USER MOD reduce.3.24.130724 H: found=0, std=0, add=1062, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1060 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 69 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 114 THR OG1 : rot -83:sc= 0.605 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -168:sc= -0.0712 (180deg=-0.517) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot -27:sc= 0.745 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot -94:sc= 1.58 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0.0012) USER MOD Single : A 43 ASN : amide:sc= -0.679 K(o=-0.68,f=-2.5!) USER MOD Single : A 45 MET CE :methyl -110:sc= -0.301 (180deg=-1.39) USER MOD Single : A 47 LYS NZ :NH3+ -166:sc= -0.0535 (180deg=-0.27) USER MOD Single : A 48 TYR OH : rot -24:sc= 0.531 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot -65:sc= 0.101 USER MOD Single : A 58 ASN : amide:sc= -1.13 K(o=-1.1,f=0) USER MOD Single : A 59 LYS NZ :NH3+ -146:sc= -1.72! (180deg=-3.81!) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -1.79! K(o=-1.8!,f=-0.019) USER MOD Single : A 71 SER OG : rot -77:sc= 0.271 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -0.153 X(o=-0.15,f=-0.29) USER MOD Single : A 83 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 89 ASN : amide:sc= -1.37! K(o=-1.4!,f=-0.029) USER MOD Single : A 90 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 THR OG1 : rot -82:sc= 0.408 USER MOD Single : A 95 THR OG1 : rot 75:sc= 1.2 USER MOD Single : A 96 THR OG1 : rot 80:sc= 0.206 USER MOD Single : A 98 GLN : amide:sc= -1.01 K(o=-1,f=0) USER MOD Single : A 99 HIS : no HD1:sc= 0 X(o=0,f=-0.0018) USER MOD Single : A 100 HIS : no HD1:sc= -1.26 K(o=-1.3,f=-4.1!) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 MET CE :methyl 138:sc= -0.217 (180deg=-1.2) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 140:sc= -0.0451 (180deg=-0.311) USER MOD Single : A 124 MET CE :methyl 144:sc= -0.168 (180deg=-0.867) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 38.265 9.531 11.183 1.00 0.00 N ATOM 2 CA MET A 1 38.702 8.111 11.195 1.00 0.00 C ATOM 3 C MET A 1 39.911 7.907 10.289 1.00 0.00 C ATOM 4 O MET A 1 40.726 7.012 10.519 1.00 0.00 O ATOM 5 CB MET A 1 37.559 7.204 10.735 1.00 0.00 C ATOM 6 CG MET A 1 36.305 7.326 11.583 1.00 0.00 C ATOM 7 SD MET A 1 36.586 6.886 13.308 1.00 0.00 S ATOM 8 CE MET A 1 34.953 7.153 13.993 1.00 0.00 C ATOM 0 H1 MET A 1 37.581 9.690 11.950 1.00 0.00 H new ATOM 0 H2 MET A 1 39.090 10.149 11.321 1.00 0.00 H new ATOM 0 H3 MET A 1 37.818 9.749 10.270 1.00 0.00 H new ATOM 0 HA MET A 1 38.983 7.852 12.216 1.00 0.00 H new ATOM 0 HB2 MET A 1 37.312 7.442 9.700 1.00 0.00 H new ATOM 0 HB3 MET A 1 37.899 6.169 10.752 1.00 0.00 H new ATOM 0 HG2 MET A 1 35.933 8.349 11.529 1.00 0.00 H new ATOM 0 HG3 MET A 1 35.528 6.682 11.170 1.00 0.00 H new ATOM 0 HE1 MET A 1 34.963 6.923 15.058 1.00 0.00 H new ATOM 0 HE2 MET A 1 34.664 8.194 13.850 1.00 0.00 H new ATOM 0 HE3 MET A 1 34.236 6.505 13.489 1.00 0.00 H new ATOM 18 N ASP A 2 40.020 8.743 9.260 1.00 0.00 N ATOM 19 CA ASP A 2 41.126 8.658 8.312 1.00 0.00 C ATOM 20 C ASP A 2 41.170 7.285 7.648 1.00 0.00 C ATOM 21 O ASP A 2 41.879 6.387 8.102 1.00 0.00 O ATOM 22 CB ASP A 2 42.457 8.946 9.012 1.00 0.00 C ATOM 23 CG ASP A 2 42.501 10.335 9.617 1.00 0.00 C ATOM 24 OD1 ASP A 2 42.061 10.493 10.776 1.00 0.00 O ATOM 25 OD2 ASP A 2 42.976 11.266 8.933 1.00 0.00 O ATOM 0 H ASP A 2 39.353 9.489 9.061 1.00 0.00 H new ATOM 0 HA ASP A 2 40.965 9.410 7.539 1.00 0.00 H new ATOM 0 HB2 ASP A 2 42.620 8.206 9.795 1.00 0.00 H new ATOM 0 HB3 ASP A 2 43.272 8.838 8.296 1.00 0.00 H new ATOM 30 N ALA A 3 40.397 7.132 6.574 1.00 0.00 N ATOM 31 CA ALA A 3 40.335 5.872 5.837 1.00 0.00 C ATOM 32 C ALA A 3 39.887 4.723 6.735 1.00 0.00 C ATOM 33 O ALA A 3 40.686 4.156 7.482 1.00 0.00 O ATOM 34 CB ALA A 3 41.684 5.560 5.204 1.00 0.00 C ATOM 0 H ALA A 3 39.803 7.869 6.194 1.00 0.00 H new ATOM 0 HA ALA A 3 39.594 5.984 5.046 1.00 0.00 H new ATOM 0 HB1 ALA A 3 41.621 4.618 4.659 1.00 0.00 H new ATOM 0 HB2 ALA A 3 41.957 6.360 4.516 1.00 0.00 H new ATOM 0 HB3 ALA A 3 42.441 5.478 5.984 1.00 0.00 H new ATOM 40 N LEU A 4 38.603 4.384 6.657 1.00 0.00 N ATOM 41 CA LEU A 4 38.046 3.302 7.462 1.00 0.00 C ATOM 42 C LEU A 4 37.324 2.285 6.583 1.00 0.00 C ATOM 43 O LEU A 4 36.381 2.627 5.867 1.00 0.00 O ATOM 44 CB LEU A 4 37.082 3.864 8.511 1.00 0.00 C ATOM 45 CG LEU A 4 36.460 2.824 9.447 1.00 0.00 C ATOM 46 CD1 LEU A 4 37.530 2.160 10.300 1.00 0.00 C ATOM 47 CD2 LEU A 4 35.398 3.466 10.328 1.00 0.00 C ATOM 0 H LEU A 4 37.929 4.843 6.044 1.00 0.00 H new ATOM 0 HA LEU A 4 38.869 2.797 7.968 1.00 0.00 H new ATOM 0 HB2 LEU A 4 37.615 4.600 9.114 1.00 0.00 H new ATOM 0 HB3 LEU A 4 36.280 4.393 7.997 1.00 0.00 H new ATOM 0 HG LEU A 4 35.984 2.056 8.837 1.00 0.00 H new ATOM 0 HD11 LEU A 4 37.067 1.425 10.958 1.00 0.00 H new ATOM 0 HD12 LEU A 4 38.254 1.664 9.654 1.00 0.00 H new ATOM 0 HD13 LEU A 4 38.037 2.915 10.900 1.00 