 GLU A 74 12.284 0.927 -4.138 1.00 33.33 O ATOM 0 H GLU A 74 15.568 -3.097 -2.142 1.00 62.15 H new ATOM 0 HA GLU A 74 12.711 -2.810 -1.531 1.00 73.34 H new ATOM 0 HB2 GLU A 74 13.868 -0.903 -2.547 1.00 12.24 H new ATOM 0 HB3 GLU A 74 14.461 -1.911 -3.852 1.00 12.24 H new ATOM 0 HG2 GLU A 74 12.187 -2.258 -4.681 1.00 1.44 H new ATOM 0 HG3 GLU A 74 11.517 -1.392 -3.313 1.00 1.44 H new ATOM 1203 N TYR A 75 11.994 -4.875 -2.685 1.00 4.15 N ATOM 1204 CA TYR A 75 11.484 -6.041 -3.396 1.00 10.12 C ATOM 1205 C TYR A 75 10.135 -5.738 -4.041 1.00 43.14 C ATOM 1206 O TYR A 75 9.441 -4.802 -3.645 1.00 11.31 O ATOM 1207 CB TYR A 75 11.350 -7.228 -2.441 1.00 73.41 C ATOM 1208 CG TYR A 75 12.551 -8.147 -2.445 1.00 34.04 C ATOM 1209 CD1 TYR A 75 12.797 -8.997 -3.515 1.00 74.44 C ATOM 1210 CD2 TYR A 75 13.440 -8.164 -1.377 1.00 40.31 C ATOM 1211 CE1 TYR A 75 13.892 -9.839 -3.522 1.00 42.32 C ATOM 1212 CE2 TYR A 75 14.539 -9.001 -1.376 1.00 41.31 C ATOM 1213 CZ TYR A 75 14.761 -9.837 -2.451 1.00 15.34 C ATOM 1214 OH TYR A 75 15.854 -10.672 -2.454 1.00 72.33 O ATOM 0 H TYR A 75 11.476 -4.638 -1.839 1.00 4.15 H new ATOM 0 HA TYR A 75 12.194 -6.295 -4.183 1.00 10.12 H new ATOM 0 HB2 TYR A 75 11.193 -6.854 -1.429 1.00 73.41 H new ATOM 0 HB3 TYR A 75 10.463 -7.802 -2.710 1.00 73.41 H new ATOM 0 HD1 TYR A 75 12.120 -9.000 -4.357 1.00 74.44 H new ATOM 0 HD2 TYR A 75 13.269 -7.512 -0.533 1.00 40.31 H new ATOM 0 HE1 TYR A 75 14.067 -10.495 -4.362 1.00 42.32 H new ATOM 0 HE2 TYR A 75 15.221 -9.001 -0.538 1.00 41.31 H new ATOM 0 HH TYR A 75 16.364 -10.546 -1.627 1.00 72.33 H new ATOM 1224 N ASP A 76 9.771 -6.537 -5.038 1.00 21.31 N ATOM 1225 CA ASP A 76 8.505 -6.357 -5.739 1.00 31.43 C ATOM 1226 C ASP A 76 7.345 -6.909 -4.916 1.00 21.42 C ATOM 1227 O ASP A 76 6.227 -6.398 -4.979 1.00 32.21 O ATOM 1228 CB ASP A 76 8.551 -7.046 -7.104 1.00 11.51 C ATOM 1229 CG ASP A 76 9.864 -6.814 -7.825 1.00 62.00 C ATOM 1230 OD1 ASP A 76 10.702 -7.740 -7.843 1.00 1.43 O ATOM 1231 OD2 ASP A 76 10.055 -5.707 -8.371 1.00 54.10 O ATOM 0 H ASP A 76 10.335 -7.316 -5.379 1.00 21.31 H new ATOM 0 HA ASP A 76 8.348 -5.288 -5.885 1.00 31.43 H new ATOM 0 HB2 ASP A 76 8.396 -8.117 -6.973 1.00 11.51 H new ATOM 0 HB3 ASP A 76 7.731 -6.679 -7.721 1.00 11.51 H new ATOM 1236 N PHE A 77 7.619 -7.957 -4.145 1.00 10.41 N ATOM 1237 CA PHE A 77 6.598 -8.580 -3.311 1.00 11.32 C ATOM 1238 C PHE A 77 6.481 -7.864 -1.968 1.00 54.55 C ATOM 1239 O PHE A 77 5.451 -7.940 -1.300 1.00 12.33 O ATOM 1240 CB PHE A 77 6.925 -10.058 -3.086 1.00 54.53 C ATOM 1241 CG PHE A 77 5.881 -10.991 -3.629 1.00 61.43 C ATOM 1242 CD1 PHE A 77 5.773 -11.214 -4.993 1.00 3.53 C ATOM 1243 CD2 PHE A 77 5.008 -11.647 -2.776 1.00 54.44 C ATOM 1244 CE1 PHE A 77 4.814 -12.073 -5.496 1.00 4.42 C ATOM 1245 CE2 PHE A 77 4.047 -12.507 -3.274 1.00 20.04 C ATOM 1246 CZ PHE A 77 3.949 -12.719 -4.635 1.00 25.30 C ATOM 0 H PHE A 77 8.539 -8.392 -4.081 1.00 10.41 H new ATOM 0 HA PHE A 77 5.643 -8.501 -3.830 1.00 11.32 H new ATOM 0 HB2 PHE A 77 7.883 -10.285 -3.554 1.00 54.53 H new ATOM 0 HB3 PHE A 77 7.041 -10.238 -2.017 1.00 54.53 H new ATOM 0 HD1 PHE A 77 6.446 -10.710 -5.671 1.00 3.53 H new ATOM 0 HD2 PHE A 77 5.079 -11.485 -1.711 1.00 54.44 H new ATOM 0 HE1 PHE A 77 4.741 -12.239 -6.561 1.00 4.42 H new ATOM 0 HE2 PHE A 77 3.373 -13.013 -2.599 1.00 20.04 H new ATOM 0 HZ PHE A 77 3.197 -13.389 -5.025 1.00 25.30 H new ATOM 1256 N GLY A 78 7.545 -7.168 -1.581 1.00 2.44 N ATOM 1257 CA GLY A 78 7.542 -6.448 -0.320 1.00 62.31 C ATOM 1258 C GLY A 78 8.941 -6.196 0.207 1.00 70.13 C ATOM 1259 O GLY A 78 9.768 -7.107 0.252 1.00 32.43 O ATOM 0 H GLY A 78 8.409 -7.089 -2.117 1.00 2.44 H new ATOM 0 HA2 GLY A 78 7.029 -5.495 -0.450 1.00 62.31 H new ATOM 0 HA3 GLY A 78 6.976 -7.016 0.418 1.00 62.31 H new ATOM 1263 N ILE A 79 9.207 -4.956 0.604 1.00 62.41 N ATOM 1264 CA ILE A 79 10.516 -4.588 1.129 1.00 12.52 C ATOM 1265 C ILE A 79 10.933 -5.515 2.265 1.00 5.03 C ATOM 1266 O ILE A 79 10.125 -5.865 3.125 1.00 54.21 O ATOM 1267 CB ILE A 79 10.529 -3.134 1.637 1.00 2.41 C ATOM 1268 CG1 ILE A 79 10.851 -2.173 0.491 1.00 44.22 C ATOM 1269 CG2 ILE A 79 11.537 -2.976 2.766 1.00 35.33 C ATOM 1270 CD1 ILE A 79 9.962 -2.356 -0.719 1.00 41.11 C ATOM 0 H ILE A 79 8.534 -4.190 0.572 1.00 62.41 H new ATOM 0 HA ILE A 79 11.225 -4.684 0.307 1.00 12.52 H new ATOM 0 HB ILE A 79 9.539 -2.891 2.023 1.00 2.41 H new ATOM 0 HG12 ILE A 79 10.756 -1.148 0.850 1.00 44.22 H new ATOM 0 HG13 ILE A 79 11.890 -2.312 0.193 1.00 44.22 H new ATOM 0 HG21 ILE A 79 11.534 -1.943 3.114 1.00 35.33 H new ATOM 0 HG22 ILE A 79 11.268 -3.637 3.590 1.00 35.33 H new ATOM 0 HG23 ILE A 79 12.532 -3.234 2.404 1.00 35.33 H new ATOM 0 HD11 ILE A 79 10.247 -1.642 -1.491 1.00 41.11 H new ATOM 0 HD12 ILE A 79 10.074 -3.370 -1.103 1.00 41.11 H new ATOM 0 HD13 ILE A 79 8.923 -2.188 -0.436 1.00 41.11 H new ATOM 1282 N VAL A 80 12.203 -5.909 2.264 1.00 1.11 N ATOM 1283 CA VAL A 80 12.730 -6.794 3.296 1.00 0.53 C ATOM 1284 C VAL A 80 13.744 -6.070 4.175 1.00 44.02 C ATOM 1285 O VAL A 80 14.625 -5.369 3.676 1.00 70.24 O ATOM 1286 CB VAL A 80 13.396 -8.039 2.682 1.00 73.23 C ATOM 1287 CG1 VAL A 80 14.603 -7.642 1.846 1.00 70.10 C ATOM 1288 CG2 VAL A 80 13.792 -9.024 3.772 1.00 52.53 C ATOM 0 H VAL A 80 12.886 -5.629 1.560 1.00 1.11 H new ATOM 0 HA VAL A 80 11.883 -7.108 3.906 1.00 0.53 H new ATOM 0 HB VAL A 80 12.676 -8.529 2.026 1.00 73.23 H new ATOM 0 HG11 VAL A 80 15.060 -8.535 1.420 1.00 70.10 H new ATOM 0 HG12 VAL A 80 14.286 -6.978 1.042 1.00 70.10 H new ATOM 0 HG13 VAL A 80 15.329 -7.128 2.476 1.00 70.10 H new ATOM 0 HG21 VAL A 80 14.261 -9.898 3.320 1.00 52.53 H new ATOM 0 HG22 VAL A 80 14.495 -8.547 4.455 1.00 52.53 H new ATOM 0 HG23 VAL A 80 12.904 -9.333 4.323 1.00 52.53 H new ATOM 1298 N ARG A 81 13.615 -6.245 5.486 1.00 51.02 N ATOM 1299 CA ARG A 81 14.520 -5.608 6.435 1.00 61.03 C ATOM 1300 C ARG A 81 15.157 -6.643 7.357 1.00 21.22 C ATOM 1301 O ARG A 81 14.474 -7.274 8.165 1.00 24.05 O ATOM 1302 CB ARG A 81 13.771 -4.563 7.264 1.00 42.24 C ATOM 1303 CG ARG A 81 12.773 -3.748 6.458 1.00 54.00 C ATOM 1304 CD ARG A 81 12.027 -2.755 7.336 1.00 51.14 C ATOM 1305 NE ARG A 81 12.565 -1.403 7.211 1.00 12.11 N ATOM 1306 CZ ARG A 81 11.943 -0.320 7.664 1.00 11.01 C ATOM 1307 NH1 ARG A 81 10.768 -0.430 8.269 1.00 60.33 N ATOM 1308 NH2 ARG A 81 12.497 0.876 7.513 1.00 15.43 N ATOM 0 H ARG A 81 12.892 -6.823 5.915 1.00 51.02 H new ATOM 0 HA ARG A 81 15.311 -5.115 5.870 1.00 61.03 H new ATOM 0 HB2 ARG A 81 13.246 -5.065 8.077 1.00 42.24 H new ATOM 0 HB3 ARG A 81 14.494 -3.888 7.721 1.00 42.24 H new ATOM 0 HG2 ARG A 81 13.295 -3.213 