USER MOD reduce.3.24.130724 H: found=0, std=0, add=852, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 847 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 55 LYS NZ :NH3+ -106:sc= 0.481 (180deg=0.0739) USER MOD Set 1.2: A 67 TYR OH : rot 180:sc= 0 USER MOD Set 1.3: A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -118:sc= 0.418 (180deg=0.0134) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc=-0.00961 X(o=-0.0096,f=0) USER MOD Single : A 13 LYS NZ :NH3+ -151:sc= -0.156 (180deg=-1.34) USER MOD Single : A 14 CYS SG : rot 120:sc= 0.859 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 CYS SG : rot 180:sc= -2.04! USER MOD Single : A 18 HIS : no HE2:sc= -2.74! C(o=-2.7!,f=-3.2!) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ -106:sc= 1.07 (180deg=-0.965) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HE2:sc= 0.722 K(o=0.72,f=-3.7!) USER MOD Single : A 27 LYS NZ :NH3+ -146:sc= 0 (180deg=-0.255) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= -0.323 K(o=-0.32,f=-2.7!) USER MOD Single : A 33 HIS : no HD1:sc= -0.331 K(o=-0.33,f=-1) USER MOD Single : A 39 LYS NZ :NH3+ -112:sc= 0 (180deg=-0.531) USER MOD Single : A 40 THR OG1 : rot 119:sc= 0.714 USER MOD Single : A 42 GLN : amide:sc= 0.947 K(o=0.95,f=-0.083) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc=-0.00815 USER MOD Single : A 52 ASN : amide:sc= 0.061 K(o=0.061,f=-12!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc=-0.00154 X(o=-0.0015,f=0) USER MOD Single : A 58 THR OG1 : rot 40:sc= 0.516 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot -170:sc= 0 USER MOD Single : A 65 MET CE :methyl 137:sc= -0.0108 (180deg=-1.5) USER MOD Single : A 70 ASN : amide:sc= -0.349 X(o=-0.35,f=-0.58) USER MOD Single : A 72 LYS NZ :NH3+ -177:sc= -0.0117 (180deg=-0.0279) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 TYR OH : rot 180:sc= -0.344 USER MOD Single : A 79 LYS NZ :NH3+ -150:sc= -0.0548 (180deg=-0.228) USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.0125 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 179:sc= 1.2 (180deg=1.18) USER MOD Single : A 102 THR OG1 : rot -71:sc= 1.13 USER MOD Single : A 103 ASN : amide:sc= -0.399 K(o=-0.4,f=-2.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -5.440 -5.106 -15.228 1.00 10.00 N ATOM 2 CA GLY A 1 -4.075 -4.615 -15.243 1.00 10.00 C ATOM 3 C GLY A 1 -3.260 -5.902 -15.392 1.00 10.00 C ATOM 4 O GLY A 1 -3.822 -6.976 -15.170 1.00 10.00 O ATOM 0 H1 GLY A 1 -5.958 -4.716 -16.041 1.00 10.00 H new ATOM 0 H2 GLY A 1 -5.436 -6.144 -15.286 1.00 10.00 H new ATOM 0 H3 GLY A 1 -5.906 -4.810 -14.346 1.00 10.00 H new ATOM 0 HA2 GLY A 1 -3.901 -3.927 -16.070 1.00 10.00 H new ATOM 0 HA3 GLY A 1 -3.826 -4.081 -14.326 1.00 10.00 H new ATOM 10 N ASP A 2 -2.070 -5.846 -15.932 1.00 10.00 N ATOM 11 CA ASP A 2 -1.267 -7.039 -16.149 1.00 10.00 C ATOM 12 C ASP A 2 -0.798 -7.584 -14.803 1.00 10.00 C ATOM 13 O ASP A 2 -0.131 -6.891 -14.041 1.00 10.00 O ATOM 14 CB ASP A 2 -0.054 -6.761 -17.034 1.00 10.00 C ATOM 15 CG ASP A 2 0.519 -8.059 -17.569 1.00 10.00 C ATOM 16 OD1 ASP A 2 -0.262 -8.834 -18.155 1.00 10.00 O ATOM 17 OD2 ASP A 2 1.723 -8.285 -17.331 1.00 10.00 O ATOM 0 H ASP A 2 -1.625 -4.980 -16.235 1.00 10.00 H new ATOM 0 HA ASP A 2 -1.891 -7.771 -16.662 1.00 10.00 H new ATOM 0 HB2 ASP A 2 -0.341 -6.114 -17.863 1.00 10.00 H new ATOM 0 HB3 ASP A 2 0.706 -6.229 -16.463 1.00 10.00 H new ATOM 22 N VAL A 3 -1.146 -8.828 -14.485 1.00 10.00 N ATOM 23 CA VAL A 3 -0.721 -9.439 -13.234 1.00 10.00 C ATOM 24 C VAL A 3 0.782 -9.720 -13.283 1.00 10.00 C ATOM 25 O VAL A 3 1.473 -9.545 -12.281 1.00 10.00 O ATOM 26 CB VAL A 3 -1.567 -10.694 -12.963 1.00 10.00 C ATOM 27 CG1 VAL A 3 -1.047 -11.504 -11.768 1.00 10.00 C ATOM 28 CG2 VAL A 3 -3.016 -10.276 -12.678 1.00 10.00 C ATOM 0 H VAL A 3 -1.720 -9.429 -15.076 1.00 10.00 H new ATOM 0 HA VAL A 3 -0.885 -8.760 -12.397 1.00 10.00 H new ATOM 0 HB VAL A 3 -1.505 -11.325 -13.850 1.00 10.00 H new ATOM 0 HG11 VAL A 3 -1.679 -12.379 -11.619 1.00 10.00 H new ATOM 0 HG12 VAL A 3 -0.024 -11.824 -11.963 1.00 10.00 H new ATOM 0 HG13 VAL A 3 -1.068 -10.884 -10.872 1.00 10.00 H new ATOM 0 HG21 VAL A 3 -3.619 -11.163 -12.485 1.00 10.00 H new ATOM 0 HG22 VAL A 3 -3.041 -9.623 -11.805 1.00 10.00 H new ATOM 0 HG23 VAL A 3 -3.418 -9.744 -13.541 1.00 10.00 H new ATOM 38 N GLU A 4 1.292 -10.148 -14.440 1.00 10.00 N ATOM 39 CA GLU A 4 2.703 -10.451 -14.604 1.00 10.00 C ATOM 40 C GLU A 4 3.525 -9.191 -14.371 1.00 10.00 C ATOM 41 O GLU A 4 4.367 -9.142 -13.476 1.00 10.00 O ATOM 42 CB GLU A 4 2.960 -11.025 -16.000 1.00 10.00 C ATOM 43 CG GLU A 4 2.837 -12.551 -16.022 1.00 10.00 C ATOM 44 CD GLU A 4 4.166 -13.223 -15.690 1.00 10.00 C ATOM 45 OE1 GLU A 4 4.599 -13.099 -14.521 1.00 10.00 O ATOM 46 OE2 GLU A 4 4.741 -13.829 -16.618 1.00 10.00 O ATOM 0 H GLU A 4 0.735 -10.292 -15.283 1.00 10.00 H new ATOM 0 HA GLU A 4 3.002 -11.201 -13.872 1.00 10.00 H new ATOM 0 HB2 GLU A 4 2.251 -10.594 -16.706 1.00 10.00 H new ATOM 0 HB3 GLU A 4 3.957 -10.736 -16.333 1.00 10.00 H new ATOM 0 HG2 GLU A 4 2.079 -12.867 -15.305 1.00 10.00 H new ATOM 0 HG3 GLU A 4 2.499 -12.876 -17.006 1.00 10.00 H new ATOM 53 N LYS A 5 3.289 -8.148 -15.161 1.00 10.00 N ATOM 54 CA LYS A 5 3.993 -6.906 -14.960 1.00 10.00 C ATOM 55 C LYS A 5 3.692 -6.364 -13.570 1.00 10.00 C ATOM 56 O LYS A 5 4.637 -6.071 -12.849 1.00 10.00 O ATOM 57 CB LYS A 5 3.740 -5.922 -16.095 1.00 10.00 C ATOM 58 CG LYS A 5 4.438 -6.365 -17.389 1.00 10.00 C ATOM 59 CD LYS A 5 4.982 -5.165 -18.181 1.00 10.00 C ATOM 60 CE LYS A 5 6.512 -5.255 -18.270 1.00 10.00 C ATOM 61 NZ LYS A 5 7.103 -4.049 -18.880 1.00 10.00 N ATOM 0 H LYS A 5 2.623 -8.146 -15.934 1.00 10.00 H new ATOM 0 HA LYS A 5 5.068 -7.083 -14.996 1.00 10.00 H new ATOM 0 HB2 LYS A 5 2.668 -5.835 -16.270 1.00 10.00 H new ATOM 0 HB3 LYS A 5 4.098 -4.933 -15.807 1.00 10.00 H new ATOM 0 HG2 LYS A 5 5.257 -7.043 -17.147 1.00 10.00 H new ATOM 0 HG3 LYS A 5 3.736 -6.922 -18.009 1.00 10.00 H new ATOM 0 HD2 LYS A 5 4.550 -5.151 -19.182 1.00 10.00 H new ATOM 0 HD3 LYS A 5 4.690 -4.234 -17.695 1.00 10.00 H new ATOM 0 HE2 LYS A 5 6.925 -5.396 -17.271 1.00 10.00 H new ATOM 0 HE3 LYS A 5 6.790 -6.131 -18.856 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 8.137 -4.152 -18.921 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 6.729 -3.928 -19.843 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 6.860 -3.216 -18.307 1.00 10.00 H new ATOM 75 N GLY A 6 2.431 -6.318 -13.139 1.00 10.00 N ATOM 76 CA GLY A 6 2.055 -5.891 -11.802 1.00 10.00 C ATOM 77 C GLY A 6 2.899 -6.546 -10.703 1.00 10.00 C ATOM 78 O GLY A 6 3.312 -5.883 -9.745 1.00 10.00 O ATOM 0 H GLY A 6 1.636 -6.581 -13.721 1.00 10.00 H new ATOM 0 HA2 GLY A 6 2.154 -4.808 -11.731 1.00 10.00 H new ATOM 0 HA3 GLY A 6 1.004 -6.126 -11.634 1.00 10.00 H new ATOM 82 N LYS A 7 3.162 -7.851 -10.846 1.00 10.00 N ATOM 83 CA LYS A 7 3.975 -8.626 -9.935 1.00 10.00 C ATOM 84 C LYS A 7 5.333 -7.963 -9.875 1.00 10.00 C ATOM 85 O LYS A 7 5.794 -7.548 -8.812 1.00 10.00 O ATOM 86 CB LYS A 7 4.022 -10.091 -10.408 1.00 10.00 C ATOM 87 CG LYS A 7 4.846 -11.016 -9.509 1.00 10.00 C ATOM 88 CD LYS A 7 4.881 -12.429 -10.116 1.00 10.00 C ATOM 89 CE LYS A 7 4.592 -13.491 -9.046 1.00 10.00 C ATOM 90 NZ LYS A 7 4.651 -14.863 -9.592 1.00 10.00 N ATOM 0 H LYS A 7 2.799 -8.401 -11.625 1.00 10.00 H new ATOM 0 HA LYS A 7 3.563 -8.652 -8.926 1.00 10.00 H new ATOM 0 HB2 LYS A 7 3.003 -10.474 -10.468 1.00 10.00 H new ATOM 0 HB3 LYS A 7 4.434 -10.122 -11.417 1.00 10.00 H new ATOM 0 HG2 LYS A 7 5.860 -10.629 -9.404 1.00 10.00 H new ATOM 0 HG3 LYS A 7 4.412 -11.049 -8.510 1.00 10.00 H new ATOM 0 HD2 LYS A 7 4.145 -12.504 -10.917 1.00 10.00 H new ATOM 0 HD3 LYS A 7 5.858 -12.613 -10.563 1.00 10.00 H new ATOM 0 HE2 LYS A 7 5.314 -13.393 -8.235 1.00 10.00 H new ATOM 0 HE3 LYS A 7 3.605 -13.314 -8.618 1.00 10.00 H new ATOM 0 HZ1 LYS A 7 4.450 -15.547 -8.835 1.00 10.00 H new ATOM 0 HZ2 LYS A 7 3.945 -14.966 -10.349 1.00 10.00 H new ATOM 0 HZ3 LYS A 7 5.600 -15.043 -9.977 1.00 10.00 H new ATOM 104 N LYS A 8 5.973 -7.846 -11.036 1.00 10.00 N ATOM 105 CA LYS A 8 7.324 -7.337 -11.060 1.00 10.00 C ATOM 106 C LYS A 8 7.360 -5.880 -10.603 1.00 10.00 C ATOM 107 O LYS A 8 8.248 -5.498 -9.856 1.00 10.00 O ATOM 108 CB LYS A 8 8.014 -7.578 -12.406 1.00 10.00 C ATOM 109 CG LYS A 8 7.743 -8.974 -12.995 1.00 10.00 C ATOM 110 CD LYS A 8 7.854 -10.147 -12.004 1.00 10.00 C ATOM 111 CE LYS A 8 9.308 -10.485 -11.637 1.00 10.00 C ATOM 112 NZ LYS A 8 9.768 -11.743 -12.264 1.00 10.00 N ATOM 0 H LYS A 8 5.583 -8.092 -11.946 1.00 10.00 H new ATOM 0 HA LYS A 8 7.914 -7.905 -10.340 1.00 10.00 H new ATOM 0 HB2 LYS A 8 7.680 -6.822 -13.117 1.00 10.00 H new ATOM 0 HB3 LYS A 8 9.089 -7.447 -12.283 1.00 10.00 H new ATOM 0 HG2 LYS A 8 6.742 -8.979 -13.425 1.00 10.00 H new ATOM 0 HG3 LYS A 8 8.442 -9.146 -13.813 1.00 10.00 H new ATOM 0 HD2 LYS A 8 7.303 -9.902 -11.096 1.00 10.00 H new ATOM 0 HD3 LYS A 8 7.380 -11.028 -12.437 1.00 10.00 H new ATOM 0 HE2 LYS A 8 9.958 -9.668 -11.949 1.00 10.00 H new ATOM 0 HE3 LYS A 8 9.397 -10.568 -10.554 1.00 10.00 H new ATOM 0 HZ1 LYS A 8 10.753 -11.929 -11.987 1.00 10.00 H new ATOM 0 HZ2 LYS A 8 9.165 -12.529 -11.947 1.00 10.00 H new ATOM 0 HZ3 LYS A 8 9.709 -11.657 -13.299 1.00 10.00 H new ATOM 126 N ILE A 9 6.380 -5.068 -10.995 1.00 10.00 N ATOM 127 CA ILE A 9 6.233 -3.698 -10.553 1.00 10.00 C ATOM 128 C ILE A 9 6.312 -3.650 -9.029 1.00 10.00 C ATOM 129 O ILE A 9 7.232 -3.032 -8.499 1.00 10.00 O ATOM 130 CB ILE A 9 4.927 -3.113 -11.125 1.00 10.00 C ATOM 131 CG1 ILE A 9 5.062 -2.856 -12.635 1.00 10.00 C ATOM 132 CG2 ILE A 9 4.504 -1.817 -10.434 1.00 10.00 C ATOM 133 CD1 ILE A 9 3.764 -2.312 -13.236 1.00 10.00 C ATOM 0 H ILE A 9 5.651 -5.360 -11.646 1.00 10.00 H new ATOM 0 HA ILE A 9 7.043 -3.073 -10.928 1.00 10.00 H new ATOM 0 HB ILE A 9 4.154 -3.859 -10.939 1.00 10.00 H new ATOM 0 HG12 ILE A 9 5.870 -2.146 -12.812 1.00 10.00 H new ATOM 0 HG13 ILE A 9 5.335 -3.783 -13.139 1.00 10.00 H new ATOM 0 HG21 ILE A 9 3.578 -1.453 -10.879 1.00 10.00 H new ATOM 0 HG22 ILE A 9 4.346 -2.006 -9.372 1.00 10.00 H new ATOM 0 HG23 ILE A 9 5.286 -1.067 -10.557 1.00 10.00 H new ATOM 0 HD11 ILE A 9 3.900 -2.143 -14.304 1.00 10.00 H new ATOM 0 HD12 ILE A 9 2.961 -3.033 -13.082 1.00 10.00 H new ATOM 0 HD13 ILE A 9 3.505 -1.371 -12.751 1.00 10.00 H new ATOM 145 N PHE A 10 5.376 -4.292 -8.325 1.00 10.00 N ATOM 146 CA PHE A 10 5.389 -4.299 -6.864 1.00 10.00 C ATOM 147 C PHE A 10 6.786 -4.679 -6.339 1.00 10.00 C ATOM 148 O PHE A 10 7.317 -4.048 -5.422 1.00 10.00 O ATOM 149 CB PHE A 10 4.290 -5.243 -6.363 1.00 10.00 C ATOM 150 CG PHE A 10 4.269 -5.435 -4.860 1.00 10.00 C ATOM 151 CD1 PHE A 10 5.071 -6.434 -4.279 1.00 10.00 C ATOM 152 CD2 PHE A 10 3.500 -4.592 -4.036 1.00 10.00 C ATOM 153 CE1 PHE A 10 5.096 -6.596 -2.886 1.00 10.00 C ATOM 154 CE2 PHE A 10 3.465 -4.804 -2.647 1.00 10.00 C ATOM 155 CZ PHE A 10 4.239 -5.830 -2.080 1.00 10.00 C ATOM 0 H PHE A 10 4.604 -4.811 -8.743 1.00 10.00 H new ATOM 0 HA PHE A 10 5.178 -3.302 -6.478 1.00 10.00 H new ATOM 0 HB2 PHE A 10 3.322 -4.856 -6.681 1.00 10.00 H new ATOM 0 HB3 PHE A 10 4.417 -6.215 -6.840 1.00 10.00 H new ATOM 0 HD1 PHE A 10 5.669 -7.078 -4.907 1.00 10.00 H new ATOM 0 HD2 PHE A 10 2.936 -3.781 -4.472 1.00 10.00 H new ATOM 0 HE1 PHE A 10 5.772 -7.307 -2.435 1.00 10.00 H new ATOM 0 HE2 PHE A 10 2.846 -4.181 -2.019 1.00 10.00 H new ATOM 0 HZ PHE A 10 4.175 -6.030 -1.021 1.00 10.00 H new ATOM 165 N VAL A 11 7.401 -5.679 -6.975 1.00 10.00 N ATOM 166 CA VAL A 11 8.705 -6.222 -6.607 1.00 10.00 C ATOM 167 C VAL A 11 9.870 -5.284 -6.966 1.00 10.00 C ATOM 168 O VAL A 11 10.975 -5.435 -6.451 1.00 10.00 O ATOM 169 CB VAL A 11 8.861 -7.605 -7.264 1.00 10.00 C ATOM 170 CG1 VAL A 11 10.217 -8.272 -7.007 1.00 10.00 C ATOM 171 CG2 VAL A 11 7.771 -8.563 -6.775 1.00 10.00 C ATOM 0 H VAL A 11 6.991 -6.145 -7.784 1.00 10.00 H new ATOM 0 HA VAL A 11 8.746 -6.321 -5.522 1.00 10.00 H new ATOM 0 HB VAL A 11 8.777 -7.415 -8.334 1.00 10.00 H new ATOM 0 HG11 VAL A 11 10.245 -9.242 -7.504 1.00 10.00 H new ATOM 0 HG12 VAL A 11 11.014 -7.640 -7.399 1.00 10.00 H new ATOM 0 HG13 VAL A 11 