USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1011 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 94 ASN : amide:sc= 0.00625 K(o=2,f=1.3) USER MOD Set 1.2: A 106 TYR OH : rot 7:sc= 1.95 USER MOD Set 2.1: A 56 SER OG : rot 150:sc= 0 USER MOD Set 2.2: A 85 MET CE :methyl 157:sc= -0.207 (180deg=-1.11) USER MOD Set 3.1: A 63 MET CE :methyl -124:sc= 0 (180deg=-0.26) USER MOD Set 3.2: A 71 THR OG1 : rot 71:sc= 1.22 USER MOD Set 4.1: A 44 ASN : amide:sc= 1.01 K(o=1.5,f=0.38) USER MOD Set 4.2: A 47 GLN : amide:sc= 0.509 K(o=1.5,f=0.38) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 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 15 SER OG : rot 180:sc= 0.63 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl -170:sc= -0.101 (180deg=-0.187) USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= -0.289 K(o=-0.29,f=-1.1) USER MOD Single : A 32 ASN : amide:sc= -0.52 K(o=-0.52,f=-4.2!) USER MOD Single : A 45 LYS NZ :NH3+ -176:sc= 0.404 (180deg=0.323) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= -0.0105 X(o=-0.011,f=-0.11) USER MOD Single : A 60 MET CE :methyl -142:sc= 0 (180deg=-0.534) USER MOD Single : A 62 ASN : amide:sc= 1.14 K(o=1.1,f=-0.0033) USER MOD Single : A 70 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.0016) USER MOD Single : A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 64:sc= 1.4 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 137:sc= 1.13 (180deg=0.0666) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=-0.047) USER MOD Single : A 104 SER OG : rot -38:sc= 1.24 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot 180:sc= -0.793 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 122 LYS NZ :NH3+ -138:sc= 1.26 (180deg=0.455) USER MOD Single : A 126 LYS NZ :NH3+ 170:sc= -0.125 (180deg=-0.283) USER MOD Single : A 129 MET CE :methyl -142:sc= -0.131 (180deg=-0.69) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 19.847 -20.257 -1.807 1.00 0.00 N ATOM 2 CA MET A 1 19.259 -19.987 -0.493 1.00 0.00 C ATOM 3 C MET A 1 19.112 -18.490 -0.311 1.00 0.00 C ATOM 4 O MET A 1 20.087 -17.752 -0.457 1.00 0.00 O ATOM 5 CB MET A 1 20.084 -20.633 0.620 1.00 0.00 C ATOM 6 CG MET A 1 19.261 -20.704 1.906 1.00 0.00 C ATOM 7 SD MET A 1 20.065 -21.609 3.248 1.00 0.00 S ATOM 8 CE MET A 1 18.595 -22.107 4.175 1.00 0.00 C ATOM 0 H1 MET A 1 19.950 -21.284 -1.937 1.00 0.00 H new ATOM 0 H2 MET A 1 19.228 -19.874 -2.550 1.00 0.00 H new ATOM 0 H3 MET A 1 20.781 -19.805 -1.869 1.00 0.00 H new ATOM 0 HA MET A 1 18.267 -20.435 -0.436 1.00 0.00 H new ATOM 0 HB2 MET A 1 20.393 -21.634 0.320 1.00 0.00 H new ATOM 0 HB3 MET A 1 20.993 -20.057 0.792 1.00 0.00 H new ATOM 0 HG2 MET A 1 19.046 -19.690 2.244 1.00 0.00 H new ATOM 0 HG3 MET A 1 18.304 -21.176 1.686 1.00 0.00 H new ATOM 0 HE1 MET A 1 18.895 -22.683 5.050 1.00 0.00 H new ATOM 0 HE2 MET A 1 18.048 -21.220 4.494 1.00 0.00 H new ATOM 0 HE3 MET A 1 17.954 -22.719 3.540 1.00 0.00 H new ATOM 20 N ALA A 2 17.893 -18.037 -0.033 1.00 0.00 N ATOM 21 CA ALA A 2 17.551 -16.638 0.146 1.00 0.00 C ATOM 22 C ALA A 2 16.406 -16.544 1.160 1.00 0.00 C ATOM 23 O ALA A 2 16.214 -17.432 1.993 1.00 0.00 O ATOM 24 CB ALA A 2 17.199 -16.040 -1.226 1.00 0.00 C ATOM 0 H ALA A 2 17.092 -18.659 0.077 1.00 0.00 H new ATOM 0 HA ALA A 2 18.385 -16.060 0.544 1.00 0.00 H new ATOM 0 HB1 ALA A 2 16.939 -14.988 -1.109 1.00 0.00 H new ATOM 0 HB2 ALA A 2 18.056 -16.130 -1.893 1.00 0.00 H new ATOM 0 HB3 ALA A 2 16.351 -16.578 -1.651 1.00 0.00 H new ATOM 30 N ASP A 3 15.656 -15.450 1.101 1.00 0.00 N ATOM 31 CA ASP A 3 14.433 -15.184 1.854 1.00 0.00 C ATOM 32 C ASP A 3 13.295 -15.083 0.837 1.00 0.00 C ATOM 33 O ASP A 3 13.542 -15.223 -0.364 1.00 0.00 O ATOM 34 CB ASP A 3 14.595 -13.861 2.617 1.00 0.00 C ATOM 35 CG ASP A 3 15.707 -13.927 3.655 1.00 0.00 C ATOM 36 OD1 ASP A 3 15.599 -14.744 4.597 1.00 0.00 O ATOM 37 OD2 ASP A 3 16.683 -13.146 3.563 1.00 0.00 O ATOM 0 H ASP A 3 15.901 -14.674 0.486 1.00 0.00 H new ATOM 0 HA ASP A 3 14.223 -15.972 2.577 1.00 0.00 H new ATOM 0 HB2 ASP A 3 14.808 -13.060 1.910 1.00 0.00 H new ATOM 0 HB3 ASP A 3 13.655 -13.610 3.109 1.00 0.00 H new ATOM 42 N LYS A 4 12.056 -14.793 1.258 1.00 0.00 N ATOM 43 CA LYS A 4 11.085 -14.253 0.298 1.00 0.00 C ATOM 44 C LYS A 4 11.598 -12.919 -0.231 1.00 0.00 C ATOM 45 O LYS A 4 11.448 -12.635 -1.422 1.00 0.00 O ATOM 46 CB LYS A 4 9.682 -14.063 0.910 1.00 0.00 C ATOM 47 CG LYS A 4 8.809 -15.315 0.819 1.00 0.00 C ATOM 48 CD LYS A 4 9.073 -16.285 1.967 1.00 0.00 C ATOM 49 CE LYS A 4 8.377 -15.832 3.255 1.00 0.00 C ATOM 50 NZ LYS A 4 9.016 -16.428 4.443 1.00 0.00 N ATOM 0 H LYS A 4 11.714 -14.916 2.211 1.00 0.00 H new ATOM 0 HA LYS A 4 10.984 -14.978 -0.510 1.00 0.00 H new ATOM 0 HB2 LYS A 4 9.785 -13.776 1.956 1.00 0.00 H new ATOM 0 HB3 LYS A 4 9.180 -13.240 0.402 1.00 0.00 H new ATOM 0 HG2 LYS A 4 7.758 -15.025 0.825 1.00 0.00 H new ATOM 0 HG3 LYS A 4 8.995 -15.818 -0.130 1.00 0.00 H new ATOM 0 HD2 LYS A 4 8.722 -17.280 1.693 1.00 0.00 H new ATOM 0 HD3 LYS A 4 10.146 -16.363 2.140 1.00 0.00 H new ATOM 0 HE2 LYS A 4 8.411 -14.745 3.327 1.00 0.00 H new ATOM 0 HE3 LYS A 4 7.325 -16.117 3.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 8.525 -16.104 5.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 8.961 -17.465 4.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 10.013 -16.136 4.484 1.00 0.00 H new ATOM 64 N GLU A 5 12.213 -12.134 0.661 1.00 0.00 N ATOM 65 CA GLU A 5 12.427 -10.702 0.515 1.00 0.00 C ATOM 66 C GLU A 5 11.094 -10.089 0.095 1.00 0.00 C ATOM 67 O GLU A 5 10.940 -9.617 -1.030 1.00 0.00 O ATOM 68 CB GLU A 5 13.596 -10.386 -0.435 1.00 0.00 C ATOM 69 CG GLU A 5 14.865 -11.183 -0.129 1.00 0.00 C ATOM 70 CD GLU A 5 16.020 -10.718 -1.002 1.00 0.00 C ATOM 71 OE1 GLU A 5 15.968 -10.889 -2.242 1.00 0.00 O ATOM 72 OE2 GLU A 5 17.010 -10.191 -0.446 1.00 0.00 O ATOM 0 H GLU A 5 12.587 -12.500 1.536 1.00 0.00 H new ATOM 0 HA GLU A 5 12.738 -10.253 1.458 1.00 0.00 H new ATOM 0 HB2 GLU A 5 13.286 -10.591 -1.460 1.00 0.00 H new ATOM 0 HB3 GLU A 5 13.823 -9.321 -0.377 1.00 0.00 H new ATOM 0 HG2 GLU A 5 15.128 -11.066 0.922 1.00 0.00 H new ATOM 0 HG3 GLU A 5 14.682 -12.245 -0.296 1.00 0.00 H new ATOM 79 N LEU A 6 10.100 -10.193 0.985 1.00 0.00 N ATOM 80 CA LEU A 6 8.731 -9.760 0.733 1.00 0.00 C ATOM 81 C LEU A 6 8.742 -8.299 0.293 1.00 0.00 C ATOM 82 O LEU A 6 9.023 -7.410 1.093 1.00 0.00 O ATOM 83 CB LEU A 6 7.866 -9.966 1.981 1.00 0.00 C ATOM 84 CG LEU A 6 6.431 -9.452 1.736 1.00 0.00 C ATOM 85 CD1 LEU A 6 5.413 -10.580 1.889 1.00 0.00 C ATOM 86 CD2 LEU A 6 6.076 -8.296 2.665 1.00 0.00 C ATOM 0 H LEU A 6 10.233 -10.588 1.916 1.00 0.00 H new ATOM 0 HA LEU A 6 8.295 -10.361 -0.065 1.00 0.00 H new ATOM 0 HB2 LEU A 6 7.840 -11.024 2.242 1.00 0.00 H new ATOM 0 HB3 LEU A 6 8.307 -9.440 2.827 1.00 0.00 H new ATOM 0 HG LEU A 6 6.395 -9.082 0.711 1.00 0.00 H new ATOM 0 HD11 LEU A 6 4.410 -10.192 1.711 1.00 0.00 H new ATOM 0 HD12 LEU A 6 5.631 -11.367 1.167 1.00 0.00 H new ATOM 0 HD13 LEU A 6 5.471 -10.988 2.898 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.058 -7.964 2.460 1.00 0.00 H new ATOM 0 HD22 LEU A 6 6.148 -8.627 3.701 1.00 0.00 H new ATOM 0 HD23 LEU A 6 6.768 -7.470 2.499 1.00 0.00 H new ATOM 98 N LYS A 7 8.504 -8.067 -0.998 1.00 0.00 N ATOM 99 CA LYS A 7 8.827 -6.772 -1.580 1.00 0.00 C ATOM 100 C LYS A 7 7.705 -5.799 -1.291 1.00 0.00 C ATOM 101 O LYS A 7 6.535 -6.158 -1.474 1.00 0.00 O ATOM 102 CB LYS A 7 9.129 -6.890 -3.075 1.00 0.00 C ATOM 103 CG LYS A 7 10.145 -5.825 -3.507 1.00 0.00 C ATOM 104 CD LYS A 7 10.809 -6.208 -4.821 1.00 0.00 C ATOM 105 CE LYS A 7 12.224 -5.631 -4.925 1.00 0.00 C ATOM 106 NZ LYS A 7 13.069 -6.368 -5.882 1.00 0.00 N ATOM 0 H LYS A 7 8.098 -8.743 -1.645 1.00 0.00 H new ATOM 0 HA LYS A 7 9.738 -6.388 -1.120 1.00 0.00 H new ATOM 0 HB2 LYS A 7 9.520 -7.883 -3.295 1.00 0.00 H new ATOM 0 HB3 LYS A 7 8.209 -6.775 -3.647 1.00 0.00 H new ATOM 0 HG2 LYS A 7 9.645 -4.862 -3.615 1.00 0.00 H new ATOM 0 HG3 LYS A 7 10.903 -5.705 -2.733 1.00 0.00 H new ATOM 0 HD2 LYS A 7 10.851 -7.294 -4.906 1.00 0.00 H new ATOM 0 HD3 LYS A 7 10.206 -5.846 -5.654 1.00 0.00 H new ATOM 0 HE2 LYS A 7 12.165 -4.586 -5.229 1.00 0.00 H new ATOM 0 HE3 LYS A 7 12.693 -5.651 -3.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 14.015 -5.937 -5.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 13.151 -7.360 -5.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 12.638 -6.328 -6.828 1.00 0.00 H new ATOM 120 N PHE A 8 8.064 -4.585 -0.884 1.00 0.00 N ATOM 121 CA PHE A 8 7.133 -3.604 -0.355 1.00 0.00 C ATOM 122 C PHE A 8 7.009 -2.486 -1.381 1.00 0.00 C ATOM 123 O PHE A 8 7.741 -1.498 -1.308 1.00 0.00 O ATOM 124 CB PHE A 8 7.619 -3.090 1.015 1.00 0.00 C ATOM 125 CG PHE A 8 6.944 -3.648 2.246 1.00 0.00 C ATOM 126 CD1 PHE A 8 5.785 -3.016 2.725 1.00 0.00 C ATOM 127 CD2 PHE A 8 7.529 -4.690 2.986 1.00 0.00 C ATOM 128 CE1 PHE A 8 5.208 -3.409 3.942 1.00 0.00 C ATOM 129 CE2 PHE A 8 6.951 -5.086 4.204 1.00 0.00 C ATOM 130 CZ PHE A 8 5.796 -4.445 4.689 1.00 0.00 C ATOM 0 H PHE A 8 9.028 -4.253 -0.915 1.00 0.00 H new ATOM 0 HA PHE A 8 6.150 -4.045 -0.187 1.00 0.00 H new ATOM 0 HB2 PHE A 8 8.686 -3.297 1.093 1.00 0.00 H new ATOM 0 HB3 PHE A 8 7.502 -2.006 1.029 1.00 0.00 H new ATOM 0 HD1 PHE A 8 5.334 -2.220 2.151 1.00 0.00 H new ATOM 0 HD2 PHE A 8 8.418 -5.183 2.621 1.00 0.00 H new ATOM 0 HE1 PHE A 8 4.316 -2.918 4.303 1.00 0.00 H new ATOM 0 HE2 PHE A 8 7.397 -5.889 4.772 1.00 0.00 H new ATOM 0 HZ PHE A 8 5.363 -4.748 5.631 1.00 0.00 H new ATOM 140 N LEU A 9 6.135 -2.635 -2.377 1.00 0.00 N ATOM 141 CA LEU A 9 5.924 -1.555 -3.330 1.00 0.00 C ATOM 142 C LEU A 9 5.208 -0.405 -2.624 1.00 0.00 C ATOM 143 O LEU A 9 4.277 -0.658 -1.855 1.00 0.00 O ATOM 144 CB LEU A 9 5.096 -2.046 -4.525 1.00 0.00 C ATOM 145 CG LEU A 9 5.041 -1.008 -5.657 1.00 0.00 C ATOM 146 CD1 LEU A 9 6.405 -0.823 -6.325 1.00 0.00 C ATOM 147 CD2 LEU A 9 4.032 -1.450 -6.708 1.00 0.00 C ATOM 0 H LEU A 9 5.576 -3.473 -2.540 1.00 0.00 H new ATOM 0 HA LEU A 9 6.887 -1.210 -3.707 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.524 -2.974 -4.905 1.00 0.00 H new ATOM 0 HB3 LEU A 9 4.083 -2.274 -4.194 1.00 0.00 H new ATOM 0 HG LEU A 9 4.743 -0.056 -5.217 1.00 0.00 H new ATOM 0 HD11 LEU A 9 6.323 -0.081 -7.120 1.00 0.00 H new ATOM 0 HD12 LEU A 9 7.130 -0.484 -5.585 1.00 0.00 H new ATOM 0 HD13 LEU A 9 6.735 -1.772 -6.747 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.995 -0.712 -7.510 1.00 0.00 H new ATOM 0 HD22 LEU A 9 4.331 -2.415 -7.117 1.00 0.00 H new ATOM 0 HD23 LEU A 9 3.046 -1.539 -6.251 1.00 0.00 H new ATOM 159 N VAL A 10 5.606 0.834 -2.914 1.00 0.00 N ATOM 160 CA VAL A 10 4.959 2.037 -2.397 1.00 0.00 C ATOM 161 C VAL A 10 4.729 2.994 -3.575 1.00 0.00 C ATOM 162 O VAL A 10 5.693 3.356 -4.255 1.00 0.00 O ATOM 163 CB VAL A 10 5.816 2.654 -1.268 1.00 0.00 C ATOM 164 CG1 VAL A 10 4.985 3.656 -0.460 1.00 0.00 C ATOM 165 CG2 VAL A 10 6.360 1.616 -0.266 1.00 0.00 C ATOM 0 H VAL A 10 6.399 1.031 -3.524 1.00 0.00 H new ATOM 0 HA VAL A 10 3.991 1.810 -1.950 1.00 0.00 H new ATOM 0 HB VAL A 10 6.658 3.127 -1.774 1.00 0.00 H new ATOM 0 HG11 VAL A 10 5.600 4.084 0.332 1.00 0.00 H new ATOM 0 HG12 VAL A 10 4.635 4.452 -1.117 1.00 0.00 H new ATOM 0 HG13 VAL A 10 4.128 3.146 -0.019 1.00 0.00 H new ATOM 0 HG21 VAL A 10 6.951 2.122 0.497 1.00 0.00 H new ATOM 0 HG22 VAL A 10 5.527 1.095 0.207 1.00 0.00 H new ATOM 0 HG23 VAL A 10 6.987 0.896 -0.792 1.00 0.00 H new ATOM 175 N VAL A 11 3.477 3.375 -3.856 1.00 0.00 N ATOM 176 CA VAL A 11 3.105 4.241 -4.983 1.00 0.00 C ATOM 177 C VAL A 11 2.230 5.376 -4.438 1.00 0.00 C ATOM 178 O VAL A 11 1.019 5.455 -4.670 1.00 0.00 O ATOM 179 CB VAL A 11 2.475 3.431 -6.145 1.00 0.00 C ATOM 180 CG1 VAL A 11 2.560 4.192 -7.477 1.00 0.00 C ATOM 181 CG2 VAL A 11 3.167 2.069 -6.326 1.00 0.00 C ATOM 0 H VAL A 11 2.677 3.084 -3.295 1.00 0.00 H new ATOM 0 HA VAL A 11 3.986 4.694 -5.437 1.00 0.00 H new ATOM 0 HB VAL A 11 1.430 3.279 -5.875 1.00 0.00 H new ATOM 0 HG11 VAL A 11 2.108 3.593 -8.268 1.00 0.00 H new ATOM 0 HG12 VAL A 11 2.027 5.139 -7.390 1.00 0.00 H new ATOM 0 HG13 VAL A 11 3.605 4.385 -7.720 1.00 0.00 H new ATOM 0 HG21 VAL A 11 2.699 1.529 -7.149 1.00 0.00 H new ATOM 0 HG22 VAL A 11 4.223 2.224 -6.548 1.00 0.00 H new ATOM 0 HG23 VAL A 11 3.070 1.487 -5.409 1.00 0.00 H new ATOM 191 N ASP A 12 2.848 6.216 -3.611 1.00 0.00 N ATOM 192 CA ASP A 12 2.180 7.329 -2.953 1.00 0.00 C ATOM 193 C ASP A 12 2.319 8.559 -3.844 1.00 0.00 C ATOM 194 O ASP A 12 3.429 9.089 -3.978 1.00 0.00 O ATOM 195 CB ASP A 12 2.739 7.606 -1.551 1.00 0.00 C ATOM 196 CG ASP A 12 2.669 6.439 -0.555 1.00 0.00 C ATOM 197 OD1 ASP A 12 1.984 5.432 -0.835 1.00 0.00 O ATOM 198 OD2 ASP A 12 3.361 6.562 0.480 1.00 0.00 O ATOM 0 H ASP A 12 3.838 6.139 -3.378 1.00 0.00 H new ATOM 0 HA ASP A 12 1.130 7.074 -2.812 1.00 0.00 H new ATOM 0 HB2 ASP A 12 3.781 7.910 -1.651 1.00 0.00 H new ATOM 0 HB3 ASP A 12 2.199 8.452 -1.127 1.00 0.00 H new ATOM 203 N ASP A 13 1.222 9.038 -4.435 1.00 0.00 N ATOM 204 CA ASP A 13 1.178 10.203 -5.332 1.00 0.00 C ATOM 205 C ASP A 13 1.926 11.406 -4.767 1.00 0.00 C ATOM 206 O ASP A 13 2.694 12.057 -5.482 1.00 0.00 O ATOM 207 CB ASP A 13 -0.270 10.636 -5.584 1.00 0.00 C ATOM 208 CG ASP A 13 -0.329 12.050 -6.188 1.00 0.00 C ATOM 209 OD1 ASP A 13 0.077 12.220 -7.362 1.00 0.00 O ATOM 210 OD2 ASP A 13 -0.656 13.026 -5.467 1.00 0.00 O ATOM 0 H ASP A 13 0.305 8.612 -4.299 1.00 0.00 H new ATOM 0 HA ASP A 13 1.660 9.886 -6.257 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -0.752 9.929 -6.259 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -0.828 10.614 -4.648 1.00 0.00 H new ATOM 215 N PHE A 14 1.704 11.722 -3.489 1.00 0.00 N ATOM 216 CA PHE A 14 2.307 12.885 -2.851 1.00 0.00 C ATOM 217 C PHE A 14 3.840 12.823 -2.856 1.00 0.00 C ATOM 218 O PHE A 14 4.481 13.838 -2.592 1.00 0.00 O ATOM 219 CB PHE A 14 1.760 13.047 -1.425 1.00 0.00 C ATOM 220 CG PHE A 14 2.356 14.211 -0.648 1.00 0.00 C ATOM 221 CD1 PHE A 14 2.365 15.498 -1.216 1.00 0.00 C ATOM 222 CD2 PHE A 14 2.964 14.008 0.609 1.00 0.00 C ATOM 223 CE1 PHE A 14 2.984 16.563 -0.546 1.00 0.00 C ATOM 224 CE2 PHE A 14 3.562 15.084 1.288 1.00 0.00 C ATOM 225 CZ PHE A 14 3.569 16.362 0.711 1.00 0.00 C ATOM 0 H PHE A 14 1.102 11.177 -2.872 1.00 0.00 H new ATOM 0 HA PHE A 14 2.032 13.763 -3.435 1.00 0.00 H new ATOM 0 HB2 PHE A 14 0.679 13.177 -1.477 1.00 0.00 H new ATOM 0 HB3 PHE A 14 1.944 12.126 -0.872 1.00 0.00 H new ATOM 0 HD1 PHE A 14 1.893 15.667 -2.173 1.00 0.00 H new ATOM 0 HD2 PHE A 14 2.970 13.023 1.051 1.00 0.00 H new ATOM 0 HE1 PHE A 14 3.010 17.542 -1.001 1.00 0.00 H new ATOM 0 HE2 PHE A 14 4.016 14.926 2.255 1.00 0.00 H new ATOM 0 HZ PHE A 14 4.024 17.190 1.235 1.00 0.00 H new ATOM 235 N SER A 15 4.453 11.673 -3.160 1.00 0.00 N ATOM 236 CA SER A 15 5.888 11.479 -3.311 1.00 0.00 C ATOM 237 C SER A 15 6.520 11.438 -1.917 1.00 0.00 C ATOM 238 O SER A 15 6.937 10.373 -1.449 1.00 0.00 O ATOM 239 CB SER A 15 6.456 12.529 -4.297 1.00 0.00 C ATOM 240 OG SER A 15 7.682 12.156 -4.890 1.00 0.00 O ATOM 0 H SER A 15 3.928 10.812 -3.314 1.00 0.00 H new ATOM 0 HA SER A 15 6.139 10.523 -3.771 1.00 0.00 H new ATOM 0 HB2 SER A 15 5.723 12.707 -5.084 1.00 0.00 H new ATOM 0 HB3 SER A 15 6.592 13.472 -3.768 1.00 0.00 H new ATOM 0 HG SER A 15 7.979 12.863 -5.500 1.00 0.00 H new ATOM 246 N THR A 16 6.530 12.553 -1.194 1.00 0.00 N ATOM 247 CA THR A 16 7.042 12.637 0.163 1.00 0.00 C ATOM 248 C THR A 16 6.352 11.626 1.094 1.00 0.00 C ATOM 249 O THR A 16 7.005 11.113 2.001 1.00 0.00 O ATOM 250 CB THR A 16 6.940 14.102 0.605 1.00 0.00 C ATOM 251 OG1 THR A 16 7.828 14.850 -0.204 1.00 0.00 O ATOM 252 CG2 THR A 16 7.301 14.343 2.069 1.00 0.00 C ATOM 0 H THR A 16 6.174 13.442 -1.546 1.00 0.00 H new ATOM 0 HA THR A 16 8.091 12.347 0.212 1.00 0.00 H new ATOM 0 HB THR A 16 5.898 14.403 0.494 1.00 0.00 H new ATOM 0 HG1 THR A 16 7.786 15.795 0.052 1.00 0.00 H new ATOM 0 HG21 THR A 16 7.202 15.404 2.298 1.00 0.00 H new ATOM 0 HG22 THR A 16 6.630 13.770 2.708 1.00 0.00 H new ATOM 0 HG23 THR A 16 8.329 14.027 2.247 1.00 0.00 H new ATOM 260 N MET A 17 5.100 11.233 0.829 1.00 0.00 N ATOM 261 CA MET A 17 4.467 10.138 1.543 1.00 0.00 C ATOM 262 C MET A 17 5.292 8.853 1.421 1.00 0.00 C ATOM 263 O MET A 17 5.594 8.286 2.468 1.00 0.00 O ATOM 264 CB MET A 17 3.015 9.968 1.084 1.00 0.00 C ATOM 265 CG MET A 17 2.029 10.607 2.070 1.00 0.00 C ATOM 266 SD MET A 17 0.501 11.271 1.348 1.00 0.00 S ATOM 267 CE MET A 17 -0.283 9.741 0.786 1.00 0.00 C ATOM 0 H MET A 17 4.509 11.666 0.119 1.00 0.00 H new ATOM 0 HA MET A 17 4.434 10.377 2.606 1.00 0.00 H new ATOM 0 HB2 MET A 17 2.889 10.419 0.100 1.00 0.00 H new ATOM 0 HB3 MET A 17 2.788 8.907 0.979 1.00 0.00 H new ATOM 0 HG2 MET A 17 1.760 9.862 2.819 1.00 0.00 H new ATOM 0 HG3 MET A 17 2.541 11.414 2.594 1.00 0.00 H new ATOM 0 HE1 MET A 17 -1.145 9.981 0.163 1.00 0.00 H new ATOM 0 HE2 MET A 17 0.432 9.157 0.206 1.00 0.00 H new ATOM 0 HE3 MET A 17 -0.610 9.161 1.649 1.00 0.00 H new ATOM 277 N ARG A 18 5.782 8.438 0.238 1.00 0.00 N ATOM 278 CA ARG A 18 6.522 7.188 0.170 1.00 0.00 C ATOM 279 C ARG A 18 7.878 7.281 0.854 1.00 0.00 C ATOM 280 O ARG A 18 8.416 6.261 1.279 1.00 0.00 O ATOM 281 CB ARG A 18 6.542 6.621 -1.259 1.00 0.00 C ATOM 282 CG ARG A 18 7.247 7.333 -2.423 1.00 0.00 C ATOM 283 CD ARG A 18 8.753 7.559 -2.229 1.00 0.00 C ATOM 284 NE ARG A 18 9.392 7.948 -3.490 1.00 0.00 N ATOM 285 CZ ARG A 18 9.333 9.138 -4.091 1.00 0.00 C ATOM 286 NH1 ARG A 18 8.955 10.200 -3.400 1.00 0.00 N ATOM 287 NH2 ARG A 18 9.634 9.262 -5.376 1.00 0.00 N ATOM 0 H ARG A 18 5.679 8.936 -0.646 1.00 0.00 H new ATOM 0 HA ARG A 18 5.987 6.441 0.756 1.00 0.00 H new ATOM 0 HB2 ARG A 18 6.980 5.625 -1.192 1.00 0.00 H new ATOM 0 HB3 ARG A 18 5.502 6.492 -1.557 1.00 0.00 H new ATOM 0 HG2 ARG A 18 7.097 6.749 -3.331 1.00 0.00 H new ATOM 0 HG3 ARG A 18 6.768 8.299 -2.582 1.00 0.00 H new ATOM 0 HD2 ARG A 18 8.915 8.335 -1.481 1.00 0.00 H new ATOM 0 HD3 ARG A 18 9.215 6.648 -1.849 1.00 0.00 H new ATOM 0 HE ARG A 18 9.943 7.229 -3.960 1.00 0.00 H new ATOM 0 HH11 ARG A 18 8.711 10.107 -2.414 1.00 0.00 H new ATOM 0 HH12 ARG A 18 8.908 11.113 -3.853 1.00 0.00 H new ATOM 0 HH21 ARG A 18 9.914 8.443 -5.916 1.00 0.00 H new ATOM 0 HH22 ARG A 18 9.585 10.176 -5.825 1.00 0.00 H new ATOM 301 N ARG A 19 8.438 8.489 1.002 1.00 0.00 N ATOM 302 CA ARG A 19 9.648 8.700 1.794 1.00 0.00 C ATOM 303 C ARG A 19 9.318 8.397 3.252 1.00 0.00 C ATOM 304 O ARG A 19 10.002 7.586 3.868 1.00 0.00 O ATOM 305 CB ARG A 19 10.197 10.130 1.653 1.00 0.00 C ATOM 306 CG ARG A 19 10.425 10.633 0.222 1.00 0.00 C ATOM 307 CD ARG A 19 11.535 9.892 -0.531 1.00 0.00 C ATOM 308 NE ARG A 19 12.019 10.726 -1.640 1.00 0.00 N ATOM 309 CZ ARG A 19 13.275 10.745 -2.100 1.00 0.00 C ATOM 310 NH1 ARG A 19 14.128 9.764 -1.836 1.00 0.00 N ATOM 311 NH2 ARG A 19 13.692 11.778 -2.813 1.00 0.00 N ATOM 0 H ARG A 19 8.065 9.339 0.578 1.00 0.00 H new ATOM 0 HA ARG A 19 10.429 8.034 1.428 1.00 0.00 H new ATOM 0 HB2 ARG A 19 9.506 10.812 2.149 1.00 0.00 H new ATOM 0 HB3 ARG A 19 11.143 10.188 2.191 1.00 0.00 H new ATOM 0 HG2 ARG A 19 9.495 10.538 -0.338 1.00 0.00 H new ATOM 0 HG3 ARG A 19 10.670 11.695 0.256 1.00 0.00 H new ATOM 0 HD2 ARG A 19 12.356 9.659 0.147 1.00 0.00 H new ATOM 0 HD3 ARG A 19 11.158 8.943 -0.913 1.00 0.00 H new ATOM 0 HE ARG A 19 11.343 11.339 -2.095 1.00 0.00 H new ATOM 0 HH11 ARG A 19 13.832 8.969 -1.269 1.00 0.00 H new ATOM 0 HH12 ARG A 19 15.080 9.804 -2.200 1.00 0.00 H new ATOM 0 HH21 ARG A 19 13.057 12.552 -3.008 1.00 0.00 H new ATOM 0 HH22 ARG A 19 14.648 11.800 -3.167 1.00 0.00 H new ATOM 325 N ILE A 20 8.258 9.024 3.773 1.00 0.00 N ATOM 326 CA ILE A 20 7.736 8.797 5.112 1.00 0.00 C ATOM 327 C ILE A 20 7.504 7.292 5.300 1.00 0.00 C ATOM 328 O ILE A 20 8.113 6.699 6.182 1.00 0.00 O ATOM 329 CB ILE A 20 6.501 9.711 5.365 1.00 0.00 C ATOM 330 CG1 ILE A 20 6.893 11.067 5.995 1.00 0.00 C ATOM 331 CG2 ILE A 20 5.474 9.082 6.317 1.00 0.00 C ATOM 332 CD1 ILE A 20 7.737 11.983 5.104 1.00 0.00 C ATOM 0 H ILE A 20 7.728 9.724 3.253 1.00 0.00 H new ATOM 0 HA ILE A 20 8.448 9.086 5.885 1.00 0.00 H new ATOM 0 HB ILE A 20 6.068 9.848 4.374 1.00 0.00 H new ATOM 0 HG12 ILE A 20 5.982 11.597 6.273 1.00 0.00 H new ATOM 0 HG13 ILE A 20 7.444 10.875 6.916 1.00 0.00 H new ATOM 0 HG21 ILE A 20 4.637 9.767 6.453 1.00 0.00 H new ATOM 0 HG22 ILE A 20 5.111 8.145 5.893 1.00 0.00 H new ATOM 0 HG23 ILE A 20 5.944 8.886 7.281 1.00 0.00 H new ATOM 0 HD11 ILE A 20 7.958 12.907 5.638 1.00 0.00 H new ATOM 0 HD12 ILE A 20 8.670 11.481 4.846 1.00 0.00 H new ATOM 0 HD13 ILE A 20 7.185 12.214 4.193 1.00 0.00 H new ATOM 344 N VAL A 21 6.649 6.665 4.495 1.00 0.00 N ATOM 345 CA VAL A 21 6.214 5.283 4.675 1.00 0.00 C ATOM 346 C VAL A 21 7.410 4.325 4.677 1.00 0.00 C ATOM 347 O VAL A 21 7.512 3.505 5.590 1.00 0.00 O ATOM 348 CB VAL A 21 5.176 4.931 3.589 1.00 0.00 C ATOM 349 CG1 VAL A 21 4.818 3.440 3.581 1.00 0.00 C ATOM 350 CG2 VAL A 21 3.877 5.726 3.800 1.00 0.00 C ATOM 0 H VAL A 21 6.230 7.115 3.681 1.00 0.00 H new ATOM 0 HA VAL A 21 5.736 5.173 5.648 1.00 0.00 H new ATOM 0 HB VAL A 21 5.638 5.190 2.636 1.00 0.00 H new ATOM 0 HG11 VAL A 21 4.084 3.246 2.799 1.00 0.00 H new ATOM 0 HG12 VAL A 21 5.715 2.851 3.391 1.00 0.00 H new ATOM 0 HG13 VAL A 21 4.399 3.161 4.548 1.00 0.00 H new ATOM 0 HG21 VAL A 21 3.159 5.463 3.023 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.458 5.486 4.778 1.00 0.00 H new ATOM 0 HG23 VAL A 21 4.091 6.793 3.749 1.00 0.00 H new ATOM 360 N ARG A 22 8.329 4.406 3.705 1.00 0.00 N ATOM 361 CA ARG A 22 9.499 3.545 3.660 1.00 0.00 C ATOM 362 C ARG A 22 10.358 3.733 4.899 1.00 0.00 C ATOM 363 O ARG A 22 10.814 2.740 5.464 1.00 0.00 O ATOM 364 CB ARG A 22 10.297 3.906 2.416 1.00 0.00 C ATOM 365 CG ARG A 22 9.760 3.220 1.155 1.00 0.00 C ATOM 366 CD ARG A 22 10.247 3.907 -0.124 1.00 0.00 C ATOM 367 NE ARG A 22 11.702 3.774 -0.306 1.00 0.00 N ATOM 368 CZ ARG A 22 12.662 4.612 0.101 1.00 0.00 C ATOM 369 NH1 ARG A 22 12.346 5.734 0.736 1.00 0.00 N ATOM 370 NH2 ARG A 22 13.934 4.306 -0.118 1.00 0.00 N ATOM 0 H ARG A 22 8.275 5.071 2.934 1.00 0.00 H new ATOM 0 HA ARG A 22 9.187 2.501 3.628 1.00 0.00 H new ATOM 0 HB2 ARG A 22 10.275 4.987 2.275 1.00 0.00 H new ATOM 0 HB3 ARG A 22 11.340 3.625 2.563 1.00 0.00 H new ATOM 0 HG2 ARG A 22 10.075 2.176 1.148 1.00 0.00 H new ATOM 0 HG3 ARG A 22 8.670 3.224 1.176 1.00 0.00 H new ATOM 0 HD2 ARG A 22 9.734 3.476 -0.984 1.00 0.00 H new ATOM 0 HD3 ARG A 22 9.982 4.964 -0.091 1.00 0.00 H new ATOM 0 HE ARG A 22 12.017 2.941 -0.803 1.00 0.00 H new ATOM 0 HH11 ARG A 22 11.368 5.960 0.916 1.00 0.00 H new ATOM 0 HH12 ARG A 22 13.081 6.370 1.044 1.00 0.00 H new ATOM 0 HH21 ARG A 22 14.175 3.437 -0.594 1.00 0.00 H new ATOM 0 HH22 ARG A 22 14.671 4.940 0.190 1.00 0.00 H new ATOM 384 N ASN A 23 10.562 4.982 5.326 1.00 0.00 N ATOM 385 CA ASN A 23 11.296 5.251 6.546 1.00 0.00 C ATOM 386 C ASN A 23 10.613 4.549 7.713 1.00 0.00 C ATOM 387 O ASN A 23 11.263 3.783 8.405 1.00 0.00 O ATOM 388 CB ASN A 23 11.437 6.753 6.804 1.00 0.00 C ATOM 389 CG ASN A 23 12.238 6.971 8.074 1.00 0.00 C ATOM 390 OD1 ASN A 23 13.455 6.807 8.074 1.00 0.00 O ATOM 391 ND2 ASN A 23 11.587 7.340 9.159 1.00 0.00 N ATOM 0 H ASN A 23 10.227 5.814 4.841 1.00 0.00 H new ATOM 0 HA ASN A 23 12.307 4.858 6.438 1.00 0.00 H new ATOM 0 HB2 ASN A 23 11.933 7.233 5.961 1.00 0.00 H new ATOM 0 HB3 ASN A 23 10.453 7.211 6.898 1.00 0.00 H new ATOM 0 HD21 ASN A 23 12.095 7.497 10.030 1.00 0.00 H new ATOM 0 HD22 ASN A 23 10.576 7.468 9.128 1.00 0.00 H new ATOM 398 N LEU A 24 9.310 4.762 7.915 1.00 0.00 N ATOM 399 CA LEU A 24 8.545 4.174 9.017 1.00 0.00 C ATOM 400 C LEU A 24 8.603 2.643 9.000 1.00 0.00 C ATOM 401 O LEU A 24 8.695 2.028 10.060 1.00 0.00 O ATOM 402 CB LEU A 24 7.080 4.627 8.955 1.00 0.00 C ATOM 403 CG LEU A 24 6.842 6.136 9.149 1.00 0.00 C ATOM 404 CD1 LEU A 24 5.374 6.420 8.807 1.00 0.00 C ATOM 405 CD2 LEU A 24 7.230 6.646 10.541 1.00 0.00 C ATOM 0 H LEU A 24 8.748 5.358 7.307 1.00 0.00 H new ATOM 0 HA LEU A 24 9.000 4.523 9.944 1.00 0.00 H new ATOM 0 HB2 LEU A 24 6.668 4.333 7.989 1.00 0.00 H new ATOM 0 HB3 LEU A 24 6.519 4.088 9.718 1.00 0.00 H new ATOM 0 HG LEU A 24 7.500 6.689 8.479 1.00 0.00 H new ATOM 0 HD11 LEU A 24 5.170 7.483 8.934 1.00 0.00 H new ATOM 0 HD12 LEU A 24 5.179 6.134 7.773 1.00 0.00 H new ATOM 0 HD13 LEU A 24 4.728 5.845 9.470 1.00 0.00 H new ATOM 0 HD21 LEU A 24 7.035 7.717 10.604 1.00 0.00 H new ATOM 0 HD22 LEU A 24 6.642 6.125 11.296 1.00 0.00 H new ATOM 0 HD23 LEU A 24 8.290 6.460 10.714 1.00 0.00 H new ATOM 417 N LEU A 25 8.555 2.023 7.819 1.00 0.00 N ATOM 418 CA LEU A 25 8.740 0.583 7.656 1.00 0.00 C ATOM 419 C LEU A 25 10.114 0.167 8.183 1.00 0.00 C ATOM 420 O LEU A 25 10.203 -0.788 8.953 1.00 0.00 O ATOM 421 CB LEU A 25 8.550 0.189 6.178 1.00 0.00 C ATOM 422 CG LEU A 25 7.071 -0.062 5.831 1.00 0.00 C ATOM 423 CD1 LEU A 25 6.830 0.080 4.326 1.00 0.00 C ATOM 424 CD2 LEU A 25 6.624 -1.462 6.274 1.00 0.00 C ATOM 0 H LEU A 25 8.385 2.513 6.941 1.00 0.00 H new ATOM 0 HA LEU A 25 7.988 0.052 8.239 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.943 0.980 5.539 1.00 0.00 H new ATOM 0 HB3 LEU A 25 9.129 -0.709 5.965 1.00 0.00 H new ATOM 0 HG LEU A 25 6.487 0.687 6.366 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.778 -0.102 4.107 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.098 1.088 4.008 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.443 -0.644 3.789 1.00 0.00 H new ATOM 0 HD21 LEU A 25 5.575 -1.608 6.015 1.00 0.00 H new ATOM 0 HD22 LEU A 25 7.231 -2.214 5.770 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.748 -1.559 7.353 1.00 0.00 H new ATOM 436 N LYS A 26 11.180 0.885 7.815 1.00 0.00 N ATOM 437 CA LYS A 26 12.518 0.629 8.342 1.00 0.00 C ATOM 438 C LYS A 26 12.597 0.902 9.846 1.00 0.00 C ATOM 439 O LYS A 26 13.276 0.144 10.532 1.00 0.00 O ATOM 440 CB LYS A 26 13.568 1.448 7.569 1.00 0.00 C ATOM 441 CG LYS A 26 13.863 0.895 6.167 1.00 0.00 C ATOM 442 CD LYS A 26 14.835 -0.296 6.223 1.00 0.00 C ATOM 443 CE LYS A 26 14.961 -1.006 4.871 1.00 0.00 C ATOM 444 NZ LYS A 26 15.671 -0.200 3.850 1.00 0.00 N ATOM 0 H LYS A 26 11.137 1.655 7.147 1.00 0.00 H new ATOM 0 HA LYS A 26 12.736 -0.429 8.199 1.00 0.00 H new ATOM 0 HB2 LYS A 26 13.221 2.477 7.480 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.494 1.473 8.144 1.00 0.00 H new ATOM 0 HG2 LYS A 26 12.931 0.584 5.694 1.00 0.00 H new ATOM 0 HG3 LYS A 26 14.288 1.684 5.546 1.00 0.00 H new ATOM 0 HD2 LYS A 26 15.817 0.054 6.540 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.492 -1.007 6.974 1.00 0.00 H new ATOM 0 HE2 LYS A 26 15.489 -1.949 5.011 1.00 0.00 H new ATOM 0 HE3 LYS A 26 13.965 -1.251 4.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 15.723 -0.735 2.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 15.156 0.689 3.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 16.633 0.012 4.183 1.00 0.00 H new ATOM 458 N GLU A 27 11.915 1.915 10.392 1.00 0.00 N ATOM 459 CA GLU A 27 11.908 2.177 11.836 1.00 0.00 C ATOM 460 C GLU A 27 11.355 0.963 12.584 1.00 0.00 C ATOM 461 O GLU A 27 11.861 0.603 13.647 1.00 0.00 O ATOM 462 CB GLU A 27 11.053 3.404 12.208 1.00 0.00 C ATOM 463 CG GLU A 27 11.473 4.755 11.617 1.00 0.00 C ATOM 464 CD GLU A 27 12.779 5.307 12.176 1.00 0.00 C ATOM 465 OE1 GLU A 27 13.869 4.733 11.942 1.00 0.00 O ATOM 466 OE2 GLU A 27 12.716 6.363 12.846 1.00 0.00 O ATOM 0 H GLU A 27 11.355 2.573 9.849 1.00 0.00 H new ATOM 0 HA GLU A 27 12.940 2.376 12.123 1.00 0.00 H new ATOM 0 HB2 GLU A 27 10.026 3.206 11.902 1.00 0.00 H new ATOM 0 HB3 GLU A 27 11.049 3.497 13.294 1.00 0.00 H new ATOM 0 HG2 GLU A 27 11.569 4.651 10.536 1.00 0.00 H new ATOM 0 HG3 GLU A 27 10.679 5.480 11.798 1.00 0.00 H new ATOM 473 N LEU A 28 10.299 0.347 12.049 1.00 0.00 N ATOM 474 CA LEU A 28 9.673 -0.820 12.653 1.00 0.00 C ATOM 475 C LEU A 28 10.562 -2.044 12.488 1.00 0.00 C ATOM 476 O LEU A 28 10.891 -2.675 13.493 1.00 0.00 O ATOM 477 CB LEU A 28 8.277 -1.049 12.068 1.00 0.00 C ATOM 478 CG LEU A 28 7.273 0.016 12.545 1.00 0.00 C ATOM 479 CD1 LEU A 28 5.998 -0.099 11.716 1.00 0.00 C ATOM 480 CD2 LEU A 28 6.939 -0.114 14.036 1.00 0.00 C ATOM 0 H LEU A 28 9.856 0.648 11.181 1.00 0.00 H new ATOM 0 HA LEU A 28 9.552 -0.640 13.721 1.00 0.00 H new ATOM 0 HB2 LEU A 28 8.333 -1.034 10.980 1.00 0.00 H new ATOM 0 HB3 LEU A 28 7.921 -2.038 12.355 1.00 0.00 H new ATOM 0 HG LEU A 28 7.734 0.994 12.408 1.00 0.00 H new ATOM 0 HD11 LEU A 28 5.280 0.652 12.047 1.00 0.00 H new ATOM 0 HD12 LEU A 28 6.232 0.062 10.664 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.569 -1.093 11.844 1.00 0.00 H new ATOM 0 HD21 LEU A 28 6.227 0.662 14.318 1.00 0.00 H new ATOM 0 HD22 LEU A 28 6.502 -1.094 14.227 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.850 -0.002 14.624 1.00 0.00 H new ATOM 492 N GLY A 29 10.968 -2.363 11.259 1.00 0.00 N ATOM 493 CA GLY A 29 11.798 -3.517 10.944 1.00 0.00 C ATOM 494 C GLY A 29 11.254 -4.254 9.729 1.00 0.00 C ATOM 495 O GLY A 29 10.837 -5.410 9.841 1.00 0.00 O ATOM 0 H GLY A 29 10.721 -1.810 10.438 1.00 0.00 H new ATOM 0 HA2 GLY A 29 12.821 -3.194 10.752 1.00 0.00 H new ATOM 0 HA3 GLY A 29 11.832 -4.191 11.800 1.00 0.00 H new ATOM 499 N PHE A 30 11.233 -3.580 8.576 1.00 0.00 N ATOM 500 CA PHE A 30 10.841 -4.153 7.297 1.00 0.00 C ATOM 501 C PHE A 30 11.804 -3.674 6.212 1.00 0.00 C ATOM 502 O PHE A 30 12.459 -2.637 6.366 1.00 0.00 O ATOM 503 CB PHE A 30 9.387 -3.792 6.973 1.00 0.00 C ATOM 504 CG PHE A 30 8.397 -4.382 7.956 1.00 0.00 C ATOM 505 CD1 PHE A 30 7.963 -5.712 7.806 1.00 0.00 C ATOM 506 CD2 PHE A 30 7.970 -3.630 9.066 1.00 0.00 C ATOM 507 CE1 