0.00 H new ATOM 0 HD21 LEU A 4 34.967 2.712 10.986 1.00 0.00 H new ATOM 0 HD22 LEU A 4 35.851 4.255 10.928 1.00 0.00 H new ATOM 0 HD23 LEU A 4 34.614 3.891 9.701 1.00 0.00 H new ATOM 59 N GLU A 5 37.771 1.034 6.644 1.00 0.00 N ATOM 60 CA GLU A 5 37.169 -0.034 5.855 1.00 0.00 C ATOM 61 C GLU A 5 36.909 -1.264 6.719 1.00 0.00 C ATOM 62 O GLU A 5 37.824 -1.797 7.348 1.00 0.00 O ATOM 63 CB GLU A 5 38.076 -0.402 4.678 1.00 0.00 C ATOM 64 CG GLU A 5 37.518 -1.508 3.798 1.00 0.00 C ATOM 65 CD GLU A 5 38.394 -1.793 2.594 1.00 0.00 C ATOM 66 OE1 GLU A 5 39.403 -2.513 2.750 1.00 0.00 O ATOM 67 OE2 GLU A 5 38.073 -1.294 1.495 1.00 0.00 O ATOM 0 H GLU A 5 38.549 0.736 7.232 1.00 0.00 H new ATOM 0 HA GLU A 5 36.215 0.325 5.468 1.00 0.00 H new ATOM 0 HB2 GLU A 5 38.243 0.486 4.068 1.00 0.00 H new ATOM 0 HB3 GLU A 5 39.048 -0.712 5.063 1.00 0.00 H new ATOM 0 HG2 GLU A 5 37.411 -2.418 4.388 1.00 0.00 H new ATOM 0 HG3 GLU A 5 36.520 -1.229 3.459 1.00 0.00 H new ATOM 74 N GLY A 6 35.656 -1.711 6.744 1.00 0.00 N ATOM 75 CA GLY A 6 35.296 -2.873 7.536 1.00 0.00 C ATOM 76 C GLY A 6 35.608 -4.179 6.833 1.00 0.00 C ATOM 77 O GLY A 6 36.115 -4.184 5.710 1.00 0.00 O ATOM 0 H GLY A 6 34.884 -1.288 6.229 1.00 0.00 H new ATOM 0 HA2 GLY A 6 35.830 -2.840 8.486 1.00 0.00 H new ATOM 0 HA3 GLY A 6 34.231 -2.835 7.767 1.00 0.00 H new ATOM 81 N GLU A 7 35.302 -5.291 7.496 1.00 0.00 N ATOM 82 CA GLU A 7 35.555 -6.611 6.931 1.00 0.00 C ATOM 83 C GLU A 7 34.310 -7.147 6.227 1.00 0.00 C ATOM 84 O GLU A 7 34.369 -7.555 5.068 1.00 0.00 O ATOM 85 CB GLU A 7 35.996 -7.581 8.032 1.00 0.00 C ATOM 86 CG GLU A 7 36.773 -8.785 7.519 1.00 0.00 C ATOM 87 CD GLU A 7 35.929 -9.708 6.662 1.00 0.00 C ATOM 88 OE1 GLU A 7 35.169 -10.518 7.233 1.00 0.00 O ATOM 89 OE2 GLU A 7 36.031 -9.624 5.420 1.00 0.00 O ATOM 0 H GLU A 7 34.879 -5.303 8.424 1.00 0.00 H new ATOM 0 HA GLU A 7 36.354 -6.521 6.195 1.00 0.00 H new ATOM 0 HB2 GLU A 7 36.613 -7.042 8.751 1.00 0.00 H new ATOM 0 HB3 GLU A 7 35.114 -7.932 8.568 1.00 0.00 H new ATOM 0 HG2 GLU A 7 37.628 -8.439 6.939 1.00 0.00 H new ATOM 0 HG3 GLU A 7 37.168 -9.345 8.367 1.00 0.00 H new ATOM 96 N SER A 8 33.183 -7.138 6.935 1.00 0.00 N ATOM 97 CA SER A 8 31.924 -7.623 6.379 1.00 0.00 C ATOM 98 C SER A 8 31.203 -6.515 5.617 1.00 0.00 C ATOM 99 O SER A 8 31.716 -5.403 5.489 1.00 0.00 O ATOM 100 CB SER A 8 31.024 -8.162 7.491 1.00 0.00 C ATOM 101 OG SER A 8 30.709 -7.149 8.430 1.00 0.00 O ATOM 0 H SER A 8 33.117 -6.800 7.895 1.00 0.00 H new ATOM 0 HA SER A 8 32.151 -8.430 5.683 1.00 0.00 H new ATOM 0 HB2 SER A 8 30.106 -8.560 7.059 1.00 0.00 H new ATOM 0 HB3 SER A 8 31.522 -8.989 7.997 1.00 0.00 H new ATOM 0 HG SER A 8 30.131 -7.520 9.129 1.00 0.00 H new ATOM 107 N PHE A 9 30.010 -6.832 5.114 1.00 0.00 N ATOM 108 CA PHE A 9 29.207 -5.870 4.363 1.00 0.00 C ATOM 109 C PHE A 9 29.950 -5.389 3.119 1.00 0.00 C ATOM 110 O PHE A 9 30.814 -4.516 3.196 1.00 0.00 O ATOM 111 CB PHE A 9 28.836 -4.676 5.249 1.00 0.00 C ATOM 112 CG PHE A 9 27.950 -3.670 4.569 1.00 0.00 C ATOM 113 CD1 PHE A 9 26.578 -3.859 4.520 1.00 0.00 C ATOM 114 CD2 PHE A 9 28.489 -2.539 3.977 1.00 0.00 C ATOM 115 CE1 PHE A 9 25.760 -2.937 3.894 1.00 0.00 C ATOM 116 CE2 PHE A 9 27.677 -1.614 3.351 1.00 0.00 C ATOM 117 CZ PHE A 9 26.310 -1.813 3.310 1.00 0.00 C ATOM 0 H PHE A 9 29.578 -7.751 5.214 1.00 0.00 H new ATOM 0 HA PHE A 9 28.293 -6.371 4.044 1.00 0.00 H new ATOM 0 HB2 PHE A 9 28.334 -5.042 6.145 1.00 0.00 H new ATOM 0 HB3 PHE A 9 29.750 -4.180 5.576 1.00 0.00 H new ATOM 0 HD1 PHE A 9 26.143 -4.736 4.976 1.00 0.00 H new ATOM 0 HD2 PHE A 9 29.557 -2.379 4.006 1.00 0.00 H new ATOM 0 HE1 PHE A 9 24.692 -3.096 3.862 1.00 0.00 H new ATOM 0 HE2 PHE A 9 28.110 -0.736 2.894 1.00 0.00 H new ATOM 0 HZ PHE A 9 25.673 -1.090 2.822 1.00 0.00 H new ATOM 127 N ALA A 10 29.607 -5.967 1.971 1.00 0.00 N ATOM 128 CA ALA A 10 30.240 -5.600 0.710 1.00 0.00 C ATOM 129 C ALA A 10 29.418 -4.556 -0.036 1.00 0.00 C ATOM 130 O ALA A 10 28.299 -4.230 0.362 1.00 0.00 O ATOM 131 CB ALA A 10 30.443 -6.832 -0.158 1.00 0.00 C ATOM 0 H ALA A 10 28.894 -6.692 1.889 1.00 0.00 H new ATOM 0 HA ALA A 10 31.213 -5.164 0.936 1.00 0.00 H new ATOM 0 HB1 ALA A 10 30.916 -6.542 -1.096 1.00 0.00 H new ATOM 0 HB2 ALA A 10 31.080 -7.545 0.365 1.00 0.00 H new ATOM 0 HB3 ALA A 10 29.478 -7.293 -0.366 1.00 0.00 H new ATOM 137 N LEU A 11 29.981 -4.035 -1.122 1.00 0.00 N ATOM 138 CA LEU A 11 29.302 -3.026 -1.926 1.00 0.00 C ATOM 139 C LEU A 11 28.501 -3.674 -3.051 1.00 0.00 C ATOM 140 O LEU A 11 29.058 -4.370 -3.901 1.00 0.00 O ATOM 141 CB LEU A 11 30.316 -2.042 -2.512 1.00 0.00 C ATOM 142 CG LEU A 11 31.168 -1.296 -1.484 1.00 0.00 C ATOM 143 CD1 LEU A 11 32.216 -0.443 -2.179 1.00 0.00 C ATOM 144 CD2 LEU A 11 30.293 -0.436 -0.584 1.00 0.00 C ATOM 0 H LEU A 11 30.906 -4.295 -1.465 1.00 0.00 H new ATOM 0 HA LEU A 11 28.613 -2.486 -1.277 1.00 0.00 H new ATOM 0 HB2 LEU A 11 30.980 -2.586 -3.184 1.00 0.00 H new ATOM 0 HB3 LEU A 11 29.780 -1.310 -3.116 1.00 0.00 H new