10.357 -8.409 -5.935 1.00 10.00 H new ATOM 0 HG21 VAL A 11 7.900 -9.535 -7.252 1.00 10.00 H new ATOM 0 HG22 VAL A 11 7.845 -8.677 -5.693 1.00 10.00 H new ATOM 0 HG23 VAL A 11 6.791 -8.160 -7.031 1.00 10.00 H new ATOM 181 N GLN A 12 9.654 -4.338 -7.876 1.00 10.00 N ATOM 182 CA GLN A 12 10.661 -3.395 -8.350 1.00 10.00 C ATOM 183 C GLN A 12 10.428 -1.998 -7.783 1.00 10.00 C ATOM 184 O GLN A 12 11.215 -1.094 -8.053 1.00 10.00 O ATOM 185 CB GLN A 12 10.619 -3.361 -9.877 1.00 10.00 C ATOM 186 CG GLN A 12 11.060 -4.716 -10.453 1.00 10.00 C ATOM 187 CD GLN A 12 12.570 -4.903 -10.409 1.00 10.00 C ATOM 188 OE1 GLN A 12 13.278 -4.477 -11.314 1.00 10.00 O ATOM 189 NE2 GLN A 12 13.073 -5.557 -9.365 1.00 10.00 N ATOM 0 H GLN A 12 8.744 -4.203 -8.317 1.00 10.00 H new ATOM 0 HA GLN A 12 11.643 -3.724 -8.009 1.00 10.00 H new ATOM 0 HB2 GLN A 12 9.610 -3.126 -10.215 1.00 10.00 H new ATOM 0 HB3 GLN A 12 11.272 -2.571 -10.248 1.00 10.00 H new ATOM 0 HG2 GLN A 12 10.581 -5.519 -9.893 1.00 10.00 H new ATOM 0 HG3 GLN A 12 10.717 -4.798 -11.484 1.00 10.00 H new ATOM 0 HE21 GLN A 12 12.453 -5.898 -8.630 1.00 10.00 H new ATOM 0 HE22 GLN A 12 14.078 -5.718 -9.300 1.00 10.00 H new ATOM 198 N LYS A 13 9.326 -1.802 -7.056 1.00 10.00 N ATOM 199 CA LYS A 13 8.996 -0.534 -6.437 1.00 10.00 C ATOM 200 C LYS A 13 9.083 -0.662 -4.924 1.00 10.00 C ATOM 201 O LYS A 13 9.736 0.151 -4.274 1.00 10.00 O ATOM 202 CB LYS A 13 7.593 -0.075 -6.838 1.00 10.00 C ATOM 203 CG LYS A 13 7.603 0.716 -8.151 1.00 10.00 C ATOM 204 CD LYS A 13 7.685 -0.200 -9.372 1.00 10.00 C ATOM 205 CE LYS A 13 7.852 0.585 -10.677 1.00 10.00 C ATOM 206 NZ LYS A 13 7.449 -0.218 -11.849 1.00 10.00 N ATOM 0 H LYS A 13 8.635 -2.533 -6.884 1.00 10.00 H new ATOM 0 HA LYS A 13 9.712 0.212 -6.783 1.00 10.00 H new ATOM 0 HB2 LYS A 13 6.943 -0.944 -6.943 1.00 10.00 H new ATOM 0 HB3 LYS A 13 7.173 0.544 -6.045 1.00 10.00 H new ATOM 0 HG2 LYS A 13 6.701 1.324 -8.214 1.00 10.00 H new ATOM 0 HG3 LYS A 13 8.451 1.401 -8.155 1.00 10.00 H new ATOM 0 HD2 LYS A 13 8.524 -0.886 -9.253 1.00 10.00 H new ATOM 0 HD3 LYS A 13 6.782 -0.808 -9.429 1.00 10.00 H new ATOM 0 HE2 LYS A 13 7.253 1.494 -10.635 1.00 10.00 H new ATOM 0 HE3 LYS A 13 8.892 0.893 -10.786 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 7.992 0.087 -12.682 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 7.637 -1.224 -11.662 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 6.434 -0.084 -12.029 1.00 10.00 H new ATOM 220 N CYS A 14 8.370 -1.645 -4.371 1.00 10.00 N ATOM 221 CA CYS A 14 8.218 -1.801 -2.940 1.00 10.00 C ATOM 222 C CYS A 14 9.096 -2.977 -2.479 1.00 10.00 C ATOM 223 O CYS A 14 10.188 -2.737 -1.974 1.00 10.00 O ATOM 224 CB CYS A 14 6.745 -1.850 -2.543 1.00 10.00 C ATOM 225 SG CYS A 14 5.527 -1.653 -3.913 1.00 10.00 S ATOM 0 H CYS A 14 7.882 -2.356 -4.916 1.00 10.00 H new ATOM 0 HA CYS A 14 8.584 -0.929 -2.397 1.00 10.00 H new ATOM 0 HB2 CYS A 14 6.555 -2.803 -2.049 1.00 10.00 H new ATOM 0 HB3 CYS A 14 6.562 -1.067 -1.807 1.00 10.00 H new ATOM 0 HG CYS A 14 4.776 -2.712 -3.982 1.00 10.00 H new ATOM 230 N ALA A 15 8.659 -4.227 -2.682 1.00 10.00 N ATOM 231 CA ALA A 15 9.340 -5.468 -2.276 1.00 10.00 C ATOM 232 C ALA A 15 10.033 -5.433 -0.907 1.00 10.00 C ATOM 233 O ALA A 15 9.505 -5.943 0.075 1.00 10.00 O ATOM 234 CB ALA A 15 10.318 -5.956 -3.349 1.00 10.00 C ATOM 0 H ALA A 15 7.776 -4.412 -3.158 1.00 10.00 H new ATOM 0 HA ALA A 15 8.522 -6.180 -2.166 1.00 10.00 H new ATOM 0 HB1 ALA A 15 10.800 -6.874 -3.012 1.00 10.00 H new ATOM 0 HB2 ALA A 15 9.776 -6.150 -4.274 1.00 10.00 H new ATOM 0 HB3 ALA A 15 11.075 -5.192 -3.526 1.00 10.00 H new ATOM 240 N GLN A 16 11.243 -4.874 -0.817 1.00 10.00 N ATOM 241 CA GLN A 16 12.048 -4.841 0.397 1.00 10.00 C ATOM 242 C GLN A 16 11.531 -3.757 1.357 1.00 10.00 C ATOM 243 O GLN A 16 12.289 -2.944 1.888 1.00 10.00 O ATOM 244 CB GLN A 16 13.524 -4.672 0.006 1.00 10.00 C ATOM 245 CG GLN A 16 14.143 -6.018 -0.393 1.00 10.00 C ATOM 246 CD GLN A 16 15.561 -5.836 -0.928 1.00 10.00 C ATOM 247 OE1 GLN A 16 15.758 -5.216 -1.966 1.00 10.00 O ATOM 248 NE2 GLN A 16 16.565 -6.364 -0.233 1.00 10.00 N ATOM 0 H GLN A 16 11.697 -4.421 -1.610 1.00 10.00 H new ATOM 0 HA GLN A 16 11.963 -5.779 0.946 1.00 10.00 H new ATOM 0 HB2 GLN A 16 13.606 -3.969 -0.823 1.00 10.00 H new ATOM 0 HB3 GLN A 16 14.079 -4.245 0.842 1.00 10.00 H new ATOM 0 HG2 GLN A 16 14.160 -6.684 0.470 1.00 10.00 H new ATOM 0 HG3 GLN A 16 13.523 -6.496 -1.152 1.00 10.00 H new ATOM 0 HE21 GLN A 16 16.375 -6.876 0.629 1.00 10.00 H new ATOM 0 HE22 GLN A 16 17.525 -6.257 -0.562 1.00 10.00 H new ATOM 257 N CYS A 17 10.228 -3.815 1.635 1.00 10.00 N ATOM 258 CA CYS A 17 9.473 -2.952 2.527 1.00 10.00 C ATOM 259 C CYS A 17 8.066 -3.536 2.700 1.00 10.00 C ATOM 260 O CYS A 17 7.561 -3.586 3.820 1.00 10.00 O ATOM 261 CB CYS A 17 9.432 -1.514 2.041 1.00 10.00 C ATOM 262 SG CYS A 17 8.377 -0.609 3.211 1.00 10.00 S ATOM 0 H CYS A 17 9.633 -4.523 1.206 1.00 10.00 H new ATOM 0 HA CYS A 17 9.974 -2.919 3.495 1.00 10.00 H new ATOM 0 HB2 CYS A 17 10.434 -1.086 2.010 1.00 10.00 H new ATOM 0 HB3 CYS A 17 9.029 -1.457 1.030 1.00 10.00 H new ATOM 0 HG CYS A 17 8.301 0.638 2.852 1.00 10.00 H new ATOM 267 N HIS A 18 7.442 -3.985 1.603 1.00 10.00 N ATOM 268 CA HIS A 18 6.085 -4.506 1.605 1.00 10.00 C ATOM 269 C HIS A 18 6.048 -5.900 1.035 1.00 10.00 C ATOM 270 O HIS A 18 6.791 -6.235 0.120 1.00 10.00 O ATOM 271 CB HIS A 18 5.193 -3.670 0.705 1.00 10.00 C ATOM 272 CG HIS A 18 4.460 -2.584 1.403 1.00 10.00 C ATOM 273 ND1 HIS A 18 3.745 -2.635 2.575 1.00 10.00 N ATOM 274 CD2 HIS A 18 4.220 -1.393 0.820 1.00 10.00 C ATOM 275 CE1 HIS A 18 3.100 -1.455 2.691 1.00 10.00 C ATOM 276 NE2 HIS A 18 3.392 -0.646 1.645 1.00 10.00 N ATOM 0 H HIS A 18 7.879 -3.993 0.681 1.00 10.00 H new ATOM 0 HA HIS A 18 5.743 -4.489 2.640 1.00 10.00 H new ATOM 0 HB2 HIS A 18 5.804 -3.231 -0.084 1.00 10.00 H new ATOM 0 HB3 HIS A 18 4.470 -4.326 0.220 1.00 10.00 H new ATOM 0 HD1 HIS A 18 3.709 -3.415 3.231 1.00 10.00 H new ATOM 0 HD2 HIS A 18 4.609 -1.072 -0.135 1.00 10.00 H new ATOM 0 HE1 HIS A 18 2.442 -1.192 3.506 1.00 10.00 H new ATOM 284 N THR A 19 5.097 -6.676 1.535 1.00 10.00 N ATOM 285 CA THR A 19 4.949 -8.057 1.171 1.00 10.00 C ATOM 286 C THR A 19 3.463 -8.367 1.039 1.00 10.00 C ATOM 287 O THR A 19 2.695 -7.961 1.902 1.00 10.00 O ATOM 288 CB THR A 19 5.607 -8.876 2.276 1.00 10.00 C ATOM 289 OG1 THR A 19 6.986 -8.591 2.381 1.00 10.00 O ATOM 290 CG2 THR A 19 5.415 -10.324 1.895 1.00 10.00 C ATOM 0 H THR A 19 4.405 -6.351 2.210 1.00 10.00 H new ATOM 0 HA THR A 19 5.420 -8.294 0.217 1.00 10.00 H new ATOM 0 HB THR A 19 5.160 -8.640 3.242 1.00 10.00 H new ATOM 0 HG1 THR A 19 7.378 -9.131 3.099 1.00 10.00 H new ATOM 0 HG21 THR A 19 5.868 -10.963 2.653 1.00 10.00 H new ATOM 0 HG22 THR A 19 4.350 -10.544 1.825 1.00 10.00 H new ATOM 0 HG23 THR A 19 5.889 -10.513 0.932 1.00 10.00 H new ATOM 298 N VAL A 20 3.064 -9.060 -0.030 1.00 10.00 N ATOM 299 CA VAL A 20 1.683 -9.408 -0.340 1.00 10.00 C ATOM 300 C VAL A 20 1.596 -10.926 -0.510 1.00 10.00 C ATOM 301 O VAL A 20 1.155 -11.423 -1.541 1.00 10.00 O ATOM 302 CB VAL A 20 1.228 -8.642 -1.597 1.00 10.00 C ATOM 303 CG1 VAL A 20 1.052 -7.148 -1.296 1.00 10.00 C ATOM 304 CG2 VAL A 20 2.207 -8.803 -2.769 1.00 10.00 C ATOM 0 H VAL A 20 3.723 -9.406 -0.728 1.00 10.00 H new ATOM 0 HA VAL A 20 1.010 -9.118 0.467 1.00 10.00 H new ATOM 0 HB VAL A 20 0.272 -9.077 -1.888 1.00 10.00 H new ATOM 0 HG11 VAL A 20 0.731 -6.630 -2.200 1.00 10.00 H new ATOM 0 HG12 VAL A 20 0.300 -7.020 -0.517 1.00 10.00 H new ATOM 0 HG13 VAL A 20 2.000 -6.731 -0.957 1.00 10.00 H new ATOM 0 HG21 VAL A 20 1.840 -8.244 -3.629 1.00 10.00 H new ATOM 0 HG22 VAL A 20 3.186 -8.422 -2.480 1.00 10.00 H new ATOM 0 HG23 VAL A 20 2.291 -9.858 -3.031 1.00 10.00 H new ATOM 314 N GLU A 21 2.051 -11.661 0.506 1.00 10.00 N ATOM 315 CA GLU A 21 2.043 -13.114 0.539 1.00 10.00 C ATOM 316 C GLU A 21 1.868 -13.579 1.981 1.00 10.00 C ATOM 317 O GLU A 21 2.037 -12.803 2.924 1.00 10.00 O ATOM 318 CB GLU A 21 3.344 -13.683 -0.042 1.00 10.00 C ATOM 319 CG GLU A 21 4.592 -13.068 0.589 1.00 10.00 C ATOM 320 CD GLU A 21 5.666 -14.102 0.879 1.00 10.00 C ATOM 321 OE1 GLU A 21 6.024 -14.832 -0.068 1.00 10.00 O ATOM 322 OE2 GLU A 21 6.076 -14.155 2.057 1.00 10.00 O ATOM 0 H GLU A 21 2.445 -11.245 1.350 1.00 10.00 H new ATOM 0 HA GLU A 21 1.215 -13.477 -0.070 1.00 10.00 H new ATOM 0 HB2 GLU A 21 3.361 -14.763 0.107 1.00 10.00 H new ATOM 0 HB3 GLU A 21 3.363 -13.509 -1.118 1.00 10.00 H new ATOM 0 HG2 GLU A 21 4.996 -12.307 -0.079 1.00 10.00 H new ATOM 0 HG3 GLU A 21 4.316 -12.565 1.516 1.00 10.00 H new ATOM 329 N LYS A 22 1.584 -14.869 2.150 1.00 10.00 N ATOM 330 CA LYS A 22 1.316 -15.491 3.438 1.00 10.00 C ATOM 331 C LYS A 22 2.611 -15.777 4.219 1.00 10.00 C ATOM 332 O LYS A 22 2.706 -16.787 4.912 1.00 10.00 O ATOM 333 CB LYS A 22 0.462 -16.756 3.227 1.00 10.00 C ATOM 334 CG LYS A 22 1.130 -17.820 2.337 1.00 10.00 C ATOM 335 CD LYS A 22 0.815 -17.660 0.835 1.00 10.00 C ATOM 336 CE LYS A 22 0.048 -18.858 0.244 1.00 10.00 C ATOM 337 NZ LYS A 22 -0.941 -18.440 -0.776 1.00 10.00 N ATOM 0 H LYS A 22 1.533 -15.525 1.371 1.00 10.00 H new ATOM 0 HA LYS A 22 0.750 -14.795 4.056 1.00 10.00 H new ATOM 0 HB2 LYS A 22 0.239 -17.197 4.198 1.00 10.00 H new ATOM 0 HB3 LYS A 22 -0.490 -16.469 2.781 1.00 10.00 H new ATOM 0 HG2 LYS A 22 2.210 -17.774 2.479 1.00 10.00 H new ATOM 0 HG3 LYS A 22 0.807 -18.809 2.663 1.00 10.00 H new ATOM 0 HD2 LYS A 22 0.228 -16.753 0.688 1.00 10.00 H new ATOM 0 HD3 LYS A 22 1.748 -17.528 0.287 1.00 10.00 H new ATOM 0 HE2 LYS A 22 0.756 -19.556 -0.203 1.00 10.00 H new ATOM 0 HE3 LYS A 22 -0.463 -19.392 1.046 1.00 10.00 H new ATOM 0 HZ1 LYS A 22 -1.900 -18.512 -0.380 1.00 10.00 H new ATOM 0 HZ2 LYS A 22 -0.755 -17.456 -1.057 1.00 10.00 H new ATOM 0 HZ3 LYS A 22 -0.863 -19.058 -1.609 1.00 10.00 H new ATOM 351 N GLY A 23 3.610 -14.902 4.105 1.00 10.00 N ATOM 352 CA GLY A 23 4.887 -15.014 4.799 1.00 10.00 C ATOM 353 C GLY A 23 5.534 -13.644 4.978 1.00 10.00 C ATOM 354 O GLY A 23 6.740 -13.539 5.208 1.00 10.00 O ATOM 0 H GLY A 23 3.549 -14.075 3.511 1.00 10.00 H new ATOM 0 HA2 GLY A 23 4.736 -15.479 5.773 1.00 10.00 H new ATOM 0 HA3 GLY A 23 5.555 -15.665 4.235 1.00 10.00 H new ATOM 358 N GLY A 24 4.725 -12.581 4.916 1.00 10.00 N ATOM 359 CA GLY A 24 5.238 -11.235 4.969 1.00 10.00 C ATOM 360 C GLY A 24 5.750 -10.915 6.363 1.00 10.00 C ATOM 361 O GLY A 24 5.004 -10.990 7.337 1.00 10.00 O ATOM 0 H GLY A 24 3.711 -12.642 4.829 1.00 10.00 H new ATOM 0 HA2 GLY A 24 6.043 -11.118 4.244 1.00 10.00 H new ATOM 0 HA3 GLY A 24 4.454 -10.530 4.692 1.00 10.00 H new ATOM 365 N LYS A 25 7.035 -10.574 6.448 1.00 10.00 N ATOM 366 CA LYS A 25 7.670 -10.210 7.697 1.00 10.00 C ATOM 367 C LYS A 25 7.339 -8.753 8.028 1.00 10.00 C ATOM 368 O LYS A 25 6.614 -8.083 7.294 1.00 10.00 O ATOM 369 CB LYS A 25 9.181 -10.470 7.597 1.00 10.00 C ATOM 370 CG LYS A 25 9.452 -11.895 7.085 1.00 10.00 C ATOM 371 CD LYS A 25 10.925 -12.279 7.280 1.00 10.00 C ATOM 372 CE LYS A 25 11.091 -13.798 7.115 1.00 10.00 C ATOM 373 NZ LYS A 25 12.489 -14.235 7.312 1.00 10.00 N ATOM 0 H LYS A 25 7.661 -10.545 5.643 1.00 10.00 H new ATOM 0 HA LYS A 25 7.292 -10.822 8.516 1.00 10.00 H new ATOM 0 HB2 LYS A 25 9.637 -9.743 6.925 1.00 10.00 H new ATOM 0 HB3 LYS A 25 9.644 -10.335 8.574 1.00 10.00 H new ATOM 0 HG2 LYS A 25 8.815 -12.603 7.615 1.00 10.00 H new ATOM 0 HG3 LYS A 25 9.192 -11.961 6.029 1.00 10.00 H new ATOM 0 HD2 LYS A 25 11.547 -11.755 6.554 1.00 10.00 H new ATOM 0 HD3 LYS A 25 11.263 -11.972 8.270 1.00 10.00 H new ATOM 0 HE2 LYS A 25 10.448 -14.311 7.830 1.00 10.00 H new ATOM 0 HE3 LYS A 25 10.758 -14.091 6.119 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 12.551 -15.266 7.191 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 13.101 -13.767 6.613 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 12.801 -13.980 8.271 1.00 10.00 H new ATOM 387 N HIS A 26 7.897 -8.262 9.132 1.00 10.00 N ATOM 388 CA HIS A 26 7.760 -6.888 9.579 1.00 10.00 C ATOM 389 C HIS A 26 9.056 -6.154 9.247 1.00 10.00 C ATOM 390 O HIS A 26 10.138 -6.639 9.587 1.00 10.00 O ATOM 391 CB HIS A 26 