PHE A 30 7.116 -6.292 8.767 1.00 0.00 C ATOM 508 CE2 PHE A 30 7.135 -4.212 10.033 1.00 0.00 C ATOM 509 CZ PHE A 30 6.717 -5.547 9.890 1.00 0.00 C ATOM 0 H PHE A 30 11.496 -2.597 8.510 1.00 0.00 H new ATOM 0 HA PHE A 30 10.897 -5.240 7.346 1.00 0.00 H new ATOM 0 HB2 PHE A 30 9.281 -2.707 6.966 1.00 0.00 H new ATOM 0 HB3 PHE A 30 9.147 -4.142 5.969 1.00 0.00 H new ATOM 0 HD1 PHE A 30 8.281 -6.289 6.950 1.00 0.00 H new ATOM 0 HD2 PHE A 30 8.285 -2.603 9.174 1.00 0.00 H new ATOM 0 HE1 PHE A 30 6.773 -7.308 8.642 1.00 0.00 H new ATOM 0 HE2 PHE A 30 6.814 -3.634 10.887 1.00 0.00 H new ATOM 0 HZ PHE A 30 6.089 -6.000 10.643 1.00 0.00 H new ATOM 519 N ASN A 31 11.907 -4.427 5.115 1.00 0.00 N ATOM 520 CA ASN A 31 12.935 -4.260 4.096 1.00 0.00 C ATOM 521 C ASN A 31 12.375 -4.517 2.695 1.00 0.00 C ATOM 522 O ASN A 31 11.172 -4.687 2.520 1.00 0.00 O ATOM 523 CB ASN A 31 14.171 -5.126 4.435 1.00 0.00 C ATOM 524 CG ASN A 31 14.174 -6.561 3.892 1.00 0.00 C ATOM 525 OD1 ASN A 31 13.159 -7.177 3.582 1.00 0.00 O ATOM 526 ND2 ASN A 31 15.358 -7.117 3.726 1.00 0.00 N ATOM 0 H ASN A 31 11.260 -5.188 4.909 1.00 0.00 H new ATOM 0 HA ASN A 31 13.270 -3.223 4.092 1.00 0.00 H new ATOM 0 HB2 ASN A 31 15.058 -4.617 4.057 1.00 0.00 H new ATOM 0 HB3 ASN A 31 14.268 -5.172 5.520 1.00 0.00 H new ATOM 0 HD21 ASN A 31 15.430 -8.058 3.340 1.00 0.00 H new ATOM 0 HD22 ASN A 31 16.202 -6.606 3.983 1.00 0.00 H new ATOM 533 N ASN A 32 13.267 -4.483 1.699 1.00 0.00 N ATOM 534 CA ASN A 32 13.006 -4.728 0.281 1.00 0.00 C ATOM 535 C ASN A 32 11.833 -3.890 -0.224 1.00 0.00 C ATOM 536 O ASN A 32 10.919 -4.384 -0.877 1.00 0.00 O ATOM 537 CB ASN A 32 12.879 -6.237 -0.014 1.00 0.00 C ATOM 538 CG ASN A 32 13.176 -6.562 -1.478 1.00 0.00 C ATOM 539 OD1 ASN A 32 13.963 -5.894 -2.141 1.00 0.00 O ATOM 540 ND2 ASN A 32 12.599 -7.618 -2.025 1.00 0.00 N ATOM 0 H ASN A 32 14.249 -4.271 1.875 1.00 0.00 H new ATOM 0 HA ASN A 32 13.869 -4.392 -0.294 1.00 0.00 H new ATOM 0 HB2 ASN A 32 13.566 -6.791 0.627 1.00 0.00 H new ATOM 0 HB3 ASN A 32 11.872 -6.571 0.234 1.00 0.00 H new ATOM 0 HD21 ASN A 32 12.809 -7.871 -2.990 1.00 0.00 H new ATOM 0 HD22 ASN A 32 11.943 -8.180 -1.482 1.00 0.00 H new ATOM 547 N VAL A 33 11.822 -2.599 0.104 1.00 0.00 N ATOM 548 CA VAL A 33 10.819 -1.688 -0.433 1.00 0.00 C ATOM 549 C VAL A 33 11.097 -1.441 -1.921 1.00 0.00 C ATOM 550 O VAL A 33 12.210 -1.658 -2.398 1.00 0.00 O ATOM 551 CB VAL A 33 10.752 -0.391 0.391 1.00 0.00 C ATOM 552 CG1 VAL A 33 10.149 -0.636 1.785 1.00 0.00 C ATOM 553 CG2 VAL A 33 12.133 0.254 0.551 1.00 0.00 C ATOM 0 H VAL A 33 12.494 -2.164 0.736 1.00 0.00 H new ATOM 0 HA VAL A 33 9.831 -2.142 -0.354 1.00 0.00 H new ATOM 0 HB VAL A 33 10.106 0.289 -0.164 1.00 0.00 H new ATOM 0 HG11 VAL A 33 10.118 0.303 2.338 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.138 -1.029 1.680 1.00 0.00 H new ATOM 0 HG13 VAL A 33 10.764 -1.355 2.326 1.00 0.00 H new ATOM 0 HG21 VAL A 33 12.042 1.167 1.139 1.00 0.00 H new ATOM 0 HG22 VAL A 33 12.802 -0.440 1.060 1.00 0.00 H new ATOM 0 HG23 VAL A 33 12.539 0.494 -0.432 1.00 0.00 H new ATOM 563 N GLU A 34 10.100 -0.949 -2.646 1.00 0.00 N ATOM 564 CA GLU A 34 10.143 -0.594 -4.052 1.00 0.00 C ATOM 565 C GLU A 34 9.247 0.616 -4.277 1.00 0.00 C ATOM 566 O GLU A 34 8.530 1.064 -3.380 1.00 0.00 O ATOM 567 CB GLU A 34 9.688 -1.782 -4.915 1.00 0.00 C ATOM 568 CG GLU A 34 10.873 -2.602 -5.418 1.00 0.00 C ATOM 569 CD GLU A 34 11.721 -1.925 -6.502 1.00 0.00 C ATOM 570 OE1 GLU A 34 11.583 -0.703 -6.757 1.00 0.00 O ATOM 571 OE2 GLU A 34 12.577 -2.636 -7.085 1.00 0.00 O ATOM 0 H GLU A 34 9.181 -0.778 -2.237 1.00 0.00 H new ATOM 0 HA GLU A 34 11.164 -0.345 -4.342 1.00 0.00 H new ATOM 0 HB2 GLU A 34 9.024 -2.421 -4.333 1.00 0.00 H new ATOM 0 HB3 GLU A 34 9.113 -1.415 -5.765 1.00 0.00 H new ATOM 0 HG2 GLU A 34 11.516 -2.839 -4.571 1.00 0.00 H new ATOM 0 HG3 GLU A 34 10.500 -3.548 -5.809 1.00 0.00 H new ATOM 578 N GLU A 35 9.310 1.169 -5.480 1.00 0.00 N ATOM 579 CA GLU A 35 8.584 2.358 -5.877 1.00 0.00 C ATOM 580 C GLU A 35 8.104 2.131 -7.306 1.00 0.00 C ATOM 581 O GLU A 35 8.826 1.512 -8.092 1.00 0.00 O ATOM 582 CB GLU A 35 9.555 3.539 -5.766 1.00 0.00 C ATOM 583 CG GLU A 35 8.924 4.906 -6.032 1.00 0.00 C ATOM 584 CD GLU A 35 9.982 6.010 -5.968 1.00 0.00 C ATOM 585 OE1 GLU A 35 10.757 6.074 -4.985 1.00 0.00 O ATOM 586 OE2 GLU A 35 10.011 6.910 -6.834 1.00 0.00 O ATOM 0 H GLU A 35 9.888 0.787 -6.228 1.00 0.00 H new ATOM 0 HA GLU A 35 7.716 2.569 -5.252 1.00 0.00 H new ATOM 0 HB2 GLU A 35 9.990 3.542 -4.767 1.00 0.00 H new ATOM 0 HB3 GLU A 35 10.373 3.388 -6.470 1.00 0.00 H new ATOM 0 HG2 GLU A 35 8.448 4.908 -7.012 1.00 0.00 H new ATOM 0 HG3 GLU A 35 8.143 5.101 -5.298 1.00 0.00 H new ATOM 593 N ALA A 36 6.931 2.648 -7.659 1.00 0.00 N ATOM 594 CA ALA A 36 6.479 2.725 -9.040 1.00 0.00 C ATOM 595 C ALA A 36 6.234 4.189 -9.366 1.00 0.00 C ATOM 596 O ALA A 36 6.014 5.001 -8.463 1.00 0.00 O ATOM 597 CB ALA A 36 5.206 1.900 -9.250 1.00 0.00 C ATOM 0 H ALA A 36 6.264 3.028 -6.988 1.00 0.00 H new ATOM 0 HA ALA A 36 7.238 2.311 -9.705 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.891 1.976 -10.291 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.404 0.856 -9.006 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.415 2.280 -8.603 1.00 0.00 H new ATOM 603 N GLU A 37 6.211 4.518 -10.652 1.00 0.00 N ATOM 604 CA GLU A 37 5.851 5.857 -11.082 1.00 0.00 C ATOM 605 C GLU A 37 4.416 6.184 -10.683 1.00 0.00 C ATOM 606 O GLU A 37 4.129 7.323 -10.323 1.00 0.00 O ATOM 607 CB GLU A 37 5.967 5.994 -12.602 1.00 0.00 C ATOM 608 CG GLU A 37 7.417 5.955 -13.112 1.00 0.00 C ATOM 609 CD GLU A 37 7.727 7.066 -14.124 1.00 0.00 C ATOM 610 OE1 GLU A 37 6.809 7.588 -14.798 1.00 0.00 O ATOM 611 OE2 GLU A 37 8.909 7.459 -14.221 1.00 0.00 O ATOM 0 H GLU A 37 6.437 3.875 -11.411 1.00 0.00 H new ATOM 0 HA GLU A 37 6.540 6.548 -10.596 1.00 0.00 H new ATOM 0 HB2 GLU A 37 5.402 5.191 -13.075 1.00 0.00 H new ATOM 0 HB3 GLU A 37 5.507 6.933 -12.911 1.00 0.00 H new ATOM 0 HG2 GLU A 37 8.097 6.043 -12.265 1.00 0.00 H new ATOM 0 HG3 GLU A 37 7.608 4.987 -13.574 1.00 0.00 H new ATOM 618 N ASP A 38 3.502 5.225 -10.792 1.00 0.00 N ATOM 619 CA ASP A 38 2.064 5.455 -10.836 1.00 0.00 C ATOM 620 C ASP A 38 1.368 4.094 -10.787 1.00 0.00 C ATOM 621 O ASP A 38 2.043 3.091 -10.986 1.00 0.00 O ATOM 622 CB ASP A 38 1.734 6.193 -12.144 1.00 0.00 C ATOM 623 CG ASP A 38 0.255 6.510 -12.282 1.00 0.00 C ATOM 624 OD1 ASP A 38 -0.388 6.785 -11.246 1.00 0.00 O ATOM 625 OD2 ASP A 38 -0.246 6.433 -13.425 1.00 0.00 O ATOM 0 H ASP A 38 3.750 4.238 -10.854 1.00 0.00 H new ATOM 0 HA ASP A 38 1.726 6.061 -9.995 1.00 0.00 H new ATOM 0 HB2 ASP A 38 2.306 7.120 -12.187 1.00 0.00 H new ATOM 0 HB3 ASP A 38 2.051 5.583 -12.990 1.00 0.00 H new ATOM 630 N GLY A 39 0.064 4.003 -10.531 1.00 0.00 N ATOM 631 CA GLY A 39 -0.681 2.744 -10.436 1.00 0.00 C ATOM 632 C GLY A 39 -0.559 1.856 -11.681 1.00 0.00 C ATOM 633 O GLY A 39 -0.460 0.625 -11.584 1.00 0.00 O ATOM 0 H GLY A 39 -0.522 4.824 -10.379 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -0.326 2.188 -9.568 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -1.734 2.968 -10.263 1.00 0.00 H new ATOM 637 N VAL A 40 -0.533 2.453 -12.869 1.00 0.00 N ATOM 638 CA VAL A 40 -0.273 1.727 -14.108 1.00 0.00 C ATOM 639 C VAL A 40 1.117 1.079 -14.044 1.00 0.00 C ATOM 640 O VAL A 40 1.247 -0.108 -14.362 1.00 0.00 O ATOM 641 CB VAL A 40 -0.480 2.676 -15.303 1.00 0.00 C ATOM 642 CG1 VAL A 40 -0.070 2.050 -16.640 1.00 0.00 C ATOM 643 CG2 VAL A 40 -1.970 3.044 -15.394 1.00 0.00 C ATOM 0 H VAL A 40 -0.691 3.452 -13.000 1.00 0.00 H new ATOM 0 HA VAL A 40 -0.977 0.906 -14.244 1.00 0.00 H new ATOM 0 HB VAL A 40 0.150 3.549 -15.130 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -0.239 2.766 -17.444 1.00 0.00 H new ATOM 0 HG12 VAL A 40 0.986 1.783 -16.608 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -0.665 1.155 -16.820 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.128 3.716 -16.237 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -2.560 2.139 -15.536 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.280 3.538 -14.473 1.00 0.00 H new ATOM 653 N ASP A 41 2.141 1.806 -13.585 1.00 0.00 N ATOM 654 CA ASP A 41 3.459 1.214 -13.359 1.00 0.00 C ATOM 655 C ASP A 41 3.426 0.259 -12.166 1.00 0.00 C ATOM 656 O ASP A 41 4.186 -0.698 -12.142 1.00 0.00 O ATOM 657 CB ASP A 41 4.544 2.275 -13.144 1.00 0.00 C ATOM 658 CG ASP A 41 5.949 1.664 -13.017 1.00 0.00 C ATOM 659 OD1 ASP A 41 6.293 0.649 -13.672 1.00 0.00 O ATOM 660 OD2 ASP A 41 6.782 2.246 -12.290 1.00 0.00 O ATOM 0 H ASP A 41 2.081 2.800 -13.364 1.00 0.00 H new ATOM 0 HA ASP A 41 3.712 0.658 -14.262 1.00 0.00 H new ATOM 0 HB2 ASP A 41 4.531 2.977 -13.977 1.00 0.00 H new ATOM 0 HB3 ASP A 41 4.317 2.845 -12.243 1.00 0.00 H new ATOM 665 N ALA A 42 2.538 0.451 -11.185 1.00 0.00 N ATOM 666 CA ALA A 42 2.446 -0.405 -10.022 1.00 0.00 C ATOM 667 C ALA A 42 2.139 -1.813 -10.490 1.00 0.00 C ATOM 668 O ALA A 42 2.880 -2.720 -10.134 1.00 0.00 O ATOM 669 CB ALA A 42 1.400 0.098 -9.024 1.00 0.00 C ATOM 0 H ALA A 42 1.862 1.215 -11.186 1.00 0.00 H new ATOM 0 HA ALA A 42 3.397 -0.394 -9.489 1.00 0.00 H new ATOM 0 HB1 ALA A 42 1.363 -0.573 -8.166 1.00 0.00 H new ATOM 0 HB2 ALA A 42 1.669 1.100 -8.689 1.00 0.00 H new ATOM 0 HB3 ALA A 42 0.422 0.126 -9.505 1.00 0.00 H new ATOM 675 N LEU A 43 1.126 -1.991 -11.345 1.00 0.00 N ATOM 676 CA LEU A 43 0.823 -3.304 -11.928 1.00 0.00 C ATOM 677 C LEU A 43 2.057 -3.907 -12.625 1.00 0.00 C ATOM 678 O LEU A 43 2.373 -5.099 -12.479 1.00 0.00 O ATOM 679 CB LEU A 43 -0.359 -3.186 -12.911 1.00 0.00 C ATOM 680 CG LEU A 43 -1.461 -4.212 -12.592 1.00 0.00 C ATOM 681 CD1 LEU A 43 -2.367 -3.708 -11.465 1.00 0.00 C ATOM 682 CD2 LEU A 43 -2.293 -4.512 -13.844 1.00 0.00 C ATOM 0 H LEU A 43 0.502 -1.243 -11.649 1.00 0.00 H new ATOM 0 HA LEU A 43 0.542 -3.979 -11.120 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -0.773 -2.179 -12.865 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.003 -3.338 -13.930 1.00 0.00 H new ATOM 0 HG LEU A 43 -0.980 -5.132 -12.261 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.138 -4.451 -11.258 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.772 -3.542 -10.567 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -2.837 -2.772 -11.767 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.068 -5.239 -13.601 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.758 -3.593 -14.201 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -1.646 -4.918 -14.622 1.00 0.00 H new ATOM 694 N ASN A 44 2.769 -3.065 -13.380 1.00 0.00 N ATOM 695 CA ASN A 44 3.998 -3.426 -14.078 1.00 0.00 C ATOM 696 C ASN A 44 5.150 -3.769 -13.114 1.00 0.00 C ATOM 697 O ASN A 44 6.053 -4.532 -13.470 1.00 0.00 O ATOM 698 CB ASN A 44 4.384 -2.310 -15.055 1.00 0.00 C ATOM 699 CG ASN A 44 5.732 -2.587 -15.695 1.00 0.00 C ATOM 700 OD1 ASN A 44 5.911 -3.589 -16.386 1.00 0.00 O ATOM 701 ND2 ASN A 44 6.721 -1.765 -15.403 1.00 0.00 N ATOM 0 H ASN A 44 2.497 -2.092 -13.524 1.00 0.00 H new ATOM 0 HA ASN A 44 3.808 -4.338 -14.643 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.622 -2.220 -15.829 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.417 -1.356 -14.528 1.00 0.00 H new ATOM 0 HD21 ASN A 44 7.661 -1.953 -15.752 1.00 0.00 H new ATOM 0 HD22 ASN A 44 6.546 -0.941 -14.828 1.00 0.00 H new ATOM 708 N LYS A 45 5.153 -3.253 -11.885 1.00 0.00 N ATOM 709 CA LYS A 45 6.048 -3.681 -10.814 1.00 0.00 C ATOM 710 C LYS A 45 5.571 -5.027 -10.284 1.00 0.00 C ATOM 711 O LYS A 45 6.387 -5.932 -10.196 1.00 0.00 O ATOM 712 CB LYS A 45 6.138 -2.616 -9.706 1.00 0.00 C ATOM 713 CG LYS A 45 6.760 -1.292 -10.184 1.00 0.00 C ATOM 714 CD LYS A 45 8.287 -1.277 -10.122 1.00 0.00 C ATOM 715 CE LYS A 45 8.896 -0.070 -10.849 1.00 0.00 C ATOM 716 NZ LYS A 45 8.666 -0.102 -12.309 1.00 0.00 N ATOM 0 H LYS A 45 4.517 -2.508 -11.601 1.00 0.00 H new ATOM 0 HA LYS A 45 7.059 -3.799 -11.203 1.00 0.00 H new ATOM 0 HB2 LYS A 45 5.139 -2.421 -9.317 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.730 -3.010 -8.880 1.00 0.00 H new ATOM 0 HG2 LYS A 45 6.444 -1.101 -11.210 1.00 0.00 H new ATOM 0 HG3 LYS A 45 6.372 -0.476 -9.574 1.00 0.00 H new ATOM 0 HD2 LYS A 45 8.604 -1.266 -9.079 1.00 0.00 H new ATOM 0 HD3 LYS A 45 8.674 -2.195 -10.564 1.00 0.00 H new ATOM 0 HE2 LYS A 45 8.472 0.847 -10.439 1.00 0.00 H new ATOM 0 HE3 LYS A 45 9.968 -0.039 -10.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 9.156 0.700 -12.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.034 -0.993 -12.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 7.646 -0.035 -12.501 1.00 0.00 H new ATOM 730 N LEU A 46 4.278 -5.216 -9.994 1.00 0.00 N ATOM 731 CA LEU A 46 3.772 -6.476 -9.436 1.00 0.00 C ATOM 732 C LEU A 46 4.103 -7.668 -10.327 1.00 0.00 C ATOM 733 O LEU A 46 4.377 -8.745 -9.800 1.00 0.00 O ATOM 734 CB LEU A 46 2.250 -6.464 -9.192 1.00 0.00 C ATOM 735 CG LEU A 46 1.679 -5.236 -8.489 1.00 0.00 C ATOM 736 CD1 LEU A 46 0.220 -5.500 -8.199 1.00 0.00 C ATOM 737 CD2 LEU A 46 2.383 -4.787 -7.208 1.00 0.00 C ATOM 0 H LEU A 46 3.559 -4.507 -10.138 1.00 0.00 H new ATOM 0 HA LEU A 46 4.279 -6.576 -8.476 1.00 0.00 H new ATOM 0 HB2 LEU A 46 1.750 -6.568 -10.155 1.00 0.00 H new ATOM 0 HB3 LEU A 46 1.993 -7.344 -8.603 1.00 0.00 H new ATOM 0 HG LEU A 46 1.838 -4.406 -9.177 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -0.213 -4.636 -7.695 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -0.310 -5.678 -9.134 1.00 0.00 H new ATOM 0 HD13 LEU A 46 0.129 -6.377 -7.558 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.882 -3.906 -6.807 1.00 0.00 H new ATOM 0 HD22 LEU A 46 2.348 -5.591 -6.473 1.00 0.00 H new ATOM 0 HD23 LEU A 46 3.422 -4.543 -7.430 1.00 0.00 H new ATOM 749 N GLN A 47 4.084 -7.500 -11.652 1.00 0.00 N ATOM 750 CA GLN A 47 4.495 -8.565 -12.575 1.00 0.00 C ATOM 751 C GLN A 47 6.023 -8.794 -12.650 1.00 0.00 C ATOM 752 O GLN A 47 6.473 -9.502 -13.552 1.00 0.00 O ATOM 753 CB GLN A 47 3.881 -8.326 -13.962 1.00 0.00 C ATOM 754 CG GLN A 47 4.468 -7.107 -14.692 1.00 0.00 C ATOM 755 CD GLN A 47 3.781 -6.836 -16.028 1.00 0.00 C ATOM 756 OE1 GLN A 47 2.749 -7.422 -16.336 1.00 0.00 O ATOM 757 NE2 GLN A 47 4.276 -5.922 -16.842 1.00 0.00 N ATOM 0 H GLN A 47 3.789 -6.638 -12.111 1.00 0.00 H new ATOM 0 HA GLN A 47 4.104 -9.496 -12.165 1.00 0.00 H new ATOM 0 HB2 GLN A 47 4.033 -9.214 -14.575 1.00 0.00 H new ATOM 0 HB3 GLN A 47 2.805 -8.192 -13.856 1.00 0.00 H new ATOM 0 HG2 GLN A 47 4.375 -6.227 -14.055 1.00 0.00 H new ATOM 0 HG3 GLN A 47 5.533 -7.267 -14.861 1.00 0.00 H new ATOM 0 HE21 GLN A 47 5.134 -5.429 -16.594 1.00 0.00 H new ATOM 0 HE22 GLN A 47 3.800 -5.709 -17.719 1.00 0.00 H new ATOM 766 N ALA A 48 6.836 -8.192 -11.779 1.00 0.00 N ATOM 767 CA ALA A 48 8.292 -8.283 -11.777 1.00 0.00 C ATOM 768 C ALA