5.664 1.00 54.00 H new ATOM 0 HG3 ARG A 81 12.060 -4.417 5.976 1.00 54.00 H new ATOM 0 HD2 ARG A 81 10.972 -2.752 7.064 1.00 51.14 H new ATOM 0 HD3 ARG A 81 12.087 -3.074 8.376 1.00 51.14 H new ATOM 0 HE ARG A 81 13.467 -1.284 6.751 1.00 12.11 H new ATOM 0 HH11 ARG A 81 10.339 -1.348 8.388 1.00 60.33 H new ATOM 0 HH12 ARG A 81 10.293 0.403 8.616 1.00 60.33 H new ATOM 0 HH21 ARG A 81 13.401 0.964 7.049 1.00 15.43 H new ATOM 0 HH22 ARG A 81 12.019 1.707 7.861 1.00 15.43 H new ATOM 1322 N LEU A 82 16.468 -6.813 7.231 1.00 65.34 N ATOM 1323 CA LEU A 82 17.198 -7.772 8.052 1.00 25.44 C ATOM 1324 C LEU A 82 18.042 -7.058 9.103 1.00 2.02 C ATOM 1325 O LEU A 82 18.774 -6.117 8.794 1.00 54.32 O ATOM 1326 CB LEU A 82 18.092 -8.650 7.174 1.00 4.24 C ATOM 1327 CG LEU A 82 18.412 -10.041 7.721 1.00 21.53 C ATOM 1328 CD1 LEU A 82 19.211 -9.938 9.011 1.00 13.54 C ATOM 1329 CD2 LEU A 82 17.132 -10.833 7.947 1.00 61.05 C ATOM 0 H LEU A 82 17.048 -6.299 6.568 1.00 65.34 H new ATOM 0 HA LEU A 82 16.470 -8.402 8.563 1.00 25.44 H new ATOM 0 HB2 LEU A 82 17.612 -8.765 6.202 1.00 4.24 H new ATOM 0 HB3 LEU A 82 19.031 -8.123 7.005 1.00 4.24 H new ATOM 0 HG LEU A 82 19.018 -10.569 6.984 1.00 21.53 H new ATOM 0 HD11 LEU A 82 19.429 -10.938 9.385 1.00 13.54 H new ATOM 0 HD12 LEU A 82 20.145 -9.411 8.819 1.00 13.54 H new ATOM 0 HD13 LEU A 82 18.632 -9.391 9.755 1.00 13.54 H new ATOM 0 HD21 LEU A 82 17.379 -11.821 8.336 1.00 61.05 H new ATOM 0 HD22 LEU A 82 16.501 -10.308 8.664 1.00 61.05 H new ATOM 0 HD23 LEU A 82 16.598 -10.939 7.003 1.00 61.05 H new ATOM 1341 N THR A 83 17.938 -7.513 10.348 1.00 14.21 N ATOM 1342 CA THR A 83 18.691 -6.918 11.445 1.00 63.52 C ATOM 1343 C THR A 83 19.522 -7.969 12.174 1.00 54.51 C ATOM 1344 O THR A 83 19.223 -9.162 12.116 1.00 12.15 O ATOM 1345 CB THR A 83 17.759 -6.225 12.456 1.00 1.30 C ATOM 1346 OG1 THR A 83 18.520 -5.371 13.318 1.00 31.53 O ATOM 1347 CG2 THR A 83 17.003 -7.250 13.287 1.00 23.42 C ATOM 0 H THR A 83 17.339 -8.292 10.622 1.00 14.21 H new ATOM 0 HA THR A 83 19.355 -6.173 11.006 1.00 63.52 H new ATOM 0 HB THR A 83 17.036 -5.628 11.900 1.00 1.30 H new ATOM 0 HG1 THR A 83 18.176 -5.440 14.233 1.00 31.53 H new ATOM 0 HG21 THR A 83 16.351 -6.736 13.994 1.00 23.42 H new ATOM 0 HG22 THR A 83 16.402 -7.879 12.630 1.00 23.42 H new ATOM 0 HG23 THR A 83 17.713 -7.871 13.833 1.00 23.42 H new ATOM 1355 N THR A 84 20.567 -7.518 12.861 1.00 13.31 N ATOM 1356 CA THR A 84 21.441 -8.419 13.601 1.00 12.55 C ATOM 1357 C THR A 84 21.736 -7.876 14.995 1.00 45.10 C ATOM 1358 O THR A 84 21.874 -6.667 15.185 1.00 64.13 O ATOM 1359 CB THR A 84 22.771 -8.647 12.859 1.00 10.10 C ATOM 1360 OG1 THR A 84 22.948 -7.645 11.852 1.00 40.33 O ATOM 1361 CG2 THR A 84 22.804 -10.027 12.220 1.00 50.12 C ATOM 0 H THR A 84 20.828 -6.534 12.920 1.00 13.31 H new ATOM 0 HA THR A 84 20.915 -9.370 13.688 1.00 12.55 H new ATOM 0 HB THR A 84 23.582 -8.580 13.584 1.00 10.10 H new ATOM 0 HG1 THR A 84 22.859 -8.053 10.965 1.00 40.33 H new ATOM 0 HG21 THR A 84 23.753 -10.165 11.702 1.00 50.12 H new ATOM 0 HG22 THR A 84 22.698 -10.788 12.993 1.00 50.12 H new ATOM 0 HG23 THR A 84 21.984 -10.118 11.507 1.00 50.12 H new ATOM 1369 N TYR A 85 21.833 -8.776 15.967 1.00 64.01 N ATOM 1370 CA TYR A 85 22.111 -8.387 17.344 1.00 2.23 C ATOM 1371 C TYR A 85 23.221 -9.248 17.941 1.00 54.25 C ATOM 1372 O TYR A 85 23.127 -10.475 17.962 1.00 20.33 O ATOM 1373 CB TYR A 85 20.846 -8.505 18.195 1.00 34.11 C ATOM 1374 CG TYR A 85 20.025 -7.236 18.239 1.00 12.01 C ATOM 1375 CD1 TYR A 85 18.861 -7.111 17.490 1.00 64.11 C ATOM 1376 CD2 TYR A 85 20.412 -6.162 19.031 1.00 44.00 C ATOM 1377 CE1 TYR A 85 18.109 -5.953 17.527 1.00 60.24 C ATOM 1378 CE2 TYR A 85 19.665 -5.001 19.075 1.00 44.30 C ATOM 1379 CZ TYR A 85 18.515 -4.901 18.321 1.00 51.03 C ATOM 1380 OH TYR A 85 17.767 -3.746 18.361 1.00 24.41 O ATOM 0 H TYR A 85 21.723 -9.780 15.827 1.00 64.01 H new ATOM 0 HA TYR A 85 22.443 -7.349 17.341 1.00 2.23 H new ATOM 0 HB2 TYR A 85 20.229 -9.314 17.803 1.00 34.11 H new ATOM 0 HB3 TYR A 85 21.126 -8.782 19.211 1.00 34.11 H new ATOM 0 HD1 TYR A 85 18.539 -7.933 16.868 1.00 64.11 H new ATOM 0 HD2 TYR A 85 21.313 -6.236 19.623 1.00 44.00 H new ATOM 0 HE1 TYR A 85 17.208 -5.872 16.937 1.00 60.24 H new ATOM 0 HE2 TYR A 85 19.980 -4.176 19.697 1.00 44.30 H new ATOM 0 HH TYR A 85 18.189 -3.104 18.969 1.00 24.41 H new ATOM 1390 N LYS A 86 24.272 -8.595 18.425 1.00 53.13 N ATOM 1391 CA LYS A 86 25.400 -9.298 19.024 1.00 40.51 C ATOM 1392 C LYS A 86 24.948 -10.140 20.212 1.00 15.24 C ATOM 1393 O LYS A 86 24.215 -9.663 21.080 1.00 11.20 O ATOM 1394 CB LYS A 86 26.470 -8.299 19.471 1.00 41.12 C ATOM 1395 CG LYS A 86 27.836 -8.556 18.858 1.00 31.23 C ATOM 1396 CD LYS A 86 28.054 -7.718 17.610 1.00 41.21 C ATOM 1397 CE LYS A 86 29.433 -7.955 17.013 1.00 72.20 C ATOM 1398 NZ LYS A 86 30.410 -6.917 17.443 1.00 31.24 N ATOM 0 H LYS A 86 24.366 -7.579 18.414 1.00 53.13 H new ATOM 0 HA LYS A 86 25.823 -9.963 18.271 1.00 40.51 H new ATOM 0 HB2 LYS A 86 26.147 -7.292 19.208 1.00 41.12 H new ATOM 0 HB3 LYS A 86 26.556 -8.333 20.557 1.00 41.12 H new ATOM 0 HG2 LYS A 86 28.612 -8.330 19.589 1.00 31.23 H new ATOM 0 HG3 LYS A 86 27.931 -9.613 18.609 1.00 31.23 H new ATOM 0 HD2 LYS A 86 27.290 -7.959 16.871 1.00 41.21 H new ATOM 0 HD3 LYS A 86 27.939 -6.662 17.855 1.00 41.21 H new ATOM 0 HE2 LYS A 86 29.794 -8.939 17.312 1.00 72.20 H new ATOM 0 HE3 LYS A 86 29.362 -7.958 15.925 1.00 72.20 H new ATOM 0 HZ1 LYS A 86 31.337 -7.114 17.015 1.00 31.24 H new ATOM 0 HZ2 LYS A 86 30.079 -5.980 17.136 1.00 31.24 H new ATOM 0 HZ3 LYS A 86 30.497 -6.931 18.479 1.00 31.24 H new ATOM 1412 N CYS A 87 25.389 -11.392 20.246 1.00 30.13 N ATOM 1413 CA CYS A 87 25.030 -12.300 21.329 1.00 35.55 C ATOM 1414 C CYS A 87 26.277 -12.875 21.993 1.00 34.33 C ATOM 1415 O CYS A 87 27.402 -12.551 21.612 1.00 20.44 O ATOM 1416 CB CYS A 87 24.150 -13.434 20.801 1.00 35.33 C ATOM 1417 SG CYS A 87 22.539 -13.558 21.613 1.00 32.25 S ATOM 0 H CYS A 87 25.996 -11.802 19.536 1.00 30.13 H new ATOM 0 HA CYS A 87 24.472 -11.734 22.075 1.00 35.55 H new ATOM 0 HB2 CYS A 87 23.996 -13.292 19.731 1.00 35.33 H new ATOM 0 HB3 CYS A 87 24.680 -14.378 20.924 1.00 35.33 H new ATOM 0 HG CYS A 87 22.504 -14.630 22.347 1.00 32.25 H new ATOM 1423 N THR A 88 26.069 -13.730 22.991 1.00 44.25 N ATOM 1424 CA THR A 88 27.176 -14.348 23.710 1.00 40.21 C ATOM 1425 C THR A 88 26.902 -15.823 23.979 1.00 73.05 C ATOM 1426 O THR A 88 25.802 -16.317 23.724 1.00 23.03 O ATOM 1427 CB THR A 88 27.444 -13.635 25.049 1.00 54.11 C ATOM 1428 OG1 THR A 88 26.945 -12.294 24.998 1.00 51.40 O ATOM 1429 CG2 THR