7.430 -6.865 11.081 1.00 10.00 C ATOM 392 CG HIS A 26 8.227 -7.828 11.933 1.00 10.00 C ATOM 393 ND1 HIS A 26 9.559 -8.144 11.780 1.00 10.00 N ATOM 394 CD2 HIS A 26 7.730 -8.626 12.929 1.00 10.00 C ATOM 395 CE1 HIS A 26 9.853 -9.114 12.662 1.00 10.00 C ATOM 396 NE2 HIS A 26 8.770 -9.443 13.382 1.00 10.00 N ATOM 0 H HIS A 26 8.472 -8.829 9.754 1.00 10.00 H new ATOM 0 HA HIS A 26 6.940 -6.381 9.071 1.00 10.00 H new ATOM 0 HB2 HIS A 26 7.592 -5.854 11.456 1.00 10.00 H new ATOM 0 HB3 HIS A 26 6.370 -7.086 11.207 1.00 10.00 H new ATOM 0 HD1 HIS A 26 10.206 -7.718 11.116 1.00 10.00 H new ATOM 0 HD2 HIS A 26 6.715 -8.624 13.299 1.00 10.00 H new ATOM 0 HE1 HIS A 26 10.827 -9.566 12.776 1.00 10.00 H new ATOM 404 N LYS A 27 8.956 -5.010 8.566 1.00 10.00 N ATOM 405 CA LYS A 27 10.086 -4.121 8.345 1.00 10.00 C ATOM 406 C LYS A 27 9.656 -2.683 8.610 1.00 10.00 C ATOM 407 O LYS A 27 10.066 -2.088 9.602 1.00 10.00 O ATOM 408 CB LYS A 27 10.683 -4.295 6.940 1.00 10.00 C ATOM 409 CG LYS A 27 11.526 -5.574 6.875 1.00 10.00 C ATOM 410 CD LYS A 27 12.441 -5.633 5.641 1.00 10.00 C ATOM 411 CE LYS A 27 13.681 -4.723 5.757 1.00 10.00 C ATOM 412 NZ LYS A 27 13.541 -3.439 5.033 1.00 10.00 N ATOM 0 H LYS A 27 8.084 -4.678 8.153 1.00 10.00 H new ATOM 0 HA LYS A 27 10.881 -4.381 9.043 1.00 10.00 H new ATOM 0 HB2 LYS A 27 9.883 -4.340 6.201 1.00 10.00 H new ATOM 0 HB3 LYS A 27 11.300 -3.432 6.690 1.00 10.00 H new ATOM 0 HG2 LYS A 27 12.136 -5.646 7.776 1.00 10.00 H new ATOM 0 HG3 LYS A 27 10.863 -6.439 6.869 1.00 10.00 H new ATOM 0 HD2 LYS A 27 12.767 -6.662 5.488 1.00 10.00 H new ATOM 0 HD3 LYS A 27 11.869 -5.345 4.759 1.00 10.00 H new ATOM 0 HE2 LYS A 27 13.874 -4.518 6.810 1.00 10.00 H new ATOM 0 HE3 LYS A 27 14.550 -5.256 5.371 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 14.466 -3.152 4.653 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 12.865 -3.553 4.251 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 13.194 -2.708 5.686 1.00 10.00 H new ATOM 426 N THR A 28 8.831 -2.144 7.714 1.00 10.00 N ATOM 427 CA THR A 28 8.380 -0.762 7.770 1.00 10.00 C ATOM 428 C THR A 28 6.856 -0.720 7.741 1.00 10.00 C ATOM 429 O THR A 28 6.240 -0.175 8.652 1.00 10.00 O ATOM 430 CB THR A 28 9.003 0.004 6.605 1.00 10.00 C ATOM 431 OG1 THR A 28 10.414 -0.046 6.674 1.00 10.00 O ATOM 432 CG2 THR A 28 8.525 1.456 6.549 1.00 10.00 C ATOM 0 H THR A 28 8.455 -2.664 6.921 1.00 10.00 H new ATOM 0 HA THR A 28 8.698 -0.286 8.698 1.00 10.00 H new ATOM 0 HB THR A 28 8.674 -0.484 5.687 1.00 10.00 H new ATOM 0 HG1 THR A 28 10.796 0.448 5.919 1.00 10.00 H new ATOM 0 HG21 THR A 28 8.994 1.961 5.705 1.00 10.00 H new ATOM 0 HG22 THR A 28 7.442 1.478 6.429 1.00 10.00 H new ATOM 0 HG23 THR A 28 8.798 1.965 7.474 1.00 10.00 H new ATOM 440 N GLY A 29 6.244 -1.278 6.691 1.00 10.00 N ATOM 441 CA GLY A 29 4.798 -1.378 6.590 1.00 10.00 C ATOM 442 C GLY A 29 4.371 -2.801 6.897 1.00 10.00 C ATOM 443 O GLY A 29 5.214 -3.701 6.917 1.00 10.00 O ATOM 0 H GLY A 29 6.743 -1.670 5.892 1.00 10.00 H new ATOM 0 HA2 GLY A 29 4.325 -0.686 7.286 1.00 10.00 H new ATOM 0 HA3 GLY A 29 4.472 -1.096 5.589 1.00 10.00 H new ATOM 447 N PRO A 30 3.074 -3.018 7.135 1.00 10.00 N ATOM 448 CA PRO A 30 2.578 -4.351 7.346 1.00 10.00 C ATOM 449 C PRO A 30 2.588 -5.153 6.064 1.00 10.00 C ATOM 450 O PRO A 30 2.654 -4.611 4.960 1.00 10.00 O ATOM 451 CB PRO A 30 1.179 -4.183 7.948 1.00 10.00 C ATOM 452 CG PRO A 30 0.746 -2.746 7.642 1.00 10.00 C ATOM 453 CD PRO A 30 2.011 -2.024 7.173 1.00 10.00 C ATOM 0 HA PRO A 30 3.211 -4.922 8.025 1.00 10.00 H new ATOM 0 HB2 PRO A 30 0.481 -4.899 7.515 1.00 10.00 H new ATOM 0 HB3 PRO A 30 1.195 -4.363 9.023 1.00 10.00 H new ATOM 0 HG2 PRO A 30 -0.025 -2.725 6.872 1.00 10.00 H new ATOM 0 HG3 PRO A 30 0.327 -2.267 8.526 1.00 10.00 H new ATOM 0 HD2 PRO A 30 1.861 -1.581 6.188 1.00 10.00 H new ATOM 0 HD3 PRO A 30 2.266 -1.211 7.853 1.00 10.00 H new ATOM 461 N ASN A 31 2.560 -6.473 6.243 1.00 10.00 N ATOM 462 CA ASN A 31 2.353 -7.393 5.156 1.00 10.00 C ATOM 463 C ASN A 31 0.983 -7.092 4.561 1.00 10.00 C ATOM 464 O ASN A 31 -0.052 -7.314 5.183 1.00 10.00 O ATOM 465 CB ASN A 31 2.497 -8.843 5.631 1.00 10.00 C ATOM 466 CG ASN A 31 1.435 -9.286 6.633 1.00 10.00 C ATOM 467 OD1 ASN A 31 1.178 -8.600 7.619 1.00 10.00 O ATOM 468 ND2 ASN A 31 0.829 -10.448 6.402 1.00 10.00 N ATOM 0 H ASN A 31 2.682 -6.922 7.151 1.00 10.00 H new ATOM 0 HA ASN A 31 3.111 -7.268 4.383 1.00 10.00 H new ATOM 0 HB2 ASN A 31 2.458 -9.502 4.764 1.00 10.00 H new ATOM 0 HB3 ASN A 31 3.481 -8.968 6.083 1.00 10.00 H new ATOM 0 HD21 ASN A 31 0.126 -10.795 7.054 1.00 10.00 H new ATOM 0 HD22 ASN A 31 1.068 -10.992 5.572 1.00 10.00 H new ATOM 475 N LEU A 32 0.975 -6.590 3.334 1.00 10.00 N ATOM 476 CA LEU A 32 -0.206 -6.255 2.568 1.00 10.00 C ATOM 477 C LEU A 32 -0.882 -7.531 2.036 1.00 10.00 C ATOM 478 O LEU A 32 -1.423 -7.567 0.933 1.00 10.00 O ATOM 479 CB LEU A 32 0.231 -5.246 1.483 1.00 10.00 C ATOM 480 CG LEU A 32 -0.129 -3.827 1.896 1.00 10.00 C ATOM 481 CD1 LEU A 32 0.545 -3.347 3.170 1.00 10.00 C ATOM 482 CD2 LEU A 32 0.071 -2.846 0.736 1.00 10.00 C ATOM 0 H LEU A 32 1.838 -6.398 2.825 1.00 10.00 H new ATOM 0 HA LEU A 32 -0.977 -5.779 3.174 1.00 10.00 H new ATOM 0 HB2 LEU A 32 1.306 -5.322 1.320 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -0.252 -5.489 0.537 1.00 10.00 H new ATOM 0 HG LEU A 32 -1.190 -3.857 2.144 1.00 10.00 H new ATOM 0 HD11 LEU A 32 0.229 -2.326 3.386 1.00 10.00 H new ATOM 0 HD12 LEU A 32 0.263 -3.997 3.998 1.00 10.00 H new ATOM 0 HD13 LEU A 32 1.627 -3.373 3.041 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -0.194 -1.840 1.061 1.00 10.00 H new ATOM 0 HD22 LEU A 32 1.114 -2.863 0.421 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -0.565 -3.137 -0.100 1.00 10.00 H new ATOM 494 N HIS A 33 -0.914 -8.588 2.848 1.00 10.00 N ATOM 495 CA HIS A 33 -1.486 -9.874 2.500 1.00 10.00 C ATOM 496 C HIS A 33 -2.988 -9.810 2.767 1.00 10.00 C ATOM 497 O HIS A 33 -3.505 -10.423 3.697 1.00 10.00 O ATOM 498 CB HIS A 33 -0.769 -10.959 3.305 1.00 10.00 C ATOM 499 CG HIS A 33 -1.283 -12.346 3.025 1.00 10.00 C ATOM 500 ND1 HIS A 33 -1.200 -13.046 1.839 1.00 10.00 N ATOM 501 CD2 HIS A 33 -2.023 -13.094 3.896 1.00 10.00 C ATOM 502 CE1 HIS A 33 -1.888 -14.188 2.001 1.00 10.00 C ATOM 503 NE2 HIS A 33 -2.394 -14.273 3.244 1.00 10.00 N ATOM 0 H HIS A 33 -0.529 -8.565 3.792 1.00 10.00 H new ATOM 0 HA HIS A 33 -1.351 -10.120 1.447 1.00 10.00 H new ATOM 0 HB2 HIS A 33 0.297 -10.922 3.082 1.00 10.00 H new ATOM 0 HB3 HIS A 33 -0.880 -10.746 4.368 1.00 10.00 H new ATOM 0 HD2 HIS A 33 -2.277 -12.822 4.910 1.00 10.00 H new ATOM 0 HE1 HIS A 33 -2.018 -14.938 1.235 1.00 10.00 H new ATOM 0 HE2 HIS A 33 -2.939 -15.043 3.633 1.00 10.00 H new ATOM 511 N GLY A 34 -3.667 -9.008 1.951 1.00 10.00 N ATOM 512 CA GLY A 34 -5.106 -8.795 2.025 1.00 10.00 C ATOM 513 C GLY A 34 -5.439 -7.311 2.117 1.00 10.00 C ATOM 514 O GLY A 34 -6.311 -6.928 2.891 1.00 10.00 O ATOM 0 H GLY A 34 -3.220 -8.477 1.204 1.00 10.00 H new ATOM 0 HA2 GLY A 34 -5.586 -9.224 1.145 1.00 10.00 H new ATOM 0 HA3 GLY A 34 -5.509 -9.315 2.894 1.00 10.00 H new ATOM 518 N LEU A 35 -4.757 -6.475 1.320 1.00 10.00 N ATOM 519 CA LEU A 35 -5.079 -5.065 1.194 1.00 10.00 C ATOM 520 C LEU A 35 -6.579 -4.920 0.911 1.00 10.00 C ATOM 521 O LEU A 35 -7.300 -4.281 1.672 1.00 10.00 O ATOM 522 CB LEU A 35 -4.208 -4.433 0.090 1.00 10.00 C ATOM 523 CG LEU A 35 -4.470 -2.929 -0.060 1.00 10.00 C ATOM 524 CD1 LEU A 35 -3.846 -2.099 1.069 1.00 10.00 C ATOM 525 CD2 LEU A 35 -3.963 -2.402 -1.394 1.00 10.00 C ATOM 0 H LEU A 35 -3.966 -6.769 0.747 1.00 10.00 H new ATOM 0 HA LEU A 35 -4.861 -4.534 2.120 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -3.155 -4.596 0.321 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -4.407 -4.932 -0.859 1.00 10.00 H new ATOM 0 HG LEU A 35 -5.553 -2.818 -0.009 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -4.065 -1.043 0.908 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -4.263 -2.415 2.026 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -2.766 -2.248 1.076 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -4.166 -1.333 -1.464 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -2.889 -2.573 -1.468 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -4.470 -2.922 -2.207 1.00 10.00 H new ATOM 537 N PHE A 36 -7.057 -5.535 -0.173 1.00 10.00 N ATOM 538 CA PHE A 36 -8.472 -5.493 -0.505 1.00 10.00 C ATOM 539 C PHE A 36 -9.265 -6.360 0.464 1.00 10.00 C ATOM 540 O PHE A 36 -9.106 -7.579 0.464 1.00 10.00 O ATOM 541 CB PHE A 36 -8.714 -5.947 -1.943 1.00 10.00 C ATOM 542 CG PHE A 36 -7.819 -5.248 -2.932 1.00 10.00 C ATOM 543 CD1 PHE A 36 -7.927 -3.864 -3.135 1.00 10.00 C ATOM 544 CD2 PHE A 36 -6.750 -5.951 -3.498 1.00 10.00 C ATOM 545 CE1 PHE A 36 -6.996 -3.210 -3.956 1.00 10.00 C ATOM 546 CE2 PHE A 36 -5.807 -5.276 -4.279 1.00 10.00 C ATOM 547 CZ PHE A 36 -5.936 -3.910 -4.536 1.00 10.00 C ATOM 0 H PHE A 36 -6.483 -6.064 -0.830 1.00 10.00 H new ATOM 0 HA PHE A 36 -8.811 -4.461 -0.416 1.00 10.00 H new ATOM 0 HB2 PHE A 36 -8.554 -7.023 -2.012 1.00 10.00 H new ATOM 0 HB3 PHE A 36 -9.755 -5.762 -2.208 1.00 10.00 H new ATOM 0 HD1 PHE A 36 -8.722 -3.306 -2.662 1.00 10.00 H new ATOM 0 HD2 PHE A 36 -6.653 -7.014 -3.332 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -7.101 -2.151 -4.142 1.00 10.00 H new ATOM 0 HE2 PHE A 36 -4.968 -5.818 -4.689 1.00 10.00 H new ATOM 0 HZ PHE A 36 -5.227 -3.402 -5.173 1.00 10.00 H new ATOM 557 N GLY A 37 -10.146 -5.734 1.244 1.00 10.00 N ATOM 558 CA GLY A 37 -11.059 -6.432 2.138 1.00 10.00 C ATOM 559 C GLY A 37 -10.642 -6.272 3.596 1.00 10.00 C ATOM 560 O GLY A 37 -10.693 -7.227 4.372 1.00 10.00 O ATOM 0 H GLY A 37 -10.244 -4.719 1.271 1.00 10.00 H new ATOM 0 HA2 GLY A 37 -12.069 -6.046 2.003 1.00 10.00 H new ATOM 0 HA3 GLY A 37 -11.085 -7.491 1.880 1.00 10.00 H new ATOM 564 N ARG A 38 -10.266 -5.049 3.982 1.00 10.00 N ATOM 565 CA ARG A 38 -9.953 -4.687 5.351 1.00 10.00 C ATOM 566 C ARG A 38 -9.951 -3.157 5.440 1.00 10.00 C ATOM 567 O ARG A 38 -9.825 -2.467 4.423 1.00 10.00 O ATOM 568 CB ARG A 38 -8.594 -5.282 5.769 1.00 10.00 C ATOM 569 CG ARG A 38 -8.606 -5.956 7.155 1.00 10.00 C ATOM 570 CD ARG A 38 -8.925 -7.464 7.109 1.00 10.00 C ATOM 571 NE ARG A 38 -10.330 -7.773 7.431 1.00 10.00 N ATOM 572 CZ ARG A 38 -10.945 -8.941 7.166 1.00 10.00 C ATOM 573 NH1 ARG A 38 -10.318 -9.898 6.473 1.00 10.00 N ATOM 574 NH2 ARG A 38 -12.186 -9.162 7.620 1.00 10.00 N ATOM 0 H ARG A 38 -10.171 -4.271 3.329 1.00 10.00 H new ATOM 0 HA ARG A 38 -10.697 -5.092 6.037 1.00 10.00 H new ATOM 0 HB2 ARG A 38 -8.284 -6.014 5.023 1.00 10.00 H new ATOM 0 HB3 ARG A 38 -7.846 -4.489 5.768 1.00 10.00 H new ATOM 0 HG2 ARG A 38 -7.634 -5.814 7.627 1.00 10.00 H new ATOM 0 HG3 ARG A 38 -9.342 -5.457 7.785 1.00 10.00 H new ATOM 0 HD2 ARG A 38 -8.695 -7.847 6.115 1.00 10.00 H new ATOM 0 HD3 ARG A 38 -8.275 -7.987 7.810 1.00 10.00 H new ATOM 0 HE ARG A 38 -10.879 -7.046 7.890 1.00 10.00 H new ATOM 0 HH11 ARG A 38 -9.366 -9.746 6.140 1.00 10.00 H new ATOM 0 HH12 ARG A 38 -10.792 -10.780 6.277 1.00 10.00 H new ATOM 0 HH21 ARG A 38 -12.664 -8.446 8.166 1.00 10.00 H new ATOM 0 HH22 ARG A 38 -12.652 -10.047 7.420 1.00 10.00 H new ATOM 588 N LYS A 39 -10.116 -2.639 6.660 1.00 10.00 N ATOM 589 CA LYS A 39 -9.920 -1.229 6.961 1.00 10.00 C ATOM 590 C LYS A 39 -8.430 -0.929 7.123 1.00 10.00 C ATOM 591 O LYS A 39 -7.608 -1.836 7.217 1.00 10.00 O ATOM 592 CB LYS A 39 -10.707 -0.834 8.227 1.00 10.00 C ATOM 593 CG LYS A 39 -12.035 -0.127 7.911 1.00 10.00 C ATOM 594 CD LYS A 39 -13.278 -0.921 8.338 1.00 10.00 C ATOM 595 CE LYS A 39 -13.615 -0.785 9.836 1.00 10.00 C ATOM 596 NZ LYS A 39 -13.152 -1.928 10.649 1.00 10.00 N ATOM 0 H LYS A 39 -10.392 -3.196 7.469 1.00 10.00 H new ATOM 0 HA LYS A 39 -10.300 -0.633 6.131 1.00 10.00 H new ATOM 0 HB2 LYS A 39 -10.909 -1.728 8.817 1.00 10.00 H new ATOM 0 HB3 LYS A 39 -10.090 -0.179 8.842 1.00 10.00 H new ATOM 0 HG2 LYS A 39 -12.047 0.843 8.408 1.00 10.00 H new ATOM 0 HG3 LYS A 39 -12.088 0.064 6.839 1.00 10.00 H new ATOM 0 HD2 LYS A 39 -14.132 -0.585 7.750 1.00 10.00 H new ATOM 0 HD3 LYS A 39 -13.124 -1.974 8.103 