A 48 8.808 -8.890 -10.464 1.00 0.00 C ATOM 769 O ALA A 48 9.788 -8.418 -9.879 1.00 0.00 O ATOM 770 CB ALA A 48 8.885 -6.904 -12.074 1.00 0.00 C ATOM 0 H ALA A 48 6.480 -7.604 -11.026 1.00 0.00 H new ATOM 0 HA ALA A 48 8.620 -8.962 -12.564 1.00 0.00 H new ATOM 0 HB1 ALA A 48 9.973 -6.968 -12.073 1.00 0.00 H new ATOM 0 HB2 ALA A 48 8.542 -6.563 -13.051 1.00 0.00 H new ATOM 0 HB3 ALA A 48 8.563 -6.197 -11.310 1.00 0.00 H new ATOM 776 N GLY A 49 8.145 -9.937 -9.977 1.00 0.00 N ATOM 777 CA GLY A 49 8.680 -10.827 -8.958 1.00 0.00 C ATOM 778 C GLY A 49 7.656 -11.133 -7.881 1.00 0.00 C ATOM 779 O GLY A 49 6.476 -10.794 -8.004 1.00 0.00 O ATOM 0 H GLY A 49 7.207 -10.192 -10.286 1.00 0.00 H new ATOM 0 HA2 GLY A 49 9.007 -11.757 -9.423 1.00 0.00 H new ATOM 0 HA3 GLY A 49 9.560 -10.372 -8.504 1.00 0.00 H new ATOM 783 N GLY A 50 8.107 -11.789 -6.813 1.00 0.00 N ATOM 784 CA GLY A 50 7.310 -12.031 -5.623 1.00 0.00 C ATOM 785 C GLY A 50 7.203 -10.741 -4.822 1.00 0.00 C ATOM 786 O GLY A 50 7.826 -10.604 -3.766 1.00 0.00 O ATOM 0 H GLY A 50 9.051 -12.171 -6.754 1.00 0.00 H new ATOM 0 HA2 GLY A 50 6.317 -12.384 -5.901 1.00 0.00 H new ATOM 0 HA3 GLY A 50 7.768 -12.813 -5.017 1.00 0.00 H new ATOM 790 N TYR A 51 6.461 -9.766 -5.339 1.00 0.00 N ATOM 791 CA TYR A 51 5.987 -8.656 -4.534 1.00 0.00 C ATOM 792 C TYR A 51 5.016 -9.216 -3.503 1.00 0.00 C ATOM 793 O TYR A 51 4.296 -10.170 -3.796 1.00 0.00 O ATOM 794 CB TYR A 51 5.341 -7.592 -5.428 1.00 0.00 C ATOM 795 CG TYR A 51 6.362 -6.688 -6.092 1.00 0.00 C ATOM 796 CD1 TYR A 51 7.057 -7.098 -7.247 1.00 0.00 C ATOM 797 CD2 TYR A 51 6.639 -5.430 -5.526 1.00 0.00 C ATOM 798 CE1 TYR A 51 8.004 -6.244 -7.845 1.00 0.00 C ATOM 799 CE2 TYR A 51 7.560 -4.565 -6.141 1.00 0.00 C ATOM 800 CZ TYR A 51 8.229 -4.955 -7.321 1.00 0.00 C ATOM 801 OH TYR A 51 9.079 -4.080 -7.930 1.00 0.00 O ATOM 0 H TYR A 51 6.176 -9.727 -6.318 1.00 0.00 H new ATOM 0 HA TYR A 51 6.810 -8.163 -4.016 1.00 0.00 H new ATOM 0 HB2 TYR A 51 4.742 -8.083 -6.195 1.00 0.00 H new ATOM 0 HB3 TYR A 51 4.659 -6.986 -4.831 1.00 0.00 H new ATOM 0 HD1 TYR A 51 6.863 -8.070 -7.675 1.00 0.00 H new ATOM 0 HD2 TYR A 51 6.142 -5.128 -4.616 1.00 0.00 H new ATOM 0 HE1 TYR A 51 8.560 -6.578 -8.708 1.00 0.00 H new ATOM 0 HE2 TYR A 51 7.757 -3.595 -5.708 1.00 0.00 H new ATOM 0 HH TYR A 51 9.104 -3.242 -7.423 1.00 0.00 H new ATOM 811 N GLY A 52 4.998 -8.640 -2.303 1.00 0.00 N ATOM 812 CA GLY A 52 4.166 -9.126 -1.211 1.00 0.00 C ATOM 813 C GLY A 52 3.500 -8.001 -0.429 1.00 0.00 C ATOM 814 O GLY A 52 2.803 -8.278 0.543 1.00 0.00 O ATOM 0 H GLY A 52 5.560 -7.824 -2.063 1.00 0.00 H new ATOM 0 HA2 GLY A 52 3.398 -9.787 -1.612 1.00 0.00 H new ATOM 0 HA3 GLY A 52 4.777 -9.722 -0.533 1.00 0.00 H new ATOM 818 N PHE A 53 3.680 -6.741 -0.838 1.00 0.00 N ATOM 819 CA PHE A 53 2.981 -5.603 -0.272 1.00 0.00 C ATOM 820 C PHE A 53 2.837 -4.531 -1.344 1.00 0.00 C ATOM 821 O PHE A 53 3.756 -4.341 -2.146 1.00 0.00 O ATOM 822 CB PHE A 53 3.765 -5.065 0.927 1.00 0.00 C ATOM 823 CG PHE A 53 2.910 -4.767 2.130 1.00 0.00 C ATOM 824 CD1 PHE A 53 2.073 -3.642 2.126 1.00 0.00 C ATOM 825 CD2 PHE A 53 2.990 -5.580 3.273 1.00 0.00 C ATOM 826 CE1 PHE A 53 1.361 -3.295 3.284 1.00 0.00 C ATOM 827 CE2 PHE A 53 2.297 -5.219 4.438 1.00 0.00 C ATOM 828 CZ PHE A 53 1.497 -4.061 4.451 1.00 0.00 C ATOM 0 H PHE A 53 4.328 -6.488 -1.584 1.00 0.00 H new ATOM 0 HA PHE A 53 1.990 -5.901 0.070 1.00 0.00 H new ATOM 0 HB2 PHE A 53 4.527 -5.792 1.206 1.00 0.00 H new ATOM 0 HB3 PHE A 53 4.286 -4.155 0.629 1.00 0.00 H new ATOM 0 HD1 PHE A 53 1.977 -3.043 1.232 1.00 0.00 H new ATOM 0 HD2 PHE A 53 3.584 -6.482 3.255 1.00 0.00 H new ATOM 0 HE1 PHE A 53 0.707 -2.436 3.277 1.00 0.00 H new ATOM 0 HE2 PHE A 53 2.377 -5.830 5.325 1.00 0.00 H new ATOM 0 HZ PHE A 53 0.990 -3.763 5.357 1.00 0.00 H new ATOM 838 N VAL A 54 1.691 -3.842 -1.360 1.00 0.00 N ATOM 839 CA VAL A 54 1.348 -2.874 -2.402 1.00 0.00 C ATOM 840 C VAL A 54 0.704 -1.665 -1.712 1.00 0.00 C ATOM 841 O VAL A 54 -0.519 -1.542 -1.642 1.00 0.00 O ATOM 842 CB VAL A 54 0.441 -3.546 -3.464 1.00 0.00 C ATOM 843 CG1 VAL A 54 0.442 -2.825 -4.815 1.00 0.00 C ATOM 844 CG2 VAL A 54 0.846 -4.980 -3.780 1.00 0.00 C ATOM 0 H VAL A 54 0.972 -3.943 -0.644 1.00 0.00 H new ATOM 0 HA VAL A 54 2.226 -2.524 -2.945 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.543 -3.503 -2.997 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.214 -3.351 -5.509 1.00 0.00 H new ATOM 0 HG12 VAL A 54 0.086 -1.803 -4.682 1.00 0.00 H new ATOM 0 HG13 VAL A 54 1.455 -2.807 -5.217 1.00 0.00 H new ATOM 0 HG21 VAL A 54 0.171 -5.392 -4.530 1.00 0.00 H new ATOM 0 HG22 VAL A 54 1.866 -4.994 -4.163 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.791 -5.582 -2.873 1.00 0.00 H new ATOM 854 N ILE A 55 1.520 -0.794 -1.117 1.00 0.00 N ATOM 855 CA ILE A 55 1.006 0.411 -0.478 1.00 0.00 C ATOM 856 C ILE A 55 0.808 1.416 -1.625 1.00 0.00 C ATOM 857 O ILE A 55 1.622 1.465 -2.553 1.00 0.00 O ATOM 858 CB ILE A 55 2.010 0.900 0.589 1.00 0.00 C ATOM 859 CG1 ILE A 55 1.887 0.040 1.869 1.00 0.00 C ATOM 860 CG2 ILE A 55 1.640 2.326 1.021 1.00 0.00 C ATOM 861 CD1 ILE A 55 3.227 -0.168 2.588 1.00 0.00 C ATOM 0 H ILE A 55 2.533 -0.902 -1.066 1.00 0.00 H new ATOM 0 HA ILE A 55 0.066 0.257 0.053 1.00 0.00 H new ATOM 0 HB ILE A 55 3.010 0.842 0.158 1.00 0.00 H new ATOM 0 HG12 ILE A 55 1.185 0.517 2.553 1.00 0.00 H new ATOM 0 HG13 ILE A 55 1.468 -0.931 1.607 1.00 0.00 H new ATOM 0 HG21 ILE A 55 2.347 2.673 1.774 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.676 2.989 0.157 1.00 0.00 H new ATOM 0 HG23 ILE A 55 0.634 2.330 1.440 1.00 0.00 H new ATOM 0 HD11 ILE A 55 3.072 -0.779 3.477 1.00 0.00 H new ATOM 0 HD12 ILE A 55 3.925 -0.672 1.919 1.00 0.00 H new ATOM 0 HD13 ILE A 55 3.638 0.799 2.879 1.00 0.00 H new ATOM 873 N SER A 56 -0.261 2.212 -1.587 1.00 0.00 N ATOM 874 CA SER A 56 -0.433 3.301 -2.548 1.00 0.00 C ATOM 875 C SER A 56 -1.272 4.430 -1.953 1.00 0.00 C ATOM 876 O SER A 56 -2.056 4.194 -1.026 1.00 0.00 O ATOM 877 CB SER A 56 -1.046 2.753 -3.851 1.00 0.00 C ATOM 878 OG SER A 56 -1.937 1.671 -3.618 1.00 0.00 O ATOM 0 H SER A 56 -1.016 2.124 -0.906 1.00 0.00 H new ATOM 0 HA SER A 56 0.543 3.726 -2.784 1.00 0.00 H new ATOM 0 HB2 SER A 56 -1.578 3.554 -4.364 1.00 0.00 H new ATOM 0 HB3 SER A 56 -0.247 2.425 -4.515 1.00 0.00 H new ATOM 0 HG SER A 56 -2.631 1.664 -4.310 1.00 0.00 H new ATOM 884 N ASP A 57 -1.140 5.637 -2.512 1.00 0.00 N ATOM 885 CA ASP A 57 -2.110 6.708 -2.268 1.00 0.00 C ATOM 886 C ASP A 57 -3.368 6.451 -3.105 1.00 0.00 C ATOM 887 O ASP A 57 -3.384 5.588 -3.980 1.00 0.00 O ATOM 888 CB ASP A 57 -1.513 8.094 -2.573 1.00 0.00 C ATOM 889 CG ASP A 57 -2.499 9.230 -2.268 1.00 0.00 C ATOM 890 OD1 ASP A 57 -3.238 9.160 -1.260 1.00 0.00 O ATOM 891 OD2 ASP A 57 -2.626 10.140 -3.098 1.00 0.00 O ATOM 0 H ASP A 57 -0.374 5.896 -3.134 1.00 0.00 H new ATOM 0 HA ASP A 57 -2.376 6.706 -1.211 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -0.606 8.235 -1.985 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -1.222 8.140 -3.623 1.00 0.00 H new ATOM 896 N TRP A 58 -4.434 7.205 -2.856 1.00 0.00 N ATOM 897 CA TRP A 58 -5.611 7.232 -3.697 1.00 0.00 C ATOM 898 C TRP A 58 -5.403 8.107 -4.941 1.00 0.00 C ATOM 899 O TRP A 58 -5.762 7.696 -6.047 1.00 0.00 O ATOM 900 CB TRP A 58 -6.789 7.762 -2.875 1.00 0.00 C ATOM 901 CG TRP A 58 -8.114 7.473 -3.496 1.00 0.00 C ATOM 902 CD1 TRP A 58 -8.554 7.933 -4.687 1.00 0.00 C ATOM 903 CD2 TRP A 58 -9.130 6.548 -3.029 1.00 0.00 C ATOM 904 NE1 TRP A 58 -9.761 7.348 -4.986 1.00 0.00 N ATOM 905 CE2 TRP A 58 -10.205 6.544 -3.964 1.00 0.00 C ATOM 906 CE3 TRP A 58 -9.234 5.697 -1.912 1.00 0.00 C ATOM 907 CZ2 TRP A 58 -11.360 5.776 -3.771 1.00 0.00 C ATOM 908 CZ3 TRP A 58 -10.387 4.923 -1.711 1.00 0.00 C ATOM 909 CH2 TRP A 58 -11.436 4.962 -2.634 1.00 0.00 C ATOM 0 H TRP A 58 -4.499 7.823 -2.047 1.00 0.00 H new ATOM 0 HA TRP A 58 -5.814 6.219 -4.044 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -6.757 7.320 -1.879 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -6.681 8.839 -2.749 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -8.037 8.650 -5.308 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -10.266 7.493 -5.860 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -8.420 5.640 -1.205 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -12.172 5.811 -4.482 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -10.464 4.293 -0.837 1.00 0.00 H new ATOM 0 HH2 TRP A 58 -12.315 4.357 -2.468 1.00 0.00 H new ATOM 920 N ASN A 59 -4.939 9.347 -4.742 1.00 0.00 N ATOM 921 CA ASN A 59 -5.071 10.456 -5.684 1.00 0.00 C ATOM 922 C ASN A 59 -4.103 10.278 -6.846 1.00 0.00 C ATOM 923 O ASN A 59 -3.054 10.920 -6.871 1.00 0.00 O ATOM 924 CB ASN A 59 -4.823 11.790 -4.943 1.00 0.00 C ATOM 925 CG ASN A 59 -4.834 13.001 -5.873 1.00 0.00 C ATOM 926 OD1 ASN A 59 -5.875 13.350 -6.418 1.00 0.00 O ATOM 927 ND2 ASN A 59 -3.713 13.683 -6.057 1.00 0.00 N ATOM 0 H ASN A 59 -4.445 9.611 -3.890 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.080 10.471 -6.095 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -5.587 11.921 -4.176 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -3.862 11.741 -4.431 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -3.710 14.508 -6.657 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -2.853 13.383 -5.598 1.00 0.00 H new ATOM 934 N MET A 60 -4.421 9.438 -7.832 1.00 0.00 N ATOM 935 CA MET A 60 -3.583 9.324 -9.016 1.00 0.00 C ATOM 936 C MET A 60 -4.426 9.316 -10.290 1.00 0.00 C ATOM 937 O MET A 60 -5.616 8.980 -10.231 1.00 0.00 O ATOM 938 CB MET A 60 -2.628 8.138 -8.868 1.00 0.00 C ATOM 939 CG MET A 60 -3.271 6.758 -8.788 1.00 0.00 C ATOM 940 SD MET A 60 -2.066 5.427 -8.514 1.00 0.00 S ATOM 941 CE MET A 60 -1.820 5.548 -6.727 1.00 0.00 C ATOM 0 H MET A 60 -5.244 8.835 -7.831 1.00 0.00 H new ATOM 0 HA MET A 60 -2.950 10.206 -9.112 1.00 0.00 H new ATOM 0 HB2 MET A 60 -1.939 8.146 -9.713 1.00 0.00 H new ATOM 0 HB3 MET A 60 -2.031 8.290 -7.969 1.00 0.00 H new ATOM 0 HG2 MET A 60 -4.002 6.750 -7.980 1.00 0.00 H new ATOM 0 HG3 MET A 60 -3.815 6.563 -9.712 1.00 0.00 H new ATOM 0 HE1 MET A 60 -0.771 5.367 -6.491 1.00 0.00 H new ATOM 0 HE2 MET A 60 -2.101 6.545 -6.388 1.00 0.00 H new ATOM 0 HE3 MET A 60 -2.439 4.805 -6.223 1.00 0.00 H new ATOM 951 N PRO A 61 -3.856 9.757 -11.424 1.00 0.00 N ATOM 952 CA PRO A 61 -4.493 9.649 -12.724 1.00 0.00 C ATOM 953 C PRO A 61 -4.436 8.194 -13.199 1.00 0.00 C ATOM 954 O PRO A 61 -3.998 7.297 -12.480 1.00 0.00 O ATOM 955 CB PRO A 61 -3.685 10.594 -13.622 1.00 0.00 C ATOM 956 CG PRO A 61 -2.269 10.459 -13.068 1.00 0.00 C ATOM 957 CD PRO A 61 -2.524 10.342 -11.570 1.00 0.00 C ATOM 0 HA PRO A 61 -5.548 9.922 -12.724 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -3.739 10.300 -14.670 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -4.048 11.620 -13.559 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -1.758 9.582 -13.464 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -1.652 11.324 -13.310 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -1.770 9.714 -11.095 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -2.474 11.319 -11.090 1.00 0.00 H new ATOM 965 N ASN A 62 -4.838 7.977 -14.450 1.00 0.00 N ATOM 966 CA ASN A 62 -4.799 6.704 -15.149 1.00 0.00 C ATOM 967 C ASN A 62 -5.602 5.661 -14.366 1.00 0.00 C ATOM 968 O ASN A 62 -6.831 5.710 -14.405 1.00 0.00 O ATOM 969 CB ASN A 62 -3.358 6.283 -15.502 1.00 0.00 C ATOM 970 CG ASN A 62 -2.539 7.384 -16.159 1.00 0.00 C ATOM 971 OD1 ASN A 62 -2.911 7.916 -17.200 1.00 0.00 O ATOM 972 ND2 ASN A 62 -1.434 7.770 -15.556 1.00 0.00 N ATOM 0 H ASN A 62 -5.218 8.726 -15.029 1.00 0.00 H new ATOM 0 HA ASN A 62 -5.286 6.803 -16.119 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -2.851 5.960 -14.593 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -3.394 5.422 -16.170 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -0.872 8.523 -15.954 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -1.140 7.316 -14.691 1.00 0.00 H new ATOM 979 N MET A 63 -4.949 4.739 -13.663 1.00 0.00 N ATOM 980 CA MET A 63 -5.576 3.849 -12.701 1.00 0.00 C ATOM 981 C MET A 63 -5.510 4.524 -11.324 1.00 0.00 C ATOM 982 O MET A 63 -4.485 4.424 -10.649 1.00 0.00 O ATOM 983 CB MET A 63 -4.895 2.463 -12.760 1.00 0.00 C ATOM 984 CG MET A 63 -5.943 1.350 -12.853 1.00 0.00 C ATOM 985 SD MET A 63 -6.711 1.238 -14.494 1.00 0.00 S ATOM 986 CE MET A 63 -7.941 -0.060 -14.199 1.00 0.00 C ATOM 0 H MET A 63 -3.944 4.590 -13.752 1.00 0.00 H new ATOM 0 HA MET A 63 -6.627 3.670 -12.927 1.00 0.00 H new ATOM 0 HB2 MET A 63 -4.229 2.416 -13.622 1.00 0.00 H new ATOM 0 HB3 MET A 63 -4.279 2.317 -11.873 1.00 0.00 H new ATOM 0 HG2 MET A 63 -5.475 0.396 -12.611 1.00 0.00 H new ATOM 0 HG3 MET A 63 -6.718 1.524 -12.106 1.00 0.00 H new ATOM 0 HE1 MET A 63 -7.792 -0.871 -14.912 1.00 0.00 H new ATOM 0 HE2 MET A 63 -7.829 -0.443 -13.185 1.00 0.00 H new ATOM 0 HE3 MET A 63 -8.942 0.353 -14.323 1.00 0.00 H new ATOM 996 N ASP A 64 -6.571 5.232 -10.920 1.00 0.00 N ATOM 997 CA ASP A 64 -6.745 5.770 -9.557 1.00 0.00 C ATOM 998 C ASP A 64 -6.559 4.645 -8.526 1.00 0.00 C ATOM 999 O ASP A 64 -6.759 3.469 -8.844 1.00 0.00 O ATOM 1000 CB ASP A 64 -8.099 6.511 -9.479 1.00 0.00 C ATOM 1001 CG ASP A 64 -8.860 6.528 -8.145 1.00 0.00 C ATOM 1002 OD1 ASP A 64 -9.135 5.455 -7.563 1.00 0.00 O ATOM 1003 OD2 ASP A 64 -9.364 7.609 -7.755 1.00 0.00 O ATOM 0 H ASP A 64 -7.350 5.454 -11.540 1.00 0.00 H new ATOM 0 HA ASP A 64 -5.982 6.509 -9.314 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -7.925 7.546 -9.773 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -8.758 6.073 -10.229 1.00 0.00 H new ATOM 1008 N GLY A 65 -6.139 4.974 -7.299 1.00 0.00 N ATOM 1009 CA GLY A 65 -5.679 3.979 -6.332 1.00 0.00 C ATOM 1010 C GLY A 65 -6.727 2.910 -6.001 1.00 0.00 C ATOM 1011 O GLY A 65 -6.371 1.762 -5.721 1.00 0.00 O ATOM 0 H GLY A 65 -6.110 5.933 -6.953 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -4.786 3.491 -6.723 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -5.388 4.487 -5.412 1.00 0.00 H new ATOM 1015 N LEU A 66 -8.018 3.249 -6.061 1.00 0.00 N ATOM 1016 CA LEU A 66 -9.089 2.289 -5.820 1.00 0.00 C ATOM 1017 C LEU A 66 -9.196 1.322 -6.992 1.00 0.00 C ATOM 1018 O LEU A 66 -9.378 0.120 -6.793 1.00 0.00 O ATOM 1019 CB LEU A 66 -10.405 3.049 -5.585 1.00 0.00 C ATOM 1020 CG LEU A 66 -11.550 2.303 -4.884 1.00 0.00 C ATOM 1021 CD1 LEU A 66 -12.338 1.328 -5.754 1.00 0.00 C ATOM 1022 CD2 LEU A 66 -11.067 1.543 -3.654 1.00 0.00 C ATOM 0 H LEU A 66 -8.344 4.191 -6.277 1.00 0.00 H new ATOM 0 HA LEU A 66 -8.871 1.699 -4.930 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -10.177 3.939 -4.998 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -10.772 3.390 -6.553 1.00 0.00 H new ATOM 0 HG LEU A 66 -12.228 