ATOM 0 HG LEU A 11 31.678 -2.033 -0.864 1.00 0.00 H new ATOM 0 HD11 LEU A 11 32.813 0.080 -1.432 1.00 0.00 H new ATOM 0 HD12 LEU A 11 32.864 -1.081 -2.780 1.00 0.00 H new ATOM 0 HD13 LEU A 11 31.724 0.284 -2.825 1.00 0.00 H new ATOM 0 HD21 LEU A 11 30.918 0.086 0.140 1.00 0.00 H new ATOM 0 HD22 LEU A 11 29.753 0.292 -1.189 1.00 0.00 H new ATOM 0 HD23 LEU A 11 29.580 -1.070 -0.057 1.00 0.00 H new ATOM 156 N SER A 12 27.195 -3.437 -3.049 1.00 0.00 N ATOM 157 CA SER A 12 26.313 -3.994 -4.069 1.00 0.00 C ATOM 158 C SER A 12 24.984 -3.246 -4.098 1.00 0.00 C ATOM 159 O SER A 12 24.088 -3.585 -4.871 1.00 0.00 O ATOM 160 CB SER A 12 26.072 -5.482 -3.806 1.00 0.00 C ATOM 161 OG SER A 12 25.228 -6.046 -4.797 1.00 0.00 O ATOM 0 H SER A 12 26.722 -2.862 -2.352 1.00 0.00 H new ATOM 0 HA SER A 12 26.796 -3.880 -5.039 1.00 0.00 H new ATOM 0 HB2 SER A 12 27.025 -6.011 -3.792 1.00 0.00 H new ATOM 0 HB3 SER A 12 25.620 -5.612 -2.822 1.00 0.00 H new ATOM 0 HG SER A 12 24.646 -5.349 -5.166 1.00 0.00 H new ATOM 167 N PHE A 13 24.871 -2.226 -3.250 1.00 0.00 N ATOM 168 CA PHE A 13 23.655 -1.419 -3.166 1.00 0.00 C ATOM 169 C PHE A 13 22.444 -2.283 -2.830 1.00 0.00 C ATOM 170 O PHE A 13 21.857 -2.919 -3.707 1.00 0.00 O ATOM 171 CB PHE A 13 23.420 -0.671 -4.479 1.00 0.00 C ATOM 172 CG PHE A 13 24.513 0.304 -4.814 1.00 0.00 C ATOM 173 CD1 PHE A 13 25.631 -0.105 -5.522 1.00 0.00 C ATOM 174 CD2 PHE A 13 24.422 1.628 -4.416 1.00 0.00 C ATOM 175 CE1 PHE A 13 26.639 0.788 -5.828 1.00 0.00 C ATOM 176 CE2 PHE A 13 25.428 2.527 -4.719 1.00 0.00 C ATOM 177 CZ PHE A 13 26.537 2.107 -5.426 1.00 0.00 C ATOM 0 H PHE A 13 25.610 -1.938 -2.609 1.00 0.00 H new ATOM 0 HA PHE A 13 23.789 -0.693 -2.364 1.00 0.00 H new ATOM 0 HB2 PHE A 13 23.328 -1.394 -5.289 1.00 0.00 H new ATOM 0 HB3 PHE A 13 22.472 -0.136 -4.419 1.00 0.00 H new ATOM 0 HD1 PHE A 13 25.715 -1.134 -5.838 1.00 0.00 H new ATOM 0 HD2 PHE A 13 23.556 1.961 -3.863 1.00 0.00 H new ATOM 0 HE1 PHE A 13 27.506 0.457 -6.381 1.00 0.00 H new ATOM 0 HE2 PHE A 13 25.346 3.556 -4.403 1.00 0.00 H new ATOM 0 HZ PHE A 13 27.324 2.808 -5.665 1.00 0.00 H new ATOM 187 N SER A 14 22.074 -2.300 -1.553 1.00 0.00 N ATOM 188 CA SER A 14 20.933 -3.084 -1.098 1.00 0.00 C ATOM 189 C SER A 14 19.878 -2.187 -0.458 1.00 0.00 C ATOM 190 O SER A 14 20.177 -1.411 0.450 1.00 0.00 O ATOM 191 CB SER A 14 21.386 -4.149 -0.100 1.00 0.00 C ATOM 192 OG SER A 14 20.292 -4.933 0.341 1.00 0.00 O ATOM 0 H SER A 14 22.549 -1.779 -0.815 1.00 0.00 H new ATOM 0 HA SER A 14 20.490 -3.574 -1.966 1.00 0.00 H new ATOM 0 HB2 SER A 14 22.134 -4.792 -0.564 1.00 0.00 H new ATOM 0 HB3 SER A 14 21.863 -3.671 0.756 1.00 0.00 H new ATOM 0 HG SER A 14 20.609 -5.608 0.977 1.00 0.00 H new ATOM 198 N SER A 15 18.644 -2.299 -0.938 1.00 0.00 N ATOM 199 CA SER A 15 17.544 -1.497 -0.414 1.00 0.00 C ATOM 200 C SER A 15 16.885 -2.183 0.777 1.00 0.00 C ATOM 201 O SER A 15 16.544 -1.537 1.771 1.00 0.00 O ATOM 202 CB SER A 15 16.507 -1.242 -1.509 1.00 0.00 C ATOM 203 OG SER A 15 17.081 -0.552 -2.606 1.00 0.00 O ATOM 0 H SER A 15 18.380 -2.937 -1.689 1.00 0.00 H new ATOM 0 HA SER A 15 17.952 -0.544 -0.078 1.00 0.00 H new ATOM 0 HB2 SER A 15 16.092 -2.191 -1.849 1.00 0.00 H new ATOM 0 HB3 SER A 15 15.680 -0.660 -1.102 1.00 0.00 H new ATOM 0 HG SER A 15 16.398 -0.403 -3.293 1.00 0.00 H new ATOM 209 N ALA A 16 16.712 -3.497 0.670 1.00 0.00 N ATOM 210 CA ALA A 16 16.090 -4.282 1.731 1.00 0.00 C ATOM 211 C ALA A 16 17.005 -4.409 2.945 1.00 0.00 C ATOM 212 O ALA A 16 16.615 -4.975 3.967 1.00 0.00 O ATOM 213 CB ALA A 16 15.713 -5.660 1.208 1.00 0.00 C ATOM 0 H ALA A 16 16.995 -4.042 -0.144 1.00 0.00 H new ATOM 0 HA ALA A 16 15.188 -3.759 2.050 1.00 0.00 H new ATOM 0 HB1 ALA A 16 15.250 -6.238 2.007 1.00 0.00 H new ATOM 0 HB2 ALA A 16 15.010 -5.556 0.381 1.00 0.00 H new ATOM 0 HB3 ALA A 16 16.609 -6.175 0.860 1.00 0.00 H new ATOM 219 N SER A 17 18.225 -3.886 2.828 1.00 0.00 N ATOM 220 CA SER A 17 19.194 -3.945 3.919 1.00 0.00 C ATOM 221 C SER A 17 18.600 -3.400 5.217 1.00 0.00 C ATOM 222 O SER A 17 18.173 -4.169 6.080 1.00 0.00 O ATOM 223 CB SER A 17 20.460 -3.167 3.549 1.00 0.00 C ATOM 224 OG SER A 17 20.150 -1.849 3.133 1.00 0.00 O ATOM 0 H SER A 17 18.565 -3.417 1.988 1.00 0.00 H new ATOM 0 HA SER A 17 19.455 -4.991 4.080 1.00 0.00 H new ATOM 0 HB2 SER A 17 21.132 -3.132 4.407 1.00 0.00 H new ATOM 0 HB3 SER A 17 20.989 -3.688 2.751 1.00 0.00 H new ATOM 0 HG SER A 17 20.063 -1.826 2.157 1.00 0.00 H new ATOM 230 N ASP A 18 18.569 -2.075 5.349 1.00 0.00 N ATOM 231 CA ASP A 18 18.027 -1.437 6.544 1.00 0.00 C ATOM 232 C ASP A 18 17.971 0.076 6.380 1.00 0.00 C ATOM 233 O ASP A 18 16.936 0.703 6.605 1.00 0.00 O ATOM 234 CB ASP A 18 18.868 -1.795 7.772 1.00 0.00 C ATOM 235 CG ASP A 18 18.353 -1.140 9.039 1.00 0.00 C ATOM 236 OD1 ASP A 18 18.797 -0.013 9.347 1.00 0.00 O ATOM 237 OD2 ASP A 18 17.508 -1.753 9.725 1.00 0.00 O ATOM 0 H ASP A 18 18.913 -1.424 4.643 1.00 0.00 H new ATOM 0 HA ASP A 18 17.012 -1.807 6.687 1.00 