1.00 10.00 H new ATOM 0 HE2 LYS A 39 -13.165 0.130 10.220 1.00 10.00 H new ATOM 0 HE3 LYS A 39 -14.694 -0.681 9.950 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 -13.974 -2.459 11.001 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 -12.561 -2.553 10.065 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 -12.595 -1.578 11.455 1.00 10.00 H new ATOM 610 N THR A 40 -8.111 0.362 7.168 1.00 10.00 N ATOM 611 CA THR A 40 -6.759 0.877 7.270 1.00 10.00 C ATOM 612 C THR A 40 -6.178 0.621 8.656 1.00 10.00 C ATOM 613 O THR A 40 -5.259 -0.174 8.836 1.00 10.00 O ATOM 614 CB THR A 40 -6.828 2.378 6.968 1.00 10.00 C ATOM 615 OG1 THR A 40 -7.755 3.015 7.835 1.00 10.00 O ATOM 616 CG2 THR A 40 -7.354 2.623 5.560 1.00 10.00 C ATOM 0 H THR A 40 -8.815 1.099 7.133 1.00 10.00 H new ATOM 0 HA THR A 40 -6.101 0.373 6.562 1.00 10.00 H new ATOM 0 HB THR A 40 -5.818 2.770 7.092 1.00 10.00 H new ATOM 0 HG1 THR A 40 -7.291 3.693 8.369 1.00 10.00 H new ATOM 0 HG21 THR A 40 -7.394 3.695 5.368 1.00 10.00 H new ATOM 0 HG22 THR A 40 -6.691 2.149 4.836 1.00 10.00 H new ATOM 0 HG23 THR A 40 -8.354 2.200 5.466 1.00 10.00 H new ATOM 624 N GLY A 41 -6.744 1.294 9.657 1.00 10.00 N ATOM 625 CA GLY A 41 -6.311 1.239 11.040 1.00 10.00 C ATOM 626 C GLY A 41 -6.755 -0.056 11.715 1.00 10.00 C ATOM 627 O GLY A 41 -7.360 -0.001 12.783 1.00 10.00 O ATOM 0 H GLY A 41 -7.543 1.912 9.516 1.00 10.00 H new ATOM 0 HA2 GLY A 41 -5.225 1.320 11.086 1.00 10.00 H new ATOM 0 HA3 GLY A 41 -6.718 2.092 11.584 1.00 10.00 H new ATOM 631 N GLN A 42 -6.482 -1.202 11.086 1.00 10.00 N ATOM 632 CA GLN A 42 -6.849 -2.544 11.522 1.00 10.00 C ATOM 633 C GLN A 42 -5.748 -3.518 11.096 1.00 10.00 C ATOM 634 O GLN A 42 -5.999 -4.481 10.373 1.00 10.00 O ATOM 635 CB GLN A 42 -8.187 -2.955 10.890 1.00 10.00 C ATOM 636 CG GLN A 42 -9.391 -2.166 11.407 1.00 10.00 C ATOM 637 CD GLN A 42 -9.703 -2.447 12.873 1.00 10.00 C ATOM 638 OE1 GLN A 42 -10.258 -3.491 13.193 1.00 10.00 O ATOM 639 NE2 GLN A 42 -9.415 -1.506 13.763 1.00 10.00 N ATOM 0 H GLN A 42 -5.967 -1.214 10.205 1.00 10.00 H new ATOM 0 HA GLN A 42 -6.959 -2.562 12.606 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -8.120 -2.828 9.809 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -8.354 -4.016 11.077 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -9.202 -1.100 11.279 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -10.265 -2.409 10.802 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -8.952 -0.647 13.465 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -9.656 -1.642 14.745 1.00 10.00 H new ATOM 648 N ALA A 43 -4.517 -3.258 11.533 1.00 10.00 N ATOM 649 CA ALA A 43 -3.385 -4.108 11.204 1.00 10.00 C ATOM 650 C ALA A 43 -3.298 -5.279 12.192 1.00 10.00 C ATOM 651 O ALA A 43 -3.659 -5.119 13.360 1.00 10.00 O ATOM 652 CB ALA A 43 -2.115 -3.271 11.237 1.00 10.00 C ATOM 0 H ALA A 43 -4.282 -2.458 12.120 1.00 10.00 H new ATOM 0 HA ALA A 43 -3.511 -4.525 10.205 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -1.259 -3.899 10.991 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -2.193 -2.463 10.510 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -1.982 -2.850 12.234 1.00 10.00 H new ATOM 658 N PRO A 44 -2.821 -6.459 11.763 1.00 10.00 N ATOM 659 CA PRO A 44 -2.735 -7.616 12.632 1.00 10.00 C ATOM 660 C PRO A 44 -1.569 -7.455 13.609 1.00 10.00 C ATOM 661 O PRO A 44 -0.447 -7.874 13.329 1.00 10.00 O ATOM 662 CB PRO A 44 -2.583 -8.826 11.703 1.00 10.00 C ATOM 663 CG PRO A 44 -2.001 -8.257 10.407 1.00 10.00 C ATOM 664 CD PRO A 44 -2.389 -6.775 10.410 1.00 10.00 C ATOM 0 HA PRO A 44 -3.619 -7.742 13.257 1.00 10.00 H new ATOM 0 HB2 PRO A 44 -1.922 -9.576 12.137 1.00 10.00 H new ATOM 0 HB3 PRO A 44 -3.543 -9.311 11.526 1.00 10.00 H new ATOM 0 HG2 PRO A 44 -0.919 -8.381 10.374 1.00 10.00 H new ATOM 0 HG3 PRO A 44 -2.407 -8.769 9.535 1.00 10.00 H new ATOM 0 HD2 PRO A 44 -1.543 -6.153 10.119 1.00 10.00 H new ATOM 0 HD3 PRO A 44 -3.188 -6.583 9.694 1.00 10.00 H new ATOM 672 N GLY A 45 -1.821 -6.818 14.756 1.00 10.00 N ATOM 673 CA GLY A 45 -0.844 -6.661 15.828 1.00 10.00 C ATOM 674 C GLY A 45 0.154 -5.541 15.533 1.00 10.00 C ATOM 675 O GLY A 45 0.402 -4.705 16.399 1.00 10.00 O ATOM 0 H GLY A 45 -2.724 -6.392 14.965 1.00 10.00 H new ATOM 0 HA2 GLY A 45 -1.362 -6.448 16.763 1.00 10.00 H new ATOM 0 HA3 GLY A 45 -0.306 -7.598 15.968 1.00 10.00 H new ATOM 679 N PHE A 46 0.718 -5.534 14.316 1.00 10.00 N ATOM 680 CA PHE A 46 1.555 -4.468 13.770 1.00 10.00 C ATOM 681 C PHE A 46 1.078 -3.095 14.272 1.00 10.00 C ATOM 682 O PHE A 46 -0.084 -2.734 14.089 1.00 10.00 O ATOM 683 CB PHE A 46 1.532 -4.535 12.233 1.00 10.00 C ATOM 684 CG PHE A 46 2.096 -3.318 11.513 1.00 10.00 C ATOM 685 CD1 PHE A 46 1.254 -2.229 11.216 1.00 10.00 C ATOM 686 CD2 PHE A 46 3.456 -3.254 11.155 1.00 10.00 C ATOM 687 CE1 PHE A 46 1.772 -1.070 10.615 1.00 10.00 C ATOM 688 CE2 PHE A 46 3.978 -2.086 10.566 1.00 10.00 C ATOM 689 CZ PHE A 46 3.143 -0.980 10.333 1.00 10.00 C ATOM 0 H PHE A 46 0.595 -6.307 13.661 1.00 10.00 H new ATOM 0 HA PHE A 46 2.581 -4.605 14.111 1.00 10.00 H new ATOM 0 HB2 PHE A 46 2.093 -5.414 11.917 1.00 10.00 H new ATOM 0 HB3 PHE A 46 0.502 -4.681 11.909 1.00 10.00 H new ATOM 0 HD1 PHE A 46 0.202 -2.285 11.452 1.00 10.00 H new ATOM 0 HD2 PHE A 46 4.100 -4.102 11.332 1.00 10.00 H new ATOM 0 HE1 PHE A 46 1.115 -0.249 10.370 1.00 10.00 H new ATOM 0 HE2 PHE A 46 5.022 -2.040 10.293 1.00 10.00 H new ATOM 0 HZ PHE A 46 3.556 -0.063 9.938 1.00 10.00 H new ATOM 699 N THR A 47 1.975 -2.355 14.929 1.00 10.00 N ATOM 700 CA THR A 47 1.691 -1.051 15.512 1.00 10.00 C ATOM 701 C THR A 47 1.126 -0.071 14.470 1.00 10.00 C ATOM 702 O THR A 47 1.503 -0.126 13.306 1.00 10.00 O ATOM 703 CB THR A 47 2.980 -0.518 16.156 1.00 10.00 C ATOM 704 OG1 THR A 47 3.996 -0.366 15.186 1.00 10.00 O ATOM 705 CG2 THR A 47 3.518 -1.480 17.223 1.00 10.00 C ATOM 0 H THR A 47 2.939 -2.657 15.071 1.00 10.00 H new ATOM 0 HA THR A 47 0.919 -1.154 16.275 1.00 10.00 H new ATOM 0 HB THR A 47 2.725 0.440 16.609 1.00 10.00 H new ATOM 0 HG1 THR A 47 4.809 -0.024 15.614 1.00 10.00 H new ATOM 0 HG21 THR A 47 4.430 -1.070 17.656 1.00 10.00 H new ATOM 0 HG22 THR A 47 2.771 -1.610 18.006 1.00 10.00 H new ATOM 0 HG23 THR A 47 3.736 -2.445 16.766 1.00 10.00 H new ATOM 713 N TYR A 48 0.222 0.823 14.876 1.00 10.00 N ATOM 714 CA TYR A 48 -0.480 1.742 13.982 1.00 10.00 C ATOM 715 C TYR A 48 0.330 3.030 13.803 1.00 10.00 C ATOM 716 O TYR A 48 1.398 3.180 14.396 1.00 10.00 O ATOM 717 CB TYR A 48 -1.868 2.038 14.575 1.00 10.00 C ATOM 718 CG TYR A 48 -2.667 0.812 14.992 1.00 10.00 C ATOM 719 CD1 TYR A 48 -2.449 0.217 16.252 1.00 10.00 C ATOM 720 CD2 TYR A 48 -3.628 0.262 14.124 1.00 10.00 C ATOM 721 CE1 TYR A 48 -3.112 -0.973 16.597 1.00 10.00 C ATOM 722 CE2 TYR A 48 -4.354 -0.879 14.509 1.00 10.00 C ATOM 723 CZ TYR A 48 -4.048 -1.533 15.713 1.00 10.00 C ATOM 724 OH TYR A 48 -4.681 -2.699 16.021 1.00 10.00 O ATOM 0 H TYR A 48 -0.047 0.929 15.854 1.00 10.00 H new ATOM 0 HA TYR A 48 -0.599 1.290 12.997 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -1.744 2.685 15.444 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -2.448 2.598 13.841 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -1.770 0.678 16.954 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -3.808 0.717 13.161 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -2.902 -1.456 17.540 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -5.147 -1.252 13.878 1.00 10.00 H new ATOM 0 HH TYR A 48 -5.296 -2.939 15.296 1.00 10.00 H new ATOM 734 N THR A 49 -0.186 3.971 13.004 1.00 10.00 N ATOM 735 CA THR A 49 0.475 5.242 12.748 1.00 10.00 C ATOM 736 C THR A 49 -0.566 6.354 12.612 1.00 10.00 C ATOM 737 O THR A 49 -1.719 6.102 12.249 1.00 10.00 O ATOM 738 CB THR A 49 1.357 5.096 11.495 1.00 10.00 C ATOM 739 OG1 THR A 49 2.342 4.112 11.749 1.00 10.00 O ATOM 740 CG2 THR A 49 2.042 6.399 11.074 1.00 10.00 C ATOM 0 H THR A 49 -1.077 3.866 12.518 1.00 10.00 H new ATOM 0 HA THR A 49 1.120 5.519 13.582 1.00 10.00 H new ATOM 0 HB THR A 49 0.703 4.809 10.671 1.00 10.00 H new ATOM 0 HG1 THR A 49 2.911 4.007 10.958 1.00 10.00 H new ATOM 0 HG21 THR A 49 2.647 6.221 10.185 1.00 10.00 H new ATOM 0 HG22 THR A 49 1.286 7.153 10.854 1.00 10.00 H new ATOM 0 HG23 THR A 49 2.682 6.752 11.883 1.00 10.00 H new ATOM 748 N ASP A 50 -0.151 7.592 12.898 1.00 10.00 N ATOM 749 CA ASP A 50 -0.990 8.785 12.935 1.00 10.00 C ATOM 750 C ASP A 50 -1.298 9.259 11.511 1.00 10.00 C ATOM 751 O ASP A 50 -1.022 10.396 11.135 1.00 10.00 O ATOM 752 CB ASP A 50 -0.285 9.889 13.750 1.00 10.00 C ATOM 753 CG ASP A 50 0.163 9.485 15.152 1.00 10.00 C ATOM 754 OD1 ASP A 50 -0.300 8.429 15.635 1.00 10.00 O ATOM 755 OD2 ASP A 50 0.985 10.241 15.710 1.00 10.00 O ATOM 0 H ASP A 50 0.824 7.795 13.119 1.00 10.00 H new ATOM 0 HA ASP A 50 -1.937 8.549 13.421 1.00 10.00 H new ATOM 0 HB2 ASP A 50 0.588 10.227 13.192 1.00 10.00 H new ATOM 0 HB3 ASP A 50 -0.959 10.741 13.834 1.00 10.00 H new ATOM 760 N ALA A 51 -1.863 8.365 10.701 1.00 10.00 N ATOM 761 CA ALA A 51 -2.074 8.562 9.278 1.00 10.00 C ATOM 762 C ALA A 51 -3.020 7.466 8.802 1.00 10.00 C ATOM 763 O ALA A 51 -4.136 7.753 8.376 1.00 10.00 O ATOM 764 CB ALA A 51 -0.726 8.529 8.537 1.00 10.00 C ATOM 0 H ALA A 51 -2.194 7.459 11.032 1.00 10.00 H new ATOM 0 HA ALA A 51 -2.519 9.535 9.071 1.00 10.00 H new ATOM 0 HB1 ALA A 51 -0.893 8.678 7.470 1.00 10.00 H new ATOM 0 HB2 ALA A 51 -0.082 9.322 8.917 1.00 10.00 H new ATOM 0 HB3 ALA A 51 -0.246 7.564 8.698 1.00 10.00 H new ATOM 770 N ASN A 52 -2.599 6.202 8.911 1.00 10.00 N ATOM 771 CA ASN A 52 -3.457 5.064 8.580 1.00 10.00 C ATOM 772 C ASN A 52 -4.678 5.027 9.500 1.00 10.00 C ATOM 773 O ASN A 52 -5.813 4.872 9.039 1.00 10.00 O ATOM 774 CB ASN A 52 -2.678 3.734 8.541 1.00 10.00 C ATOM 775 CG ASN A 52 -1.855 3.380 9.788 1.00 10.00 C ATOM 776 OD1 ASN A 52 -2.222 3.682 10.920 1.00 10.00 O ATOM 777 ND2 ASN A 52 -0.721 2.716 9.597 1.00 10.00 N ATOM 0 H ASN A 52 -1.665 5.942 9.227 1.00 10.00 H new ATOM 0 HA ASN A 52 -3.828 5.202 7.564 1.00 10.00 H new ATOM 0 HB2 ASN A 52 -3.390 2.928 8.363 1.00 10.00 H new ATOM 0 HB3 ASN A 52 -2.004 3.759 7.685 1.00 10.00 H new ATOM 0 HD21 ASN A 52 -0.144 2.451 10.396 1.00 10.00 H new ATOM 0 HD22 ASN A 52 -0.427 2.471 8.652 1.00 10.00 H new ATOM 784 N LYS A 53 -4.448 5.230 10.797 1.00 10.00 N ATOM 785 CA LYS A 53 -5.482 5.156 11.813 1.00 10.00 C ATOM 786 C LYS A 53 -6.417 6.360 11.709 1.00 10.00 C ATOM 787 O LYS A 53 -7.614 6.237 11.955 1.00 10.00 O ATOM 788 CB LYS A 53 -4.824 5.004 13.199 1.00 10.00 C ATOM 789 CG LYS A 53 -5.427 3.844 14.003 1.00 10.00 C ATOM 790 CD LYS A 53 -6.799 4.223 14.587 1.00 10.00 C ATOM 791 CE LYS A 53 -6.780 4.299 16.123 1.00 10.00 C ATOM 792 NZ LYS A 53 -7.319 3.074 16.748 1.00 10.00 N ATOM 0 H LYS A 53 -3.525 5.453 11.170 1.00 10.00 H new ATOM 0 HA LYS A 53 -6.108 4.277 11.658 1.00 10.00 H new ATOM 0 HB2 LYS A 53 -3.754 4.840 13.075 1.00 10.00 H new ATOM 0 HB3 LYS A 53 -4.942 5.932 13.759 1.00 10.00 H new ATOM 0 HG2 LYS A 53 -5.532 2.969 13.361 1.00 10.00 H new ATOM 0 HG3 LYS A 53 -4.749 3.567 14.811 1.00 10.00 H new ATOM 0 HD2 LYS A 53 -7.110 5.186 14.182 1.00 10.00 H new ATOM 0 HD3 LYS A 53 -7.541 3.490 14.271 1.00 10.00 H new ATOM 0 HE2 LYS A 53 -5.757 4.460 16.465 1.00 10.00 H new ATOM 0 HE3 LYS A 53 -7.364 5.159 16.450 1.00 10.00 H new ATOM 0 HZ1 LYS A 53 -7.287 3.169 17.783 1.00 10.00 H new ATOM 0 HZ2 LYS A 53 -8.303 2.933 16.444 1.00 10.00 H new ATOM 0 HZ3 LYS A 53 -6.747 2.256 16.458 1.00 10.00 H new ATOM 806 N ASN A 54 -5.878 7.518 11.318 1.00 10.00 N ATOM 807 CA ASN A 54 -6.678 8.718 11.120 1.00 10.00 C ATOM 808 C ASN A 54 -7.519 8.627 9.843 1.00 10.00 C ATOM 809 O ASN A 54 -8.480 9.374 9.691 1.00 10.00 O ATOM 810 CB ASN A 54 -5.771 9.957 11.111 1.00 10.00 C ATOM 811 CG ASN A 54 -6.477 11.159 11.733 1.00 10.00 C ATOM 812 OD1 ASN A 54 -6.856 12.102 11.049 1.00 10.00 O ATOM 813 ND2 ASN A 54 -6.642 11.136 13.055 1.00 10.00 N ATOM 0 H ASN A 54 -4.883 7.644 11.133 1.00 10.00 H new ATOM 0 HA ASN A 54 -7.377 8.809 11.952 1.00 10.00 H new ATOM 0 HB2 ASN A 54 -4.854 9.745 11.661 1.00 10.00 H new ATOM 0 HB3 ASN A 54 -5.481 10.192 