3.112 -4.611 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -13.120 0.858 -5.157 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.791 1.867 -6.586 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -11.667 0.561 -6.141 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -11.909 1.030 -3.189 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -10.315 0.811 -3.950 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -10.631 2.243 -2.942 1.00 0.00 H new ATOM 1034 N GLU A 67 -9.043 1.832 -8.212 1.00 0.00 N ATOM 1035 CA GLU A 67 -9.033 1.031 -9.427 1.00 0.00 C ATOM 1036 C GLU A 67 -7.807 0.116 -9.434 1.00 0.00 C ATOM 1037 O GLU A 67 -7.926 -1.044 -9.825 1.00 0.00 O ATOM 1038 CB GLU A 67 -9.032 1.925 -10.674 1.00 0.00 C ATOM 1039 CG GLU A 67 -10.200 2.907 -10.764 1.00 0.00 C ATOM 1040 CD GLU A 67 -11.536 2.212 -11.032 1.00 0.00 C ATOM 1041 OE1 GLU A 67 -12.126 1.593 -10.117 1.00 0.00 O ATOM 1042 OE2 GLU A 67 -12.051 2.326 -12.171 1.00 0.00 O ATOM 0 H GLU A 67 -8.921 2.830 -8.383 1.00 0.00 H new ATOM 0 HA GLU A 67 -9.937 0.423 -9.447 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -8.100 2.489 -10.698 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -9.042 1.289 -11.559 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -10.268 3.470 -9.833 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -10.004 3.627 -11.559 1.00 0.00 H new ATOM 1049 N LEU A 68 -6.642 0.594 -8.979 1.00 0.00 N ATOM 1050 CA LEU A 68 -5.441 -0.225 -8.816 1.00 0.00 C ATOM 1051 C LEU A 68 -5.732 -1.395 -7.875 1.00 0.00 C ATOM 1052 O LEU A 68 -5.480 -2.543 -8.246 1.00 0.00 O ATOM 1053 CB LEU A 68 -4.265 0.633 -8.314 1.00 0.00 C ATOM 1054 CG LEU A 68 -2.996 -0.179 -7.976 1.00 0.00 C ATOM 1055 CD1 LEU A 68 -2.399 -0.870 -9.213 1.00 0.00 C ATOM 1056 CD2 LEU A 68 -1.959 0.747 -7.334 1.00 0.00 C ATOM 0 H LEU A 68 -6.509 1.569 -8.712 1.00 0.00 H new ATOM 0 HA LEU A 68 -5.152 -0.636 -9.784 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -4.018 1.374 -9.075 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.581 1.181 -7.426 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.278 -0.967 -7.277 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.509 -1.428 -8.924 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -3.134 -1.554 -9.638 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -2.131 -0.119 -9.956 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.061 0.177 -7.094 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -1.706 1.547 -8.030 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -2.371 1.177 -6.421 1.00 0.00 H new ATOM 1068 N LEU A 69 -6.299 -1.116 -6.692 1.00 0.00 N ATOM 1069 CA LEU A 69 -6.782 -2.141 -5.764 1.00 0.00 C ATOM 1070 C LEU A 69 -7.672 -3.118 -6.522 1.00 0.00 C ATOM 1071 O LEU A 69 -7.375 -4.308 -6.546 1.00 0.00 O ATOM 1072 CB LEU A 69 -7.443 -1.492 -4.520 1.00 0.00 C ATOM 1073 CG LEU A 69 -8.679 -2.151 -3.858 1.00 0.00 C ATOM 1074 CD1 LEU A 69 -8.619 -3.641 -3.479 1.00 0.00 C ATOM 1075 CD2 LEU A 69 -8.954 -1.443 -2.522 1.00 0.00 C ATOM 0 H LEU A 69 -6.435 -0.164 -6.353 1.00 0.00 H new ATOM 0 HA LEU A 69 -5.952 -2.723 -5.363 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.673 -1.407 -3.753 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.729 -0.478 -4.799 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.429 -2.057 -4.643 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -9.565 -3.940 -3.028 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -8.439 -4.237 -4.374 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.810 -3.803 -2.767 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.822 -1.895 -2.042 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.086 -1.545 -1.871 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.149 -0.386 -2.704 1.00 0.00 H new ATOM 1087 N LYS A 70 -8.744 -2.654 -7.158 1.00 0.00 N ATOM 1088 CA LYS A 70 -9.707 -3.554 -7.785 1.00 0.00 C ATOM 1089 C LYS A 70 -9.134 -4.342 -8.958 1.00 0.00 C ATOM 1090 O LYS A 70 -9.615 -5.450 -9.208 1.00 0.00 O ATOM 1091 CB LYS A 70 -10.947 -2.769 -8.205 1.00 0.00 C ATOM 1092 CG LYS A 70 -11.763 -2.411 -6.961 1.00 0.00 C ATOM 1093 CD LYS A 70 -13.106 -1.788 -7.355 1.00 0.00 C ATOM 1094 CE LYS A 70 -14.194 -2.108 -6.333 1.00 0.00 C ATOM 1095 NZ LYS A 70 -14.695 -3.487 -6.511 1.00 0.00 N ATOM 0 H LYS A 70 -8.967 -1.663 -7.253 1.00 0.00 H new ATOM 0 HA LYS A 70 -9.978 -4.300 -7.038 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -10.655 -1.863 -8.736 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -11.551 -3.361 -8.892 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -11.933 -3.306 -6.362 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -11.201 -1.713 -6.340 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -12.995 -0.707 -7.443 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -13.406 -2.158 -8.335 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -13.798 -1.988 -5.325 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -15.017 -1.401 -6.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -15.457 -3.670 -5.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -15.062 -3.601 -7.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -13.919 -4.161 -6.353 1.00 0.00 H new ATOM 1109 N THR A 71 -8.125 -3.817 -9.648 1.00 0.00 N ATOM 1110 CA THR A 71 -7.364 -4.549 -10.647 1.00 0.00 C ATOM 1111 C THR A 71 -6.725 -5.754 -9.946 1.00 0.00 C ATOM 1112 O THR A 71 -7.049 -6.897 -10.271 1.00 0.00 O ATOM 1113 CB THR A 71 -6.353 -3.608 -11.327 1.00 0.00 C ATOM 1114 OG1 THR A 71 -7.015 -2.479 -11.861 1.00 0.00 O ATOM 1115 CG2 THR A 71 -5.629 -4.287 -12.487 1.00 0.00 C ATOM 0 H THR A 71 -7.811 -2.855 -9.524 1.00 0.00 H new ATOM 0 HA THR A 71 -7.994 -4.926 -11.452 1.00 0.00 H new ATOM 0 HB THR A 71 -5.634 -3.324 -10.558 1.00 0.00 H new ATOM 0 HG1 THR A 71 -7.323 -1.904 -11.130 1.00 0.00 H new ATOM 0 HG21 THR A 71 -4.926 -3.586 -12.937 1.00 0.00 H new ATOM 0 HG22 THR A 71 -5.087 -5.158 -12.118 1.00 0.00 H new ATOM 0 HG23 THR A 71 -6.356 -4.602 -13.235 1.00 0.00 H new ATOM 1123 N ILE A 72 -5.896 -5.490 -8.932 1.00 0.00 N ATOM 1124 CA ILE A 72 -5.107 -6.482 -8.210 1.00 0.00 C ATOM 1125 C ILE A 72 -6.041 -7.537 -7.589 1.00 0.00 C ATOM 1126 O ILE A 72 -5.738 -8.727 -7.598 1.00 0.00 O ATOM 1127 CB ILE A 72 -4.289 -5.722 -7.137 1.00 0.00 C ATOM 1128 CG1 ILE A 72 -3.067 -5.037 -7.786 1.00 0.00 C ATOM 1129 CG2 ILE A 72 -3.740 -6.663 -6.050 1.00 0.00 C ATOM 1130 CD1 ILE A 72 -2.534 -3.891 -6.911 1.00 0.00 C ATOM 0 H ILE A 72 -5.753 -4.543 -8.581 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.425 -7.017 -8.872 1.00 0.00 H new ATOM 0 HB ILE A 72 -4.970 -4.998 -6.690 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.278 -5.772 -7.945 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -3.344 -4.649 -8.766 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.174 -6.085 -5.320 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -4.569 -7.165 -5.551 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -3.088 -7.407 -6.508 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.674 -3.431 -7.398 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -3.316 -3.144 -6.774 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.234 -4.284 -5.940 1.00 0.00 H new ATOM 1142 N ARG A 73 -7.179 -7.102 -7.034 1.00 0.00 N ATOM 1143 CA ARG A 73 -8.099 -7.910 -6.226 1.00 0.00 C ATOM 1144 C ARG A 73 -8.713 -9.085 -6.994 1.00 0.00 C ATOM 1145 O ARG A 73 -9.325 -9.931 -6.350 1.00 0.00 O ATOM 1146 CB ARG A 73 -9.193 -6.978 -5.656 1.00 0.00 C ATOM 1147 CG ARG A 73 -9.785 -7.351 -4.287 1.00 0.00 C ATOM 1148 CD ARG A 73 -10.907 -8.395 -4.326 1.00 0.00 C ATOM 1149 NE ARG A 73 -11.907 -8.156 -3.271 1.00 0.00 N ATOM 1150 CZ ARG A 73 -12.925 -8.970 -2.966 1.00 0.00 C ATOM 1151 NH1 ARG A 73 -13.037 -10.150 -3.571 1.00 0.00 N ATOM 1152 NH2 ARG A 73 -13.830 -8.596 -2.064 1.00 0.00 N ATOM 0 H ARG A 73 -7.496 -6.138 -7.140 1.00 0.00 H new ATOM 0 HA ARG A 73 -7.529 -8.368 -5.417 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -8.777 -5.973 -5.583 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -10.009 -6.933 -6.377 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -8.983 -7.726 -3.652 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -10.168 -6.446 -3.816 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -11.393 -8.371 -5.301 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -10.482 -9.392 -4.206 1.00 0.00 H new ATOM 0 HE ARG A 73 -11.816 -7.298 -2.727 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -12.347 -10.434 -4.267 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -13.813 -10.771 -3.339 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -13.748 -7.689 -1.605 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -14.605 -9.217 -1.832 1.00 0.00 H new ATOM 1166 N ALA A 74 -8.606 -9.133 -8.326 1.00 0.00 N ATOM 1167 CA ALA A 74 -9.199 -10.188 -9.133 1.00 0.00 C ATOM 1168 C ALA A 74 -8.491 -11.526 -8.892 1.00 0.00 C ATOM 1169 O ALA A 74 -9.005 -12.357 -8.144 1.00 0.00 O ATOM 1170 CB ALA A 74 -9.202 -9.776 -10.608 1.00 0.00 C ATOM 0 H ALA A 74 -8.101 -8.434 -8.871 1.00 0.00 H new ATOM 0 HA ALA A 74 -10.237 -10.333 -8.833 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -9.647 -10.570 -11.207 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.783 -8.861 -10.729 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.178 -9.602 -10.939 1.00 0.00 H new ATOM 1176 N ASP A 75 -7.352 -11.768 -9.542 1.00 0.00 N ATOM 1177 CA ASP A 75 -6.625 -13.041 -9.554 1.00 0.00 C ATOM 1178 C ASP A 75 -5.280 -12.837 -10.265 1.00 0.00 C ATOM 1179 O ASP A 75 -4.807 -11.703 -10.365 1.00 0.00 O ATOM 1180 CB ASP A 75 -7.452 -14.199 -10.156 1.00 0.00 C ATOM 1181 CG ASP A 75 -7.737 -14.071 -11.646 1.00 0.00 C ATOM 1182 OD1 ASP A 75 -8.727 -13.407 -12.024 1.00 0.00 O ATOM 1183 OD2 ASP A 75 -7.065 -14.741 -12.465 1.00 0.00 O ATOM 0 H ASP A 75 -6.889 -11.051 -10.100 1.00 0.00 H new ATOM 0 HA ASP A 75 -6.436 -13.348 -8.525 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -6.922 -15.135 -9.981 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -8.401 -14.265 -9.623 1.00 0.00 H new ATOM 1188 N GLY A 76 -4.603 -13.911 -10.684 1.00 0.00 N ATOM 1189 CA GLY A 76 -3.185 -13.877 -11.033 1.00 0.00 C ATOM 1190 C GLY A 76 -2.329 -13.926 -9.767 1.00 0.00 C ATOM 1191 O GLY A 76 -1.265 -13.313 -9.719 1.00 0.00 O ATOM 0 H GLY A 76 -5.029 -14.832 -10.790 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -2.941 -14.721 -11.678 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -2.963 -12.970 -11.596 1.00 0.00 H new ATOM 1195 N ALA A 77 -2.834 -14.571 -8.707 1.00 0.00 N ATOM 1196 CA ALA A 77 -2.393 -14.574 -7.311 1.00 0.00 C ATOM 1197 C ALA A 77 -2.374 -13.193 -6.647 1.00 0.00 C ATOM 1198 O ALA A 77 -2.413 -13.116 -5.422 1.00 0.00 O ATOM 1199 CB ALA A 77 -1.051 -15.294 -7.156 1.00 0.00 C ATOM 0 H ALA A 77 -3.652 -15.169 -8.823 1.00 0.00 H new ATOM 0 HA ALA A 77 -3.154 -15.135 -6.768 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -0.749 -15.280 -6.109 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -1.151 -16.326 -7.491 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.296 -14.789 -7.758 1.00 0.00 H new ATOM 1205 N MET A 78 -2.383 -12.097 -7.414 1.00 0.00 N ATOM 1206 CA MET A 78 -2.242 -10.744 -6.885 1.00 0.00 C ATOM 1207 C MET A 78 -3.382 -10.370 -5.941 1.00 0.00 C ATOM 1208 O MET A 78 -3.208 -9.507 -5.088 1.00 0.00 O ATOM 1209 CB MET A 78 -2.085 -9.702 -8.008 1.00 0.00 C ATOM 1210 CG MET A 78 -1.140 -10.163 -9.127 1.00 0.00 C ATOM 1211 SD MET A 78 -0.363 -8.829 -10.080 1.00 0.00 S ATOM 1212 CE MET A 78 0.439 -9.807 -11.381 1.00 0.00 C ATOM 0 H MET A 78 -2.490 -12.129 -8.428 1.00 0.00 H new ATOM 0 HA MET A 78 -1.323 -10.737 -6.298 1.00 0.00 H new ATOM 0 HB2 MET A 78 -3.065 -9.485 -8.434 1.00 0.00 H new ATOM 0 HB3 MET A 78 -1.709 -8.772 -7.583 1.00 0.00 H new ATOM 0 HG2 MET A 78 -0.355 -10.779 -8.687 1.00 0.00 H new ATOM 0 HG3 MET A 78 -1.698 -10.800 -9.813 1.00 0.00 H new ATOM 0 HE1 MET A 78 0.968 -9.141 -12.063 1.00 0.00 H new ATOM 0 HE2 MET A 78 1.147 -10.502 -10.930 1.00 0.00 H new ATOM 0 HE3 MET A 78 -0.316 -10.366 -11.933 1.00 0.00 H new ATOM 1222 N SER A 79 -4.503 -11.079 -6.009 1.00 0.00 N ATOM 1223 CA SER A 79 -5.630 -10.923 -5.104 1.00 0.00 C ATOM 1224 C SER A 79 -5.203 -11.087 -3.635 1.00 0.00 C ATOM 1225 O SER A 79 -5.793 -10.467 -2.748 1.00 0.00 O ATOM 1226 CB SER A 79 -6.727 -11.908 -5.529 1.00 0.00 C ATOM 1227 OG SER A 79 -6.249 -13.248 -5.555 1.00 0.00 O ATOM 0 H SER A 79 -4.655 -11.798 -6.716 1.00 0.00 H new ATOM 0 HA SER A 79 -6.029 -9.911 -5.169 1.00 0.00 H new ATOM 0 HB2 SER A 79 -7.569 -11.835 -4.840 1.00 0.00 H new ATOM 0 HB3 SER A 79 -7.099 -11.635 -6.517 1.00 0.00 H new ATOM 0 HG SER A 79 -6.974 -13.849 -5.828 1.00 0.00 H new ATOM 1233 N ALA A 80 -4.153 -11.877 -3.373 1.00 0.00 N ATOM 1234 CA ALA A 80 -3.593 -12.123 -2.053 1.00 0.00 C ATOM 1235 C ALA A 80 -2.667 -10.999 -1.564 1.00 0.00 C ATOM 1236 O ALA A 80 -2.157 -11.087 -0.443 1.00 0.00 O ATOM 1237 CB ALA A 80 -2.824 -13.446 -2.090 1.00 0.00 C ATOM 0 H ALA A 80 -3.656 -12.378 -4.110 1.00 0.00 H new ATOM 0 HA ALA A 80 -4.422 -12.165 -1.347 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -2.397 -13.646 -1.107 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -3.503 -14.254 -2.362 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -2.024 -13.381 -2.827 1.00 0.00 H new ATOM 1243 N LEU A 81 -2.418 -9.952 -2.354 1.00 0.00 N ATOM 1244 CA LEU A 81 -1.563 -8.846 -1.936 1.00 0.00 C ATOM 1245 C LEU A 81 -2.297 -7.965 -0.924 1.00 0.00 C ATOM 1246 O LEU A 81 -3.460 -7.614 -1.160 1.00 0.00 O ATOM 1247 CB LEU A 81 -1.157 -7.985 -3.145 1.00 0.00 C ATOM 1248 CG LEU A 81 -0.038 -8.625 -3.990 1.00 0.00 C ATOM 1249 CD1 LEU A 81 0.168 -7.896 -5.327 1.00 0.00 C ATOM 1250 CD2 LEU A 81 1.290 -8.623 -3.216 1.00 0.00 C ATOM 0 H LEU A 81 -2.801 -9.850 -3.294 1.00 0.00 H new ATOM 0 HA LEU A 81 -0.668 -9.267 -1.478 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.031 -7.818 -3.775 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -0.826 -7.008 -2.794 1.00 0.00 H new ATOM 0 HG LEU A 81 -0.350 -9.648 -4.199 1.00 0.00 H new ATOM 0 HD11 LEU A 81 0.966 -8.383 -5.888 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -0.755 -7.930 -5.906 1.00 0.00 H new ATOM 0 HD13 LEU A 81 0.439 -6.857 -5.137 1.00 0.00 H new ATOM 0 HD21 LEU A 81 2.068 -9.079 -3.828 1.00 0.00 H new ATOM 0 HD22 LEU A 81 1.570 -7.597 -2.977 1.00 0.00 H new ATOM 0 HD23 LEU A 81 1.174 -9.192 -2.293 1.00 0.00 H new ATOM 1262 N PRO A 82 -1.648 -7.537 0.171 1.00 0.00 N ATOM 1263 CA PRO A 82 -2.149 -6.460 0.998 1.00 0.00 C ATOM 1264 C PRO A 82 -1.976 -5.139 0.239 1.00 0.00 C ATOM 1265 O PRO A 82 -0.944 -4.468 0.321 1.00 0.00 O ATOM 1266 CB PRO A 82 -1.372 -6.542 2.310 1.00 0.00 C ATOM 1267 CG PRO A 82 -0.031 -7.133 1.891 1.00 0.00 C ATOM 1268 CD PRO A 82 -0.359 -7.993 0.667 1.00 0.00 C ATOM 0 HA PRO A 82 -3.213 -6.530 1.226 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.253 -5.560 2.768 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -1.880 -7.174 3.039 1.00 0.00 H new ATOM 0 HG2 PRO A 82 0.688 -6.352 1.646 1.00 0.00 H new ATOM 0 HG3 PRO A 82 0.407 -7.730 2.691 1.00 0.00 H new ATOM 0 HD2 PRO A 82 0.410 -7.887 -0.098 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -0.399 -9.049 0.935 1.00 0.00 H new ATOM 1276 N VAL A 83 -2.994 -4.790 -0.546 1.00 0.00 N ATOM 1277 CA VAL A 83 -3.182 -3.456 -1.090 1.00 0.00 C ATOM 1278 C VAL A 83 -3.585 -2.556 0.076 1.00 0.00 C ATOM 1279 O VAL A 83 -4.649 -2.765 0.677 1.00 0.00 O ATOM 1280 CB VAL A 83 -4.206 -3.462 -2.243 1.00 0.00 C ATOM 1281 CG1 VAL A 83 -3.530 -3.971 -3.521 1.00 0.00 C ATOM 1282 CG2 VAL A 83 -5.468 -4.299 -1.981 1.00 0.00 C ATOM 0 H VAL A 83 -3.724 -5.445 -0.825 1.00 0.00 H new ATOM 0 HA VAL A 83 -2.265 -3.074 -1.538 1.00 0.00 H new ATOM 0 HB VAL A 83 -4.542 -2.430 -2.343 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.252 -3.976 -4.337 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -2.697 -3.316 -3.777 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -3.159 -4.983 -3.358 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -6.128 -4.243 -2.847 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -5.186 -5.337 -1.807 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -5.986 -3.911 -1.104 1.00 0.00 H new ATOM 1292 N LEU A 84 -2.708 -1.635 0.473 1.00 0.00 N ATOM 1293 CA LEU A 84 -2.874 -0.794 1.654 1.00 0.00 C ATOM 1294 C LEU A 84 -2.999 0.645 1.188 1.00 0.00 C ATOM 1295 O LEU A 84 -2.051 1.193 0.620 1.00 0.00 O ATOM 1296 CB LEU A 84 -1.690 -0.991 2.614 1.00 0.00 C ATOM 1297 CG LEU A 84 -1.768 -0.162 3.913 1.00 0.00 C ATOM 1298 CD1 LEU A 84 -3.122 -0.229 4.622 1.00 0.00 C ATOM 1299 CD2 LEU A 84 -0.695 -0.629 4.896 1.00 0.00 C ATOM 0 H LEU A 84 -1.841 -1.450 -0.032 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.773 -1.067 2.206 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -1.624 -2.047 2.876 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -0.769 -0.735 2.090 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.614 0.872 3.604 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -3.091 0.381 5.525 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.900 0.147 3.957 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -3.342 -1.262 4.890 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.757 -0.039 5.810 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.851 -1.681 5.132 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.290 -0.501 4.447 1.00 0.00 H new ATOM 1311 N MET A 85 -4.175 1.237 1.383 1.00 0.00 N ATOM 1312 CA MET A 85 -4.380 2.622 0.982 1.00 0.00 C ATOM 1313 C MET A 85 -3.756 3.500 2.064 1.00 0.00 C ATOM 1314 O MET A 85 -4.200 3.452 3.213 1.00 0.00 O ATOM 1315 CB MET A 85 -5.874 2.910 0.829 1.00 0.00 C ATOM 1316 CG MET A 85 -6.559 2.121 -0.299 1.00 0.00 C ATOM 1317 SD MET A 85 -6.729 2.966 -1.897 1.00 0.00 S ATOM 1318 CE MET A 85 -5.007 3.037 -2.470 1.00 0.00 C ATOM 0 H MET A 85 -4.986 0.787 1.809 1.00 0.00 H new ATOM 0 HA MET A 85 -3.914 2.827 0.018 1.00 0.00 H new ATOM 0 HB2 MET A 85 -6.374 2.683 1.771 1.00 0.00 H new ATOM 0 HB3 MET A 85 -6.010 3.976 0.645 1.00 0.00 H new ATOM 0 HG2 MET A 85 -5.999 1.200 -0.459 1.00 0.00 H new ATOM 0 HG3 MET A 85 -7.554 1.834 0.042 1.00 0.00 H new ATOM 0 HE1 MET A 85 -4.989 3.139 -3.555 1.00 0.00 H new ATOM 0 HE2 MET A 85 -4.508 3.893 -2.017 1.00 0.00 H new ATOM 0 HE3 MET A 85 -4.490 2.122 -2.183 1.00 0.00 H new ATOM 1328 N VAL A 86 -2.740 4.285 1.722 1.00 0.00 N ATOM 1329 CA VAL A 86 -2.100 5.247 2.603 1.00 0.00 C ATOM 1330 C VAL A 86 -2.302 6.601 1.949 1.00 0.00 C ATOM 1331 O VAL A 86 -1.578 6.971 1.032 1.00 0.00 O ATOM 1332 CB VAL A 86 -0.625 4.880 2.864 1.00 0.00 C ATOM 1333 CG1 VAL A 86 0.048 5.918 3.771 1.00 0.00 C ATOM 1334 CG2 VAL A 86 -0.517 3.514 3.558 1.00 0.00 C ATOM 0 H VAL A 86 -2.327 4.266 0.790 1.00 0.00 H new ATOM 0 HA VAL A 86 -2.540 5.256 3.600 1.00 0.00 H new ATOM 0 HB VAL A 86 -0.128 4.852 1.894 1.00 0.00 H new ATOM 0 HG11 VAL A 86 1.087 5.635 3.939 1.00 0.00 H new ATOM 0 HG12 VAL A 86 0.011 6.897 3.293 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -0.475 5.960 4.726 1.00 0.00 H new ATOM 0 HG21 VAL A 86 0.532 3.276 3.732 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.044 3.548 4.511 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -0.962 2.747 2.924 1.00 0.00 H new ATOM 1344 N THR A 87 -3.331 7.316 2.391 1.00 0.00 N ATOM 1345 CA THR A 87 -3.817 8.513 1.740 1.00 0.00 C ATOM 1346 C THR A 87 -4.024 9.625 2.771 1.00 0.00 C ATOM 1347 O THR A 87 -3.537 9.560 3.903 1.00 0.00 O ATOM 1348 CB THR A 87 -5.045 8.126 0.881 1.00 0.00 C ATOM 1349 OG1 THR A 87 -5.443 9.214 0.075 1.00 0.00 O ATOM 1350 CG2 THR A 87 -6.261 7.633 1.674 1.00 0.00 C ATOM 0 H THR A 87 -3.857 7.069 3.229 1.00 0.00 H new ATOM 0 HA THR A 87 -3.094 8.941 1.046 1.00 0.00 H new ATOM 0 HB THR A 87 -4.706 7.284 0.278 1.00 0.00 H new ATOM 0 HG1 THR A 87 -4.727 9.431 -0.558 1.00 0.00 H new ATOM 0 HG21 THR A 87 -7.069 7.387 0.985 1.00 0.00 H new ATOM 0 HG22 THR A 87 -5.988 6.746 2.245 1.00 0.00 H new ATOM 0 HG23 THR A 87 -6.592 8.416 2.356 1.00 0.00 H new ATOM 1358 N ALA A 88 -4.723 10.681 2.368 1.00 0.00 N ATOM 1359 CA ALA A 88 -5.239 11.755 3.202 1.00 0.00 C ATOM 1360 C ALA A 88 -6.751 11.910 3.024 1.00 0.00 C ATOM 1361 O ALA A 88 -7.364 12.765 3.658 1.00 0.00 O ATOM 1362 CB ALA A 88 -4.534 13.046 2.804 1.00 0.00 C ATOM 0 H ALA A 88 -4.958 10.816 1.385 1.00 0.00 H new ATOM 0 HA ALA A 88 -5.051 11.523 4.250 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -4.905 13.867 3.417 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -3.460 12.936 2.956 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -4.731 13.259 1.753 1.00 0.00 H new ATOM 1368 N GLU A 89 -7.359 11.133 2.132 1.00 0.00 N ATOM 1369 CA GLU A 89 -8.698 11.383 1.644 1.00 0.00 C ATOM 1370 C GLU A 89 -9.713 10.733 2.581 1.00 0.00 C ATOM 1371 O GLU A 89 -10.195 9.627 2.340 1.00 0.00 O ATOM 1372 CB GLU A 89 -8.770 10.921 0.183 1.00 0.00 C ATOM 1373 CG GLU A 89 -7.901 11.825 -0.715 1.00 0.00 C ATOM 1374 CD GLU A 89 -8.452 13.249 -0.853 1.00 0.00 C ATOM 1375 OE1 GLU A 89 -9.645 13.495 -0.568 1.00 0.00 O ATOM 1376 OE2 GLU A 89 -7.707 14.151 -1.299 1.00 0.00 O ATOM 0 H GLU A 89 -6.924 10.304 1.727 1.00 0.00 H new ATOM 0 HA GLU A 89 -8.950 12.444 1.646 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -8.431 9.888 0.105 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -9.804 10.944 -0.161 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -6.892 11.871 -0.305 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.823 11.375 -1.705 1.00 0.00 H new ATOM 1383 N ALA A 90 -10.011 11.433 3.681 1.00 0.00 N ATOM 1384 CA ALA A 90 -10.925 11.007 4.735 1.00 0.00 C ATOM 1385 C ALA A 90 -12.392 10.894 4.277 1.00 0.00 C ATOM 1386 O ALA A 90 -13.243 10.515 5.083 1.00 0.00 O ATOM 1387 CB ALA A 90 -10.849 11.993 5.905 1.00 0.00 C ATOM 0 H ALA A 90 -9.602 12.349 3.864 1.00 0.00 H new ATOM 0 HA ALA A 90 -10.605 10.008 5.032 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -11.532 11.676 6.693 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -9.831 12.018 6.295 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -11.130 12.988 5.561 1.00 0.00 H new ATOM 1393 N LYS A 91 -12.708 11.271 3.030 1.00 0.00 N ATOM 1394 CA LYS A 91 -14.049 11.264 2.454 1.00 0.00 C ATOM 1395 C LYS A 91 -14.750 9.941 2.756 1.00 0.00 C ATOM 1396 O LYS A 91 -14.251 8.869 2.408 1.00 0.00 O ATOM 1397 CB LYS A 91 -13.959 11.649 0.964 1.00 0.00 C ATOM 1398 CG LYS A 91 -15.203 11.323 0.124 1.00 0.00 C ATOM 1399 CD LYS A 91 -15.100 11.978 -1.262 1.00 0.00 C ATOM 1400 CE LYS A 91 -16.275 11.577 -2.161 1.00 0.00 C ATOM 1401 NZ LYS A 91 -16.038 10.325 -2.913 1.00 0.00 N ATOM 0 H LYS A 91 -12.002 11.602 2.372 1.00 0.00 H new ATOM 0 HA LYS A 91 -14.688 12.018 2.915 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -13.764 12.719 0.894 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -13.101 11.139 0.525 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -15.304 10.243 0.016 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -16.098 11.678 0.635 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -15.078 13.062 -1.153 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -14.162 11.686 -1.735 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -17.169 11.460 -1.548 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -16.475 12.384 -2.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -16.869 10.110 -3.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -15.203 10.439 -3.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -15.875 9.544 -2.245 1.00 0.00 H new ATOM 1415 N LYS A 92 -15.929 10.007 3.385 1.00 0.00 N ATOM 1416 CA LYS A 92 -16.635 8.816 3.859 1.00 0.00 C ATOM 1417 C LYS A 92 -16.801 7.808 2.743 1.00 0.00 C ATOM 1418 O LYS A 92 -16.397 6.662 2.860 1.00 0.00 O ATOM 1419 CB LYS A 92 -17.986 9.184 4.502 1.00 0.00 C ATOM 1420 CG LYS A 92 -19.005 9.998 3.673 1.00 0.00 C ATOM 1421 CD LYS A 92 -20.214 9.178 3.187 1.00 0.00 C ATOM 1422 CE LYS A 92 -21.162 10.098 2.404 1.00 0.00 C ATOM 1423 NZ LYS A 92 -22.301 9.395 1.776 1.00 0.00 N ATOM 0 H LYS A 92 -16.416 10.882 3.578 1.00 0.00 H new ATOM 0 HA LYS A 92 -16.028 8.350 4.635 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -18.472 8.256 4.804 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -17.777 9.746 5.412 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -19.364 10.833 4.275 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -18.497 10.424 2.808 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -19.881 8.355 2.554 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -20.735 8.736 4.036 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -21.548 10.863 3.078 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -20.594 10.613 1.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -23.171 9.948 1.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -22.122 9.285 0.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -22.413 8.457 2.211 1.00 0.00 H new ATOM 1437 N GLU A 93 -17.357 8.256 1.630 1.00 0.00 N ATOM 1438 CA GLU A 93 -17.578 7.406 0.465 1.00 0.00 C ATOM 1439 C GLU A 93 -16.283 6.806 -0.101 1.00 0.00 C ATOM 1440 O GLU A 93 -16.314 5.728 -0.678 1.00 0.00 O ATOM 1441 CB GLU A 93 -18.349 8.182 -0.607 1.00 0.00 C ATOM 1442 CG GLU A 93 -19.803 7.693 -0.617 1.00 0.00 C ATOM 1443 CD GLU A 93 -20.683 8.551 -1.513 1.00 0.00 C ATOM 1444 OE1 GLU A 93 -20.494 8.516 -2.748 1.00 0.00 O ATOM 1445 OE2 GLU A 93 -21.562 9.258 -0.965 1.00 0.00 O ATOM 0 H GLU A 93 -17.669 9.219 1.505 1.00 0.00 H new ATOM 0 HA GLU A 93 -18.176 6.556 0.794 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -18.311 9.251 -0.400 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -17.892 8.030 -1.585 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -19.836 6.659 -0.959 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -20.197 7.706 0.399 1.00 0.00 H new ATOM 1452 N ASN A 94 -15.146 7.472 0.094 1.00 0.00 N ATOM 1453 CA ASN A 94 -13.812 6.958 -0.222 1.00 0.00 C ATOM 1454 C ASN A 94 -13.493 5.763 0.688 1.00 0.00 C ATOM 1455 O ASN A 94 -13.057 4.719 0.200 1.00 0.00 O ATOM 1456 CB ASN A 94 -12.773 8.084 -0.043 1.00 0.00 C ATOM 1457 CG ASN A 94 -11.872 8.310 -1.243 1.00 0.00 C ATOM 1458 OD1 ASN A 94 -12.338 8.444 -2.374 1.00 0.00 O ATOM 1459 ND2 ASN A 94 -10.587 8.487 -1.006 1.00 0.00 N ATOM 0 H ASN A 94 -15.126 8.413 0.488 1.00 0.00 H new ATOM 0 HA ASN A 94 -13.779 6.619 -1.257 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -13.298 9.013 0.180 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -12.152 7.853 0.822 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -9.958 8.740 -1.768 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -10.222 8.371 -0.061 1.00 0.00 H new ATOM 1466 N ILE A 95 -13.750 5.886 2.000 1.00 0.00 N ATOM 1467 CA ILE A 95 -13.623 4.762 2.941 1.00 0.00 C ATOM 1468 C ILE A 95 -14.539 3.614 2.478 1.00 0.00 C ATOM 1469 O ILE A 95 -14.096 2.460 2.457 1.00 0.00 O ATOM 1470 CB ILE A 95 -13.920 5.182 4.412 1.00 0.00 C ATOM 1471 CG1 ILE A 95 -12.737 5.923 5.077 1.00 0.00 C ATOM 1472 CG2 ILE A 95 -14.226 3.962 5.306 1.00 0.00 C ATOM 1473 CD1 ILE A 95 -12.676 7.405 4.700 1.00 0.00 C ATOM 0 H ILE A 95 -14.049 6.759 2.435 1.00 0.00 H new ATOM 0 HA ILE A 95 -12.588 4.420 2.937 1.00 0.00 H new ATOM 0 HB ILE A 95 -14.783 5.844 4.337 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -12.820 5.832 6.160 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -11.803 5.441 4.787 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -14.428 4.298 6.323 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -15.098 3.436 4.918 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -13.369 3.289 5.309 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -11.826 7.872 5.197 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -12.563 7.501 3.620 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -13.596 7.899 5.014 1.00 0.00 H new ATOM 1485 N ILE A 96 -15.803 3.910 2.128 1.00 0.00 N ATOM 1486 CA ILE A 96 -16.768 2.914 1.655 1.00 0.00 C ATOM 1487 C ILE A 96 -16.175 2.208 0.447 1.00 0.00 C ATOM 1488 O ILE A 96 -16.112 0.986 0.456 1.00 0.00 O ATOM 1489 CB ILE A 96 -18.169 3.513 1.347 1.00 0.00 C ATOM 1490 CG1 ILE A 96 -19.036 3.616 2.616 1.00 0.00 C ATOM 1491 CG2 ILE A 96 -18.987 2.683 0.337 1.00 0.00 C ATOM 1492 CD1 ILE A 96 -18.648 4.769 3.529 1.00 0.00 C ATOM 0 H ILE A 96 -16.182 4.856 2.167 1.00 0.00 H new ATOM 0 HA ILE A 96 -16.944 2.196 2.456 1.00 0.00 H new ATOM 0 HB ILE A 96 -17.949 4.494 0.927 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -20.080 3.731 2.324 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -18.962 2.682 3.173 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -19.952 3.161 0.171 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -18.445 2.621 -0.607 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -19.142 1.679 0.732 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -19.302 4.778 4.401 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -17.614 4.646 3.852 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -18.750 5.711 2.989 1.00 0.00 H new ATOM 1504 N ALA A 97 -15.745 2.948 -0.576 1.00 0.00 N ATOM 1505 CA ALA A 97 -15.200 2.386 -1.797 1.00 0.00 C ATOM 1506 C ALA A 97 -14.037 1.439 -1.483 1.00 0.00 C ATOM 1507 O ALA A 97 -14.006 0.328 -2.014 1.00 0.00 O ATOM 1508 CB ALA A 97 -14.813 3.524 -2.742 1.00 0.00 C ATOM 0 H ALA A 97 -15.769 3.968 -0.572 1.00 0.00 H new ATOM 0 HA ALA A 97 -15.951 1.780 -2.303 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -14.402 