0.00 H new ATOM 0 HB2 ASP A 18 18.873 -2.877 7.902 1.00 0.00 H new ATOM 0 HB3 ASP A 18 19.901 -1.490 7.603 1.00 0.00 H new ATOM 242 N ALA A 19 19.095 0.651 5.984 1.00 0.00 N ATOM 243 CA ALA A 19 19.196 2.094 5.786 1.00 0.00 C ATOM 244 C ALA A 19 18.246 2.572 4.692 1.00 0.00 C ATOM 245 O ALA A 19 17.404 3.440 4.923 1.00 0.00 O ATOM 246 CB ALA A 19 20.629 2.478 5.446 1.00 0.00 C ATOM 0 H ALA A 19 19.957 0.140 5.792 1.00 0.00 H new ATOM 0 HA ALA A 19 18.907 2.583 6.717 1.00 0.00 H new ATOM 0 HB1 ALA A 19 20.692 3.556 5.301 1.00 0.00 H new ATOM 0 HB2 ALA A 19 21.288 2.183 6.262 1.00 0.00 H new ATOM 0 HB3 ALA A 19 20.935 1.970 4.531 1.00 0.00 H new ATOM 252 N GLU A 20 18.390 2.000 3.500 1.00 0.00 N ATOM 253 CA GLU A 20 17.548 2.370 2.369 1.00 0.00 C ATOM 254 C GLU A 20 16.083 2.053 2.655 1.00 0.00 C ATOM 255 O GLU A 20 15.206 2.884 2.424 1.00 0.00 O ATOM 256 CB GLU A 20 18.004 1.637 1.109 1.00 0.00 C ATOM 257 CG GLU A 20 17.262 2.061 -0.148 1.00 0.00 C ATOM 258 CD GLU A 20 17.484 3.521 -0.493 1.00 0.00 C ATOM 259 OE1 GLU A 20 16.713 4.371 0.001 1.00 0.00 O ATOM 260 OE2 GLU A 20 18.429 3.814 -1.254 1.00 0.00 O ATOM 0 H GLU A 20 19.081 1.279 3.293 1.00 0.00 H new ATOM 0 HA GLU A 20 17.644 3.444 2.211 1.00 0.00 H new ATOM 0 HB2 GLU A 20 19.071 1.809 0.966 1.00 0.00 H new ATOM 0 HB3 GLU A 20 17.870 0.565 1.255 1.00 0.00 H new ATOM 0 HG2 GLU A 20 17.587 1.441 -0.984 1.00 0.00 H new ATOM 0 HG3 GLU A 20 16.195 1.882 -0.014 1.00 0.00 H new ATOM 267 N PHE A 21 15.829 0.844 3.152 1.00 0.00 N ATOM 268 CA PHE A 21 14.470 0.418 3.473 1.00 0.00 C ATOM 269 C PHE A 21 13.766 1.464 4.330 1.00 0.00 C ATOM 270 O PHE A 21 12.612 1.812 4.081 1.00 0.00 O ATOM 271 CB PHE A 21 14.491 -0.928 4.203 1.00 0.00 C ATOM 272 CG PHE A 21 13.158 -1.624 4.227 1.00 0.00 C ATOM 273 CD1 PHE A 21 12.153 -1.199 5.082 1.00 0.00 C ATOM 274 CD2 PHE A 21 12.909 -2.703 3.393 1.00 0.00 C ATOM 275 CE1 PHE A 21 10.926 -1.835 5.104 1.00 0.00 C ATOM 276 CE2 PHE A 21 11.686 -3.344 3.411 1.00 0.00 C ATOM 277 CZ PHE A 21 10.693 -2.910 4.267 1.00 0.00 C ATOM 0 H PHE A 21 16.546 0.144 3.341 1.00 0.00 H new ATOM 0 HA PHE A 21 13.919 0.305 2.539 1.00 0.00 H new ATOM 0 HB2 PHE A 21 15.222 -1.579 3.724 1.00 0.00 H new ATOM 0 HB3 PHE A 21 14.827 -0.770 5.228 1.00 0.00 H new ATOM 0 HD1 PHE A 21 12.331 -0.361 5.739 1.00 0.00 H new ATOM 0 HD2 PHE A 21 13.681 -3.047 2.721 1.00 0.00 H new ATOM 0 HE1 PHE A 21 10.151 -1.493 5.774 1.00 0.00 H new ATOM 0 HE2 PHE A 21 11.506 -4.184 2.756 1.00 0.00 H new ATOM 0 HZ PHE A 21 9.736 -3.410 4.282 1.00 0.00 H new ATOM 287 N ASP A 22 14.471 1.966 5.342 1.00 0.00 N ATOM 288 CA ASP A 22 13.917 2.975 6.236 1.00 0.00 C ATOM 289 C ASP A 22 13.553 4.239 5.465 1.00 0.00 C ATOM 290 O ASP A 22 12.502 4.840 5.696 1.00 0.00 O ATOM 291 CB ASP A 22 14.915 3.310 7.344 1.00 0.00 C ATOM 292 CG ASP A 22 14.391 4.373 8.290 1.00 0.00 C ATOM 293 OD1 ASP A 22 13.740 4.008 9.291 1.00 0.00 O ATOM 294 OD2 ASP A 22 14.631 5.571 8.028 1.00 0.00 O ATOM 0 H ASP A 22 15.428 1.689 5.562 1.00 0.00 H new ATOM 0 HA ASP A 22 13.011 2.569 6.686 1.00 0.00 H new ATOM 0 HB2 ASP A 22 15.145 2.406 7.908 1.00 0.00 H new ATOM 0 HB3 ASP A 22 15.848 3.653 6.897 1.00 0.00 H new ATOM 299 N ALA A 23 14.430 4.638 4.549 1.00 0.00 N ATOM 300 CA ALA A 23 14.202 5.828 3.739 1.00 0.00 C ATOM 301 C ALA A 23 12.891 5.717 2.969 1.00 0.00 C ATOM 302 O ALA A 23 12.137 6.687 2.861 1.00 0.00 O ATOM 303 CB ALA A 23 15.364 6.045 2.781 1.00 0.00 C ATOM 0 H ALA A 23 15.305 4.154 4.350 1.00 0.00 H new ATOM 0 HA ALA A 23 14.133 6.688 4.406 1.00 0.00 H new ATOM 0 HB1 ALA A 23 15.180 6.937 2.182 1.00 0.00 H new ATOM 0 HB2 ALA A 23 16.285 6.173 3.349 1.00 0.00 H new ATOM 0 HB3 ALA A 23 15.460 5.181 2.124 1.00 0.00 H new ATOM 309 N VAL A 24 12.622 4.527 2.439 1.00 0.00 N ATOM 310 CA VAL A 24 11.399 4.288 1.685 1.00 0.00 C ATOM 311 C VAL A 24 10.172 4.518 2.557 1.00 0.00 C ATOM 312 O VAL A 24 9.277 5.279 2.191 1.00 0.00 O ATOM 313 CB VAL A 24 11.351 2.857 1.116 1.00 0.00 C ATOM 314 CG1 VAL A 24 10.095 2.653 0.280 1.00 0.00 C ATOM 315 CG2 VAL A 24 12.598 2.572 0.292 1.00 0.00 C ATOM 0 H VAL A 24 13.235 3.715 2.519 1.00 0.00 H new ATOM 0 HA VAL A 24 11.396 4.994 0.855 1.00 0.00 H new ATOM 0 HB VAL A 24 11.321 2.155 1.949 1.00 0.00 H new ATOM 0 HG11 VAL A 24 10.080 1.636 -0.113 1.00 0.00 H new ATOM 0 HG12 VAL A 24 9.214 2.815 0.901 1.00 0.00 H new ATOM 0 HG13 VAL A 24 10.090 3.362 -0.548 1.00 0.00 H new ATOM 0 HG21 VAL A 24 12.549 1.557 -0.103 1.00 0.00 H new ATOM 0 HG22 VAL A 24 12.658 3.281 -0.534 1.00 0.00 H new ATOM 0 HG23 VAL A 24 13.482 2.674 0.922 1.00 0.00 H new ATOM 325 N VAL A 25 10.139 3.862 3.716 1.00 0.00 N ATOM 326 CA VAL A 25 9.020 4.002 4.641 1.00 0.00 C ATOM 327 C VAL A 25 8.717 5.472 4.887 1.00 0.00 C ATOM 328 O VAL A 25 7.561 5.860 5.052 1.00 0.00 O ATOM 329 CB VAL A 25 9.308 3.314 5.989 1.00 0.00 C ATOM 330 CG1 VAL A 25 8.081 3.362 6.889 1.00 0.00 C ATOM 331 CG2 VAL A 25 9.762 1.880 5.770 1.00 0.00 C ATOM 0 H VAL A 25 10.874 3.230 4.035 1.00 