10.087 1.00 10.00 H new ATOM 0 HD21 ASN A 54 -7.095 11.919 13.526 1.00 10.00 H new ATOM 0 HD22 ASN A 54 -6.315 10.335 13.596 1.00 10.00 H new ATOM 820 N LYS A 55 -7.162 7.725 8.918 1.00 10.00 N ATOM 821 CA LYS A 55 -7.837 7.602 7.638 1.00 10.00 C ATOM 822 C LYS A 55 -9.224 6.987 7.816 1.00 10.00 C ATOM 823 O LYS A 55 -10.219 7.546 7.369 1.00 10.00 O ATOM 824 CB LYS A 55 -6.976 6.750 6.693 1.00 10.00 C ATOM 825 CG LYS A 55 -7.106 7.191 5.230 1.00 10.00 C ATOM 826 CD LYS A 55 -5.737 7.659 4.711 1.00 10.00 C ATOM 827 CE LYS A 55 -4.791 6.462 4.506 1.00 10.00 C ATOM 828 NZ LYS A 55 -3.364 6.850 4.521 1.00 10.00 N ATOM 0 H LYS A 55 -6.396 7.064 9.045 1.00 10.00 H new ATOM 0 HA LYS A 55 -7.970 8.593 7.203 1.00 10.00 H new ATOM 0 HB2 LYS A 55 -5.932 6.816 6.998 1.00 10.00 H new ATOM 0 HB3 LYS A 55 -7.269 5.704 6.782 1.00 10.00 H new ATOM 0 HG2 LYS A 55 -7.474 6.365 4.622 1.00 10.00 H new ATOM 0 HG3 LYS A 55 -7.834 7.998 5.146 1.00 10.00 H new ATOM 0 HD2 LYS A 55 -5.863 8.194 3.770 1.00 10.00 H new ATOM 0 HD3 LYS A 55 -5.295 8.360 5.419 1.00 10.00 H new ATOM 0 HE2 LYS A 55 -4.971 5.725 5.289 1.00 10.00 H new ATOM 0 HE3 LYS A 55 -5.022 5.981 3.556 1.00 10.00 H new ATOM 0 HZ1 LYS A 55 -2.986 6.821 3.552 1.00 10.00 H new ATOM 0 HZ2 LYS A 55 -3.270 7.814 4.901 1.00 10.00 H new ATOM 0 HZ3 LYS A 55 -2.831 6.188 5.120 1.00 10.00 H new ATOM 842 N GLY A 56 -9.268 5.809 8.445 1.00 10.00 N ATOM 843 CA GLY A 56 -10.499 5.082 8.714 1.00 10.00 C ATOM 844 C GLY A 56 -11.353 4.854 7.466 1.00 10.00 C ATOM 845 O GLY A 56 -12.530 5.206 7.438 1.00 10.00 O ATOM 0 H GLY A 56 -8.433 5.331 8.784 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -10.253 4.118 9.159 1.00 10.00 H new ATOM 0 HA3 GLY A 56 -11.084 5.633 9.450 1.00 10.00 H new ATOM 849 N ILE A 57 -10.766 4.219 6.452 1.00 10.00 N ATOM 850 CA ILE A 57 -11.423 3.859 5.203 1.00 10.00 C ATOM 851 C ILE A 57 -11.132 2.397 4.887 1.00 10.00 C ATOM 852 O ILE A 57 -10.315 1.762 5.558 1.00 10.00 O ATOM 853 CB ILE A 57 -10.995 4.824 4.075 1.00 10.00 C ATOM 854 CG1 ILE A 57 -9.485 4.936 3.884 1.00 10.00 C ATOM 855 CG2 ILE A 57 -11.568 6.224 4.328 1.00 10.00 C ATOM 856 CD1 ILE A 57 -8.877 3.864 2.974 1.00 10.00 C ATOM 0 H ILE A 57 -9.787 3.933 6.482 1.00 10.00 H new ATOM 0 HA ILE A 57 -12.504 3.962 5.297 1.00 10.00 H new ATOM 0 HB ILE A 57 -11.398 4.394 3.158 1.00 10.00 H new ATOM 0 HG12 ILE A 57 -9.256 5.918 3.470 1.00 10.00 H new ATOM 0 HG13 ILE A 57 -9.003 4.881 4.860 1.00 10.00 H new ATOM 0 HG21 ILE A 57 -11.259 6.894 3.526 1.00 10.00 H new ATOM 0 HG22 ILE A 57 -12.656 6.172 4.358 1.00 10.00 H new ATOM 0 HG23 ILE A 57 -11.197 6.603 5.280 1.00 10.00 H new ATOM 0 HD11 ILE A 57 -7.801 4.021 2.895 1.00 10.00 H new ATOM 0 HD12 ILE A 57 -9.070 2.877 3.395 1.00 10.00 H new ATOM 0 HD13 ILE A 57 -9.327 3.930 1.983 1.00 10.00 H new ATOM 868 N THR A 58 -11.832 1.857 3.890 1.00 10.00 N ATOM 869 CA THR A 58 -11.678 0.493 3.426 1.00 10.00 C ATOM 870 C THR A 58 -10.851 0.508 2.151 1.00 10.00 C ATOM 871 O THR A 58 -11.216 1.216 1.210 1.00 10.00 O ATOM 872 CB THR A 58 -13.068 -0.083 3.138 1.00 10.00 C ATOM 873 OG1 THR A 58 -13.765 0.824 2.303 1.00 10.00 O ATOM 874 CG2 THR A 58 -13.849 -0.286 4.438 1.00 10.00 C ATOM 0 H THR A 58 -12.540 2.378 3.373 1.00 10.00 H new ATOM 0 HA THR A 58 -11.179 -0.119 4.177 1.00 10.00 H new ATOM 0 HB THR A 58 -12.964 -1.051 2.647 1.00 10.00 H new ATOM 0 HG1 THR A 58 -13.149 1.194 1.636 1.00 10.00 H new ATOM 0 HG21 THR A 58 -14.833 -0.696 4.211 1.00 10.00 H new ATOM 0 HG22 THR A 58 -13.308 -0.978 5.083 1.00 10.00 H new ATOM 0 HG23 THR A 58 -13.963 0.671 4.947 1.00 10.00 H new ATOM 882 N TRP A 59 -9.784 -0.283 2.093 1.00 10.00 N ATOM 883 CA TRP A 59 -9.017 -0.414 0.871 1.00 10.00 C ATOM 884 C TRP A 59 -9.794 -1.273 -0.124 1.00 10.00 C ATOM 885 O TRP A 59 -10.038 -2.454 0.115 1.00 10.00 O ATOM 886 CB TRP A 59 -7.649 -0.986 1.203 1.00 10.00 C ATOM 887 CG TRP A 59 -6.834 -0.090 2.073 1.00 10.00 C ATOM 888 CD1 TRP A 59 -6.480 -0.363 3.347 1.00 10.00 C ATOM 889 CD2 TRP A 59 -6.328 1.252 1.783 1.00 10.00 C ATOM 890 NE1 TRP A 59 -5.766 0.708 3.840 1.00 10.00 N ATOM 891 CE2 TRP A 59 -5.648 1.734 2.932 1.00 10.00 C ATOM 892 CE3 TRP A 59 -6.390 2.129 0.678 1.00 10.00 C ATOM 893 CZ2 TRP A 59 -5.034 3.000 2.978 1.00 10.00 C ATOM 894 CZ3 TRP A 59 -5.718 3.365 0.690 1.00 10.00 C ATOM 895 CH2 TRP A 59 -5.023 3.794 1.827 1.00 10.00 C ATOM 0 H TRP A 59 -9.437 -0.837 2.876 1.00 10.00 H new ATOM 0 HA TRP A 59 -8.859 0.557 0.401 1.00 10.00 H new ATOM 0 HB2 TRP A 59 -7.775 -1.948 1.700 1.00 10.00 H new ATOM 0 HB3 TRP A 59 -7.106 -1.174 0.277 1.00 10.00 H new ATOM 0 HD1 TRP A 59 -6.716 -1.267 3.888 1.00 10.00 H new ATOM 0 HE1 TRP A 59 -5.368 0.737 4.779 1.00 10.00 H new ATOM 0 HE3 TRP A 59 -6.964 1.846 -0.192 1.00 10.00 H new ATOM 0 HZ2 TRP A 59 -4.577 3.353 3.891 1.00 10.00 H new ATOM 0 HZ3 TRP A 59 -5.739 3.991 -0.190 1.00 10.00 H new ATOM 0 HH2 TRP A 59 -4.483 4.729 1.815 1.00 10.00 H new ATOM 906 N LYS A 60 -10.210 -0.649 -1.227 1.00 10.00 N ATOM 907 CA LYS A 60 -11.002 -1.257 -2.285 1.00 10.00 C ATOM 908 C LYS A 60 -10.624 -0.615 -3.620 1.00 10.00 C ATOM 909 O LYS A 60 -11.454 0.048 -4.226 1.00 10.00 O ATOM 910 CB LYS A 60 -12.498 -1.087 -1.987 1.00 10.00 C ATOM 911 CG LYS A 60 -12.853 0.323 -1.487 1.00 10.00 C ATOM 912 CD LYS A 60 -14.254 0.720 -1.962 1.00 10.00 C ATOM 913 CE LYS A 60 -14.876 1.822 -1.088 1.00 10.00 C ATOM 914 NZ LYS A 60 -16.319 1.591 -0.882 1.00 10.00 N ATOM 0 H LYS A 60 -9.994 0.331 -1.410 1.00 10.00 H new ATOM 0 HA LYS A 60 -10.796 -2.326 -2.339 1.00 10.00 H new ATOM 0 HB2 LYS A 60 -13.070 -1.301 -2.890 1.00 10.00 H new ATOM 0 HB3 LYS A 60 -12.799 -1.819 -1.238 1.00 10.00 H new ATOM 0 HG2 LYS A 60 -12.809 0.352 -0.398 1.00 10.00 H new ATOM 0 HG3 LYS A 60 -12.120 1.041 -1.854 1.00 10.00 H new ATOM 0 HD2 LYS A 60 -14.201 1.065 -2.995 1.00 10.00 H new ATOM 0 HD3 LYS A 60 -14.901 -0.157 -1.952 1.00 10.00 H new ATOM 0 HE2 LYS A 60 -14.369 1.854 -0.124 1.00 10.00 H new ATOM 0 HE3 LYS A 60 -14.724 2.793 -1.560 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 -16.711 2.350 -0.289 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 -16.804 1.585 -1.802 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 -16.460 0.675 -0.410 1.00 10.00 H new ATOM 928 N GLU A 61 -9.358 -0.784 -4.020 1.00 10.00 N ATOM 929 CA GLU A 61 -8.718 -0.262 -5.235 1.00 10.00 C ATOM 930 C GLU A 61 -9.294 1.073 -5.720 1.00 10.00 C ATOM 931 O GLU A 61 -9.525 1.275 -6.904 1.00 10.00 O ATOM 932 CB GLU A 61 -8.688 -1.319 -6.355 1.00 10.00 C ATOM 933 CG GLU A 61 -10.076 -1.821 -6.789 1.00 10.00 C ATOM 934 CD GLU A 61 -10.528 -1.291 -8.144 1.00 10.00 C ATOM 935 OE1 GLU A 61 -9.686 -1.327 -9.066 1.00 10.00 O ATOM 936 OE2 GLU A 61 -11.726 -0.954 -8.246 1.00 10.00 O ATOM 0 H GLU A 61 -8.704 -1.331 -3.460 1.00 10.00 H new ATOM 0 HA GLU A 61 -7.689 -0.040 -4.954 1.00 10.00 H new ATOM 0 HB2 GLU A 61 -8.179 -0.898 -7.222 1.00 10.00 H new ATOM 0 HB3 GLU A 61 -8.095 -2.170 -6.020 1.00 10.00 H new ATOM 0 HG2 GLU A 61 -10.064 -2.910 -6.822 1.00 10.00 H new ATOM 0 HG3 GLU A 61 -10.808 -1.533 -6.035 1.00 10.00 H new ATOM 943 N GLU A 62 -9.485 1.997 -4.783 1.00 10.00 N ATOM 944 CA GLU A 62 -10.148 3.269 -5.030 1.00 10.00 C ATOM 945 C GLU A 62 -9.335 4.335 -4.312 1.00 10.00 C ATOM 946 O GLU A 62 -8.653 5.146 -4.929 1.00 10.00 O ATOM 947 CB GLU A 62 -11.596 3.165 -4.516 1.00 10.00 C ATOM 948 CG GLU A 62 -12.432 4.433 -4.743 1.00 10.00 C ATOM 949 CD GLU A 62 -13.318 4.320 -5.978 1.00 10.00 C ATOM 950 OE1 GLU A 62 -14.189 3.423 -5.953 1.00 10.00 O ATOM 951 OE2 GLU A 62 -13.132 5.150 -6.892 1.00 10.00 O ATOM 0 H GLU A 62 -9.178 1.879 -3.817 1.00 10.00 H new ATOM 0 HA GLU A 62 -10.202 3.530 -6.087 1.00 10.00 H new ATOM 0 HB2 GLU A 62 -12.086 2.326 -5.009 1.00 10.00 H new ATOM 0 HB3 GLU A 62 -11.577 2.941 -3.449 1.00 10.00 H new ATOM 0 HG2 GLU A 62 -13.053 4.619 -3.867 1.00 10.00 H new ATOM 0 HG3 GLU A 62 -11.768 5.291 -4.851 1.00 10.00 H new ATOM 958 N THR A 63 -9.332 4.274 -2.979 1.00 10.00 N ATOM 959 CA THR A 63 -8.520 5.182 -2.191 1.00 10.00 C ATOM 960 C THR A 63 -7.042 4.944 -2.531 1.00 10.00 C ATOM 961 O THR A 63 -6.267 5.888 -2.682 1.00 10.00 O ATOM 962 CB THR A 63 -8.851 5.003 -0.700 1.00 10.00 C ATOM 963 OG1 THR A 63 -10.249 5.087 -0.486 1.00 10.00 O ATOM 964 CG2 THR A 63 -8.197 6.100 0.138 1.00 10.00 C ATOM 0 H THR A 63 -9.880 3.609 -2.433 1.00 10.00 H new ATOM 0 HA THR A 63 -8.738 6.223 -2.429 1.00 10.00 H new ATOM 0 HB THR A 63 -8.475 4.024 -0.404 1.00 10.00 H new ATOM 0 HG1 THR A 63 -10.431 5.130 0.476 1.00 10.00 H new ATOM 0 HG21 THR A 63 -8.446 5.952 1.189 1.00 10.00 H new ATOM 0 HG22 THR A 63 -7.115 6.058 0.012 1.00 10.00 H new ATOM 0 HG23 THR A 63 -8.563 7.074 -0.188 1.00 10.00 H new ATOM 972 N LEU A 64 -6.642 3.674 -2.683 1.00 10.00 N ATOM 973 CA LEU A 64 -5.257 3.350 -2.973 1.00 10.00 C ATOM 974 C LEU A 64 -4.820 3.814 -4.359 1.00 10.00 C ATOM 975 O LEU A 64 -3.716 4.330 -4.496 1.00 10.00 O ATOM 976 CB LEU A 64 -4.923 1.882 -2.720 1.00 10.00 C ATOM 977 CG LEU A 64 -5.764 0.821 -3.411 1.00 10.00 C ATOM 978 CD1 LEU A 64 -4.827 -0.165 -4.114 1.00 10.00 C ATOM 979 CD2 LEU A 64 -6.711 0.179 -2.384 1.00 10.00 C ATOM 0 H LEU A 64 -7.260 2.866 -2.609 1.00 10.00 H new ATOM 0 HA LEU A 64 -4.666 3.922 -2.258 1.00 10.00 H new ATOM 0 HB2 LEU A 64 -3.884 1.723 -3.009 1.00 10.00 H new ATOM 0 HB3 LEU A 64 -4.985 1.708 -1.646 1.00 10.00 H new ATOM 0 HG LEU A 64 -6.404 1.245 -4.185 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -5.416 -0.933 -4.615 1.00 10.00 H new ATOM 0 HD12 LEU A 64 -4.224 0.367 -4.850 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -4.172 -0.632 -3.378 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -7.317 -0.583 -2.874 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -6.126 -0.280 -1.587 1.00 10.00 H new ATOM 0 HD23 LEU A 64 -7.362 0.944 -1.962 1.00 10.00 H new ATOM 991 N MET A 65 -5.663 3.653 -5.381 1.00 10.00 N ATOM 992 CA MET A 65 -5.365 4.135 -6.723 1.00 10.00 C ATOM 993 C MET A 65 -4.826 5.568 -6.710 1.00 10.00 C ATOM 994 O MET A 65 -3.880 5.869 -7.436 1.00 10.00 O ATOM 995 CB MET A 65 -6.630 4.028 -7.581 1.00 10.00 C ATOM 996 CG MET A 65 -6.741 2.676 -8.294 1.00 10.00 C ATOM 997 SD MET A 65 -6.894 2.798 -10.093 1.00 10.00 S ATOM 998 CE MET A 65 -7.474 1.132 -10.482 1.00 10.00 C ATOM 0 H MET A 65 -6.566 3.187 -5.298 1.00 10.00 H new ATOM 0 HA MET A 65 -4.578 3.514 -7.152 1.00 10.00 H new ATOM 0 HB2 MET A 65 -7.507 4.176 -6.950 1.00 10.00 H new ATOM 0 HB3 MET A 65 -6.632 4.827 -8.322 1.00 10.00 H new ATOM 0 HG2 MET A 65 -5.861 2.078 -8.055 1.00 10.00 H new ATOM 0 HG3 MET A 65 -7.606 2.141 -7.902 1.00 10.00 H new ATOM 0 HE1 MET A 65 -8.275 1.188 -11.219 1.00 10.00 H new ATOM 0 HE2 MET A 65 -6.649 0.545 -10.886 1.00 10.00 H new ATOM 0 HE3 MET A 65 -7.848 0.656 -9.576 1.00 10.00 H new ATOM 1008 N GLU A 66 -5.395 6.422 -5.857 1.00 10.00 N ATOM 1009 CA GLU A 66 -5.009 7.816 -5.756 1.00 10.00 C ATOM 1010 C GLU A 66 -3.846 7.946 -4.771 1.00 10.00 C ATOM 1011 O GLU A 66 -2.840 8.579 -5.080 1.00 10.00 O ATOM 1012 CB GLU A 66 -6.245 8.612 -5.333 1.00 10.00 C ATOM 1013 CG GLU A 66 -7.246 8.780 -6.483 1.00 10.00 C ATOM 1014 CD GLU A 66 -6.991 10.084 -7.229 1.00 10.00 C ATOM 1015 OE1 GLU A 66 -7.466 11.125 -6.722 1.00 10.00 O ATOM 1016 OE2 GLU A 66 -6.291 10.026 -8.260 1.00 10.00 O ATOM 0 H GLU A 66 -6.142 6.156 -5.215 1.00 10.00 H new ATOM 0 HA GLU A 66 -4.658 8.214 -6.708 1.00 10.00 H new ATOM 0 HB2 GLU A 66 -6.733 8.107 -4.499 1.00 10.00 H new ATOM 0 HB3 GLU A 66 -5.938 9.594 -4.974 1.00 10.00 H new ATOM 0 HG2 GLU A 66 -7.162 7.939 -7.171 1.00 10.00 H new ATOM 0 HG3 GLU A 66 -8.263 8.772 -6.091 1.00 10.00 H new ATOM 1023 N TYR A 67 -3.949 7.324 -3.590 1.00 10.00 N ATOM 1024 CA TYR A 67 -2.913 7.370 -2.560 1.00 10.00 C ATOM 1025 C TYR A 67 -1.540 7.024 -3.130 1.00 10.00 C ATOM 1026 O TYR A 67 -0.560 7.748 -2.951 1.00 10.00 O ATOM 1027 CB TYR A 67 -3.276 6.383 -1.446 1.00 10.00 C ATOM 1028 CG TYR A 67 -2.411 6.460 -0.199 1.00 10.00 C ATOM 1029 CD1 TYR A 67 -2.326 7.664 0.520 1.00 10.00 C ATOM 1030 CD2 TYR A 67 -1.730 5.323 0.276 1.00 10.00 C ATOM 1031 CE1 TYR A 67 -1.582 7.738 1.709 1.00 10.00 C ATOM 1032 