A 88 28.932 -13.617 25.364 1.00 14.53 C ATOM 0 H THR A 88 25.144 -14.009 23.319 1.00 44.25 H new ATOM 0 HA THR A 88 28.057 -14.255 23.074 1.00 40.21 H new ATOM 0 HB THR A 88 26.929 -14.184 25.837 1.00 54.11 H new ATOM 0 HG1 THR A 88 27.118 -11.848 25.853 1.00 51.40 H new ATOM 0 HG21 THR A 88 29.097 -13.108 26.314 1.00 14.53 H new ATOM 0 HG22 THR A 88 29.302 -14.640 25.431 1.00 14.53 H new ATOM 0 HG23 THR A 88 29.465 -13.090 24.573 1.00 14.53 H new ATOM 1437 N LEU A 89 27.907 -16.522 24.494 1.00 35.32 N ATOM 1438 CA LEU A 89 27.773 -17.943 24.799 1.00 42.24 C ATOM 1439 C LEU A 89 27.023 -18.151 26.110 1.00 13.42 C ATOM 1440 O LEU A 89 27.053 -17.297 26.996 1.00 73.13 O ATOM 1441 CB LEU A 89 29.153 -18.599 24.878 1.00 74.34 C ATOM 1442 CG LEU A 89 29.197 -20.103 24.604 1.00 31.14 C ATOM 1443 CD1 LEU A 89 28.835 -20.393 23.156 1.00 22.41 C ATOM 1444 CD2 LEU A 89 30.572 -20.665 24.936 1.00 73.13 C ATOM 0 H LEU A 89 28.823 -16.129 24.709 1.00 35.32 H new ATOM 0 HA LEU A 89 27.200 -18.409 23.997 1.00 42.24 H new ATOM 0 HB2 LEU A 89 29.811 -18.101 24.166 1.00 74.34 H new ATOM 0 HB3 LEU A 89 29.563 -18.419 25.872 1.00 74.34 H new ATOM 0 HG LEU A 89 28.463 -20.592 25.244 1.00 31.14 H new ATOM 0 HD11 LEU A 89 28.872 -21.468 22.980 1.00 22.41 H new ATOM 0 HD12 LEU A 89 27.829 -20.026 22.952 1.00 22.41 H new ATOM 0 HD13 LEU A 89 29.544 -19.893 22.496 1.00 22.41 H new ATOM 0 HD21 LEU A 89 30.585 -21.736 24.735 1.00 73.13 H new ATOM 0 HD22 LEU A 89 31.325 -20.171 24.322 1.00 73.13 H new ATOM 0 HD23 LEU A 89 30.792 -20.491 25.989 1.00 73.13 H new ATOM 1456 N ASN A 90 26.352 -19.292 26.228 1.00 53.23 N ATOM 1457 CA ASN A 90 25.595 -19.613 27.432 1.00 14.21 C ATOM 1458 C ASN A 90 25.765 -21.082 27.806 1.00 33.03 C ATOM 1459 O ASN A 90 26.513 -21.816 27.161 1.00 65.10 O ATOM 1460 CB ASN A 90 24.112 -19.295 27.227 1.00 31.53 C ATOM 1461 CG ASN A 90 23.683 -19.446 25.781 1.00 51.05 C ATOM 1462 OD1 ASN A 90 24.134 -20.351 25.079 1.00 45.15 O ATOM 1463 ND2 ASN A 90 22.807 -18.557 25.328 1.00 53.22 N ATOM 0 H ASN A 90 26.317 -20.010 25.504 1.00 53.23 H new ATOM 0 HA ASN A 90 25.981 -19.002 28.248 1.00 14.21 H new ATOM 0 HB2 ASN A 90 23.512 -19.956 27.852 1.00 31.53 H new ATOM 0 HB3 ASN A 90 23.913 -18.276 27.558 1.00 31.53 H new ATOM 0 HD21 ASN A 90 22.482 -18.608 24.363 1.00 53.22 H new ATOM 0 HD22 ASN A 90 22.459 -17.823 25.945 1.00 53.22 H new ATOM 1470 N LYS A 91 25.064 -21.505 28.853 1.00 62.20 N ATOM 1471 CA LYS A 91 25.135 -22.887 29.313 1.00 12.15 C ATOM 1472 C LYS A 91 24.679 -23.849 28.221 1.00 52.41 C ATOM 1473 O LYS A 91 25.443 -24.704 27.776 1.00 24.15 O ATOM 1474 CB LYS A 91 24.273 -23.074 30.564 1.00 3.24 C ATOM 1475 CG LYS A 91 24.946 -22.604 31.842 1.00 24.24 C ATOM 1476 CD LYS A 91 26.094 -23.518 32.236 1.00 23.45 C ATOM 1477 CE LYS A 91 26.604 -23.202 33.634 1.00 31.53 C ATOM 1478 NZ LYS A 91 28.053 -23.513 33.780 1.00 71.41 N ATOM 0 H LYS A 91 24.440 -20.910 29.399 1.00 62.20 H new ATOM 0 HA LYS A 91 26.174 -23.109 29.557 1.00 12.15 H new ATOM 0 HB2 LYS A 91 23.337 -22.530 30.435 1.00 3.24 H new ATOM 0 HB3 LYS A 91 24.017 -24.129 30.665 1.00 3.24 H new ATOM 0 HG2 LYS A 91 25.318 -21.589 31.706 1.00 24.24 H new ATOM 0 HG3 LYS A 91 24.214 -22.570 32.649 1.00 24.24 H new ATOM 0 HD2 LYS A 91 25.765 -24.556 32.194 1.00 23.45 H new ATOM 0 HD3 LYS A 91 26.907 -23.412 31.518 1.00 23.45 H new ATOM 0 HE2 LYS A 91 26.435 -22.147 33.852 1.00 31.53 H new ATOM 0 HE3 LYS A 91 26.034 -23.774 34.366 1.00 31.53 H new ATOM 0 HZ1 LYS A 91 28.362 -23.284 34.746 1.00 71.41 H new ATOM 0 HZ2 LYS A 91 28.211 -24.524 33.597 1.00 71.41 H new ATOM 0 HZ3 LYS A 91 28.600 -22.948 33.099 1.00 71.41 H new ATOM 1492 N GLU A 92 23.429 -23.700 27.792 1.00 22.51 N ATOM 1493 CA GLU A 92 22.873 -24.556 26.751 1.00 62.43 C ATOM 1494 C GLU A 92 23.237 -24.033 25.364 1.00 22.03 C ATOM 1495 O GLU A 92 23.691 -22.898 25.216 1.00 5.33 O ATOM 1496 CB GLU A 92 21.352 -24.646 26.891 1.00 41.40 C ATOM 1497 CG GLU A 92 20.763 -25.929 26.330 1.00 43.02 C ATOM 1498 CD GLU A 92 21.427 -27.171 26.893 1.00 11.54 C ATOM 1499 OE1 GLU A 92 21.702 -28.103 26.109 1.00 5.23 O ATOM 1500 OE2 GLU A 92 21.670 -27.210 28.117 1.00 23.24 O ATOM 0 H GLU A 92 22.784 -22.995 28.149 1.00 22.51 H new ATOM 0 HA GLU A 92 23.301 -25.552 26.869 1.00 62.43 H new ATOM 0 HB2 GLU A 92 21.087 -24.566 27.945 1.00 41.40 H new ATOM 0 HB3 GLU A 92 20.898 -23.795 26.383 1.00 41.40 H new ATOM 0 HG2 GLU A 92 19.696 -25.961 26.550 1.00 43.02 H new ATOM 0 HG3 GLU A 92 20.865 -25.927 25.245 1.00 43.02 H new ATOM 1507 N LEU A 93 23.035 -24.868 24.351 1.00 23.44 N ATOM 1508 CA LEU A 93 23.342 -24.492 22.976 1.00 43.51 C ATOM 1509 C LEU A 93 22.082 -24.055 22.237 1.00 54.14 C ATOM 1510 O LEU A 93 20.959 -24.364 22.637 1.00 61.22 O ATOM 1511 CB LEU A 93 23.999 -25.661 22.240 1.00 3.14 C ATOM 1512 CG LEU A 93 25.527 -25.705 22.280 1.00 43.15 C ATOM 1513 CD1 LEU A 93 26.025 -25.703 23.717 1.00 72.44 C ATOM 1514 CD2 LEU A 93 26.045 -26.927 21.535 1.00 32.24 C ATOM 0 H LEU A 93 22.660 -25.811 24.456 1.00 23.44 H new ATOM 0 HA LEU A 93 24.036 -23.652 23.002 1.00 43.51 H new ATOM 0 HB2 LEU A 93 23.617 -26.591 22.662 1.00 3.14 H new ATOM 0 HB3 LEU A 93 23.683 -25.631 21.197 1.00 3.14 H new ATOM 0 HG LEU A 93 25.910 -24.813 21.784 1.00 43.15 H new ATOM 0 HD11 LEU A 93 27.115 -25.735 23.725 1.00 72.44 H new ATOM 0 HD12 LEU A 93 25.685 -24.797 24.219 1.00 72.44 H new ATOM 0 HD13 LEU A 93 25.633 -26.576 24.239 1.00 72.44 H new ATOM 0 HD21 LEU A 93 27.134 -26.942 21.574 1.00 32.24 H new ATOM 0 HD22 LEU A 93 25.653 -27.831 22.001 1.00 32.24 H new ATOM 0 HD23 LEU A 93 25.719 -26.884 20.496 1.00 32.24 H new ATOM 1526 N PRO A 94 22.269 -23.320 21.130 1.00 33.12 N ATOM 1527 CA PRO A 94 21.158 -22.828 20.310 1.00 41.42 C ATOM 1528 C PRO A 94 20.447 -23.951 19.562 1.00 2.52 C ATOM 1529 O PRO A 94 21.023 -25.012 19.321 1.00 32.20 O ATOM 1530 CB PRO A 94 21.840 -21.877 19.323 1.00 3.43 C ATOM 1531 CG PRO A 94 23.244 -22.366 19.235 1.00 65.34 C ATOM 1532 CD PRO A 94 23.579 -22.914 20.594 1.00 12.15 C ATOM 0 HA PRO A 94 20.384 -22.355 20.914 1.00 41.42 H new ATOM 0 HB2 PRO A 94 21.351 -21.900 18.349 1.00 3.43 H new ATOM 0 HB3 PRO A 94 21.801 -20.846 19.675 1.00 3.43 H new ATOM 0 HG2 PRO A 94 23.342 -23.136 18.469 1.00 65.34 H new ATOM 0 HG3 PRO A 94 23.922 -21.557 18.963 1.00 65.34 H new ATOM 0 HD2 PRO A 94 24.266 -23.758 20.529 1.00 12.15 H new ATOM 0 HD3 PRO A 94 24.056 -22.163 21.224 1.00 12.15 H new ATOM 1540 N THR A 95 19.192 -23.710 19.197 1.00 52.14 N ATOM 1541 CA THR A 95 18.402 -24.701 18.477 1.00 61.01 C ATOM 1542 C THR A 95 18.464 -24.466 16.972 1.00 71.00 