0.00 H new ATOM 0 HA VAL A 25 8.158 3.518 4.181 1.00 0.00 H new ATOM 0 HB VAL A 25 10.114 3.854 6.486 1.00 0.00 H new ATOM 0 HG11 VAL A 25 8.305 2.871 7.836 1.00 0.00 H new ATOM 0 HG12 VAL A 25 7.806 4.400 7.075 1.00 0.00 H new ATOM 0 HG13 VAL A 25 7.252 2.849 6.402 1.00 0.00 H new ATOM 0 HG21 VAL A 25 9.961 1.410 6.733 1.00 0.00 H new ATOM 0 HG22 VAL A 25 8.980 1.326 5.251 1.00 0.00 H new ATOM 0 HG23 VAL A 25 10.671 1.874 5.169 1.00 0.00 H new ATOM 341 N GLY A 26 9.766 6.288 4.909 1.00 0.00 N ATOM 342 CA GLY A 26 9.592 7.710 5.122 1.00 0.00 C ATOM 343 C GLY A 26 8.818 8.363 3.993 1.00 0.00 C ATOM 344 O GLY A 26 7.896 9.143 4.234 1.00 0.00 O ATOM 0 H GLY A 26 10.733 5.988 4.783 1.00 0.00 H new ATOM 0 HA2 GLY A 26 9.068 7.874 6.063 1.00 0.00 H new ATOM 0 HA3 GLY A 26 10.569 8.185 5.214 1.00 0.00 H new ATOM 348 N TYR A 27 9.193 8.038 2.757 1.00 0.00 N ATOM 349 CA TYR A 27 8.529 8.597 1.582 1.00 0.00 C ATOM 350 C TYR A 27 7.037 8.271 1.581 1.00 0.00 C ATOM 351 O TYR A 27 6.204 9.155 1.384 1.00 0.00 O ATOM 352 CB TYR A 27 9.175 8.070 0.299 1.00 0.00 C ATOM 353 CG TYR A 27 10.579 8.585 0.066 1.00 0.00 C ATOM 354 CD1 TYR A 27 10.825 9.946 -0.075 1.00 0.00 C ATOM 355 CD2 TYR A 27 11.657 7.712 -0.010 1.00 0.00 C ATOM 356 CE1 TYR A 27 12.106 10.421 -0.286 1.00 0.00 C ATOM 357 CE2 TYR A 27 12.940 8.180 -0.220 1.00 0.00 C ATOM 358 CZ TYR A 27 13.159 9.535 -0.357 1.00 0.00 C ATOM 359 OH TYR A 27 14.436 10.004 -0.566 1.00 0.00 O ATOM 0 H TYR A 27 9.952 7.391 2.544 1.00 0.00 H new ATOM 0 HA TYR A 27 8.644 9.680 1.622 1.00 0.00 H new ATOM 0 HB2 TYR A 27 9.199 6.981 0.336 1.00 0.00 H new ATOM 0 HB3 TYR A 27 8.551 8.346 -0.551 1.00 0.00 H new ATOM 0 HD1 TYR A 27 10.002 10.643 -0.019 1.00 0.00 H new ATOM 0 HD2 TYR A 27 11.490 6.650 0.097 1.00 0.00 H new ATOM 0 HE1 TYR A 27 12.281 11.481 -0.395 1.00 0.00 H new ATOM 0 HE2 TYR A 27 13.767 7.488 -0.277 1.00 0.00 H new ATOM 0 HH TYR A 27 15.062 9.250 -0.589 1.00 0.00 H new ATOM 369 N LEU A 28 6.707 7.000 1.798 1.00 0.00 N ATOM 370 CA LEU A 28 5.314 6.566 1.819 1.00 0.00 C ATOM 371 C LEU A 28 4.505 7.372 2.831 1.00 0.00 C ATOM 372 O LEU A 28 3.415 7.853 2.520 1.00 0.00 O ATOM 373 CB LEU A 28 5.214 5.073 2.148 1.00 0.00 C ATOM 374 CG LEU A 28 5.549 4.124 0.994 1.00 0.00 C ATOM 375 CD1 LEU A 28 7.044 4.098 0.735 1.00 0.00 C ATOM 376 CD2 LEU A 28 5.031 2.724 1.289 1.00 0.00 C ATOM 0 H LEU A 28 7.384 6.255 1.961 1.00 0.00 H new ATOM 0 HA LEU A 28 4.901 6.737 0.825 1.00 0.00 H new ATOM 0 HB2 LEU A 28 5.883 4.856 2.981 1.00 0.00 H new ATOM 0 HB3 LEU A 28 4.201 4.860 2.489 1.00 0.00 H new ATOM 0 HG LEU A 28 5.056 4.492 0.094 1.00 0.00 H new ATOM 0 HD11 LEU A 28 7.259 3.417 -0.089 1.00 0.00 H new ATOM 0 HD12 LEU A 28 7.386 5.100 0.476 1.00 0.00 H new ATOM 0 HD13 LEU A 28 7.563 3.758 1.631 1.00 0.00 H new ATOM 0 HD21 LEU A 28 5.278 2.062 0.459 1.00 0.00 H new ATOM 0 HD22 LEU A 28 5.495 2.349 2.202 1.00 0.00 H new ATOM 0 HD23 LEU A 28 3.949 2.756 1.418 1.00 0.00 H new ATOM 388 N GLU A 29 5.046 7.518 4.037 1.00 0.00 N ATOM 389 CA GLU A 29 4.373 8.264 5.097 1.00 0.00 C ATOM 390 C GLU A 29 3.964 9.655 4.618 1.00 0.00 C ATOM 391 O GLU A 29 2.830 10.086 4.836 1.00 0.00 O ATOM 392 CB GLU A 29 5.275 8.379 6.329 1.00 0.00 C ATOM 393 CG GLU A 29 5.483 7.059 7.056 1.00 0.00 C ATOM 394 CD GLU A 29 6.365 7.200 8.282 1.00 0.00 C ATOM 395 OE1 GLU A 29 7.601 7.091 8.140 1.00 0.00 O ATOM 396 OE2 GLU A 29 5.819 7.419 9.384 1.00 0.00 O ATOM 0 H GLU A 29 5.950 7.129 4.305 1.00 0.00 H new ATOM 0 HA GLU A 29 3.471 7.716 5.368 1.00 0.00 H new ATOM 0 HB2 GLU A 29 6.244 8.773 6.024 1.00 0.00 H new ATOM 0 HB3 GLU A 29 4.841 9.101 7.021 1.00 0.00 H new ATOM 0 HG2 GLU A 29 4.515 6.656 7.354 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.931 6.338 6.372 1.00 0.00 H new ATOM 403 N ASP A 30 4.890 10.354 3.966 1.00 0.00 N ATOM 404 CA ASP A 30 4.615 11.694 3.457 1.00 0.00 C ATOM 405 C ASP A 30 3.427 11.678 2.502 1.00 0.00 C ATOM 406 O ASP A 30 2.664 12.642 2.426 1.00 0.00 O ATOM 407 CB ASP A 30 5.846 12.264 2.749 1.00 0.00 C ATOM 408 CG ASP A 30 6.973 12.586 3.711 1.00 0.00 C ATOM 409 OD1 ASP A 30 6.928 13.667 4.335 1.00 0.00 O ATOM 410 OD2 ASP A 30 7.900 11.761 3.836 1.00 0.00 O ATOM 0 H ASP A 30 5.834 10.016 3.778 1.00 0.00 H new ATOM 0 HA ASP A 30 4.370 12.332 4.306 1.00 0.00 H new ATOM 0 HB2 ASP A 30 6.199 11.547 2.008 1.00 0.00 H new ATOM 0 HB3 ASP A 30 5.564 13.168 2.209 1.00 0.00 H new ATOM 415 N ILE A 31 3.276 10.577 1.773 1.00 0.00 N ATOM 416 CA ILE A 31 2.180 10.433 0.823 1.00 0.00 C ATOM 417 C ILE A 31 0.865 10.144 1.541 1.00 0.00 C ATOM 418 O ILE A 31 -0.198 10.584 1.106 1.00 0.00 O ATOM 419 CB ILE A 31 2.459 9.304 -0.191 1.00 0.00 C ATOM 420 CG1 ILE A 31 3.781 9.561 -0.919 1.00 0.00 C ATOM 421 CG2 ILE A 31 1.310 9.189 -1.184 1.00 0.00 C ATOM 422 CD1 ILE A 31 4.205 8.429 -1.831 1.00 0.00 C ATOM 0 H ILE A 31 3.900 9.771 1.822 1.00 0.00 H new ATOM 0 HA ILE A 31 2.098 11.379 0.288 1.00 0.00 H new ATOM 0 HB ILE A 31 2.541 8.360 0.348 1.00 0.00 H new