CE2 TYR A 67 -1.046 5.377 1.504 1.00 10.00 C ATOM 1033 CZ TYR A 67 -0.946 6.590 2.206 1.00 10.00 C ATOM 1034 OH TYR A 67 -0.434 6.601 3.470 1.00 10.00 O ATOM 0 H TYR A 67 -4.763 6.770 -3.324 1.00 10.00 H new ATOM 0 HA TYR A 67 -2.861 8.385 -2.165 1.00 10.00 H new ATOM 0 HB2 TYR A 67 -4.314 6.552 -1.159 1.00 10.00 H new ATOM 0 HB3 TYR A 67 -3.217 5.371 -1.847 1.00 10.00 H new ATOM 0 HD1 TYR A 67 -2.838 8.542 0.155 1.00 10.00 H new ATOM 0 HD2 TYR A 67 -1.733 4.411 -0.302 1.00 10.00 H new ATOM 0 HE1 TYR A 67 -1.500 8.675 2.239 1.00 10.00 H new ATOM 0 HE2 TYR A 67 -0.596 4.483 1.909 1.00 10.00 H new ATOM 0 HH TYR A 67 -0.027 5.731 3.666 1.00 10.00 H new ATOM 1044 N LEU A 68 -1.480 5.904 -3.844 1.00 10.00 N ATOM 1045 CA LEU A 68 -0.265 5.392 -4.444 1.00 10.00 C ATOM 1046 C LEU A 68 0.225 6.261 -5.604 1.00 10.00 C ATOM 1047 O LEU A 68 1.323 6.016 -6.112 1.00 10.00 O ATOM 1048 CB LEU A 68 -0.513 3.971 -4.954 1.00 10.00 C ATOM 1049 CG LEU A 68 -1.025 2.957 -3.929 1.00 10.00 C ATOM 1050 CD1 LEU A 68 -1.512 1.671 -4.615 1.00 10.00 C ATOM 1051 CD2 LEU A 68 0.083 2.660 -2.923 1.00 10.00 C ATOM 0 H LEU A 68 -2.296 5.318 -4.022 1.00 10.00 H new ATOM 0 HA LEU A 68 0.508 5.400 -3.675 1.00 10.00 H new ATOM 0 HB2 LEU A 68 -1.232 4.023 -5.771 1.00 10.00 H new ATOM 0 HB3 LEU A 68 0.419 3.592 -5.373 1.00 10.00 H new ATOM 0 HG LEU A 68 -1.881 3.381 -3.403 1.00 10.00 H new ATOM 0 HD11 LEU A 68 -1.870 0.970 -3.861 1.00 10.00 H new ATOM 0 HD12 LEU A 68 -2.323 1.910 -5.302 1.00 10.00 H new ATOM 0 HD13 LEU A 68 -0.689 1.220 -5.169 1.00 10.00 H new ATOM 0 HD21 LEU A 68 -0.276 1.938 -2.190 1.00 10.00 H new ATOM 0 HD22 LEU A 68 0.947 2.249 -3.445 1.00 10.00 H new ATOM 0 HD23 LEU A 68 0.370 3.581 -2.415 1.00 10.00 H new ATOM 1063 N GLU A 69 -0.585 7.231 -6.045 1.00 10.00 N ATOM 1064 CA GLU A 69 -0.198 8.249 -7.004 1.00 10.00 C ATOM 1065 C GLU A 69 -0.058 9.615 -6.326 1.00 10.00 C ATOM 1066 O GLU A 69 -0.001 10.634 -7.007 1.00 10.00 O ATOM 1067 CB GLU A 69 -1.192 8.280 -8.183 1.00 10.00 C ATOM 1068 CG GLU A 69 -0.411 8.497 -9.491 1.00 10.00 C ATOM 1069 CD GLU A 69 -1.261 9.035 -10.636 1.00 10.00 C ATOM 1070 OE1 GLU A 69 -1.996 10.013 -10.388 1.00 10.00 O ATOM 1071 OE2 GLU A 69 -1.122 8.480 -11.750 1.00 10.00 O ATOM 0 H GLU A 69 -1.551 7.324 -5.731 1.00 10.00 H new ATOM 0 HA GLU A 69 0.782 7.997 -7.410 1.00 10.00 H new ATOM 0 HB2 GLU A 69 -1.751 7.345 -8.229 1.00 10.00 H new ATOM 0 HB3 GLU A 69 -1.919 9.080 -8.042 1.00 10.00 H new ATOM 0 HG2 GLU A 69 0.408 9.191 -9.303 1.00 10.00 H new ATOM 0 HG3 GLU A 69 0.036 7.551 -9.797 1.00 10.00 H new ATOM 1078 N ASN A 70 0.014 9.669 -4.989 1.00 10.00 N ATOM 1079 CA ASN A 70 0.034 10.936 -4.267 1.00 10.00 C ATOM 1080 C ASN A 70 0.209 10.692 -2.762 1.00 10.00 C ATOM 1081 O ASN A 70 -0.676 10.997 -1.959 1.00 10.00 O ATOM 1082 CB ASN A 70 -1.252 11.720 -4.598 1.00 10.00 C ATOM 1083 CG ASN A 70 -0.995 12.928 -5.492 1.00 10.00 C ATOM 1084 OD1 ASN A 70 -0.099 13.728 -5.231 1.00 10.00 O ATOM 1085 ND2 ASN A 70 -1.807 13.096 -6.530 1.00 10.00 N ATOM 0 H ASN A 70 0.059 8.845 -4.390 1.00 10.00 H new ATOM 0 HA ASN A 70 0.886 11.539 -4.582 1.00 10.00 H new ATOM 0 HB2 ASN A 70 -1.961 11.054 -5.090 1.00 10.00 H new ATOM 0 HB3 ASN A 70 -1.718 12.053 -3.670 1.00 10.00 H new ATOM 0 HD21 ASN A 70 -1.697 13.908 -7.138 1.00 10.00 H new ATOM 0 HD22 ASN A 70 -2.541 12.413 -6.719 1.00 10.00 H new ATOM 1092 N PRO A 71 1.368 10.162 -2.342 1.00 10.00 N ATOM 1093 CA PRO A 71 1.601 9.869 -0.948 1.00 10.00 C ATOM 1094 C PRO A 71 1.741 11.156 -0.153 1.00 10.00 C ATOM 1095 O PRO A 71 1.167 11.274 0.928 1.00 10.00 O ATOM 1096 CB PRO A 71 2.854 8.983 -0.906 1.00 10.00 C ATOM 1097 CG PRO A 71 3.605 9.307 -2.203 1.00 10.00 C ATOM 1098 CD PRO A 71 2.525 9.833 -3.153 1.00 10.00 C ATOM 0 HA PRO A 71 0.767 9.341 -0.485 1.00 10.00 H new ATOM 0 HB2 PRO A 71 3.464 9.202 -0.030 1.00 10.00 H new ATOM 0 HB3 PRO A 71 2.590 7.927 -0.855 1.00 10.00 H new ATOM 0 HG2 PRO A 71 4.383 10.052 -2.035 1.00 10.00 H new ATOM 0 HG3 PRO A 71 4.094 8.422 -2.610 1.00 10.00 H new ATOM 0 HD2 PRO A 71 2.880 10.711 -3.692 1.00 10.00 H new ATOM 0 HD3 PRO A 71 2.270 9.082 -3.901 1.00 10.00 H new ATOM 1106 N LYS A 72 2.441 12.152 -0.701 1.00 10.00 N ATOM 1107 CA LYS A 72 2.610 13.422 -0.020 1.00 10.00 C ATOM 1108 C LYS A 72 1.434 14.374 -0.281 1.00 10.00 C ATOM 1109 O LYS A 72 1.646 15.559 -0.528 1.00 10.00 O ATOM 1110 CB LYS A 72 3.961 14.059 -0.377 1.00 10.00 C ATOM 1111 CG LYS A 72 4.157 14.441 -1.858 1.00 10.00 C ATOM 1112 CD LYS A 72 4.792 13.313 -2.690 1.00 10.00 C ATOM 1113 CE LYS A 72 5.759 13.853 -3.758 1.00 10.00 C ATOM 1114 NZ LYS A 72 5.077 14.199 -5.026 1.00 10.00 N ATOM 0 H LYS A 72 2.896 12.097 -1.612 1.00 10.00 H new ATOM 0 HA LYS A 72 2.613 13.226 1.052 1.00 10.00 H new ATOM 0 HB2 LYS A 72 4.089 14.956 0.229 1.00 10.00 H new ATOM 0 HB3 LYS A 72 4.753 13.366 -0.093 1.00 10.00 H new ATOM 0 HG2 LYS A 72 3.192 14.705 -2.290 1.00 10.00 H new ATOM 0 HG3 LYS A 72 4.787 15.329 -1.918 1.00 10.00 H new ATOM 0 HD2 LYS A 72 5.328 12.633 -2.028 1.00 10.00 H new ATOM 0 HD3 LYS A 72 4.006 12.734 -3.174 1.00 10.00 H new ATOM 0 HE2 LYS A 72 6.265 14.737 -3.370 1.00 10.00 H new ATOM 0 HE3 LYS A 72 6.528 13.106 -3.956 1.00 10.00 H new ATOM 0 HZ1 LYS A 72 5.781 14.509 -5.726 1.00 10.00 H new ATOM 0 HZ2 LYS A 72 4.573 13.364 -5.388 1.00 10.00 H new ATOM 0 HZ3 LYS A 72 4.397 14.967 -4.856 1.00 10.00 H new ATOM 1128 N LYS A 73 0.203 13.860 -0.270 1.00 10.00 N ATOM 1129 CA LYS A 73 -0.981 14.634 -0.633 1.00 10.00 C ATOM 1130 C LYS A 73 -2.117 14.308 0.329 1.00 10.00 C ATOM 1131 O LYS A 73 -2.589 15.190 1.038 1.00 10.00 O ATOM 1132 CB LYS A 73 -1.356 14.350 -2.096 1.00 10.00 C ATOM 1133 CG LYS A 73 -1.803 15.584 -2.888 1.00 10.00 C ATOM 1134 CD LYS A 73 -3.157 16.152 -2.428 1.00 10.00 C ATOM 1135 CE LYS A 73 -3.820 16.942 -3.573 1.00 10.00 C ATOM 1136 NZ LYS A 73 -4.893 16.174 -4.246 1.00 10.00 N ATOM 0 H LYS A 73 0.001 12.895 -0.009 1.00 10.00 H new ATOM 0 HA LYS A 73 -0.776 15.701 -0.550 1.00 10.00 H new ATOM 0 HB2 LYS A 73 -0.498 13.903 -2.598 1.00 10.00 H new ATOM 0 HB3 LYS A 73 -2.157 13.611 -2.116 1.00 10.00 H new ATOM 0 HG2 LYS A 73 -1.043 16.360 -2.796 1.00 10.00 H new ATOM 0 HG3 LYS A 73 -1.867 15.324 -3.945 1.00 10.00 H new ATOM 0 HD2 LYS A 73 -3.811 15.340 -2.110 1.00 10.00 H new ATOM 0 HD3 LYS A 73 -3.013 16.801 -1.564 1.00 10.00 H new ATOM 0 HE2 LYS A 73 -4.235 17.869 -3.178 1.00 10.00 H new ATOM 0 HE3 LYS A 73 -3.062 17.219 -4.306 1.00 10.00 H new ATOM 0 HZ1 LYS A 73 -5.306 16.749 -5.008 1.00 10.00 H new ATOM 0 HZ2 LYS A 73 -4.495 15.301 -4.648 1.00 10.00 H new ATOM 0 HZ3 LYS A 73 -5.632 15.932 -3.555 1.00 10.00 H new ATOM 1150 N TYR A 74 -2.541 13.039 0.351 1.00 10.00 N ATOM 1151 CA TYR A 74 -3.577 12.550 1.254 1.00 10.00 C ATOM 1152 C TYR A 74 -3.307 12.995 2.684 1.00 10.00 C ATOM 1153 O TYR A 74 -4.100 13.722 3.275 1.00 10.00 O ATOM 1154 CB TYR A 74 -3.624 11.020 1.206 1.00 10.00 C ATOM 1155 CG TYR A 74 -4.639 10.477 0.231 1.00 10.00 C ATOM 1156 CD1 TYR A 74 -4.356 10.468 -1.144 1.00 10.00 C ATOM 1157 CD2 TYR A 74 -5.874 9.993 0.701 1.00 10.00 C ATOM 1158 CE1 TYR A 74 -5.293 9.939 -2.041 1.00 10.00 C ATOM 1159 CE2 TYR A 74 -6.827 9.505 -0.205 1.00 10.00 C ATOM 1160 CZ TYR A 74 -6.535 9.474 -1.578 1.00 10.00 C ATOM 1161 OH TYR A 74 -7.484 9.080 -2.468 1.00 10.00 O ATOM 0 H TYR A 74 -2.167 12.319 -0.267 1.00 10.00 H new ATOM 0 HA TYR A 74 -4.532 12.964 0.931 1.00 10.00 H new ATOM 0 HB2 TYR A 74 -2.637 10.643 0.938 1.00 10.00 H new ATOM 0 HB3 TYR A 74 -3.850 10.640 2.202 1.00 10.00 H new ATOM 0 HD1 TYR A 74 -3.421 10.867 -1.508 1.00 10.00 H new ATOM 0 HD2 TYR A 74 -6.088 9.997 1.760 1.00 10.00 H new ATOM 0 HE1 TYR A 74 -5.059 9.888 -3.094 1.00 10.00 H new ATOM 0 HE2 TYR A 74 -7.784 9.154 0.153 1.00 10.00 H new ATOM 0 HH TYR A 74 -8.284 8.785 -1.984 1.00 10.00 H new ATOM 1171 N ILE A 75 -2.197 12.510 3.246 1.00 10.00 N ATOM 1172 CA ILE A 75 -1.805 12.837 4.602 1.00 10.00 C ATOM 1173 C ILE A 75 -0.284 12.645 4.721 1.00 10.00 C ATOM 1174 O ILE A 75 0.193 11.511 4.667 1.00 10.00 O ATOM 1175 CB ILE A 75 -2.675 12.044 5.610 1.00 10.00 C ATOM 1176 CG1 ILE A 75 -2.710 12.713 6.997 1.00 10.00 C ATOM 1177 CG2 ILE A 75 -2.391 10.536 5.665 1.00 10.00 C ATOM 1178 CD1 ILE A 75 -1.521 12.392 7.899 1.00 10.00 C ATOM 0 H ILE A 75 -1.552 11.881 2.767 1.00 10.00 H new ATOM 0 HA ILE A 75 -1.995 13.880 4.854 1.00 10.00 H new ATOM 0 HB ILE A 75 -3.688 12.094 5.210 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -2.762 13.793 6.861 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -3.625 12.411 7.506 1.00 10.00 H new ATOM 0 HG21 ILE A 75 -3.048 10.068 6.398 1.00 10.00 H new ATOM 0 HG22 ILE A 75 -2.570 10.096 4.684 1.00 10.00 H new ATOM 0 HG23 ILE A 75 -1.352 10.372 5.952 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -1.637 12.909 8.852 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -1.476 11.317 8.073 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -0.600 12.721 7.418 1.00 10.00 H new ATOM 1190 N PRO A 76 0.507 13.725 4.851 1.00 10.00 N ATOM 1191 CA PRO A 76 1.950 13.652 5.046 1.00 10.00 C ATOM 1192 C PRO A 76 2.294 13.237 6.476 1.00 10.00 C ATOM 1193 O PRO A 76 2.969 13.959 7.204 1.00 10.00 O ATOM 1194 CB PRO A 76 2.495 15.009 4.592 1.00 10.00 C ATOM 1195 CG PRO A 76 1.327 15.977 4.785 1.00 10.00 C ATOM 1196 CD PRO A 76 0.069 15.107 4.750 1.00 10.00 C ATOM 0 HA PRO A 76 2.429 12.873 4.453 1.00 10.00 H new ATOM 0 HB2 PRO A 76 3.360 15.308 5.185 1.00 10.00 H new ATOM 0 HB3 PRO A 76 2.817 14.979 3.551 1.00 10.00 H new ATOM 0 HG2 PRO A 76 1.410 16.509 5.732 1.00 10.00 H new ATOM 0 HG3 PRO A 76 1.306 16.730 3.997 1.00 10.00 H new ATOM 0 HD2 PRO A 76 -0.599 15.361 5.573 1.00 10.00 H new ATOM 0 HD3 PRO A 76 -0.487 15.269 3.826 1.00 10.00 H new ATOM 1204 N GLY A 77 1.845 12.033 6.843 1.00 10.00 N ATOM 1205 CA GLY A 77 2.052 11.411 8.142 1.00 10.00 C ATOM 1206 C GLY A 77 2.782 10.074 8.022 1.00 10.00 C ATOM 1207 O GLY A 77 3.087 9.469 9.043 1.00 10.00 O ATOM 0 H GLY A 77 1.304 11.444 6.210 1.00 10.00 H new ATOM 0 HA2 GLY A 77 2.627 12.083 8.779 1.00 10.00 H new ATOM 0 HA3 GLY A 77 1.089 11.257 8.629 1.00 10.00 H new ATOM 1211 N THR A 78 3.046 9.605 6.792 1.00 10.00 N ATOM 1212 CA THR A 78 3.761 8.363 6.539 1.00 10.00 C ATOM 1213 C THR A 78 5.228 8.495 6.995 1.00 10.00 C ATOM 1214 O THR A 78 5.521 8.377 8.179 1.00 10.00 O ATOM 1215 CB THR A 78 3.555 7.963 5.063 1.00 10.00 C ATOM 1216 OG1 THR A 78 2.168 7.843 4.806 1.00 10.00 O ATOM 1217 CG2 THR A 78 4.216 6.630 4.694 1.00 10.00 C ATOM 0 H THR A 78 2.762 10.090 5.941 1.00 10.00 H new ATOM 0 HA THR A 78 3.364 7.538 7.130 1.00 10.00 H new ATOM 0 HB THR A 78 4.021 8.744 4.463 1.00 10.00 H new ATOM 0 HG1 THR A 78 2.030 7.590 3.869 1.00 10.00 H new ATOM 0 HG21 THR A 78 4.031 6.411 3.642 1.00 10.00 H new ATOM 0 HG22 THR A 78 5.290 6.696 4.867 1.00 10.00 H new ATOM 0 HG23 THR A 78 3.797 5.834 5.309 1.00 10.00 H new ATOM 1225 N LYS A 79 6.172 8.745 6.080 1.00 10.00 N ATOM 1226 CA LYS A 79 7.564 9.002 6.450 1.00 10.00 C ATOM 1227 C LYS A 79 8.320 9.724 5.331 1.00 10.00 C ATOM 1228 O LYS A 79 9.544 9.643 5.284 1.00 10.00 O ATOM 1229 CB LYS A 79 8.260 7.680 6.834 1.00 10.00 C ATOM 1230 CG LYS A 79 8.568 6.791 5.619 1.00 10.00 C ATOM 1231 CD LYS A 79 7.936 5.404 5.747 1.00 10.00 C ATOM 1232 CE LYS A 79 8.357 4.488 4.596 1.00 10.00 C ATOM 1233 NZ LYS A 79 8.239 5.131 3.269 1.00 10.00 N ATOM 0 H LYS A 79 5.994 8.774 5.076 1.00 10.00 H new ATOM 0 HA LYS A 79 7.572 9.664 7.316 1.00 10.00 H new ATOM 0 HB2 LYS A 79 9.189 7.903 7.359 1.00 10.00 H new ATOM 0 HB3 LYS A 79 7.626 7.130 7.529 1.00 10.00 H new ATOM 0 HG2 LYS A 79 8.200 7.274 4.714 1.00 10.00 H new ATOM 0 HG3 LYS A 79 9.648 6.688 5.510 1.00 10.00 H new ATOM 0 HD2 LYS A 79 8.229 4.956 6.696 1.00 10.00 H new ATOM 0 HD3 LYS A 79 6.850 5.498 5.761 1.00 10.00 H new ATOM 0 HE2 LYS A 79 9.389 4.173 4.750 1.00 10.00 H new ATOM 0 HE3 LYS A 79 7.743 3.588 4.613 1.00 10.00 H new ATOM 0 HZ1 LYS A 79 8.034 4.408 2.550 1.00 10.00 H new ATOM 0 HZ2 LYS A 79 7.468 5.829 3.289 1.00 10.00 H new ATOM 0 HZ3 LYS A 79 9.132 5.609 3.034 1.00 10.00 H new ATOM 1247 N MET A 80 7.581 10.349 4.401 1.00 10.00 N ATOM 