C ATOM 1543 O THR A 95 18.784 -23.367 16.518 1.00 52.35 O ATOM 1544 CB THR A 95 16.929 -24.681 18.928 1.00 64.20 C ATOM 1545 OG1 THR A 95 16.855 -24.574 20.354 1.00 23.30 O ATOM 1546 CG2 THR A 95 16.206 -25.939 18.470 1.00 23.04 C ATOM 0 H THR A 95 18.701 -22.837 19.388 1.00 52.14 H new ATOM 0 HA THR A 95 18.832 -25.676 18.708 1.00 61.01 H new ATOM 0 HB THR A 95 16.444 -23.817 18.474 1.00 64.20 H new ATOM 0 HG1 THR A 95 15.931 -24.720 20.645 1.00 23.30 H new ATOM 0 HG21 THR A 95 15.168 -25.902 18.800 1.00 23.04 H new ATOM 0 HG22 THR A 95 16.239 -26.002 17.382 1.00 23.04 H new ATOM 0 HG23 THR A 95 16.692 -26.815 18.899 1.00 23.04 H new ATOM 1554 N LEU A 96 18.155 -25.504 16.203 1.00 64.23 N ATOM 1555 CA LEU A 96 18.175 -25.410 14.747 1.00 21.40 C ATOM 1556 C LEU A 96 19.551 -24.982 14.248 1.00 63.55 C ATOM 1557 O LEU A 96 19.693 -24.493 13.126 1.00 31.13 O ATOM 1558 CB LEU A 96 17.114 -24.419 14.266 1.00 43.12 C ATOM 1559 CG LEU A 96 17.590 -22.984 14.040 1.00 45.51 C ATOM 1560 CD1 LEU A 96 17.564 -22.639 12.559 1.00 72.21 C ATOM 1561 CD2 LEU A 96 16.734 -22.007 14.832 1.00 11.40 C ATOM 0 H LEU A 96 17.888 -26.420 16.563 1.00 64.23 H new ATOM 0 HA LEU A 96 17.953 -26.397 14.340 1.00 21.40 H new ATOM 0 HB2 LEU A 96 16.693 -24.792 13.332 1.00 43.12 H new ATOM 0 HB3 LEU A 96 16.304 -24.401 14.996 1.00 43.12 H new ATOM 0 HG LEU A 96 18.618 -22.904 14.392 1.00 45.51 H new ATOM 0 HD11 LEU A 96 17.906 -21.614 12.418 1.00 72.21 H new ATOM 0 HD12 LEU A 96 18.221 -23.318 12.016 1.00 72.21 H new ATOM 0 HD13 LEU A 96 16.547 -22.737 12.180 1.00 72.21 H new ATOM 0 HD21 LEU A 96 17.087 -20.991 14.659 1.00 11.40 H new ATOM 0 HD22 LEU A 96 15.696 -22.090 14.511 1.00 11.40 H new ATOM 0 HD23 LEU A 96 16.805 -22.240 15.895 1.00 11.40 H new ATOM 1573 N THR A 97 20.565 -25.172 15.086 1.00 2.05 N ATOM 1574 CA THR A 97 21.930 -24.807 14.730 1.00 4.13 C ATOM 1575 C THR A 97 22.569 -25.867 13.840 1.00 34.23 C ATOM 1576 O THR A 97 23.381 -25.553 12.971 1.00 71.20 O ATOM 1577 CB THR A 97 22.805 -24.611 15.983 1.00 15.33 C ATOM 1578 OG1 THR A 97 24.082 -24.081 15.611 1.00 20.35 O ATOM 1579 CG2 THR A 97 22.991 -25.926 16.724 1.00 22.13 C ATOM 0 H THR A 97 20.466 -25.577 16.017 1.00 2.05 H new ATOM 0 HA THR A 97 21.872 -23.865 14.185 1.00 4.13 H new ATOM 0 HB THR A 97 22.300 -23.908 16.646 1.00 15.33 H new ATOM 0 HG1 THR A 97 24.631 -23.958 16.413 1.00 20.35 H new ATOM 0 HG21 THR A 97 23.612 -25.763 17.605 1.00 22.13 H new ATOM 0 HG22 THR A 97 22.019 -26.311 17.032 1.00 22.13 H new ATOM 0 HG23 THR A 97 23.476 -26.648 16.067 1.00 22.13 H new ATOM 1587 N GLU A 98 22.195 -27.123 14.063 1.00 21.41 N ATOM 1588 CA GLU A 98 22.732 -28.230 13.280 1.00 45.21 C ATOM 1589 C GLU A 98 21.987 -28.372 11.956 1.00 32.01 C ATOM 1590 O GLU A 98 22.290 -29.253 11.151 1.00 22.44 O ATOM 1591 CB GLU A 98 22.642 -29.536 14.072 1.00 54.11 C ATOM 1592 CG GLU A 98 21.243 -29.843 14.581 1.00 63.24 C ATOM 1593 CD GLU A 98 20.948 -31.330 14.614 1.00 24.31 C ATOM 1594 OE1 GLU A 98 21.093 -31.987 13.562 1.00 50.04 O ATOM 1595 OE2 GLU A 98 20.573 -31.837 15.692 1.00 61.22 O ATOM 0 H GLU A 98 21.523 -27.399 14.779 1.00 21.41 H new ATOM 0 HA GLU A 98 23.779 -28.015 13.066 1.00 45.21 H new ATOM 0 HB2 GLU A 98 22.979 -30.358 13.440 1.00 54.11 H new ATOM 0 HB3 GLU A 98 23.325 -29.485 14.920 1.00 54.11 H new ATOM 0 HG2 GLU A 98 21.126 -29.431 15.583 1.00 63.24 H new ATOM 0 HG3 GLU A 98 20.511 -29.345 13.945 1.00 63.24 H new ATOM 1602 N HIS A 99 21.009 -27.498 11.738 1.00 70.53 N ATOM 1603 CA HIS A 99 20.219 -27.526 10.512 1.00 41.13 C ATOM 1604 C HIS A 99 21.110 -27.767 9.297 1.00 71.22 C ATOM 1605 O HIS A 99 20.755 -28.526 8.394 1.00 1.22 O ATOM 1606 CB HIS A 99 19.453 -26.214 10.344 1.00 12.53 C ATOM 1607 CG HIS A 99 17.983 -26.340 10.606 1.00 65.34 C ATOM 1608 ND1 HIS A 99 17.456 -27.226 11.521 1.00 34.01 N ATOM 1609 CD2 HIS A 99 16.929 -25.685 10.066 1.00 33.54 C ATOM 1610 CE1 HIS A 99 16.139 -27.112 11.532 1.00 5.14 C ATOM 1611 NE2 HIS A 99 15.794 -26.183 10.659 1.00 63.31 N ATOM 0 H HIS A 99 20.745 -26.763 12.394 1.00 70.53 H new ATOM 0 HA HIS A 99 19.506 -28.347 10.587 1.00 41.13 H new ATOM 0 HB2 HIS A 99 19.872 -25.469 11.021 1.00 12.53 H new ATOM 0 HB3 HIS A 99 19.602 -25.843 9.330 1.00 12.53 H new ATOM 0 HD2 HIS A 99 16.972 -24.915 9.310 1.00 33.54 H new ATOM 0 HE1 HIS A 99 15.461 -27.682 12.150 1.00 5.14 H new ATOM 0 HE2 HIS A 99 14.840 -25.884 10.458 1.00 63.31 H new ATOM 1619 N LYS A 100 22.268 -27.116 9.280 1.00 62.51 N ATOM 1620 CA LYS A 100 23.211 -27.260 8.177 1.00 52.22 C ATOM 1621 C LYS A 100 24.356 -28.193 8.557 1.00 34.22 C ATOM 1622 O LYS A 100 24.559 -29.231 7.927 1.00 54.22 O ATOM 1623 CB LYS A 100 23.766 -25.892 7.773 1.00 65.32 C ATOM 1624 CG LYS A 100 24.250 -25.833 6.334 1.00 24.23 C ATOM 1625 CD LYS A 100 25.650 -26.408 6.193 1.00 71.03 C ATOM 1626 CE LYS A 100 26.249 -26.087 4.832 1.00 21.40 C ATOM 1627 NZ LYS A 100 26.795 -24.703 4.779 1.00 54.35 N ATOM 0 H LYS A 100 22.576 -26.483 10.018 1.00 62.51 H new ATOM 0 HA LYS A 100 22.679 -27.694 7.331 1.00 52.22 H new ATOM 0 HB2 LYS A 100 22.992 -25.138 7.919 1.00 65.32 H new ATOM 0 HB3 LYS A 100 24.592 -25.634 8.436 1.00 65.32 H new ATOM 0 HG2 LYS A 100 23.562 -26.386 5.695 1.00 24.23 H new ATOM 0 HG3 LYS A 100 24.244 -24.799 5.989 1.00 24.23 H new ATOM 0 HD2 LYS A 100 26.291 -26.006 6.978 1.00 71.03 H new ATOM 0 HD3 LYS A 100 25.616 -27.489 6.331 1.00 71.03 H new ATOM 0 HE2 LYS A 100 27.043 -26.799 4.607 1.00 21.40 H new ATOM 0 HE3 LYS A 100 25.486 -26.206 4.062 1.00 21.40 H new ATOM 0 HZ1 LYS A 100 27.194 -24.523 3.836 1.00 54.35 H new ATOM 0 HZ2 LYS A 100 26.033 -24.022 4.968 1.00 54.35 H new ATOM 0 HZ3 LYS A 100 27.541 -24.596 5.496 1.00 54.35 H new ATOM 1641 N SER A 101 25.100 -27.818 9.593 1.00 70.14 N ATOM 1642 CA SER A 101 26.226 -28.621 10.055 1.00 12.04 C ATOM 1643 C SER A 101 26.961 -27.920 11.194 1.00 64.14 C ATOM 1644 O SER A 101 26.545 -26.857 11.654 1.00 10.33 O ATOM 1645 CB SER A 101 27.192 -28.896 8.901 1.00 0.25 C ATOM 1646 OG SER A 101 27.401 -27.730 8.123 1.00 62.41 O ATOM 0 H SER A 101 24.943 -26.964 10.128 1.00 70.14 H new ATOM 0 HA SER A 101 25.837 -29.569 10.426 1.00 12.04 H new ATOM 0 HB2 SER A 101 28.145 -29.249 9.296 1.00 0.25 H new ATOM 0 HB3 SER A 101 26.794 -29.691 8.271 1.00 0.25 H new ATOM 0 HG SER A 101 28.023 -27.931 7.393 1.00 62.41 H new ATOM 1652 N ILE A 102 28.057 -28.524 11.642 1.00 52.21 N ATOM 1653 CA ILE A 102 28.851 -27.958 12.725 1.00 3.11 C ATOM 1654 C ILE A 102 30.153 -27.363 12.199 1.00 1.11 C ATOM 1655 O ILE A 102 31.107 -28.087 11.915 1.00 52.55 O ATOM 1656 CB ILE A 102 29.179 -29.016 13.795 1.00 