ATOM 0 HG12 ILE A 31 3.690 10.474 -1.507 1.00 0.00 H new ATOM 0 HG13 ILE A 31 4.564 9.734 -0.181 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.521 8.389 -1.893 1.00 0.00 H new ATOM 0 HG22 ILE A 31 0.387 8.966 -0.648 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.199 10.130 -1.722 1.00 0.00 H new ATOM 0 HD11 ILE A 31 5.150 8.683 -2.312 1.00 0.00 H new ATOM 0 HD12 ILE A 31 4.329 7.518 -1.246 1.00 0.00 H new ATOM 0 HD13 ILE A 31 3.442 8.270 -2.593 1.00 0.00 H new ATOM 434 N ILE A 32 0.944 9.407 2.644 1.00 0.00 N ATOM 435 CA ILE A 32 -0.243 9.060 3.416 1.00 0.00 C ATOM 436 C ILE A 32 -0.910 10.306 3.991 1.00 0.00 C ATOM 437 O ILE A 32 -2.136 10.375 4.088 1.00 0.00 O ATOM 438 CB ILE A 32 0.092 8.090 4.568 1.00 0.00 C ATOM 439 CG1 ILE A 32 0.796 6.843 4.025 1.00 0.00 C ATOM 440 CG2 ILE A 32 -1.177 7.706 5.318 1.00 0.00 C ATOM 441 CD1 ILE A 32 1.281 5.897 5.104 1.00 0.00 C ATOM 0 H ILE A 32 1.817 9.039 3.023 1.00 0.00 H new ATOM 0 HA ILE A 32 -0.931 8.567 2.729 1.00 0.00 H new ATOM 0 HB ILE A 32 0.766 8.590 5.263 1.00 0.00 H new ATOM 0 HG12 ILE A 32 0.111 6.308 3.367 1.00 0.00 H new ATOM 0 HG13 ILE A 32 1.646 7.153 3.417 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -0.928 7.021 6.129 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -1.641 8.602 5.730 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -1.871 7.220 4.633 1.00 0.00 H new ATOM 0 HD11 ILE A 32 1.769 5.038 4.643 1.00 0.00 H new ATOM 0 HD12 ILE A 32 1.991 6.414 5.749 1.00 0.00 H new ATOM 0 HD13 ILE A 32 0.433 5.557 5.698 1.00 0.00 H new ATOM 453 N MET A 33 -0.100 11.289 4.370 1.00 0.00 N ATOM 454 CA MET A 33 -0.619 12.527 4.939 1.00 0.00 C ATOM 455 C MET A 33 -0.879 13.567 3.854 1.00 0.00 C ATOM 456 O MET A 33 -1.214 14.715 4.150 1.00 0.00 O ATOM 457 CB MET A 33 0.358 13.085 5.976 1.00 0.00 C ATOM 458 CG MET A 33 0.696 12.099 7.080 1.00 0.00 C ATOM 459 SD MET A 33 -0.763 11.540 7.979 1.00 0.00 S ATOM 460 CE MET A 33 -0.030 10.382 9.132 1.00 0.00 C ATOM 0 H MET A 33 0.916 11.252 4.294 1.00 0.00 H new ATOM 0 HA MET A 33 -1.567 12.300 5.427 1.00 0.00 H new ATOM 0 HB2 MET A 33 1.277 13.385 5.473 1.00 0.00 H new ATOM 0 HB3 MET A 33 -0.070 13.984 6.420 1.00 0.00 H new ATOM 0 HG2 MET A 33 1.205 11.237 6.649 1.00 0.00 H new ATOM 0 HG3 MET A 33 1.392 12.565 7.778 1.00 0.00 H new ATOM 0 HE1 MET A 33 -0.810 9.951 9.760 1.00 0.00 H new ATOM 0 HE2 MET A 33 0.472 9.587 8.580 1.00 0.00 H new ATOM 0 HE3 MET A 33 0.695 10.902 9.759 1.00 0.00 H new ATOM 470 N ASP A 34 -0.725 13.160 2.599 1.00 0.00 N ATOM 471 CA ASP A 34 -0.947 14.060 1.475 1.00 0.00 C ATOM 472 C ASP A 34 -2.441 14.265 1.236 1.00 0.00 C ATOM 473 O ASP A 34 -3.201 13.302 1.140 1.00 0.00 O ATOM 474 CB ASP A 34 -0.283 13.509 0.212 1.00 0.00 C ATOM 475 CG ASP A 34 -0.373 14.471 -0.954 1.00 0.00 C ATOM 476 OD1 ASP A 34 -1.373 14.408 -1.700 1.00 0.00 O ATOM 477 OD2 ASP A 34 0.555 15.291 -1.121 1.00 0.00 O ATOM 0 H ASP A 34 -0.448 12.214 2.335 1.00 0.00 H new ATOM 0 HA ASP A 34 -0.499 15.024 1.716 1.00 0.00 H new ATOM 0 HB2 ASP A 34 0.765 13.292 0.421 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -0.755 12.566 -0.062 1.00 0.00 H new ATOM 482 N ASP A 35 -2.850 15.526 1.144 1.00 0.00 N ATOM 483 CA ASP A 35 -4.252 15.865 0.925 1.00 0.00 C ATOM 484 C ASP A 35 -4.781 15.234 -0.359 1.00 0.00 C ATOM 485 O ASP A 35 -5.851 14.624 -0.365 1.00 0.00 O ATOM 486 CB ASP A 35 -4.424 17.384 0.870 1.00 0.00 C ATOM 487 CG ASP A 35 -3.921 18.067 2.128 1.00 0.00 C ATOM 488 OD1 ASP A 35 -4.719 18.236 3.073 1.00 0.00 O ATOM 489 OD2 ASP A 35 -2.726 18.430 2.167 1.00 0.00 O ATOM 0 H ASP A 35 -2.229 16.332 1.218 1.00 0.00 H new ATOM 0 HA ASP A 35 -4.828 15.467 1.760 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -3.887 17.777 0.007 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -5.478 17.623 0.726 1.00 0.00 H new ATOM 494 N GLU A 36 -4.030 15.386 -1.447 1.00 0.00 N ATOM 495 CA GLU A 36 -4.432 14.829 -2.734 1.00 0.00 C ATOM 496 C GLU A 36 -4.569 13.312 -2.648 1.00 0.00 C ATOM 497 O GLU A 36 -5.335 12.705 -3.398 1.00 0.00 O ATOM 498 CB GLU A 36 -3.421 15.207 -3.819 1.00 0.00 C ATOM 499 CG GLU A 36 -3.837 14.776 -5.217 1.00 0.00 C ATOM 500 CD GLU A 36 -5.149 15.400 -5.652 1.00 0.00 C ATOM 501 OE1 GLU A 36 -5.132 16.565 -6.103 1.00 0.00 O ATOM 502 OE2 GLU A 36 -6.194 14.723 -5.541 1.00 0.00 O ATOM 0 H GLU A 36 -3.143 15.889 -1.462 1.00 0.00 H new ATOM 0 HA GLU A 36 -5.403 15.248 -2.997 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -3.277 16.287 -3.809 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.458 14.755 -3.580 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -3.056 15.050 -5.926 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -3.927 13.690 -5.247 1.00 0.00 H new ATOM 509 N PHE A 37 -3.825 12.706 -1.727 1.00 0.00 N ATOM 510 CA PHE A 37 -3.866 11.259 -1.538 1.00 0.00 C ATOM 511 C PHE A 37 -5.154 10.841 -0.836 1.00 0.00 C ATOM 512 O PHE A 37 -5.838 9.916 -1.273 1.00 0.00 O ATOM 513 CB PHE A 37 -2.651 10.795 -0.729 1.00 