1248 CA MET A 80 8.082 10.833 3.119 1.00 10.00 C ATOM 1249 C MET A 80 8.578 9.672 2.243 1.00 10.00 C ATOM 1250 O MET A 80 9.021 8.637 2.741 1.00 10.00 O ATOM 1251 CB MET A 80 9.128 11.934 3.352 1.00 10.00 C ATOM 1252 CG MET A 80 9.610 12.665 2.090 1.00 10.00 C ATOM 1253 SD MET A 80 9.683 14.461 2.298 1.00 10.00 S ATOM 1254 CE MET A 80 7.916 14.829 2.193 1.00 10.00 C ATOM 0 H MET A 80 6.586 10.534 4.532 1.00 10.00 H new ATOM 0 HA MET A 80 7.270 11.289 2.553 1.00 10.00 H new ATOM 0 HB2 MET A 80 8.709 12.669 4.039 1.00 10.00 H new ATOM 0 HB3 MET A 80 9.992 11.491 3.847 1.00 10.00 H new ATOM 0 HG2 MET A 80 10.599 12.296 1.818 1.00 10.00 H new ATOM 0 HG3 MET A 80 8.942 12.427 1.262 1.00 10.00 H new ATOM 0 HE1 MET A 80 7.761 15.903 2.301 1.00 10.00 H new ATOM 0 HE2 MET A 80 7.533 14.502 1.226 1.00 10.00 H new ATOM 0 HE3 MET A 80 7.387 14.304 2.989 1.00 10.00 H new ATOM 1264 N ILE A 81 8.451 9.827 0.923 1.00 10.00 N ATOM 1265 CA ILE A 81 9.066 8.984 -0.088 1.00 10.00 C ATOM 1266 C ILE A 81 8.858 9.692 -1.438 1.00 10.00 C ATOM 1267 O ILE A 81 8.298 10.790 -1.453 1.00 10.00 O ATOM 1268 CB ILE A 81 8.595 7.504 0.042 1.00 10.00 C ATOM 1269 CG1 ILE A 81 9.298 6.483 -0.860 1.00 10.00 C ATOM 1270 CG2 ILE A 81 7.064 7.440 -0.136 1.00 10.00 C ATOM 1271 CD1 ILE A 81 9.315 5.107 -0.183 1.00 10.00 C ATOM 0 H ILE A 81 7.891 10.578 0.519 1.00 10.00 H new ATOM 0 HA ILE A 81 10.143 8.870 0.035 1.00 10.00 H new ATOM 0 HB ILE A 81 8.890 7.196 1.045 1.00 10.00 H new ATOM 0 HG12 ILE A 81 8.784 6.419 -1.819 1.00 10.00 H new ATOM 0 HG13 ILE A 81 10.318 6.809 -1.066 1.00 10.00 H new ATOM 0 HG21 ILE A 81 6.730 6.406 -0.046 1.00 10.00 H new ATOM 0 HG22 ILE A 81 6.583 8.045 0.632 1.00 10.00 H new ATOM 0 HG23 ILE A 81 6.796 7.823 -1.121 1.00 10.00 H new ATOM 0 HD11 ILE A 81 9.816 4.389 -0.832 1.00 10.00 H new ATOM 0 HD12 ILE A 81 9.849 5.174 0.765 1.00 10.00 H new ATOM 0 HD13 ILE A 81 8.292 4.779 -0.001 1.00 10.00 H new ATOM 1283 N PHE A 82 9.358 9.110 -2.534 1.00 10.00 N ATOM 1284 CA PHE A 82 9.256 9.625 -3.902 1.00 10.00 C ATOM 1285 C PHE A 82 7.826 10.018 -4.319 1.00 10.00 C ATOM 1286 O PHE A 82 6.865 9.802 -3.582 1.00 10.00 O ATOM 1287 CB PHE A 82 9.832 8.576 -4.872 1.00 10.00 C ATOM 1288 CG PHE A 82 8.950 7.370 -5.189 1.00 10.00 C ATOM 1289 CD1 PHE A 82 7.945 6.928 -4.303 1.00 10.00 C ATOM 1290 CD2 PHE A 82 9.116 6.703 -6.418 1.00 10.00 C ATOM 1291 CE1 PHE A 82 7.133 5.832 -4.628 1.00 10.00 C ATOM 1292 CE2 PHE A 82 8.299 5.607 -6.745 1.00 10.00 C ATOM 1293 CZ PHE A 82 7.305 5.172 -5.853 1.00 10.00 C ATOM 0 H PHE A 82 9.867 8.228 -2.488 1.00 10.00 H new ATOM 0 HA PHE A 82 9.832 10.549 -3.942 1.00 10.00 H new ATOM 0 HB2 PHE A 82 10.072 9.077 -5.810 1.00 10.00 H new ATOM 0 HB3 PHE A 82 10.771 8.210 -4.457 1.00 10.00 H new ATOM 0 HD1 PHE A 82 7.799 7.440 -3.363 1.00 10.00 H new ATOM 0 HD2 PHE A 82 9.874 7.035 -7.112 1.00 10.00 H new ATOM 0 HE1 PHE A 82 6.376 5.496 -3.935 1.00 10.00 H new ATOM 0 HE2 PHE A 82 8.436 5.097 -7.687 1.00 10.00 H new ATOM 0 HZ PHE A 82 6.676 4.333 -6.110 1.00 10.00 H new ATOM 1303 N ALA A 83 7.678 10.559 -5.536 1.00 10.00 N ATOM 1304 CA ALA A 83 6.377 10.893 -6.105 1.00 10.00 C ATOM 1305 C ALA A 83 5.384 9.743 -5.997 1.00 10.00 C ATOM 1306 O ALA A 83 4.410 9.848 -5.263 1.00 10.00 O ATOM 1307 CB ALA A 83 6.517 11.371 -7.552 1.00 10.00 C ATOM 0 H ALA A 83 8.463 10.776 -6.150 1.00 10.00 H new ATOM 0 HA ALA A 83 5.972 11.714 -5.513 1.00 10.00 H new ATOM 0 HB1 ALA A 83 5.532 11.613 -7.952 1.00 10.00 H new ATOM 0 HB2 ALA A 83 7.149 12.258 -7.583 1.00 10.00 H new ATOM 0 HB3 ALA A 83 6.969 10.582 -8.154 1.00 10.00 H new ATOM 1313 N GLY A 84 5.596 8.670 -6.746 1.00 10.00 N ATOM 1314 CA GLY A 84 4.687 7.549 -6.755 1.00 10.00 C ATOM 1315 C GLY A 84 5.090 6.659 -7.912 1.00 10.00 C ATOM 1316 O GLY A 84 6.193 6.784 -8.446 1.00 10.00 O ATOM 0 H GLY A 84 6.403 8.559 -7.360 1.00 10.00 H new ATOM 0 HA2 GLY A 84 4.739 7.003 -5.813 1.00 10.00 H new ATOM 0 HA3 GLY A 84 3.658 7.889 -6.870 1.00 10.00 H new ATOM 1320 N ILE A 85 4.190 5.769 -8.313 1.00 10.00 N ATOM 1321 CA ILE A 85 4.419 4.930 -9.472 1.00 10.00 C ATOM 1322 C ILE A 85 4.608 5.789 -10.726 1.00 10.00 C ATOM 1323 O ILE A 85 4.204 6.947 -10.776 1.00 10.00 O ATOM 1324 CB ILE A 85 3.253 3.939 -9.585 1.00 10.00 C ATOM 1325 CG1 ILE A 85 3.555 2.646 -8.829 1.00 10.00 C ATOM 1326 CG2 ILE A 85 2.836 3.604 -11.010 1.00 10.00 C ATOM 1327 CD1 ILE A 85 4.405 1.657 -9.628 1.00 10.00 C ATOM 0 H ILE A 85 3.295 5.613 -7.849 1.00 10.00 H new ATOM 0 HA ILE A 85 5.340 4.357 -9.365 1.00 10.00 H new ATOM 0 HB ILE A 85 2.409 4.458 -9.131 1.00 10.00 H new ATOM 0 HG12 ILE A 85 4.071 2.889 -7.900 1.00 10.00 H new ATOM 0 HG13 ILE A 85 2.615 2.167 -8.555 1.00 10.00 H new ATOM 0 HG21 ILE A 85 2.006 2.897 -10.990 1.00 10.00 H new ATOM 0 HG22 ILE A 85 2.525 4.515 -11.522 1.00 10.00 H new ATOM 0 HG23 ILE A 85 3.678 3.160 -11.541 1.00 10.00 H new ATOM 0 HD11 ILE A 85 4.580 0.762 -9.030 1.00 10.00 H new ATOM 0 HD12 ILE A 85 3.881 1.384 -10.544 1.00 10.00 H new ATOM 0 HD13 ILE A 85 5.360 2.118 -9.880 1.00 10.00 H new ATOM 1339 N LYS A 86 5.215 5.170 -11.742 1.00 10.00 N ATOM 1340 CA LYS A 86 5.462 5.727 -13.060 1.00 10.00 C ATOM 1341 C LYS A 86 4.307 6.607 -13.561 1.00 10.00 C ATOM 1342 O LYS A 86 4.548 7.746 -13.948 1.00 10.00 O ATOM 1343 CB LYS A 86 5.753 4.596 -14.057 1.00 10.00 C ATOM 1344 CG LYS A 86 6.725 3.528 -13.534 1.00 10.00 C ATOM 1345 CD LYS A 86 7.351 2.787 -14.728 1.00 10.00 C ATOM 1346 CE LYS A 86 8.635 3.504 -15.183 1.00 10.00 C ATOM 1347 NZ LYS A 86 8.990 3.204 -16.586 1.00 10.00 N ATOM 0 H LYS A 86 5.563 4.215 -11.655 1.00 10.00 H new ATOM 0 HA LYS A 86 6.333 6.378 -12.979 1.00 10.00 H new ATOM 0 HB2 LYS A 86 4.813 4.114 -14.327 1.00 10.00 H new ATOM 0 HB3 LYS A 86 6.163 5.028 -14.970 1.00 10.00 H new ATOM 0 HG2 LYS A 86 7.504 3.993 -12.930 1.00 10.00 H new ATOM 0 HG3 LYS A 86 6.199 2.824 -12.889 1.00 10.00 H new ATOM 0 HD2 LYS A 86 7.579 1.759 -14.448 1.00 10.00 H new ATOM 0 HD3 LYS A 86 6.639 2.742 -15.552 1.00 10.00 H new ATOM 0 HE2 LYS A 86 8.506 4.580 -15.068 1.00 10.00 H new ATOM 0 HE3 LYS A 86 9.460 3.211 -14.533 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 9.861 3.712 -16.840 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 9.142 2.181 -16.695 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 8.217 3.508 -17.212 1.00 10.00 H new ATOM 1361 N LYS A 87 3.081 6.063 -13.600 1.00 10.00 N ATOM 1362 CA LYS A 87 1.856 6.752 -13.977 1.00 10.00 C ATOM 1363 C LYS A 87 0.646 5.841 -13.718 1.00 10.00 C ATOM 1364 O LYS A 87 0.788 4.740 -13.182 1.00 10.00 O ATOM 1365 CB LYS A 87 1.919 7.157 -15.456 1.00 10.00 C ATOM 1366 CG LYS A 87 1.851 5.936 -16.388 1.00 10.00 C ATOM 1367 CD LYS A 87 2.816 6.042 -17.567 1.00 10.00 C ATOM 1368 CE LYS A 87 4.264 5.913 -17.083 1.00 10.00 C ATOM 1369 NZ LYS A 87 5.189 5.717 -18.209 1.00 10.00 N ATOM 0 H LYS A 87 2.919 5.086 -13.357 1.00 10.00 H new ATOM 0 HA LYS A 87 1.749 7.654 -13.374 1.00 10.00 H new ATOM 0 HB2 LYS A 87 1.095 7.833 -15.683 1.00 10.00 H new ATOM 0 HB3 LYS A 87 2.842 7.706 -15.643 1.00 10.00 H new ATOM 0 HG2 LYS A 87 2.078 5.035 -15.818 1.00 10.00 H new ATOM 0 HG3 LYS A 87 0.834 5.827 -16.765 1.00 10.00 H new ATOM 0 HD2 LYS A 87 2.598 5.261 -18.295 1.00 10.00 H new ATOM 0 HD3 LYS A 87 2.678 6.997 -18.073 1.00 10.00 H new ATOM 0 HE2 LYS A 87 4.546 6.809 -16.530 1.00 10.00 H new ATOM 0 HE3 LYS A 87 4.345 5.073 -16.393 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 6.161 5.633 -17.849 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 4.933 4.849 -18.721 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 5.128 6.530 -18.854 1.00 10.00 H new ATOM 1383 N LYS A 88 -0.528 6.251 -14.201 1.00 10.00 N ATOM 1384 CA LYS A 88 -1.793 5.573 -13.974 1.00 10.00 C ATOM 1385 C LYS A 88 -1.770 4.155 -14.549 1.00 10.00 C ATOM 1386 O LYS A 88 -2.260 3.213 -13.933 1.00 10.00 O ATOM 1387 CB LYS A 88 -2.936 6.404 -14.570 1.00 10.00 C ATOM 1388 CG LYS A 88 -4.285 5.720 -14.301 1.00 10.00 C ATOM 1389 CD LYS A 88 -5.468 6.615 -14.690 1.00 10.00 C ATOM 1390 CE LYS A 88 -5.969 6.294 -16.105 1.00 10.00 C ATOM 1391 NZ LYS A 88 -7.083 7.180 -16.501 1.00 10.00 N ATOM 0 H LYS A 88 -0.621 7.088 -14.776 1.00 10.00 H new ATOM 0 HA LYS A 88 -1.957 5.478 -12.901 1.00 10.00 H new ATOM 0 HB2 LYS A 88 -2.934 7.404 -14.135 1.00 10.00 H new ATOM 0 HB3 LYS A 88 -2.788 6.523 -15.643 1.00 10.00 H new ATOM 0 HG2 LYS A 88 -4.337 4.786 -14.861 1.00 10.00 H new ATOM 0 HG3 LYS A 88 -4.357 5.462 -13.244 1.00 10.00 H new ATOM 0 HD2 LYS A 88 -6.280 6.480 -13.975 1.00 10.00 H new ATOM 0 HD3 LYS A 88 -5.168 7.662 -14.637 1.00 10.00 H new ATOM 0 HE2 LYS A 88 -5.149 6.400 -16.815 1.00 10.00 H new ATOM 0 HE3 LYS A 88 -6.296 5.255 -16.149 1.00 10.00 H new ATOM 0 HZ1 LYS A 88 -7.397 6.935 -17.462 1.00 10.00 H new ATOM 0 HZ2 LYS A 88 -7.875 7.060 -15.837 1.00 10.00 H new ATOM 0 HZ3 LYS A 88 -6.763 8.169 -16.483 1.00 10.00 H new ATOM 1405 N THR A 89 -1.213 4.009 -15.751 1.00 10.00 N ATOM 1406 CA THR A 89 -1.084 2.734 -16.430 1.00 10.00 C ATOM 1407 C THR A 89 -0.464 1.704 -15.489 1.00 10.00 C ATOM 1408 O THR A 89 -1.074 0.690 -15.153 1.00 10.00 O ATOM 1409 CB THR A 89 -0.229 2.970 -17.679 1.00 10.00 C ATOM 1410 OG1 THR A 89 -0.840 3.994 -18.438 1.00 10.00 O ATOM 1411 CG2 THR A 89 -0.087 1.701 -18.512 1.00 10.00 C ATOM 0 H THR A 89 -0.834 4.792 -16.284 1.00 10.00 H new ATOM 0 HA THR A 89 -2.054 2.337 -16.728 1.00 10.00 H new ATOM 0 HB THR A 89 0.777 3.264 -17.379 1.00 10.00 H new ATOM 0 HG1 THR A 89 -0.309 4.165 -19.244 1.00 10.00 H new ATOM 0 HG21 THR A 89 0.526 1.908 -19.389 1.00 10.00 H new ATOM 0 HG22 THR A 89 0.388 0.924 -17.913 1.00 10.00 H new ATOM 0 HG23 THR A 89 -1.073 1.362 -18.830 1.00 10.00 H new ATOM 1419 N GLU A 90 0.738 2.018 -15.014 1.00 10.00 N ATOM 1420 CA GLU A 90 1.419 1.185 -14.057 1.00 10.00 C ATOM 1421 C GLU A 90 0.602 1.045 -12.776 1.00 10.00 C ATOM 1422 O GLU A 90 0.554 -0.046 -12.223 1.00 10.00 O ATOM 1423 CB GLU A 90 2.782 1.785 -13.742 1.00 10.00 C ATOM 1424 CG GLU A 90 3.900 1.229 -14.635 1.00 10.00 C ATOM 1425 CD GLU A 90 3.731 1.572 -16.109 1.00 10.00 C ATOM 1426 OE1 GLU A 90 4.044 2.731 -16.459 1.00 10.00 O ATOM 1427 OE2 GLU A 90 3.338 0.663 -16.865 1.00 10.00 O ATOM 0 H GLU A 90 1.255 2.854 -15.286 1.00 10.00 H new ATOM 0 HA GLU A 90 1.546 0.192 -14.488 1.00 10.00 H new ATOM 0 HB2 GLU A 90 2.733 2.867 -13.861 1.00 10.00 H new ATOM 0 HB3 GLU A 90 3.027 1.590 -12.698 1.00 10.00 H new ATOM 0 HG2 GLU A 90 4.858 1.617 -14.288 1.00 10.00 H new ATOM 0 HG3 GLU A 90 3.936 0.145 -14.525 1.00 10.00 H new ATOM 1434 N ARG A 91 0.006 2.127 -12.257 1.00 10.00 N ATOM 1435 CA ARG A 91 -0.770 2.047 -11.028 1.00 10.00 C ATOM 1436 C ARG A 91 -1.801 0.919 -11.127 1.00 10.00 C ATOM 1437 O ARG A 91 -1.927 0.104 -10.209 1.00 10.00 O ATOM 1438 CB ARG A 91 -1.481 3.381 -10.745 1.00 10.00 C ATOM 1439 CG ARG A 91 -0.622 4.494 -10.134 1.00 10.00 C ATOM 1440 CD ARG A 91 -0.711 4.587 -8.605 1.00 10.00 C ATOM 1441 NE ARG A 91 0.192 3.664 -7.911 1.00 10.00 N ATOM 1442 CZ ARG A 91 -0.055 2.379 -7.621 1.00 10.00 C ATOM 1443 NH1 ARG A 91 -1.194 1.800 -7.998 1.00 10.00 N ATOM 1444 NH2 ARG A 91 0.844 1.680 -6.929 1.00 10.00 N ATOM 0 H ARG A 91 0.050 3.058 -12.671 1.00 10.00 H new ATOM 0 HA ARG A 91 -0.086 1.836 -10.206 1.00 10.00 H new ATOM 0 HB2 ARG A 91 -1.902 3.749 -11.681 1.00 10.00 H new ATOM 0 HB3 ARG A 91 -2.317 3.187 -10.073 1.00 10.00 H new ATOM 0 HG2 ARG A 91 0.418 4.332 -10.417 1.00 10.00 H new ATOM 0 HG3 ARG A 91 -0.925 5.449 -10.563 1.00 10.00 H new ATOM 0 HD2 ARG A 91 -0.483 5.607 -8.297 1.00 10.00 H new ATOM 0 HD3 ARG A 91 -1.736 4.382 -8.295 1.00 10.00 H new ATOM 0 HE ARG A 91 1.096 4.036 -7.621 1.00 10.00 H new ATOM 0 HH11 ARG A 91 -1.892 2.336 -8.514 1.00 10.00 H new ATOM 0 HH12 ARG A 91 -1.368 0.821 -7.770 1.00 10.00 H new ATOM 0 HH21 ARG A 91 1.711 2.123 -6.625 1.00 10.00 H new ATOM 0 HH22 ARG A 91 0.665 0.701 -6.703 1.00 10.00 H new ATOM 1458 N GLU A 92 -2.518 0.895 -12.250 1.00 10.00 N ATOM 1459 CA GLU A 92 -3.573 -0.064 -12.532 1.00 10.00 C ATOM 1460 C GLU A 92 -2.964 -1.463 -12.587 1.00 10.00 C ATOM 1461 O GLU A 92 -3.371 -2.379 -11.870 1.00 10.00 O ATOM 1462 CB GLU A 92 -4.229 