0.01 C ATOM 1657 CG1 ILE A 102 27.944 -29.307 14.651 1.00 64.13 C ATOM 1658 CG2 ILE A 102 30.335 -28.548 14.666 1.00 23.00 C ATOM 1659 CD1 ILE A 102 27.460 -30.736 14.546 1.00 73.24 C ATOM 0 H ILE A 102 28.415 -29.405 11.272 1.00 52.21 H new ATOM 0 HA ILE A 102 28.250 -27.169 13.178 1.00 3.11 H new ATOM 0 HB ILE A 102 29.477 -29.937 13.294 1.00 0.01 H new ATOM 0 HG12 ILE A 102 28.174 -29.085 15.693 1.00 64.13 H new ATOM 0 HG13 ILE A 102 27.138 -28.636 14.352 1.00 64.13 H new ATOM 0 HG21 ILE A 102 30.555 -29.307 15.417 1.00 23.00 H new ATOM 0 HG22 ILE A 102 31.216 -28.386 14.045 1.00 23.00 H new ATOM 0 HG23 ILE A 102 30.064 -27.615 15.161 1.00 23.00 H new ATOM 0 HD11 ILE A 102 26.583 -30.870 15.178 1.00 73.24 H new ATOM 0 HD12 ILE A 102 27.199 -30.956 13.511 1.00 73.24 H new ATOM 0 HD13 ILE A 102 28.250 -31.413 14.873 1.00 73.24 H new ATOM 1671 N GLU A 103 30.185 -26.040 12.074 1.00 10.24 N ATOM 1672 CA GLU A 103 31.371 -25.348 11.584 1.00 51.35 C ATOM 1673 C GLU A 103 31.593 -24.043 12.344 1.00 63.34 C ATOM 1674 O GLU A 103 30.756 -23.141 12.307 1.00 25.33 O ATOM 1675 CB GLU A 103 31.239 -25.062 10.086 1.00 33.12 C ATOM 1676 CG GLU A 103 30.268 -25.988 9.373 1.00 31.32 C ATOM 1677 CD GLU A 103 30.191 -25.718 7.883 1.00 1.21 C ATOM 1678 OE1 GLU A 103 29.096 -25.359 7.402 1.00 50.23 O ATOM 1679 OE2 GLU A 103 31.225 -25.865 7.199 1.00 70.23 O ATOM 0 H GLU A 103 29.404 -25.426 12.305 1.00 10.24 H new ATOM 0 HA GLU A 103 32.232 -25.996 11.749 1.00 51.35 H new ATOM 0 HB2 GLU A 103 30.912 -24.031 9.949 1.00 33.12 H new ATOM 0 HB3 GLU A 103 32.220 -25.150 9.620 1.00 33.12 H new ATOM 0 HG2 GLU A 103 30.572 -27.022 9.536 1.00 31.32 H new ATOM 0 HG3 GLU A 103 29.276 -25.875 9.811 1.00 31.32 H new ATOM 1686 N TRP A 104 32.726 -23.952 13.031 1.00 32.31 N ATOM 1687 CA TRP A 104 33.059 -22.759 13.801 1.00 54.22 C ATOM 1688 C TRP A 104 34.288 -22.065 13.225 1.00 50.11 C ATOM 1689 O TRP A 104 35.419 -22.504 13.440 1.00 53.13 O ATOM 1690 CB TRP A 104 33.303 -23.124 15.266 1.00 41.40 C ATOM 1691 CG TRP A 104 32.387 -24.197 15.772 1.00 43.13 C ATOM 1692 CD1 TRP A 104 32.742 -25.311 16.478 1.00 74.14 C ATOM 1693 CD2 TRP A 104 30.966 -24.258 15.608 1.00 22.12 C ATOM 1694 NE1 TRP A 104 31.626 -26.061 16.763 1.00 62.22 N ATOM 1695 CE2 TRP A 104 30.524 -25.436 16.241 1.00 24.43 C ATOM 1696 CE3 TRP A 104 30.024 -23.431 14.991 1.00 72.42 C ATOM 1697 CZ2 TRP A 104 29.183 -25.806 16.272 1.00 75.31 C ATOM 1698 CZ3 TRP A 104 28.692 -23.800 15.022 1.00 64.12 C ATOM 1699 CH2 TRP A 104 28.282 -24.978 15.659 1.00 35.43 C ATOM 0 H TRP A 104 33.429 -24.690 13.071 1.00 32.31 H new ATOM 0 HA TRP A 104 32.216 -22.071 13.741 1.00 54.22 H new ATOM 0 HB2 TRP A 104 34.336 -23.453 15.384 1.00 41.40 H new ATOM 0 HB3 TRP A 104 33.180 -22.232 15.880 1.00 41.40 H new ATOM 0 HD1 TRP A 104 33.750 -25.565 16.769 1.00 74.14 H new ATOM 0 HE1 TRP A 104 31.619 -26.941 17.280 1.00 62.22 H new ATOM 0 HE3 TRP A 104 30.331 -22.520 14.499 1.00 72.42 H new ATOM 0 HZ2 TRP A 104 28.865 -26.714 16.762 1.00 75.31 H new ATOM 0 HZ3 TRP A 104 27.955 -23.169 14.547 1.00 64.12 H new ATOM 0 HH2 TRP A 104 27.234 -25.238 15.667 1.00 35.43 H new ATOM 1710 N LEU A 105 34.061 -20.980 12.493 1.00 11.20 N ATOM 1711 CA LEU A 105 35.151 -20.224 11.886 1.00 24.40 C ATOM 1712 C LEU A 105 35.513 -19.011 12.737 1.00 63.40 C ATOM 1713 O LEU A 105 34.652 -18.416 13.385 1.00 44.24 O ATOM 1714 CB LEU A 105 34.764 -19.775 10.476 1.00 31.30 C ATOM 1715 CG LEU A 105 34.762 -20.863 9.402 1.00 74.52 C ATOM 1716 CD1 LEU A 105 36.102 -21.580 9.365 1.00 24.22 C ATOM 1717 CD2 LEU A 105 33.632 -21.853 9.648 1.00 62.23 C ATOM 0 H LEU A 105 33.132 -20.604 12.305 1.00 11.20 H new ATOM 0 HA LEU A 105 36.023 -20.876 11.826 1.00 24.40 H new ATOM 0 HB2 LEU A 105 33.769 -19.332 10.518 1.00 31.30 H new ATOM 0 HB3 LEU A 105 35.451 -18.988 10.166 1.00 31.30 H new ATOM 0 HG LEU A 105 34.600 -20.390 8.434 1.00 74.52 H new ATOM 0 HD11 LEU A 105 36.081 -22.351 8.595 1.00 24.22 H new ATOM 0 HD12 LEU A 105 36.892 -20.863 9.140 1.00 24.22 H new ATOM 0 HD13 LEU A 105 36.295 -22.041 10.334 1.00 24.22 H new ATOM 0 HD21 LEU A 105 33.646 -22.620 8.874 1.00 62.23 H new ATOM 0 HD22 LEU A 105 33.763 -22.320 10.624 1.00 62.23 H new ATOM 0 HD23 LEU A 105 32.677 -21.329 9.622 1.00 62.23 H new ATOM 1729 N SER A 106 36.792 -18.650 12.729 1.00 43.41 N ATOM 1730 CA SER A 106 37.269 -17.508 13.501 1.00 33.23 C ATOM 1731 C SER A 106 36.734 -16.201 12.924 1.00 5.24 C ATOM 1732 O SER A 106 35.944 -16.204 11.980 1.00 2.40 O ATOM 1733 CB SER A 106 38.798 -17.482 13.522 1.00 23.32 C ATOM 1734 OG SER A 106 39.332 -18.788 13.391 1.00 63.34 O ATOM 0 H SER A 106 37.517 -19.132 12.197 1.00 43.41 H new ATOM 0 HA SER A 106 36.901 -17.612 14.522 1.00 33.23 H new ATOM 0 HB2 SER A 106 39.165 -16.853 12.711 1.00 23.32 H new ATOM 0 HB3 SER A 106 39.145 -17.036 14.454 1.00 23.32 H new ATOM 0 HG SER A 106 40.311 -18.744 13.406 1.00 63.34 H new ATOM 1740 N ILE A 107 37.172 -15.085 13.499 1.00 34.53 N ATOM 1741 CA ILE A 107 36.739 -13.771 13.042 1.00 12.23 C ATOM 1742 C ILE A 107 37.381 -13.414 11.706 1.00 23.30 C ATOM 1743 O ILE A 107 36.839 -12.623 10.937 1.00 55.44 O ATOM 1744 CB ILE A 107 37.080 -12.677 14.071 1.00 11.31 C ATOM 1745 CG1 ILE A 107 36.433 -12.995 15.420 1.00 34.34 C ATOM 1746 CG2 ILE A 107 36.624 -11.315 13.567 1.00 24.43 C ATOM 1747 CD1 ILE A 107 36.726 -11.966 16.489 1.00 12.04 C ATOM 0 H ILE A 107 37.826 -15.065 14.282 1.00 34.53 H new ATOM 0 HA ILE A 107 35.657 -13.820 12.921 1.00 12.23 H new ATOM 0 HB ILE A 107 38.161 -12.650 14.205 1.00 11.31 H new ATOM 0 HG12 ILE A 107 35.354 -13.071 15.287 1.00 34.34 H new ATOM 0 HG13 ILE A 107 36.782 -13.970 15.760 1.00 34.34 H new ATOM 0 HG21 ILE A 107 36.872 -10.552 14.305 1.00 24.43 H new ATOM 0 HG22 ILE A 107 37.127 -11.088 12.627 1.00 24.43 H new ATOM 0 HG23 ILE A 107 35.546 -11.328 13.407 1.00 24.43 H new ATOM 0 HD11 ILE A 107 36.235 -12.257 17.418 1.00 12.04 H new ATOM 0 HD12 ILE A 107 37.802 -11.906 16.651 1.00 12.04 H new ATOM 0 HD13 ILE A 107 36.352 -10.993 16.170 1.00 12.04 H new ATOM 1759 N ASN A 108 38.540 -14.006 11.436 1.00 23.23 N ATOM 1760 CA ASN A 108 39.257 -13.752 10.192 1.00 71.13 C ATOM 1761 C ASN A 108 38.949 -14.830 9.157 1.00 54.12 C ATOM 1762 O ASN A 108 39.637 -14.945 8.143 1.00 34.22 O ATOM 1763 CB ASN A 108 40.764 -13.693 10.449 1.00 31.05 C ATOM 1764 CG ASN A 108 41.093 -13.516 11.919 1.00 35.34 C ATOM 1765 OD1 ASN A 108 41.709 -14.384 12.538 1.00 43.04 O ATOM 1766 ND2 ASN A 108 40.680 -12.388 12.486 1.00 24.21 N ATOM 0 H ASN A 108 39.003 -14.665 12.062 1.00 23.23 H new ATOM 0 HA ASN A 108 38.924 -12.791 9.801 