0.00 C ATOM 514 CG PHE A 37 -2.723 9.355 -0.306 1.00 0.00 C ATOM 515 CD1 PHE A 37 -2.518 8.335 -1.221 1.00 0.00 C ATOM 516 CD2 PHE A 37 -3.001 9.022 1.011 1.00 0.00 C ATOM 517 CE1 PHE A 37 -2.588 7.011 -0.833 1.00 0.00 C ATOM 518 CE2 PHE A 37 -3.073 7.700 1.405 1.00 0.00 C ATOM 519 CZ PHE A 37 -2.866 6.692 0.483 1.00 0.00 C ATOM 0 H PHE A 37 -3.186 13.195 -1.100 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.840 10.786 -2.520 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -1.750 10.945 -1.324 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -2.555 11.421 0.158 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -2.301 8.578 -2.251 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -3.163 9.805 1.737 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -2.426 6.226 -1.557 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -3.291 7.454 2.434 1.00 0.00 H new ATOM 0 HZ PHE A 37 -2.921 5.658 0.790 1.00 0.00 H new ATOM 529 N GLN A 38 -5.476 11.525 0.257 1.00 0.00 N ATOM 530 CA GLN A 38 -6.680 11.224 1.023 1.00 0.00 C ATOM 531 C GLN A 38 -7.935 11.535 0.212 1.00 0.00 C ATOM 532 O GLN A 38 -8.984 10.924 0.414 1.00 0.00 O ATOM 533 CB GLN A 38 -6.687 12.020 2.330 1.00 0.00 C ATOM 534 CG GLN A 38 -5.488 11.731 3.221 1.00 0.00 C ATOM 535 CD GLN A 38 -5.553 12.464 4.546 1.00 0.00 C ATOM 536 OE1 GLN A 38 -6.112 11.962 5.519 1.00 0.00 O ATOM 537 NE2 GLN A 38 -4.971 13.658 4.592 1.00 0.00 N ATOM 0 H GLN A 38 -4.919 12.293 0.633 1.00 0.00 H new ATOM 0 HA GLN A 38 -6.679 10.159 1.255 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -6.709 13.085 2.098 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -7.601 11.794 2.879 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -5.429 10.659 3.406 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -4.575 12.015 2.698 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -4.518 14.037 3.760 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -4.977 14.195 5.459 1.00 0.00 H new ATOM 546 N LEU A 39 -7.817 12.493 -0.702 1.00 0.00 N ATOM 547 CA LEU A 39 -8.936 12.893 -1.549 1.00 0.00 C ATOM 548 C LEU A 39 -9.276 11.791 -2.551 1.00 0.00 C ATOM 549 O LEU A 39 -10.434 11.396 -2.687 1.00 0.00 O ATOM 550 CB LEU A 39 -8.591 14.193 -2.289 1.00 0.00 C ATOM 551 CG LEU A 39 -9.784 15.049 -2.739 1.00 0.00 C ATOM 552 CD1 LEU A 39 -10.606 14.331 -3.798 1.00 0.00 C ATOM 553 CD2 LEU A 39 -10.656 15.424 -1.549 1.00 0.00 C ATOM 0 H LEU A 39 -6.954 13.009 -0.876 1.00 0.00 H new ATOM 0 HA LEU A 39 -9.808 13.061 -0.917 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.958 14.799 -1.641 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -7.998 13.941 -3.168 1.00 0.00 H new ATOM 0 HG LEU A 39 -9.391 15.964 -3.181 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -11.444 14.961 -4.097 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -9.980 14.123 -4.666 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -10.984 13.393 -3.391 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -11.495 16.030 -1.890 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -11.032 14.518 -1.074 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -10.066 15.993 -0.830 1.00 0.00 H new ATOM 565 N LEU A 40 -8.255 11.301 -3.247 1.00 0.00 N ATOM 566 CA LEU A 40 -8.435 10.250 -4.244 1.00 0.00 C ATOM 567 C LEU A 40 -8.876 8.942 -3.595 1.00 0.00 C ATOM 568 O LEU A 40 -9.825 8.303 -4.050 1.00 0.00 O ATOM 569 CB LEU A 40 -7.134 10.044 -5.030 1.00 0.00 C ATOM 570 CG LEU A 40 -7.096 8.806 -5.932 1.00 0.00 C ATOM 571 CD1 LEU A 40 -6.357 9.113 -7.226 1.00 0.00 C ATOM 572 CD2 LEU A 40 -6.436 7.642 -5.209 1.00 0.00 C ATOM 0 H LEU A 40 -7.291 11.616 -3.139 1.00 0.00 H new ATOM 0 HA LEU A 40 -9.221 10.563 -4.931 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -6.959 10.926 -5.646 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -6.308 9.981 -4.321 1.00 0.00 H new ATOM 0 HG LEU A 40 -8.121 8.526 -6.177 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -6.339 8.223 -7.855 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -6.866 9.920 -7.753 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -5.335 9.417 -6.998 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -6.417 6.771 -5.864 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -5.416 7.914 -4.937 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -7.001 7.406 -4.307 1.00 0.00 H new ATOM 584 N GLN A 41 -8.181 8.549 -2.532 1.00 0.00 N ATOM 585 CA GLN A 41 -8.496 7.311 -1.825 1.00 0.00 C ATOM 586 C GLN A 41 -9.943 7.303 -1.338 1.00 0.00 C ATOM 587 O GLN A 41 -10.643 6.300 -1.469 1.00 0.00 O ATOM 588 CB GLN A 41 -7.544 7.121 -0.642 1.00 0.00 C ATOM 589 CG GLN A 41 -7.785 5.835 0.133 1.00 0.00 C ATOM 590 CD GLN A 41 -6.847 5.684 1.316 1.00 0.00 C ATOM 591 OE1 GLN A 41 -5.763 5.115 1.193 1.00 0.00 O ATOM 592 NE2 GLN A 41 -7.262 6.193 2.470 1.00 0.00 N ATOM 0 H GLN A 41 -7.396 9.070 -2.141 1.00 0.00 H new ATOM 0 HA GLN A 41 -8.370 6.484 -2.524 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -6.517 