3.109 -3.662 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -15.696 4.120 -2.975 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -14.065 4.156 -2.263 1.00 0.00 H new ATOM 1514 N ALA A 98 -13.120 1.818 -0.584 1.00 0.00 N ATOM 1515 CA ALA A 98 -12.038 0.934 -0.154 1.00 0.00 C ATOM 1516 C ALA A 98 -12.571 -0.358 0.468 1.00 0.00 C ATOM 1517 O ALA A 98 -12.075 -1.439 0.148 1.00 0.00 O ATOM 1518 CB ALA A 98 -11.113 1.648 0.833 1.00 0.00 C ATOM 0 H ALA A 98 -13.109 2.736 -0.140 1.00 0.00 H new ATOM 0 HA ALA A 98 -11.469 0.667 -1.045 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -10.316 0.971 1.139 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -10.680 2.527 0.355 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -11.684 1.956 1.709 1.00 0.00 H new ATOM 1524 N ALA A 99 -13.552 -0.271 1.368 1.00 0.00 N ATOM 1525 CA ALA A 99 -14.106 -1.439 2.043 1.00 0.00 C ATOM 1526 C ALA A 99 -14.883 -2.325 1.062 1.00 0.00 C ATOM 1527 O ALA A 99 -14.761 -3.549 1.095 1.00 0.00 O ATOM 1528 CB ALA A 99 -15.011 -0.980 3.191 1.00 0.00 C ATOM 0 H ALA A 99 -13.982 0.611 1.647 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.287 -2.035 2.446 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -15.427 -1.851 3.697 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -14.429 -0.391 3.900 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.822 -0.370 2.793 1.00 0.00 H new ATOM 1534 N GLN A 100 -15.652 -1.707 0.167 1.00 0.00 N ATOM 1535 CA GLN A 100 -16.386 -2.331 -0.921 1.00 0.00 C ATOM 1536 C GLN A 100 -15.426 -3.106 -1.812 1.00 0.00 C ATOM 1537 O GLN A 100 -15.721 -4.251 -2.161 1.00 0.00 O ATOM 1538 CB GLN A 100 -17.102 -1.246 -1.740 1.00 0.00 C ATOM 1539 CG GLN A 100 -18.389 -0.736 -1.079 1.00 0.00 C ATOM 1540 CD GLN A 100 -19.572 -1.640 -1.404 1.00 0.00 C ATOM 1541 OE1 GLN A 100 -19.916 -1.820 -2.571 1.00 0.00 O ATOM 1542 NE2 GLN A 100 -20.224 -2.226 -0.422 1.00 0.00 N ATOM 0 H GLN A 100 -15.784 -0.696 0.188 1.00 0.00 H new ATOM 0 HA GLN A 100 -17.124 -3.021 -0.513 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -16.423 -0.407 -1.891 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -17.341 -1.644 -2.726 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -18.251 -0.687 0.001 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -18.599 0.278 -1.420 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -19.935 -2.074 0.544 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -21.018 -2.832 -0.627 1.00 0.00 H new ATOM 1551 N ALA A 101 -14.291 -2.510 -2.187 1.00 0.00 N ATOM 1552 CA ALA A 101 -13.277 -3.176 -2.972 1.00 0.00 C ATOM 1553 C ALA A 101 -12.599 -4.299 -2.177 1.00 0.00 C ATOM 1554 O ALA A 101 -12.248 -5.329 -2.755 1.00 0.00 O ATOM 1555 CB ALA A 101 -12.268 -2.119 -3.408 1.00 0.00 C ATOM 0 H ALA A 101 -14.059 -1.546 -1.947 1.00 0.00 H new ATOM 0 HA ALA A 101 -13.729 -3.650 -3.843 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -11.485 -2.587 -4.005 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -12.772 -1.358 -4.004 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -11.824 -1.655 -2.527 1.00 0.00 H new ATOM 1561 N GLY A 102 -12.441 -4.118 -0.866 1.00 0.00 N ATOM 1562 CA GLY A 102 -11.794 -5.060 0.032 1.00 0.00 C ATOM 1563 C GLY A 102 -10.328 -4.706 0.253 1.00 0.00 C ATOM 1564 O GLY A 102 -9.488 -5.607 0.290 1.00 0.00 O ATOM 0 H GLY A 102 -12.773 -3.280 -0.388 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -12.315 -5.068 0.989 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -11.868 -6.066 -0.380 1.00 0.00 H new ATOM 1568 N ALA A 103 -9.992 -3.412 0.375 1.00 0.00 N ATOM 1569 CA ALA A 103 -8.621 -3.001 0.655 1.00 0.00 C ATOM 1570 C ALA A 103 -8.175 -3.611 1.981 1.00 0.00 C ATOM 1571 O ALA A 103 -8.966 -3.662 2.931 1.00 0.00 O ATOM 1572 CB ALA A 103 -8.487 -1.477 0.730 1.00 0.00 C ATOM 0 H ALA A 103 -10.653 -2.641 0.283 1.00 0.00 H new ATOM 0 HA ALA A 103 -7.991 -3.354 -0.161 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -7.451 -1.213 0.940 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -8.788 -1.038 -0.221 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.127 -1.094 1.525 1.00 0.00 H new ATOM 1578 N SER A 104 -6.907 -4.007 2.076 1.00 0.00 N ATOM 1579 CA SER A 104 -6.390 -4.654 3.276 1.00 0.00 C ATOM 1580 C SER A 104 -6.363 -3.705 4.482 1.00 0.00 C ATOM 1581 O SER A 104 -6.343 -4.160 5.632 1.00 0.00 O ATOM 1582 CB SER A 104 -5.011 -5.241 2.979 1.00 0.00 C ATOM 1583 OG SER A 104 -4.023 -4.253 2.769 1.00 0.00 O ATOM 0 H SER A 104 -6.218 -3.890 1.333 1.00 0.00 H new ATOM 0 HA SER A 104 -7.065 -5.464 3.553 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.708 -5.879 3.809 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.075 -5.876 2.095 1.00 0.00 H new ATOM 0 HG SER A 104 -4.413 -3.500 2.278 1.00 0.00 H new ATOM 1589 N GLY A 105 -6.401 -2.394 4.229 1.00 0.00 N ATOM 1590 CA GLY A 105 -6.468 -1.359 5.236 1.00 0.00 C ATOM 1591 C GLY A 105 -6.497 0.011 4.572 1.00 0.00 C ATOM 1592 O GLY A 105 -6.268 0.149 3.361 1.00 0.00 O ATOM 0 H GLY A 105 -6.385 -2.022 3.279 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -7.359 -1.494 5.850 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -5.608 -1.432 5.902 1.00 0.00 H new ATOM 1596 N TYR A 106 -6.768 1.014 5.404 1.00 0.00 N ATOM 1597 CA TYR A 106 -6.929 2.401 5.019 1.00 0.00 C ATOM 1598 C TYR A 106 -6.233 3.250 6.074 1.00 0.00 C ATOM 1599 O TYR A 106 -6.454 3.051 7.272 1.00 0.00 O ATOM 1600 CB TYR A 106 -8.430 2.726 4.926 1.00 0.00 C ATOM 1601 CG TYR A 106 -8.762 3.790 3.906 1.00 0.00 C ATOM 1602 CD1 TYR A 106 -8.728 3.437 2.549 1.00 0.00 C ATOM 1603 CD2 TYR A 106 -9.106 5.101 4.285 1.00 0.00 C ATOM 1604 CE1 TYR A 106 -8.996 4.392 1.561 1.00 0.00 C ATOM 1605 CE2 TYR A 106 -9.433 6.052 3.296 1.00 0.00 C ATOM 1606 CZ TYR A 106 -9.383 5.696 1.931 1.00 0.00 C ATOM 1607 OH TYR A 106 -9.723 6.607 0.983 1.00 0.00 O ATOM 0 H TYR A 106 -6.885 0.869 6.407 1.00 0.00 H new ATOM 0 HA TYR A 106 -6.487 2.606 4.044 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -8.975 1.815 4.677 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -8.783 3.051 5.905 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -8.494 2.422 2.264 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -9.120 5.378 5.329 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -8.906 4.130 0.517 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -9.722 7.052 3.583 1.00 0.00 H new ATOM 0 HH TYR A 106 -9.754 6.171 0.106 1.00 0.00 H new ATOM 1617 N VAL A 107 -5.397 4.186 5.653 1.00 0.00 N ATOM 1618 CA VAL A 107 -4.722 5.173 6.477 1.00 0.00 C ATOM 1619 C VAL A 107 -5.044 6.519 5.836 1.00 0.00 C ATOM 1620 O VAL A 107 -5.025 6.650 4.614 1.00 0.00 O ATOM 1621 CB VAL A 107 -3.212 4.865 6.536 1.00 0.00 C ATOM 1622 CG1 VAL A 107 -2.433 5.999 7.209 1.00 0.00 C ATOM 1623 CG2 VAL A 107 -2.930 3.564 7.295 1.00 0.00 C ATOM 0 H VAL A 107 -5.158 4.281 4.666 1.00 0.00 H new ATOM 0 HA VAL A 107 -5.054 5.170 7.515 1.00 0.00 H new ATOM 0 HB VAL A 107 -2.882 4.760 5.503 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -1.373 5.748 7.233 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -2.575 6.922 6.646 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -2.797 6.136 8.227 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -1.856 3.380 7.316 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -3.303 3.650 8.316 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -3.430 2.735 6.794 1.00 0.00 H new ATOM 1633 N VAL A 108 -5.348 7.510 6.667 1.00 0.00 N ATOM 1634 CA VAL A 108 -5.660 8.875 6.286 1.00 0.00 C ATOM 1635 C VAL A 108 -4.721 9.721 7.141 1.00 0.00 C ATOM 1636 O VAL A 108 -4.686 9.536 8.357 1.00 0.00 O ATOM 1637 CB VAL A 108 -7.171 9.120 6.504 1.00 0.00 C ATOM 1638 CG1 VAL A 108 -7.582 10.588 6.629 1.00 0.00 C ATOM 1639 CG2 VAL A 108 -7.967 8.502 5.341 1.00 0.00 C ATOM 0 H VAL A 108 -5.384 7.371 7.677 1.00 0.00 H new ATOM 0 HA VAL A 108 -5.500 9.123 5.237 1.00 0.00 H new ATOM 0 HB VAL A 108 -7.396 8.650 7.462 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -8.660 10.653 6.779 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -7.069 11.038 7.479 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -7.310 11.121 5.718 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -9.032 8.676 5.496 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -7.657 8.962 4.403 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -7.777 7.430 5.299 1.00 0.00 H new ATOM 1649 N LYS A 109 -3.906 10.579 6.512 1.00 0.00 N ATOM 1650 CA LYS A 109 -2.998 11.495 7.204 1.00 0.00 C ATOM 1651 C LYS A 109 -3.766 12.283 8.266 1.00 0.00 C ATOM 1652 O LYS A 109 -4.905 12.667 7.998 1.00 0.00 O ATOM 1653 CB LYS A 109 -2.321 12.464 6.214 1.00 0.00 C ATOM 1654 CG LYS A 109 -1.132 11.794 5.515 1.00 0.00 C ATOM 1655 CD LYS A 109 -0.442 12.647 4.447 1.00 0.00 C ATOM 1656 CE LYS A 109 0.136 13.959 4.984 1.00 0.00 C ATOM 1657 NZ LYS A 109 0.907 14.681 3.950 1.00 0.00 N ATOM 0 H LYS A 109 -3.861 10.655 5.496 1.00 0.00 H new ATOM 0 HA LYS A 109 -2.218 10.904 7.684 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -3.046 12.794 5.470 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -1.981 13.353 6.745 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -0.395 11.518 6.269 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -1.476 10.869 5.053 1.00 0.00 H new ATOM 0 HD2 LYS A 109 0.361 12.066 3.993 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -1.158 12.873 3.657 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -0.674 14.594 5.343 1.00 0.00 H new ATOM 0 HE3 LYS A 109 0.780 13.750 5.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 1.283 15.564 4.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 1.695 14.085 3.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 0.286 14.902 3.145 1.00 0.00 H new ATOM 1671 N PRO A 110 -3.146 12.622 9.409 1.00 0.00 N ATOM 1672 CA PRO A 110 -1.788 12.259 9.814 1.00 0.00 C ATOM 1673 C PRO A 110 -1.673 10.769 10.161 1.00 0.00 C ATOM 1674 O PRO A 110 -2.677 10.089 10.383 1.00 0.00 O ATOM 1675 CB PRO A 110 -1.489 13.140 11.031 1.00 0.00 C ATOM 1676 CG PRO A 110 -2.866 13.415 11.630 1.00 0.00 C ATOM 1677 CD PRO A 110 -3.801 13.411 10.432 1.00 0.00 C ATOM 0 HA PRO A 110 -1.074 12.420 9.007 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -0.838 12.632 11.742 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -0.987 14.063 10.742 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -3.145 12.651 12.355 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -2.890 14.372 12.151 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -4.768 12.982 10.695 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -3.987 14.426 10.081 1.00 0.00 H new ATOM 1685 N PHE A 111 -0.442 10.278 10.307 1.00 0.00 N ATOM 1686 CA PHE A 111 -0.128 8.863 10.488 1.00 0.00 C ATOM 1687 C PHE A 111 1.379 8.705 10.669 1.00 0.00 C ATOM 1688 O PHE A 111 2.172 9.511 10.179 1.00 0.00 O ATOM 1689 CB PHE A 111 -0.568 8.013 9.268 1.00 0.00 C ATOM 1690 CG PHE A 111 0.244 8.106 7.977 1.00 0.00 C ATOM 1691 CD1 PHE A 111 1.498 7.465 7.874 1.00 0.00 C ATOM 1692 CD2 PHE A 111 -0.301 8.716 6.833 1.00 0.00 C ATOM 1693 CE1 PHE A 111 2.221 7.499 6.670 1.00 0.00 C ATOM 1694 CE2 PHE A 111 0.416 8.736 5.622 1.00 0.00 C ATOM 1695 CZ PHE A 111 1.687 8.147 5.545 1.00 0.00 C ATOM 0 H PHE A 111 0.387 10.872 10.302 1.00 0.00 H new ATOM 0 HA PHE A 111 -0.670 8.512 11.366 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -0.576 6.968 9.579 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -1.597 8.283 9.031 1.00 0.00 H new ATOM 0 HD1 PHE A 111 1.905 6.944 8.728 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -1.278 9.173 6.884 1.00 0.00 H new ATOM 0 HE1 PHE A 111 3.190 7.026 6.610 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -0.013 9.206 4.750 1.00 0.00 H new ATOM 0 HZ PHE A 111 2.251 8.192 4.625 1.00 0.00 H new ATOM 1705 N THR A 112 1.771 7.656 11.379 1.00 0.00 N ATOM 1706 CA THR A 112 3.136 7.335 11.774 1.00 0.00 C ATOM 1707 C THR A 112 3.309 5.817 11.849 1.00 0.00 C ATOM 1708 O THR A 112 2.376 5.064 11.540 1.00 0.00 O ATOM 1709 CB THR A 112 3.476 8.056 13.097 1.00 0.00 C ATOM 1710 OG1 THR A 112 2.372 8.061 13.984 1.00 0.00 O ATOM 1711 CG2 THR A 112 3.970 9.477 12.875 1.00 0.00 C ATOM 0 H THR A 112 1.102 6.963 11.716 1.00 0.00 H new ATOM 0 HA THR A 112 3.846 7.694 11.028 1.00 0.00 H new ATOM 0 HB THR A 112 4.289 7.488 13.550 1.00 0.00 H new ATOM 0 HG1 THR A 112 2.620 8.523 14.812 1.00 0.00 H new ATOM 0 HG21 THR A 112 4.195 9.938 13.837 1.00 0.00 H new ATOM 0 HG22 THR A 112 4.871 9.457 12.262 1.00 0.00 H new ATOM 0 HG23 THR A 112 3.198 10.055 12.367 1.00 0.00 H new ATOM 1719 N ALA A 113 4.502 5.362 12.251 1.00 0.00 N ATOM 1720 CA ALA A 113 4.801 3.954 12.447 1.00 0.00 C ATOM 1721 C ALA A 113 3.803 3.317 13.418 1.00 0.00 C ATOM 1722 O ALA A 113 3.522 2.136 13.263 1.00 0.00 O ATOM 1723 CB ALA A 113 6.252 3.752 12.904 1.00 0.00 C ATOM 0 H ALA A 113 5.292 5.976 12.450 1.00 0.00 H new ATOM 0 HA ALA A 113 4.695 3.447 11.488 1.00 0.00 H new ATOM 0 HB1 ALA A 113 6.445 2.688 13.042 1.00 0.00 H new ATOM 0 HB2 ALA A 113 6.930 4.149 12.148 1.00 0.00 H new ATOM 0 HB3 ALA A 113 6.413 4.275 13.847 1.00 0.00 H new ATOM 1729 N ALA A 114 3.209 4.095 14.329 1.00 0.00 N ATOM 1730 CA ALA A 114 2.118 3.673 15.196 1.00 0.00 C ATOM 1731 C ALA A 114 0.959 3.058 14.407 1.00 0.00 C ATOM 1732 O ALA A 114 0.528 1.950 14.725 1.00 0.00 O ATOM 1733 CB ALA A 114 1.645 4.876 16.020 1.00 0.00 C ATOM 0 H ALA A 114 3.487 5.064 14.483 1.00 0.00 H new ATOM 0 HA ALA A 114 2.485 2.892 15.862 1.00 0.00 H new ATOM 0 HB1 ALA A 114 0.827 4.571 16.673 1.00 0.00 H new ATOM 0 HB2 ALA A 114 2.471 5.251 16.624 1.00 0.00 H new ATOM 0 HB3 ALA A 114 1.299 5.663 15.350 1.00 0.00 H new ATOM 1739 N THR A 115 0.427 3.747 13.389 1.00 0.00 N ATOM 1740 CA THR A 115 -0.636 3.149 12.589 1.00 0.00 C ATOM 1741 C THR A 115 -0.043 2.095 11.650 1.00 0.00 C ATOM 1742 O THR A 115 -0.704 1.095 11.401 1.00 0.00 O ATOM 1743 CB THR A 115 -1.497 4.210 11.877 1.00 0.00 C ATOM 1744 OG1 THR A 115 -2.846 3.794 11.818 1.00 0.00 O ATOM 1745 CG2 THR A 115 -1.081 4.531 10.443 1.00 0.00 C ATOM 0 H THR A 115 0.707 4.687 13.110 1.00 0.00 H new ATOM 0 HA THR A 115 -1.334 2.635 13.249 1.00 0.00 H new ATOM 0 HB THR A 115 -1.354 5.107 12.479 1.00 0.00 H new ATOM 0 HG1 THR A 115 -3.380 4.479 11.365 1.00 0.00 H new ATOM 0 HG21 THR A 115 -1.749 5.288 10.031 1.00 0.00 H new ATOM 0 HG22 THR A 115 -0.058 4.907 10.436 1.00 0.00 H new ATOM 0 HG23 THR A 115 -1.139 3.627 9.836 1.00 0.00 H new ATOM 1753 N LEU A 116 1.185 2.281 11.144 1.00 0.00 N ATOM 1754 CA LEU A 116 1.807 1.343 10.208 1.00 0.00 C ATOM 1755 C LEU A 116 1.855 -0.056 10.846 1.00 0.00 C ATOM 1756 O LEU A 116 1.352 -1.013 10.253 1.00 0.00 O ATOM 1757 CB LEU A 116 3.194 1.882 9.796 1.00 