1.00 71.13 H new ATOM 0 HB2 ASN A 108 41.228 -14.609 10.083 1.00 31.05 H new ATOM 0 HB3 ASN A 108 41.195 -12.868 9.881 1.00 31.05 H new ATOM 0 HD21 ASN A 108 40.870 -12.214 13.473 1.00 24.21 H new ATOM 0 HD22 ASN A 108 40.173 -11.696 11.935 1.00 24.21 H new ATOM 1773 N GLU A 109 37.909 -15.616 9.420 1.00 4.14 N ATOM 1774 CA GLU A 109 37.510 -16.684 8.512 1.00 65.24 C ATOM 1775 C GLU A 109 36.063 -16.505 8.064 1.00 73.41 C ATOM 1776 O GLU A 109 35.681 -16.931 6.973 1.00 42.23 O ATOM 1777 CB GLU A 109 37.683 -18.048 9.185 1.00 41.54 C ATOM 1778 CG GLU A 109 39.034 -18.691 8.919 1.00 53.11 C ATOM 1779 CD GLU A 109 40.190 -17.849 9.422 1.00 41.21 C ATOM 1780 OE1 GLU A 109 41.099 -17.550 8.619 1.00 53.31 O ATOM 1781 OE2 GLU A 109 40.187 -17.489 10.618 1.00 71.33 O ATOM 0 H GLU A 109 37.328 -15.533 10.254 1.00 4.14 H new ATOM 0 HA GLU A 109 38.153 -16.637 7.633 1.00 65.24 H new ATOM 0 HB2 GLU A 109 37.551 -17.932 10.261 1.00 41.54 H new ATOM 0 HB3 GLU A 109 36.896 -18.718 8.837 1.00 41.54 H new ATOM 0 HG2 GLU A 109 39.067 -19.670 9.398 1.00 53.11 H new ATOM 0 HG3 GLU A 109 39.149 -18.856 7.848 1.00 53.11 H new ATOM 1788 N LEU A 110 35.261 -15.874 8.914 1.00 14.00 N ATOM 1789 CA LEU A 110 33.854 -15.639 8.608 1.00 51.55 C ATOM 1790 C LEU A 110 33.692 -15.056 7.207 1.00 32.12 C ATOM 1791 O LEU A 110 32.679 -15.281 6.544 1.00 1.41 O ATOM 1792 CB LEU A 110 33.238 -14.693 9.640 1.00 10.21 C ATOM 1793 CG LEU A 110 34.034 -13.424 9.947 1.00 1.11 C ATOM 1794 CD1 LEU A 110 33.769 -12.359 8.894 1.00 34.30 C ATOM 1795 CD2 LEU A 110 33.691 -12.902 11.335 1.00 51.55 C ATOM 0 H LEU A 110 35.561 -15.516 9.821 1.00 14.00 H new ATOM 0 HA LEU A 110 33.334 -16.596 8.646 1.00 51.55 H new ATOM 0 HB2 LEU A 110 32.248 -14.401 9.290 1.00 10.21 H new ATOM 0 HB3 LEU A 110 33.098 -15.244 10.570 1.00 10.21 H new ATOM 0 HG LEU A 110 35.096 -13.670 9.925 1.00 1.11 H new ATOM 0 HD11 LEU A 110 34.344 -11.463 9.129 1.00 34.30 H new ATOM 0 HD12 LEU A 110 34.066 -12.734 7.915 1.00 34.30 H new ATOM 0 HD13 LEU A 110 32.707 -12.115 8.882 1.00 34.30 H new ATOM 0 HD21 LEU A 110 34.267 -11.999 11.537 1.00 51.55 H new ATOM 0 HD22 LEU A 110 32.627 -12.673 11.385 1.00 51.55 H new ATOM 0 HD23 LEU A 110 33.934 -13.660 12.079 1.00 51.55 H new ATOM 1807 N ASP A 111 34.697 -14.309 6.763 1.00 75.32 N ATOM 1808 CA ASP A 111 34.667 -13.697 5.440 1.00 62.14 C ATOM 1809 C ASP A 111 34.450 -14.751 4.358 1.00 4.10 C ATOM 1810 O ASP A 111 33.605 -14.588 3.478 1.00 72.40 O ATOM 1811 CB ASP A 111 35.969 -12.938 5.176 1.00 31.42 C ATOM 1812 CG ASP A 111 36.107 -12.511 3.728 1.00 11.54 C ATOM 1813 OD1 ASP A 111 36.512 -13.350 2.898 1.00 22.41 O ATOM 1814 OD2 ASP A 111 35.810 -11.336 3.426 1.00 44.43 O ATOM 0 H ASP A 111 35.542 -14.113 7.300 1.00 75.32 H new ATOM 0 HA ASP A 111 33.834 -12.995 5.410 1.00 62.14 H new ATOM 0 HB2 ASP A 111 36.009 -12.057 5.817 1.00 31.42 H new ATOM 0 HB3 ASP A 111 36.815 -13.569 5.448 1.00 31.42 H new ATOM 1819 N LYS A 112 35.221 -15.831 4.429 1.00 34.31 N ATOM 1820 CA LYS A 112 35.114 -16.913 3.457 1.00 12.20 C ATOM 1821 C LYS A 112 33.720 -17.531 3.482 1.00 54.03 C ATOM 1822 O LYS A 112 33.311 -18.204 2.534 1.00 14.52 O ATOM 1823 CB LYS A 112 36.165 -17.988 3.742 1.00 0.10 C ATOM 1824 CG LYS A 112 35.809 -18.893 4.909 1.00 53.13 C ATOM 1825 CD LYS A 112 35.459 -20.295 4.440 1.00 61.40 C ATOM 1826 CE LYS A 112 35.799 -21.337 5.495 1.00 3.32 C ATOM 1827 NZ LYS A 112 37.155 -21.917 5.285 1.00 13.23 N ATOM 0 H LYS A 112 35.927 -15.980 5.150 1.00 34.31 H new ATOM 0 HA LYS A 112 35.290 -16.496 2.465 1.00 12.20 H new ATOM 0 HB2 LYS A 112 36.300 -18.598 2.849 1.00 0.10 H new ATOM 0 HB3 LYS A 112 37.121 -17.505 3.946 1.00 0.10 H new ATOM 0 HG2 LYS A 112 36.648 -18.939 5.604 1.00 53.13 H new ATOM 0 HG3 LYS A 112 34.966 -18.470 5.455 1.00 53.13 H new ATOM 0 HD2 LYS A 112 34.396 -20.347 4.206 1.00 61.40 H new ATOM 0 HD3 LYS A 112 35.999 -20.518 3.520 1.00 61.40 H new ATOM 0 HE2 LYS A 112 35.748 -20.882 6.484 1.00 3.32 H new ATOM 0 HE3 LYS A 112 35.056 -22.134 5.471 1.00 3.32 H new ATOM 0 HZ1 LYS A 112 37.349 -22.623 6.024 1.00 13.23 H new ATOM 0 HZ2 LYS A 112 37.197 -22.373 4.351 1.00 13.23 H new ATOM 0 HZ3 LYS A 112 37.867 -21.161 5.333 1.00 13.23 H new ATOM 1841 N LEU A 113 32.993 -17.298 4.569 1.00 25.14 N ATOM 1842 CA LEU A 113 31.643 -17.831 4.717 1.00 44.13 C ATOM 1843 C LEU A 113 30.619 -16.907 4.066 1.00 42.30 C ATOM 1844 O LEU A 113 29.560 -16.640 4.633 1.00 64.51 O ATOM 1845 CB LEU A 113 31.308 -18.021 6.197 1.00 73.21 C ATOM 1846 CG LEU A 113 32.432 -18.572 7.075 1.00 70.23 C ATOM 1847 CD1 LEU A 113 31.924 -18.851 8.481 1.00 53.43 C ATOM 1848 CD2 LEU A 113 33.020 -19.833 6.459 1.00 61.32 C ATOM 0 H LEU A 113 33.316 -16.743 5.362 1.00 25.14 H new ATOM 0 HA LEU A 113 31.603 -18.798 4.215 1.00 44.13 H new ATOM 0 HB2 LEU A 113 30.994 -17.060 6.604 1.00 73.21 H new ATOM 0 HB3 LEU A 113 30.453 -18.693 6.272 1.00 73.21 H new ATOM 0 HG LEU A 113 33.219 -17.821 7.138 1.00 70.23 H new ATOM 0 HD11 LEU A 113 32.738 -19.243 9.091 1.00 53.43 H new ATOM 0 HD12 LEU A 113 31.551 -17.927 8.923 1.00 53.43 H new ATOM 0 HD13 LEU A 113 31.118 -19.584 8.438 1.00 53.43 H new ATOM 0 HD21 LEU A 113 33.819 -20.211 7.097 1.00 61.32 H new ATOM 0 HD22 LEU A 113 32.241 -20.590 6.365 1.00 61.32 H new ATOM 0 HD23 LEU A 113 33.422 -19.603 5.473 1.00 61.32 H new ATOM 1860 N ASN A 114 30.942 -16.422 2.871 1.00 30.11 N ATOM 1861 CA ASN A 114 30.049 -15.529 2.142 1.00 0.20 C ATOM 1862 C ASN A 114 28.602 -15.728 2.582 1.00 71.20 C ATOM 1863 O ASN A 114 27.973 -16.732 2.247 1.00 65.22 O ATOM 1864 CB ASN A 114 30.173 -15.767 0.636 1.00 64.42 C ATOM 1865 CG ASN A 114 30.104 -14.479 -0.161 1.00 64.13 C ATOM 1866 OD1 ASN A 114 29.310 -14.355 -1.093 1.00 52.34 O ATOM 1867 ND2 ASN A 114 30.939 -13.513 0.203 1.00 43.11 N ATOM 0 H ASN A 114 31.815 -16.632 2.387 1.00 30.11 H new ATOM 0 HA ASN A 114 30.340 -14.503 2.366 1.00 0.20 H new ATOM 0 HB2 ASN A 114 31.117 -16.270 0.427 1.00 64.42 H new ATOM 0 HB3 ASN A 114 29.376 -16.436 0.310 1.00 64.42 H new ATOM 0 HD21 ASN A 114 30.939 -12.624 -0.297 1.00 43.11 H new ATOM 0 HD22 ASN A 114 31.580 -13.660 0.982 1.00 43.11 H new ATOM 1874 N TRP A 115 28.080 -14.765 3.333 1.00 21.43 N ATOM 1875 CA TRP A 115 26.706 -14.835 3.819 1.00 45.22 C ATOM 1876 C TRP A 115 25.770 -14.038 2.917 1.00 34.53 C ATOM 1877 O TRP A 115 26.158 -13.601 1.835 1.00 44.21 O ATOM 1878 CB TRP A 115 26.624 -14.309 5.253 1.00 75.12 C ATOM 1879 CG TRP A 115 27.799 -14.699 6.097 1.00 34.24 C ATOM 1880 CD1 TRP A 115 29.058 -14.173 6.043 1.00 72.44 C ATOM 1881 CD2 TRP A 115 27.824 -15.700 7.121 1.00 15.43 C ATOM 1882 NE1 TRP