0.350 -13.858 1.00 10.00 C ATOM 1463 CG GLU A 92 -5.193 -0.695 -14.418 1.00 10.00 C ATOM 1464 CD GLU A 92 -6.393 -0.919 -13.517 1.00 10.00 C ATOM 1465 OE1 GLU A 92 -7.196 0.031 -13.419 1.00 10.00 O ATOM 1466 OE2 GLU A 92 -6.477 -2.040 -12.971 1.00 10.00 O ATOM 0 H GLU A 92 -2.373 1.563 -13.007 1.00 10.00 H new ATOM 0 HA GLU A 92 -4.340 -0.078 -11.757 1.00 10.00 H new ATOM 0 HB2 GLU A 92 -4.767 1.286 -13.710 1.00 10.00 H new ATOM 0 HB3 GLU A 92 -3.449 0.544 -14.594 1.00 10.00 H new ATOM 0 HG2 GLU A 92 -5.536 -0.378 -15.403 1.00 10.00 H new ATOM 0 HG3 GLU A 92 -4.663 -1.638 -14.554 1.00 10.00 H new ATOM 1473 N ASP A 93 -1.948 -1.609 -13.438 1.00 10.00 N ATOM 1474 CA ASP A 93 -1.190 -2.838 -13.601 1.00 10.00 C ATOM 1475 C ASP A 93 -0.806 -3.421 -12.232 1.00 10.00 C ATOM 1476 O ASP A 93 -1.010 -4.598 -11.938 1.00 10.00 O ATOM 1477 CB ASP A 93 0.045 -2.488 -14.432 1.00 10.00 C ATOM 1478 CG ASP A 93 0.469 -3.672 -15.256 1.00 10.00 C ATOM 1479 OD1 ASP A 93 -0.260 -3.916 -16.243 1.00 10.00 O ATOM 1480 OD2 ASP A 93 1.490 -4.283 -14.882 1.00 10.00 O ATOM 0 H ASP A 93 -1.626 -0.855 -14.045 1.00 10.00 H new ATOM 0 HA ASP A 93 -1.780 -3.603 -14.107 1.00 10.00 H new ATOM 0 HB2 ASP A 93 -0.174 -1.642 -15.083 1.00 10.00 H new ATOM 0 HB3 ASP A 93 0.860 -2.182 -13.775 1.00 10.00 H new ATOM 1485 N LEU A 94 -0.314 -2.549 -11.352 1.00 10.00 N ATOM 1486 CA LEU A 94 0.052 -2.873 -9.985 1.00 10.00 C ATOM 1487 C LEU A 94 -1.142 -3.418 -9.198 1.00 10.00 C ATOM 1488 O LEU A 94 -1.055 -4.518 -8.645 1.00 10.00 O ATOM 1489 CB LEU A 94 0.653 -1.634 -9.311 1.00 10.00 C ATOM 1490 CG LEU A 94 1.838 -2.000 -8.420 1.00 10.00 C ATOM 1491 CD1 LEU A 94 2.534 -0.733 -7.943 1.00 10.00 C ATOM 1492 CD2 LEU A 94 1.394 -2.780 -7.205 1.00 10.00 C ATOM 0 H LEU A 94 -0.157 -1.568 -11.584 1.00 10.00 H new ATOM 0 HA LEU A 94 0.802 -3.664 -9.999 1.00 10.00 H new ATOM 0 HB2 LEU A 94 0.975 -0.924 -10.073 1.00 10.00 H new ATOM 0 HB3 LEU A 94 -0.112 -1.136 -8.715 1.00 10.00 H new ATOM 0 HG LEU A 94 2.516 -2.615 -9.011 1.00 10.00 H new ATOM 0 HD11 LEU A 94 3.379 -0.999 -7.308 1.00 10.00 H new ATOM 0 HD12 LEU A 94 2.891 -0.168 -8.804 1.00 10.00 H new ATOM 0 HD13 LEU A 94 1.831 -0.123 -7.375 1.00 10.00 H new ATOM 0 HD21 LEU A 94 2.262 -3.024 -6.592 1.00 10.00 H new ATOM 0 HD22 LEU A 94 0.696 -2.179 -6.622 1.00 10.00 H new ATOM 0 HD23 LEU A 94 0.903 -3.700 -7.523 1.00 10.00 H new ATOM 1504 N ILE A 95 -2.249 -2.659 -9.132 1.00 10.00 N ATOM 1505 CA ILE A 95 -3.487 -3.138 -8.530 1.00 10.00 C ATOM 1506 C ILE A 95 -3.829 -4.530 -9.037 1.00 10.00 C ATOM 1507 O ILE A 95 -4.269 -5.359 -8.251 1.00 10.00 O ATOM 1508 CB ILE A 95 -4.655 -2.156 -8.769 1.00 10.00 C ATOM 1509 CG1 ILE A 95 -4.789 -1.184 -7.597 1.00 10.00 C ATOM 1510 CG2 ILE A 95 -6.015 -2.863 -8.934 1.00 10.00 C ATOM 1511 CD1 ILE A 95 -3.799 -0.029 -7.617 1.00 10.00 C ATOM 0 H ILE A 95 -2.303 -1.707 -9.493 1.00 10.00 H new ATOM 0 HA ILE A 95 -3.330 -3.196 -7.453 1.00 10.00 H new ATOM 0 HB ILE A 95 -4.412 -1.635 -9.695 1.00 10.00 H new ATOM 0 HG12 ILE A 95 -5.801 -0.778 -7.592 1.00 10.00 H new ATOM 0 HG13 ILE A 95 -4.663 -1.738 -6.666 1.00 10.00 H new ATOM 0 HG21 ILE A 95 -6.794 -2.119 -9.099 1.00 10.00 H new ATOM 0 HG22 ILE A 95 -5.972 -3.539 -9.788 1.00 10.00 H new ATOM 0 HG23 ILE A 95 -6.241 -3.432 -8.032 1.00 10.00 H new ATOM 0 HD11 ILE A 95 -3.967 0.609 -6.749 1.00 10.00 H new ATOM 0 HD12 ILE A 95 -2.782 -0.421 -7.588 1.00 10.00 H new ATOM 0 HD13 ILE A 95 -3.938 0.553 -8.528 1.00 10.00 H new ATOM 1523 N ALA A 96 -3.660 -4.789 -10.330 1.00 10.00 N ATOM 1524 CA ALA A 96 -3.957 -6.097 -10.898 1.00 10.00 C ATOM 1525 C ALA A 96 -3.249 -7.208 -10.148 1.00 10.00 C ATOM 1526 O ALA A 96 -3.874 -8.179 -9.724 1.00 10.00 O ATOM 1527 CB ALA A 96 -3.511 -6.157 -12.344 1.00 10.00 C ATOM 0 H ALA A 96 -3.317 -4.106 -11.006 1.00 10.00 H new ATOM 0 HA ALA A 96 -5.035 -6.237 -10.820 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -3.740 -7.140 -12.755 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -4.035 -5.393 -12.918 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -2.437 -5.981 -12.401 1.00 10.00 H new ATOM 1533 N TYR A 97 -1.930 -7.064 -10.013 1.00 10.00 N ATOM 1534 CA TYR A 97 -1.169 -8.031 -9.261 1.00 10.00 C ATOM 1535 C TYR A 97 -1.697 -8.073 -7.850 1.00 10.00 C ATOM 1536 O TYR A 97 -2.184 -9.114 -7.430 1.00 10.00 O ATOM 1537 CB TYR A 97 0.311 -7.699 -9.238 1.00 10.00 C ATOM 1538 CG TYR A 97 1.081 -8.557 -8.255 1.00 10.00 C ATOM 1539 CD1 TYR A 97 1.132 -9.949 -8.446 1.00 10.00 C ATOM 1540 CD2 TYR A 97 1.739 -7.977 -7.153 1.00 10.00 C ATOM 1541 CE1 TYR A 97 1.917 -10.745 -7.599 1.00 10.00 C ATOM 1542 CE2 TYR A 97 2.592 -8.764 -6.359 1.00 10.00 C ATOM 1543 CZ TYR A 97 2.700 -10.144 -6.601 1.00 10.00 C ATOM 1544 OH TYR A 97 3.682 -10.874 -6.001 1.00 10.00 O ATOM 0 H TYR A 97 -1.385 -6.299 -10.410 1.00 10.00 H new ATOM 0 HA TYR A 97 -1.279 -9.001 -9.745 1.00 10.00 H new ATOM 0 HB2 TYR A 97 0.726 -7.834 -10.237 1.00 10.00 H new ATOM 0 HB3 TYR A 97 0.441 -6.648 -8.978 1.00 10.00 H new ATOM 0 HD1 TYR A 97 0.567 -10.405 -9.245 1.00 10.00 H new ATOM 0 HD2 TYR A 97 1.589 -6.933 -6.919 1.00 10.00 H new ATOM 0 HE1 TYR A 97 1.919 -11.819 -7.715 1.00 10.00 H new ATOM 0 HE2 TYR A 97 3.164 -8.308 -5.564 1.00 10.00 H new ATOM 0 HH TYR A 97 4.138 -10.321 -5.332 1.00 10.00 H new ATOM 1554 N LEU A 98 -1.584 -6.944 -7.142 1.00 10.00 N ATOM 1555 CA LEU A 98 -2.022 -6.820 -5.761 1.00 10.00 C ATOM 1556 C LEU A 98 -3.356 -7.537 -5.554 1.00 10.00 C ATOM 1557 O LEU A 98 -3.488 -8.257 -4.580 1.00 10.00 O ATOM 1558 CB LEU A 98 -2.067 -5.348 -5.315 1.00 10.00 C ATOM 1559 CG LEU A 98 -1.021 -4.974 -4.242 1.00 10.00 C ATOM 1560 CD1 LEU A 98 -0.068 -3.936 -4.797 1.00 10.00 C ATOM 1561 CD2 LEU A 98 -1.650 -4.405 -2.968 1.00 10.00 C ATOM 0 H LEU A 98 -1.181 -6.087 -7.521 1.00 10.00 H new ATOM 0 HA LEU A 98 -1.289 -7.311 -5.121 1.00 10.00 H new ATOM 0 HB2 LEU A 98 -1.918 -4.712 -6.188 1.00 10.00 H new ATOM 0 HB3 LEU A 98 -3.062 -5.129 -4.927 1.00 10.00 H new ATOM 0 HG LEU A 98 -0.501 -5.897 -3.983 1.00 10.00 H new ATOM 0 HD11 LEU A 98 0.668 -3.675 -4.037 1.00 10.00 H new ATOM 0 HD12 LEU A 98 0.441 -4.340 -5.672 1.00 10.00 H new ATOM 0 HD13 LEU A 98 -0.627 -3.045 -5.082 1.00 10.00 H new ATOM 0 HD21 LEU A 98 -0.865 -4.161 -2.252 1.00 10.00 H new ATOM 0 HD22 LEU A 98 -2.212 -3.503 -3.211 1.00 10.00 H new ATOM 0 HD23 LEU A 98 -2.322 -5.145 -2.532 1.00 10.00 H new ATOM 1573 N LYS A 99 -4.344 -7.383 -6.441 1.00 10.00 N ATOM 1574 CA LYS A 99 -5.626 -8.060 -6.336 1.00 10.00 C ATOM 1575 C LYS A 99 -5.440 -9.547 -6.083 1.00 10.00 C ATOM 1576 O LYS A 99 -5.919 -10.061 -5.075 1.00 10.00 O ATOM 1577 CB LYS A 99 -6.499 -7.799 -7.574 1.00 10.00 C ATOM 1578 CG LYS A 99 -7.504 -6.676 -7.303 1.00 10.00 C ATOM 1579 CD LYS A 99 -8.590 -6.628 -8.391 1.00 10.00 C ATOM 1580 CE LYS A 99 -9.915 -6.087 -7.833 1.00 10.00 C ATOM 1581 NZ LYS A 99 -10.702 -7.133 -7.142 1.00 10.00 N ATOM 0 H LYS A 99 -4.268 -6.777 -7.258 1.00 10.00 H new ATOM 0 HA LYS A 99 -6.153 -7.646 -5.477 1.00 10.00 H new ATOM 0 HB2 LYS A 99 -5.867 -7.531 -8.421 1.00 10.00 H new ATOM 0 HB3 LYS A 99 -7.030 -8.710 -7.849 1.00 10.00 H new ATOM 0 HG2 LYS A 99 -7.968 -6.827 -6.328 1.00 10.00 H new ATOM 0 HG3 LYS A 99 -6.983 -5.720 -7.263 1.00 10.00 H new ATOM 0 HD2 LYS A 99 -8.255 -5.997 -9.215 1.00 10.00 H new ATOM 0 HD3 LYS A 99 -8.745 -7.627 -8.798 1.00 10.00 H new ATOM 0 HE2 LYS A 99 -9.709 -5.272 -7.139 1.00 10.00 H new ATOM 0 HE3 LYS A 99 -10.506 -5.669 -8.648 1.00 10.00 H new ATOM 0 HZ1 LYS A 99 -11.587 -6.721 -6.783 1.00 10.00 H new ATOM 0 HZ2 LYS A 99 -10.923 -7.899 -7.810 1.00 10.00 H new ATOM 0 HZ3 LYS A 99 -10.150 -7.515 -6.347 1.00 10.00 H new ATOM 1595 N LYS A 100 -4.735 -10.233 -6.979 1.00 10.00 N ATOM 1596 CA LYS A 100 -4.465 -11.635 -6.808 1.00 10.00 C ATOM 1597 C LYS A 100 -3.532 -11.835 -5.604 1.00 10.00 C ATOM 1598 O LYS A 100 -3.808 -12.683 -4.773 1.00 10.00 O ATOM 1599 CB LYS A 100 -3.945 -12.177 -8.144 1.00 10.00 C ATOM 1600 CG LYS A 100 -3.499 -13.636 -8.040 1.00 10.00 C ATOM 1601 CD LYS A 100 -4.289 -14.602 -8.935 1.00 10.00 C ATOM 1602 CE LYS A 100 -5.737 -14.792 -8.441 1.00 10.00 C ATOM 1603 NZ LYS A 100 -6.041 -16.209 -8.157 1.00 10.00 N ATOM 0 H LYS A 100 -4.344 -9.828 -7.830 1.00 10.00 H new ATOM 0 HA LYS A 100 -5.357 -12.212 -6.565 1.00 10.00 H new ATOM 0 HB2 LYS A 100 -4.727 -12.091 -8.898 1.00 10.00 H new ATOM 0 HB3 LYS A 100 -3.108 -11.566 -8.481 1.00 10.00 H new ATOM 0 HG2 LYS A 100 -2.442 -13.700 -8.299 1.00 10.00 H new ATOM 0 HG3 LYS A 100 -3.593 -13.960 -7.003 1.00 10.00 H new ATOM 0 HD2 LYS A 100 -4.301 -14.222 -9.957 1.00 10.00 H new ATOM 0 HD3 LYS A 100 -3.785 -15.568 -8.960 1.00 10.00 H new ATOM 0 HE2 LYS A 100 -5.894 -14.199 -7.540 1.00 10.00 H new ATOM 0 HE3 LYS A 100 -6.430 -14.416 -9.194 1.00 10.00 H new ATOM 0 HZ1 LYS A 100 -7.018 -16.292 -7.811 1.00 10.00 H new ATOM 0 HZ2 LYS A 100 -5.933 -16.768 -9.027 1.00 10.00 H new ATOM 0 HZ3 LYS A 100 -5.386 -16.566 -7.432 1.00 10.00 H new ATOM 1617 N ALA A 101 -2.454 -11.062 -5.492 1.00 10.00 N ATOM 1618 CA ALA A 101 -1.383 -11.257 -4.518 1.00 10.00 C ATOM 1619 C ALA A 101 -1.905 -11.190 -3.077 1.00 10.00 C ATOM 1620 O ALA A 101 -1.658 -12.044 -2.235 1.00 10.00 O ATOM 1621 CB ALA A 101 -0.304 -10.191 -4.757 1.00 10.00 C ATOM 0 H ALA A 101 -2.297 -10.256 -6.097 1.00 10.00 H new ATOM 0 HA ALA A 101 -0.959 -12.252 -4.652 1.00 10.00 H new ATOM 0 HB1 ALA A 101 0.504 -10.323 -4.037 1.00 10.00 H new ATOM 0 HB2 ALA A 101 0.091 -10.293 -5.768 1.00 10.00 H new ATOM 0 HB3 ALA A 101 -0.739 -9.199 -4.636 1.00 10.00 H new ATOM 1627 N THR A 102 -2.633 -10.121 -2.778 1.00 10.00 N ATOM 1628 CA THR A 102 -3.260 -9.907 -1.490 1.00 10.00 C ATOM 1629 C THR A 102 -4.243 -11.043 -1.204 1.00 10.00 C ATOM 1630 O THR A 102 -4.248 -11.600 -0.109 1.00 10.00 O ATOM 1631 CB THR A 102 -3.965 -8.547 -1.496 1.00 10.00 C ATOM 1632 OG1 THR A 102 -5.024 -8.529 -2.424 1.00 10.00 O ATOM 1633 CG2 THR A 102 -3.015 -7.384 -1.795 1.00 10.00 C ATOM 0 H THR A 102 -2.804 -9.366 -3.442 1.00 10.00 H new ATOM 0 HA THR A 102 -2.510 -9.904 -0.699 1.00 10.00 H new ATOM 0 HB THR A 102 -4.355 -8.410 -0.487 1.00 10.00 H new ATOM 0 HG1 THR A 102 -4.661 -8.527 -3.334 1.00 10.00 H new ATOM 0 HG21 THR A 102 -3.572 -6.447 -1.786 1.00 10.00 H new ATOM 0 HG22 THR A 102 -2.233 -7.349 -1.036 1.00 10.00 H new ATOM 0 HG23 THR A 102 -2.562 -7.527 -2.776 1.00 10.00 H new ATOM 1641 N ASN A 103 -5.080 -11.361 -2.199 1.00 10.00 N ATOM 1642 CA ASN A 103 -6.057 -12.436 -2.142 1.00 10.00 C ATOM 1643 C ASN A 103 -5.395 -13.783 -1.825 1.00 10.00 C ATOM 1644 O ASN A 103 -5.894 -14.499 -0.958 1.00 10.00 O ATOM 1645 CB ASN A 103 -6.872 -12.441 -3.447 1.00 10.00 C ATOM 1646 CG ASN A 103 -7.949 -13.520 -3.539 1.00 10.00 C ATOM 1647 OD1 ASN A 103 -7.724 -14.689 -3.257 1.00 10.00 O ATOM 1648 ND2 ASN A 103 -9.143 -13.149 -3.999 1.00 10.00 N ATOM 0 H ASN A 103 -5.090 -10.859 -3.087 1.00 10.00 H new ATOM 0 HA ASN A 103 -6.751 -12.264 -1.319 1.00 10.00 H new ATOM 0 HB2 ASN A 103 -7.346 -11.467 -3.564 1.00 10.00 H new ATOM 0 HB3 ASN A 103 -6.185 -12.564 -4.285 1.00 10.00 H new ATOM 0 HD21 ASN A 103 -9.881 -13.843 -4.119 1.00 10.00 H new ATOM 0 HD22 ASN A 103 -9.319 -12.171 -4.231 1.00 10.00 H new ATOM 1655 N GLU A 104 -4.301 -14.133 -2.511 1.00 10.00 N ATOM 1656 CA GLU A 104 -3.682 -15.449 -2.435 1.00 10.00 C ATOM 1657 C GLU A 104 -2.146 -15.383 -2.414 1.00 10.00 C ATOM 1658 O GLU A 104 -1.567 -16.061 -1.529 1.00 10.00 O ATOM 1659 CB GLU A 104 -4.246 -16.356 -3.546 1.00 10.00 C ATOM 1660 CG GLU A 104 -3.945 -15.906 -4.989 1.00 10.00 C ATOM 1661 CD GLU A 104 -3.393 -17.033 -5.854 1.00 10.00 C ATOM 1662 OE1 GLU A 104 -2.350 -17.610 -5.487 1.00 10.00 O ATOM 1663 OE2 GLU A 104 -4.043 -17.295 -6.892 1.00 10.00 O ATOM 1664 OXT GLU A 104 -1.560 -14.688 -3.270 1.00 10.00 O ATOM 0 H GLU A 104 -3.818 -13.495 -3.143 1.00 10.00 H new ATOM 0 HA GLU A 104 -3.944 -15.900 -1.478 1.00 10.00 H new ATOM 0 HB2 GLU A 104 -3.848 -17.361 -3.407 1.00 10.00 H new ATOM 0 HB3 GLU A 104 -5.327 -16.422 -3.423 1.00 10.00 H new ATOM 0 HG2 GLU A 104 -4.858 -15.519 -5.442 1.00 10.00 H new ATOM 0 HG3 GLU A 104 -3.228 -15.086 -4.967 1.00 10.00 H new