0.00 C ATOM 1758 CG LEU A 116 3.863 1.318 8.527 1.00 0.00 C ATOM 1759 CD1 LEU A 116 4.041 -0.193 8.562 1.00 0.00 C ATOM 1760 CD2 LEU A 116 3.158 1.699 7.223 1.00 0.00 C ATOM 0 H LEU A 116 1.770 3.084 11.373 1.00 0.00 H new ATOM 0 HA LEU A 116 1.221 1.250 9.294 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.105 2.961 9.670 1.00 0.00 H new ATOM 0 HB3 LEU A 116 3.875 1.714 10.631 1.00 0.00 H new ATOM 0 HG LEU A 116 4.843 1.795 8.534 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.517 -0.525 7.639 1.00 0.00 H new ATOM 0 HD12 LEU A 116 4.667 -0.466 9.412 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.067 -0.672 8.660 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.692 1.262 6.379 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.135 1.322 7.239 1.00 0.00 H new ATOM 0 HD23 LEU A 116 3.144 2.784 7.121 1.00 0.00 H new ATOM 1772 N GLU A 117 2.392 -0.176 12.065 1.00 0.00 N ATOM 1773 CA GLU A 117 2.458 -1.438 12.799 1.00 0.00 C ATOM 1774 C GLU A 117 1.066 -1.967 13.149 1.00 0.00 C ATOM 1775 O GLU A 117 0.872 -3.177 13.262 1.00 0.00 O ATOM 1776 CB GLU A 117 3.350 -1.327 14.049 1.00 0.00 C ATOM 1777 CG GLU A 117 2.778 -0.493 15.202 1.00 0.00 C ATOM 1778 CD GLU A 117 3.714 -0.362 16.406 1.00 0.00 C ATOM 1779 OE1 GLU A 117 4.551 -1.256 16.673 1.00 0.00 O ATOM 1780 OE2 GLU A 117 3.550 0.593 17.199 1.00 0.00 O ATOM 0 H GLU A 117 2.797 0.611 12.573 1.00 0.00 H new ATOM 0 HA GLU A 117 2.922 -2.166 12.134 1.00 0.00 H new ATOM 0 HB2 GLU A 117 3.553 -2.332 14.418 1.00 0.00 H new ATOM 0 HB3 GLU A 117 4.307 -0.896 13.753 1.00 0.00 H new ATOM 0 HG2 GLU A 117 2.540 0.504 14.831 1.00 0.00 H new ATOM 0 HG3 GLU A 117 1.841 -0.943 15.531 1.00 0.00 H new ATOM 1787 N GLU A 118 0.080 -1.090 13.312 1.00 0.00 N ATOM 1788 CA GLU A 118 -1.266 -1.499 13.663 1.00 0.00 C ATOM 1789 C GLU A 118 -2.016 -2.031 12.440 1.00 0.00 C ATOM 1790 O GLU A 118 -2.649 -3.081 12.523 1.00 0.00 O ATOM 1791 CB GLU A 118 -1.972 -0.340 14.369 1.00 0.00 C ATOM 1792 CG GLU A 118 -3.398 -0.691 14.794 1.00 0.00 C ATOM 1793 CD GLU A 118 -3.554 -2.044 15.493 1.00 0.00 C ATOM 1794 OE1 GLU A 118 -2.697 -2.398 16.331 1.00 0.00 O ATOM 1795 OE2 GLU A 118 -4.575 -2.721 15.222 1.00 0.00 O ATOM 0 H GLU A 118 0.196 -0.082 13.204 1.00 0.00 H new ATOM 0 HA GLU A 118 -1.238 -2.334 14.363 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -1.396 -0.050 15.248 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -1.997 0.524 13.705 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -3.764 0.089 15.461 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -4.037 -0.680 13.911 1.00 0.00 H new ATOM 1802 N LYS A 119 -1.936 -1.379 11.276 1.00 0.00 N ATOM 1803 CA LYS A 119 -2.529 -1.938 10.062 1.00 0.00 C ATOM 1804 C LYS A 119 -1.796 -3.222 9.664 1.00 0.00 C ATOM 1805 O LYS A 119 -2.444 -4.118 9.117 1.00 0.00 O ATOM 1806 CB LYS A 119 -2.541 -0.949 8.887 1.00 0.00 C ATOM 1807 CG LYS A 119 -3.084 0.467 9.110 1.00 0.00 C ATOM 1808 CD LYS A 119 -4.352 0.568 9.957 1.00 0.00 C ATOM 1809 CE LYS A 119 -4.847 2.015 9.892 1.00 0.00 C ATOM 1810 NZ LYS A 119 -6.074 2.224 10.677 1.00 0.00 N ATOM 0 H LYS A 119 -1.474 -0.478 11.151 1.00 0.00 H new ATOM 0 HA LYS A 119 -3.571 -2.161 10.293 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -1.517 -0.855 8.526 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -3.122 -1.401 8.083 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -2.305 1.064 9.584 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -3.283 0.917 8.137 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -5.116 -0.114 9.583 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -4.146 0.281 10.988 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -4.066 2.680 10.260 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -5.033 2.286 8.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -6.369 3.218 10.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -6.829 1.610 10.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -5.892 1.992 11.674 1.00 0.00 H new ATOM 1824 N LEU A 120 -0.493 -3.332 9.968 1.00 0.00 N ATOM 1825 CA LEU A 120 0.261 -4.578 9.865 1.00 0.00 C ATOM 1826 C LEU A 120 -0.391 -5.632 10.756 1.00 0.00 C ATOM 1827 O LEU A 120 -0.725 -6.692 10.240 1.00 0.00 O ATOM 1828 CB LEU A 120 1.746 -4.403 10.225 1.00 0.00 C ATOM 1829 CG LEU A 120 2.649 -3.899 9.087 1.00 0.00 C ATOM 1830 CD1 LEU A 120 3.977 -3.423 9.670 1.00 0.00 C ATOM 1831 CD2 LEU A 120 2.948 -4.964 8.030 1.00 0.00 C ATOM 0 H LEU A 120 0.067 -2.545 10.296 1.00 0.00 H new ATOM 0 HA LEU A 120 0.235 -4.902 8.825 1.00 0.00 H new ATOM 0 HB2 LEU A 120 1.820 -3.706 11.059 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.132 -5.360 10.575 1.00 0.00 H new ATOM 0 HG LEU A 120 2.106 -3.091 8.597 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.620 -3.065 8.866 1.00 0.00 H new ATOM 0 HD12 LEU A 120 3.795 -2.613 10.377 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.466 -4.250 10.184 1.00 0.00 H new ATOM 0 HD21 LEU A 120 3.590 -4.540 7.258 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.453 -5.809 8.498 1.00 0.00 H new ATOM 0 HD23 LEU A 120 2.015 -5.303 7.581 1.00 0.00 H new ATOM 1843 N ASN A 121 -0.626 -5.359 12.047 1.00 0.00 N ATOM 1844 CA ASN A 121 -1.311 -6.303 12.942 1.00 0.00 C ATOM 1845 C ASN A 121 -2.626 -6.777 12.339 1.00 0.00 C ATOM 1846 O ASN A 121 -2.875 -7.977 12.263 1.00 0.00 O ATOM 1847 CB ASN A 121 -1.574 -5.727 14.340 1.00 0.00 C ATOM 1848 CG ASN A 121 -2.222 -6.799 15.213 1.00 0.00 C ATOM 1849 OD1 ASN A 121 -3.443 -6.879 15.314 1.00 0.00 O ATOM 1850 ND2 ASN A 121 -1.423 -7.662 15.812 1.00 0.00 N ATOM 0 H ASN A 121 -0.350 -4.486 12.497 1.00 0.00 H new ATOM 0 HA ASN A 121 -0.631 -7.147 13.054 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -0.639 -5.391 14.789 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -2.225 -4.856 14.270 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -1.817 -8.417 16.374 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -0.412 -7.574 15.713 1.00 0.00 H new ATOM 1857 N LYS A 122 -3.448 -5.842 11.853 1.00 0.00 N ATOM 1858 CA LYS A 122 -4.713 -6.177 11.215 1.00 0.00 C ATOM 1859 C LYS A 122 -4.491 -7.165 10.076 1.00 0.00 C ATOM 1860 O LYS A 122 -5.196 -8.161 10.021 1.00 0.00 O ATOM 1861 CB LYS A 122 -5.442 -4.922 10.724 1.00 0.00 C ATOM 1862 CG LYS A 122 -5.848 -3.986 11.868 1.00 0.00 C ATOM 1863 CD LYS A 122 -6.427 -2.663 11.348 1.00 0.00 C ATOM 1864 CE LYS A 122 -6.084 -1.487 12.264 1.00 0.00 C ATOM 1865 NZ LYS A 122 -6.598 -1.646 13.645 1.00 0.00 N ATOM 0 H LYS A 122 -3.253 -4.842 11.893 1.00 0.00 H new ATOM 0 HA LYS A 122 -5.351 -6.652 11.960 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -4.799 -4.382 10.029 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -6.332 -5.218 10.169 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -6.586 -4.482 12.498 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -4.980 -3.781 12.495 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -6.042 -2.467 10.347 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -7.510 -2.751 11.261 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -5.001 -1.367 12.299 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -6.492 -0.572 11.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -6.989 -0.741 13.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -7.344 -2.370 13.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -5.822 -1.938 14.273 1.00 0.00 H new ATOM 1879 N ILE A 123 -3.578 -6.930 9.133 1.00 0.00 N ATOM 1880 CA ILE A 123 -3.427 -7.868 8.012 1.00 0.00 C ATOM 1881 C ILE A 123 -2.714 -9.167 8.408 1.00 0.00 C ATOM 1882 O ILE A 123 -3.022 -10.220 7.843 1.00 0.00 O ATOM 1883 CB ILE A 123 -2.776 -7.207 6.787 1.00 0.00 C ATOM 1884 CG1 ILE A 123 -1.360 -6.693 7.079 1.00 0.00 C ATOM 1885 CG2 ILE A 123 -3.698 -6.093 6.277 1.00 0.00 C ATOM 1886 CD1 ILE A 123 -0.741 -5.954 5.903 1.00 0.00 C ATOM 0 H ILE A 123 -2.949 -6.127 9.117 1.00 0.00 H new ATOM 0 HA ILE A 123 -4.439 -8.153 7.724 1.00 0.00 H new ATOM 0 HB ILE A 123 -2.654 -7.959 6.007 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -1.392 -6.028 7.942 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.722 -7.535 7.348 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -3.246 -5.616 5.407 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -4.662 -6.518 5.998 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -3.842 -5.352 7.063 1.00 0.00 H new ATOM 0 HD11 ILE A 123 0.260 -5.615 6.172 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -0.679 -6.623 5.045 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -1.359 -5.093 5.648 1.00 0.00 H new ATOM 1898 N PHE A 124 -1.811 -9.126 9.387 1.00 0.00 N ATOM 1899 CA PHE A 124 -1.205 -10.317 9.952 1.00 0.00 C ATOM 1900 C PHE A 124 -2.301 -11.219 10.498 1.00 0.00 C ATOM 1901 O PHE A 124 -2.300 -12.412 10.210 1.00 0.00 O ATOM 1902 CB PHE A 124 -0.232 -9.953 11.079 1.00 0.00 C ATOM 1903 CG PHE A 124 1.095 -9.302 10.697 1.00 0.00 C ATOM 1904 CD1 PHE A 124 1.797 -9.684 9.536 1.00 0.00 C ATOM 1905 CD2 PHE A 124 1.679 -8.349 11.553 1.00 0.00 C ATOM 1906 CE1 PHE A 124 3.042 -9.112 9.227 1.00 0.00 C ATOM 1907 CE2 PHE A 124 2.931 -7.783 11.257 1.00 0.00 C ATOM 1908 CZ PHE A 124 3.612 -8.160 10.087 1.00 0.00 C ATOM 0 H PHE A 124 -1.482 -8.257 9.808 1.00 0.00 H new ATOM 0 HA PHE A 124 -0.647 -10.833 9.171 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -0.750 -9.280 11.763 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -0.009 -10.864 11.635 1.00 0.00 H new ATOM 0 HD1 PHE A 124 1.372 -10.426 8.876 1.00 0.00 H new ATOM 0 HD2 PHE A 124 1.158 -8.049 12.450 1.00 0.00 H new ATOM 0 HE1 PHE A 124 3.562 -9.405 8.327 1.00 0.00 H new ATOM 0 HE2 PHE A 124 3.369 -7.059 11.928 1.00 0.00 H new ATOM 0 HZ PHE A 124 4.569 -7.719 9.851 1.00 0.00 H new ATOM 1918 N GLU A 125 -3.230 -10.664 11.270 1.00 0.00 N ATOM 1919 CA GLU A 125 -4.198 -11.450 12.013 1.00 0.00 C ATOM 1920 C GLU A 125 -5.485 -11.707 11.227 1.00 0.00 C ATOM 1921 O GLU A 125 -6.202 -12.668 11.519 1.00 0.00 O ATOM 1922 CB GLU A 125 -4.522 -10.704 13.317 1.00 0.00 C ATOM 1923 CG GLU A 125 -3.341 -10.569 14.292 1.00 0.00 C ATOM 1924 CD GLU A 125 -2.934 -11.906 14.910 1.00 0.00 C ATOM 1925 OE1 GLU A 125 -2.131 -12.653 14.304 1.00 0.00 O ATOM 1926 OE2 GLU A 125 -3.390 -12.224 16.034 1.00 0.00 O ATOM 0 H GLU A 125 -3.330 -9.657 11.395 1.00 0.00 H new ATOM 0 HA GLU A 125 -3.760 -12.427 12.215 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -4.886 -9.707 13.068 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -5.336 -11.223 13.824 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -2.487 -10.141 13.766 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -3.608 -9.872 15.086 1.00 0.00 H new ATOM 1933 N LYS A 126 -5.811 -10.857 10.250 1.00 0.00 N ATOM 1934 CA LYS A 126 -7.001 -10.985 9.424 1.00 0.00 C ATOM 1935 C LYS A 126 -6.619 -11.820 8.209 1.00 0.00 C ATOM 1936 O LYS A 126 -7.096 -12.945 8.078 1.00 0.00 O ATOM 1937 CB LYS A 126 -7.618 -9.598 9.125 1.00 0.00 C ATOM 1938 CG LYS A 126 -9.101 -9.663 8.726 1.00 0.00 C ATOM 1939 CD LYS A 126 -9.314 -10.110 7.270 1.00 0.00 C ATOM 1940 CE LYS A 126 -9.657 -9.055 6.195 1.00 0.00 C ATOM 1941 NZ LYS A 126 -9.450 -7.646 6.597 1.00 0.00 N ATOM 0 H LYS A 126 -5.240 -10.046 10.011 1.00 0.00 H new ATOM 0 HA LYS A 126 -7.809 -11.510 9.934 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -7.514 -8.965 10.006 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -7.054 -9.123 8.322 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -9.620 -10.353 9.391 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -9.553 -8.681 8.868 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -8.406 -10.621 6.949 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -10.114 -10.850 7.269 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -9.054 -9.254 5.309 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -10.700 -9.183 5.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -9.543 -7.030 5.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -10.162 -7.379 7.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -8.499 -7.537 7.003 1.00 0.00 H new ATOM 1955 N LEU A 127 -5.782 -11.282 7.314 1.00 0.00 N ATOM 1956 CA LEU A 127 -5.421 -11.972 6.075 1.00 0.00 C ATOM 1957 C LEU A 127 -4.590 -13.222 6.374 1.00 0.00 C ATOM 1958 O LEU A 127 -4.577 -14.145 5.556 1.00 0.00 O ATOM 1959 CB LEU A 127 -4.612 -11.093 5.093 1.00 0.00 C ATOM 1960 CG LEU A 127 -4.989 -9.608 4.931 1.00 0.00 C ATOM 1961 CD1 LEU A 127 -4.213 -8.951 3.786 1.00 0.00 C ATOM 1962 CD2 LEU A 127 -6.482 -9.384 4.705 1.00 0.00 C ATOM 0 H LEU A 127 -5.342 -10.369 7.427 1.00 0.00 H new ATOM 0 HA LEU A 127 -6.369 -12.230 5.604 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.567 -11.135 5.399 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -4.675 -11.557 4.109 1.00 0.00 H new ATOM 0 HG LEU A 127 -4.717 -9.143 5.879 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -4.505 -7.904 3.702 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -3.144 -9.014 3.988 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -4.437 -9.466 2.852 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -6.678 -8.317 4.599 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -6.794 -9.902 3.798 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -7.041 -9.773 5.556 1.00 0.00 H new ATOM 1974 N GLY A 128 -3.866 -13.245 7.498 1.00 0.00 N ATOM 1975 CA GLY A 128 -2.823 -14.227 7.737 1.00 0.00 C ATOM 1976 C GLY A 128 -1.562 -13.807 6.991 1.00 0.00 C ATOM 1977 O GLY A 128 -0.936 -14.654 6.345 1.00 0.00 O ATOM 0 H GLY A 128 -3.992 -12.581 8.262 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -2.619 -14.307 8.805 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -3.149 -15.211 7.400 1.00 0.00 H new ATOM 1981 N MET A 129 -1.248 -12.503 6.973 1.00 0.00 N ATOM 1982 CA MET A 129 0.001 -12.043 6.356 1.00 0.00 C ATOM 1983 C MET A 129 1.181 -12.588 7.133 1.00 0.00 C ATOM 1984 O MET A 129 1.063 -12.790 8.356 1.00 0.00 O ATOM 1985 CB MET A 129 0.086 -10.517 6.243 1.00 0.00 C ATOM 1986 CG MET A 129 -0.685 -9.946 5.053 1.00 0.00 C ATOM 1987 SD MET A 129 -0.184 -10.546 3.413 1.00 0.00 S ATOM 1988 CE MET A 129 -1.438 -11.820 3.083 1.00 0.00 C ATOM 1989 OXT MET A 129 2.222 -12.859 6.497 1.00 0.00 O ATOM 0 H MET A 129 -1.828 -11.764 7.370 1.00 0.00 H new ATOM 0 HA MET A 129 0.021 -12.425 5.335 1.00 0.00 H new ATOM 0 HB2 MET A 129 -0.298 -10.071 7.161 1.00 0.00 H new ATOM 0 HB3 MET A 129 1.133 -10.225 6.160 1.00 0.00 H new ATOM 0 HG2 MET A 129 -1.743 -10.169 5.191 1.00 0.00 H new ATOM 0 HG3 MET A 129 -0.583 -8.861 5.067 1.00 0.00 H new ATOM 0 HE1 MET A 129 -0.974 -12.664 2.573 1.00 0.00 H new ATOM 0 HE2 MET A 129 -1.870 -12.158 4.025 1.00 0.00 H new ATOM 0 HE3 MET A 129 -2.223 -11.403 2.453 1.00 0.00 H new TER 1999 MET A 129