A 115 29.864 -14.787 6.971 1.00 41.21 N ATOM 1883 CE2 TRP A 115 29.131 -15.726 7.646 1.00 35.10 C ATOM 1884 CE3 TRP A 115 26.869 -16.574 7.647 1.00 12.04 C ATOM 1885 CZ2 TRP A 115 29.504 -16.594 8.669 1.00 1.40 C ATOM 1886 CZ3 TRP A 115 27.241 -17.435 8.662 1.00 2.54 C ATOM 1887 CH2 TRP A 115 28.549 -17.439 9.165 1.00 2.12 C ATOM 0 H TRP A 115 28.587 -13.927 3.619 1.00 21.43 H new ATOM 0 HA TRP A 115 26.393 -15.879 3.804 1.00 45.22 H new ATOM 0 HB2 TRP A 115 26.547 -13.222 5.230 1.00 75.12 H new ATOM 0 HB3 TRP A 115 25.712 -14.683 5.718 1.00 75.12 H new ATOM 0 HD1 TRP A 115 29.374 -13.390 5.370 1.00 72.44 H new ATOM 0 HE1 TRP A 115 30.849 -14.577 7.131 1.00 41.21 H new ATOM 0 HE3 TRP A 115 25.858 -16.577 7.267 1.00 12.04 H new ATOM 0 HZ2 TRP A 115 30.512 -16.600 9.057 1.00 1.40 H new ATOM 0 HZ3 TRP A 115 26.511 -18.116 9.074 1.00 2.54 H new ATOM 0 HH2 TRP A 115 28.808 -18.123 9.960 1.00 2.12 H new ATOM 1898 N ALA A 116 24.534 -13.854 3.371 1.00 70.14 N ATOM 1899 CA ALA A 116 23.543 -13.108 2.605 1.00 32.22 C ATOM 1900 C ALA A 116 23.992 -11.668 2.381 1.00 21.32 C ATOM 1901 O ALA A 116 24.924 -11.177 3.018 1.00 20.15 O ATOM 1902 CB ALA A 116 22.197 -13.139 3.313 1.00 14.04 C ATOM 0 H ALA A 116 24.196 -14.211 4.265 1.00 70.14 H new ATOM 0 HA ALA A 116 23.440 -13.584 1.630 1.00 32.22 H new ATOM 0 HB1 ALA A 116 21.466 -12.578 2.730 1.00 14.04 H new ATOM 0 HB2 ALA A 116 21.864 -14.172 3.416 1.00 14.04 H new ATOM 0 HB3 ALA A 116 22.295 -12.689 4.301 1.00 14.04 H new ATOM 1908 N PRO A 117 23.316 -10.974 1.454 1.00 71.01 N ATOM 1909 CA PRO A 117 23.628 -9.580 1.125 1.00 65.25 C ATOM 1910 C PRO A 117 23.260 -8.622 2.252 1.00 43.42 C ATOM 1911 O PRO A 117 23.783 -7.510 2.329 1.00 33.14 O ATOM 1912 CB PRO A 117 22.769 -9.307 -0.112 1.00 51.31 C ATOM 1913 CG PRO A 117 21.635 -10.267 -0.005 1.00 53.40 C ATOM 1914 CD PRO A 117 22.194 -11.496 0.656 1.00 71.11 C ATOM 0 HA PRO A 117 24.695 -9.429 0.961 1.00 65.25 H new ATOM 0 HB2 PRO A 117 22.415 -8.276 -0.128 1.00 51.31 H new ATOM 0 HB3 PRO A 117 23.335 -9.464 -1.030 1.00 51.31 H new ATOM 0 HG2 PRO A 117 20.820 -9.844 0.583 1.00 53.40 H new ATOM 0 HG3 PRO A 117 21.229 -10.503 -0.989 1.00 53.40 H new ATOM 0 HD2 PRO A 117 21.450 -11.989 1.282 1.00 71.11 H new ATOM 0 HD3 PRO A 117 22.529 -12.229 -0.077 1.00 71.11 H new ATOM 1922 N ALA A 118 22.358 -9.060 3.124 1.00 42.41 N ATOM 1923 CA ALA A 118 21.922 -8.241 4.248 1.00 5.04 C ATOM 1924 C ALA A 118 22.794 -8.485 5.476 1.00 70.44 C ATOM 1925 O ALA A 118 22.949 -7.607 6.324 1.00 51.42 O ATOM 1926 CB ALA A 118 20.462 -8.522 4.571 1.00 3.22 C ATOM 0 H ALA A 118 21.915 -9.977 3.074 1.00 42.41 H new ATOM 0 HA ALA A 118 22.025 -7.194 3.964 1.00 5.04 H new ATOM 0 HB1 ALA A 118 20.150 -7.903 5.412 1.00 3.22 H new ATOM 0 HB2 ALA A 118 19.846 -8.290 3.702 1.00 3.22 H new ATOM 0 HB3 ALA A 118 20.343 -9.574 4.830 1.00 3.22 H new ATOM 1932 N ASP A 119 23.360 -9.684 5.564 1.00 1.11 N ATOM 1933 CA ASP A 119 24.217 -10.044 6.688 1.00 13.21 C ATOM 1934 C ASP A 119 25.682 -9.765 6.366 1.00 75.31 C ATOM 1935 O ASP A 119 26.496 -9.557 7.265 1.00 2.15 O ATOM 1936 CB ASP A 119 24.032 -11.519 7.046 1.00 72.32 C ATOM 1937 CG ASP A 119 22.916 -11.737 8.048 1.00 14.44 C ATOM 1938 OD1 ASP A 119 21.864 -12.286 7.657 1.00 44.22 O ATOM 1939 OD2 ASP A 119 23.094 -11.358 9.225 1.00 74.11 O ATOM 0 H ASP A 119 23.241 -10.423 4.871 1.00 1.11 H new ATOM 0 HA ASP A 119 23.929 -9.432 7.543 1.00 13.21 H new ATOM 0 HB2 ASP A 119 23.818 -12.086 6.140 1.00 72.32 H new ATOM 0 HB3 ASP A 119 24.964 -11.910 7.454 1.00 72.32 H new ATOM 1944 N ILE A 120 26.009 -9.765 5.078 1.00 11.41 N ATOM 1945 CA ILE A 120 27.375 -9.512 4.638 1.00 3.10 C ATOM 1946 C ILE A 120 27.974 -8.312 5.365 1.00 61.42 C ATOM 1947 O ILE A 120 29.026 -8.401 5.998 1.00 0.33 O ATOM 1948 CB ILE A 120 27.441 -9.263 3.120 1.00 53.14 C ATOM 1949 CG1 ILE A 120 27.636 -10.584 2.372 1.00 12.41 C ATOM 1950 CG2 ILE A 120 28.564 -8.291 2.790 1.00 14.32 C ATOM 1951 CD1 ILE A 120 27.009 -10.597 0.996 1.00 71.15 C ATOM 0 H ILE A 120 25.347 -9.937 4.322 1.00 11.41 H new ATOM 0 HA ILE A 120 27.953 -10.405 4.877 1.00 3.10 H new ATOM 0 HB ILE A 120 26.498 -8.821 2.799 1.00 53.14 H new ATOM 0 HG12 ILE A 120 28.703 -10.785 2.278 1.00 12.41 H new ATOM 0 HG13 ILE A 120 27.210 -11.394 2.964 1.00 12.41 H new ATOM 0 HG21 ILE A 120 28.597 -8.126 1.713 1.00 14.32 H new ATOM 0 HG22 ILE A 120 28.385 -7.343 3.297 1.00 14.32 H new ATOM 0 HG23 ILE A 120 29.515 -8.707 3.123 1.00 14.32 H new ATOM 0 HD11 ILE A 120 27.186 -11.564 0.524 1.00 71.15 H new ATOM 0 HD12 ILE A 120 25.936 -10.428 1.084 1.00 71.15 H new ATOM 0 HD13 ILE A 120 27.452 -9.809 0.387 1.00 71.15 H new ATOM 1963 N PRO A 121 27.289 -7.163 5.274 1.00 35.11 N ATOM 1964 CA PRO A 121 27.732 -5.924 5.919 1.00 44.32 C ATOM 1965 C PRO A 121 27.617 -5.987 7.438 1.00 54.20 C ATOM 1966 O PRO A 121 28.292 -5.247 8.153 1.00 40.14 O ATOM 1967 CB PRO A 121 26.779 -4.868 5.353 1.00 33.42 C ATOM 1968 CG PRO A 121 25.554 -5.628 4.977 1.00 54.11 C ATOM 1969 CD PRO A 121 26.027 -6.985 4.536 1.00 70.23 C ATOM 0 HA PRO A 121 28.784 -5.717 5.723 1.00 44.32 H new ATOM 0 HB2 PRO A 121 26.556 -4.098 6.092 1.00 33.42 H new ATOM 0 HB3 PRO A 121 27.213 -4.364 4.489 1.00 33.42 H new ATOM 0 HG2 PRO A 121 24.870 -5.709 5.822 1.00 54.11 H new ATOM 0 HG3 PRO A 121 25.013 -5.124 4.176 1.00 54.11 H new ATOM 0 HD2 PRO A 121 25.304 -7.762 4.783 1.00 70.23 H new ATOM 0 HD3 PRO A 121 26.183 -7.025 3.458 1.00 70.23 H new ATOM 1977 N ALA A 122 26.757 -6.875 7.925 1.00 74.42 N ATOM 1978 CA ALA A 122 26.555 -7.036 9.359 1.00 33.44 C ATOM 1979 C ALA A 122 27.660 -7.887 9.977 1.00 15.43 C ATOM 1980 O ALA A 122 28.003 -7.722 11.148 1.00 15.40 O ATOM 1981 CB ALA A 122 25.193 -7.657 9.634 1.00 13.53 C ATOM 0 H ALA A 122 26.189 -7.494 7.347 1.00 74.42 H new ATOM 0 HA ALA A 122 26.592 -6.048 9.819 1.00 33.44 H new ATOM 0 HB1 ALA A 122 25.056 -7.771 10.709 1.00 13.53 H new ATOM 0 HB2 ALA A 122 24.411 -7.011 9.235 1.00 13.53 H new ATOM 0 HB3 ALA A 122 25.135 -8.634 9.155 1.00 13.53 H new ATOM 1987 N VAL A 123 28.213 -8.798 9.183 1.00 2.51 N ATOM 1988 CA VAL A 123 29.280 -9.674 9.652 1.00 10.32 C ATOM 1989 C VAL A 123 30.641 -9.000 9.523 1.00 4.34 C ATOM 1990 O VAL A 123 31.522 -9.192 10.361 1.00 60.15 O ATOM 1991 CB VAL A 123 29.301 -11.001 8.871 1.00 55.12 C ATOM 1992 CG1 VAL A 123 30.561 -11.790 9.191 1.00 41.31 C ATOM 1993 CG2 VAL A 123 28.056 -11.820 9.180 1.00 44.12 C ATOM 0 H VAL A 123 27.940 -8.949 8.212 1.00 2.51 H new ATOM 0 HA VAL A 123 29.079 -9.883 10.703 1.00 10.32 H new ATOM 0 HB VAL A 123 29.305 -10.775 7.805 1.00 55.12 H new ATOM 0 HG11 VAL A 123 30.558 -12.724 8.630 1.00 41.31 H new ATOM 0 HG12 VAL A 123 31.437 -11.204 8.915 1.00 41.31 H new ATOM 0 HG13 VAL A 123 30.592 -12.008 10.258 1.00 41.31 H new ATOM 0 HG21 VAL A 123 28.087 -12.755 8.620 1.00 44.12 H new ATOM 0 HG22 VAL A 123 28.019 -12.038 10.247 1.00 44.12 H new ATOM 0 HG23 VAL A 123 27.169 -11.255 8.894 1.00 44.12 H new ATOM 2003 N ASN A 124 30.806 -8.208 8.469 1.00 62.04 N ATOM 2004 CA ASN A 124 32.061 -7.505 8.230 1.00 41.53 C ATOM 2005 C ASN A 124 32.427 -6.625 9.421 1.00 10.32 C ATOM 2006 O ASN A 124 33.579 -6.593 9.853 1.00 5.32 O ATOM 2007 CB ASN A 124 31.959 -6.651 6.964 1.00 74.32 C ATOM 2008 CG ASN A 124 32.332 -7.424 5.714 1.00 73.43 C ATOM 2009 OD1 ASN A 124 33.289 -8.199 5.712 1.00 52.32 O ATOM 2010 ND2 ASN A 124 31.575 -7.217 4.642 1.00 5.30 N ATOM 0 H ASN A 124 30.086 -8.037 7.767 1.00 62.04 H new ATOM 0 HA ASN A 124 32.845 -8.250 8.096 1.00 41.53 H new ATOM 0 HB2 ASN A 124 30.941 -6.274 6.864 1.00 74.32 H new ATOM 0 HB3 ASN A 124 32.612 -5.784 7.060 1.00 74.32 H new ATOM 0 HD21 ASN A 124 31.777 -7.710 3.772 1.00 5.30 H new ATOM 0 HD22 ASN A 124 30.792 -6.565 4.689 1.00 5.30 H new ATOM 2017 N LYS A 125 31.438 -5.912 9.949 1.00 13.20 N ATOM 2018 CA LYS A 125 31.653 -5.032 11.092 1.00 70.40 C ATOM 2019 C LYS A 125 32.352 -5.775 12.226 1.00 34.52 C ATOM 2020 O LYS A 125 33.146 -5.193 12.965 1.00 64.30 O ATOM 2021 CB LYS A 125 30.319 -4.466 11.584 1.00 22.33 C ATOM 2022 CG LYS A 125 29.450 -5.489 12.295 1.00 14.21 C ATOM 2023 CD LYS A 125 29.614 -5.408 13.804 1.00 70.34 C ATOM 2024 CE LYS A 125 28.884 -4.205 14.380 1.00 3.22 C ATOM 2025 NZ LYS A 125 29.830 -3.184 14.911 1.00 63.42 N ATOM 0 H LYS A 125 30.478 -5.926 9.603 1.00 13.20 H new ATOM 0 HA LYS A 125 32.293 -4.210 10.771 1.00 70.40 H new ATOM 0 HB2 LYS A 125 30.514 -3.634 12.261 1.00 22.33 H new ATOM 0 HB3 LYS A 125 29.769 -4.063 10.734 1.00 22.33 H new ATOM 0 HG2 LYS A 125 28.405 -5.325 12.032 1.00 14.21 H new ATOM 0 HG3 LYS A 125 29.711 -6.490 11.953 1.00 14.21 H new ATOM 0 HD2 LYS A 125 29.232 -6.320 14.262 1.00 70.34 H new ATOM 0 HD3 LYS A 125 30.673 -5.346 14.053 1.00 70.34 H new ATOM 0 HE2 LYS A 125 28.260 -3.755 13.608 1.00 3.22 H new ATOM 0 HE3 LYS A 125 28.218 -4.532 15.178 1.00 3.22 H new ATOM 0 HZ1 LYS A 125 29.421 -2.235 14.790 1.00 63.42 H new ATOM 0 HZ2 LYS A 125 30.000 -3.361 15.922 1.00 63.42 H new ATOM 0 HZ3 LYS A 125 30.730 -3.242 14.393 1.00 63.42 H new ATOM 2039 N ILE A 126 32.051 -7.063 12.357 1.00 22.12 N ATOM 2040 CA ILE A 126 32.653 -7.885 13.400 1.00 72.12 C ATOM 2041 C ILE A 126 34.173 -7.890 13.287 1.00 65.33 C ATOM 2042 O ILE A 126 34.880 -7.683 14.273 1.00 51.12 O ATOM 2043 CB ILE A 126 32.140 -9.336 13.339 1.00 52.00 C ATOM 2044 CG1 ILE A 126 30.614 -9.366 13.452 1.00 2.32 C ATOM 2045 CG2 ILE A 126 32.775 -10.169 14.443 1.00 54.15 C ATOM 2046 CD1 ILE A 126 29.999 -10.669 12.993 1.00 25.42 C ATOM 0 H ILE A 126 31.395 -7.559 11.754 1.00 22.12 H new ATOM 0 HA ILE A 126 32.364 -7.446 14.355 1.00 72.12 H new ATOM 0 HB ILE A 126 32.423 -9.766 12.378 1.00 52.00 H new ATOM 0 HG12 ILE A 126 30.331 -9.186 14.489 1.00 2.32 H new ATOM 0 HG13 ILE A 126 30.198 -8.550 12.862 1.00 2.32 H new ATOM 0 HG21 ILE A 126 32.403 -11.192 14.387 1.00 54.15 H new ATOM 0 HG22 ILE A 126 33.858 -10.170 14.321 1.00 54.15 H new ATOM 0 HG23 ILE A 126 32.520 -9.743 15.413 1.00 54.15 H new ATOM 0 HD11 ILE A 126 28.916 -10.618 13.101 1.00 25.42 H new ATOM 0 HD12 ILE A 126 30.251 -10.842 11.947 1.00 25.42 H new ATOM 0 HD13 ILE A 126 30.386 -11.488 13.600 1.00 25.42 H new ATOM 2058 N MET A 127 34.671 -8.127 12.077 1.00 34.12 N ATOM 2059 CA MET A 127 36.108 -8.156 11.834 1.00 23.05 C ATOM 2060 C MET A 127 36.777 -6.897 12.378 1.00 32.30 C ATOM 2061 O MET A 127 37.906 -6.943 12.868 1.00 33.01 O ATOM 2062 CB MET A 127 36.392 -8.292 10.337 1.00 33.23 C ATOM 2063 CG MET A 127 36.643 -9.724 9.894 1.00 33.40 C ATOM 2064 SD MET A 127 38.387 -10.060 9.585 1.00 70.23 S ATOM 2065 CE MET A 127 39.127 -9.416 11.083 1.00 12.13 C ATOM 0 H MET A 127 34.100 -8.302 11.250 1.00 34.12 H new ATOM 0 HA MET A 127 36.521 -9.020 12.354 1.00 23.05 H new ATOM 0 HB2 MET A 127 35.548 -7.890 9.777 1.00 33.23 H new ATOM 0 HB3 MET A 127 37.261 -7.684 10.084 1.00 33.23 H new ATOM 0 HG2 MET A 127 36.276 -10.407 10.660 1.00 33.40 H new ATOM 0 HG3 MET A 127 36.072 -9.925 8.988 1.00 33.40 H new ATOM 0 HE1 MET A 127 40.177 -9.707 11.125 1.00 12.13 H new ATOM 0 HE2 MET A 127 39.052 -8.329 11.088 1.00 12.13 H new ATOM 0 HE3 MET A 127 38.604 -9.820 11.950 1.00 12.13 H new ATOM 2075 N THR A 128 36.073 -5.773 12.288 1.00 2.22 N ATOM 2076 CA THR A 128 36.599 -4.502 12.769 1.00 1.43 C ATOM 2077 C THR A 128 37.102 -4.622 14.203 1.00 31.14 C ATOM 2078 O THR A 128 38.079 -3.978 14.584 1.00 52.02 O ATOM 2079 CB THR A 128 35.533 -3.391 12.703 1.00 65.44 C ATOM 2080 OG1 THR A 128 34.767 -3.520 11.500 1.00 41.42 O ATOM 2081 CG2 THR A 128 36.181 -2.016 12.753 1.00 42.10 C ATOM 0 H THR A 128 35.137 -5.717 11.886 1.00 2.22 H new ATOM 0 HA THR A 128 37.430 -4.237 12.116 1.00 1.43 H new ATOM 0 HB THR A 128 34.875 -3.496 13.566 1.00 65.44 H new ATOM 0 HG1 THR A 128 34.090 -2.812 11.465 1.00 41.42 H new ATOM 0 HG21 THR A 128 35.409 -1.248 12.705 1.00 42.10 H new ATOM 0 HG22 THR A 128 36.740 -1.911 13.683 1.00 42.10 H new ATOM 0 HG23 THR A 128 36.859 -1.902 11.907 1.00 42.10 H new ATOM 2089 N GLU A 129 36.428 -5.452 14.994 1.00 2.42 N ATOM 2090 CA GLU A 129 36.808 -5.655 16.387 1.00 22.41 C ATOM 2091 C GLU A 129 38.227 -6.207 16.489 1.00 63.22 C ATOM 2092 O GLU A 129 39.022 -5.758 17.313 1.00 21.05 O ATOM 2093 CB GLU A 129 35.828 -6.610 17.072 1.00 71.01 C ATOM 2094 CG GLU A 129 36.204 -6.943 18.506 1.00 14.31 C ATOM 2095 CD GLU A 129 35.080 -7.628 19.260 1.00 42.04 C ATOM 2096 OE1 GLU A 129 34.726 -8.767 18.891 1.00 52.15 O ATOM 2097 OE2 GLU A 129 34.556 -7.024 20.219 1.00 33.40 O ATOM 0 H GLU A 129 35.617 -5.994 14.694 1.00 2.42 H new ATOM 0 HA GLU A 129 36.775 -4.689 16.890 1.00 22.41 H new ATOM 0 HB2 GLU A 129 34.833 -6.166 17.060 1.00 71.01 H new ATOM 0 HB3 GLU A 129 35.772 -7.534 16.496 1.00 71.01 H new ATOM 0 HG2 GLU A 129 37.083 -7.588 18.507 1.00 14.31 H new ATOM 0 HG3 GLU A 129 36.481 -6.027 19.027 1.00 14.31 H new ATOM 2104 N GLY A 130 38.538 -7.185 15.643 1.00 32.54 N ATOM 2105 CA GLY A 130 39.860 -7.784 15.654 1.00 10.53 C ATOM 2106 C GLY A 130 40.885 -6.939 14.924 1.00 54.53 C ATOM 2107 O GLY A 130 40.767 -5.714 14.873 1.00 30.33 O ATOM 0 H GLY A 130 37.898 -7.573 14.950 1.00 32.54 H new ATOM 0 HA2 GLY A 130 40.181 -7.929 16.685 1.00 10.53 H new ATOM 0 HA3 GLY A 130 39.812 -8.771 15.193 1.00 10.53 H new TER 2111 GLY A 130