7.128 -1.008 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -7.646 7.968 0.036 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -8.816 5.816 0.486 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -7.661 4.983 -0.536 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -8.169 6.657 2.526 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -6.674 6.120 3.300 1.00 0.00 H new ATOM 601 N ARG A 42 -10.387 8.425 -0.782 1.00 0.00 N ATOM 602 CA ARG A 42 -11.750 8.536 -0.272 1.00 0.00 C ATOM 603 C ARG A 42 -12.763 8.605 -1.413 1.00 0.00 C ATOM 604 O ARG A 42 -13.891 8.131 -1.283 1.00 0.00 O ATOM 605 CB ARG A 42 -11.891 9.771 0.623 1.00 0.00 C ATOM 606 CG ARG A 42 -13.264 9.903 1.262 1.00 0.00 C ATOM 607 CD ARG A 42 -13.354 11.135 2.149 1.00 0.00 C ATOM 608 NE ARG A 42 -12.411 11.078 3.262 1.00 0.00 N ATOM 609 CZ ARG A 42 -12.488 11.857 4.338 1.00 0.00 C ATOM 610 NH1 ARG A 42 -13.463 12.748 4.449 1.00 0.00 N ATOM 611 NH2 ARG A 42 -11.588 11.741 5.304 1.00 0.00 N ATOM 0 H ARG A 42 -9.825 9.269 -0.673 1.00 0.00 H new ATOM 0 HA ARG A 42 -11.956 7.643 0.318 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -11.136 9.729 1.408 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -11.687 10.664 0.032 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -14.024 9.959 0.483 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -13.478 9.012 1.853 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -13.158 12.026 1.553 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -14.368 11.229 2.538 1.00 0.00 H new ATOM 0 HE ARG A 42 -11.649 10.402 3.212 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -14.158 12.838 3.708 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -13.518 13.343 5.276 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -10.837 11.055 5.222 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -11.646 12.338 6.129 1.00 0.00 H new ATOM 625 N ASN A 43 -12.351 9.196 -2.531 1.00 0.00 N ATOM 626 CA ASN A 43 -13.225 9.336 -3.692 1.00 0.00 C ATOM 627 C ASN A 43 -13.658 7.977 -4.237 1.00 0.00 C ATOM 628 O ASN A 43 -14.843 7.745 -4.476 1.00 0.00 O ATOM 629 CB ASN A 43 -12.520 10.138 -4.788 1.00 0.00 C ATOM 630 CG ASN A 43 -13.453 10.528 -5.919 1.00 0.00 C ATOM 631 OD1 ASN A 43 -14.415 9.823 -6.219 1.00 0.00 O ATOM 632 ND2 ASN A 43 -13.171 11.660 -6.554 1.00 0.00 N ATOM 0 H ASN A 43 -11.417 9.586 -2.658 1.00 0.00 H new ATOM 0 HA ASN A 43 -14.120 9.869 -3.371 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -12.087 11.039 -4.352 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -11.695 9.550 -5.189 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -13.763 11.974 -7.323 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -12.363 12.215 -6.273 1.00 0.00 H new ATOM 639 N PHE A 44 -12.695 7.080 -4.430 1.00 0.00 N ATOM 640 CA PHE A 44 -12.983 5.749 -4.957 1.00 0.00 C ATOM 641 C PHE A 44 -13.583 4.839 -3.891 1.00 0.00 C ATOM 642 O PHE A 44 -14.522 4.091 -4.163 1.00 0.00 O ATOM 643 CB PHE A 44 -11.712 5.116 -5.529 1.00 0.00 C ATOM 644 CG PHE A 44 -11.332 5.652 -6.880 1.00 0.00 C ATOM 645 CD1 PHE A 44 -11.820 5.061 -8.035 1.00 0.00 C ATOM 646 CD2 PHE A 44 -10.490 6.746 -6.996 1.00 0.00 C ATOM 647 CE1 PHE A 44 -11.474 5.549 -9.280 1.00 0.00 C ATOM 648 CE2 PHE A 44 -10.142 7.240 -8.240 1.00 0.00 C ATOM 649 CZ PHE A 44 -10.634 6.641 -9.383 1.00 0.00 C ATOM 0 H PHE A 44 -11.709 7.250 -4.230 1.00 0.00 H new ATOM 0 HA PHE A 44 -13.718 5.864 -5.753 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -10.888 5.284 -4.835 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -11.853 4.038 -5.601 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -12.479 4.208 -7.961 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -10.101 7.218 -6.106 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -11.860 5.077 -10.172 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -9.486 8.094 -8.318 1.00 0.00 H new ATOM 0 HZ PHE A 44 -10.363 7.025 -10.355 1.00 0.00 H new ATOM 659 N MET A 45 -13.042 4.904 -2.678 1.00 0.00 N ATOM 660 CA MET A 45 -13.530 4.071 -1.583 1.00 0.00 C ATOM 661 C MET A 45 -15.002 4.354 -1.300 1.00 0.00 C ATOM 662 O MET A 45 -15.719 3.499 -0.782 1.00 0.00 O ATOM 663 CB MET A 45 -12.685 4.301 -0.325 1.00 0.00 C ATOM 664 CG MET A 45 -13.161 5.454 0.547 1.00 0.00 C ATOM 665 SD MET A 45 -14.375 4.944 1.780 1.00 0.00 S ATOM 666 CE MET A 45 -13.402 3.802 2.760 1.00 0.00 C ATOM 0 H MET A 45 -12.269 5.522 -2.429 1.00 0.00 H new ATOM 0 HA MET A 45 -13.438 3.026 -1.878 1.00 0.00 H new ATOM 0 HB2 MET A 45 -12.684 3.388 0.270 1.00 0.00 H new ATOM 0 HB3 MET A 45 -11.654 4.488 -0.624 1.00 0.00 H new ATOM 0 HG2 MET A 45 -12.304 5.900 1.051 1.00 0.00 H new ATOM 0 HG3 MET A 45 -13.596 6.227 -0.087 1.00 0.00 H new ATOM 0 HE1 MET A 45 -13.758 2.785 2.594 1.00 0.00 H new ATOM 0 HE2 MET A 45 -12.354 3.872 2.467 1.00 0.00 H new ATOM 0 HE3 MET A 45 -13.501 4.053 3.816 1.00 0.00 H new ATOM 676 N ASP A 46 -15.441 5.561 -1.640 1.00 0.00 N ATOM 677 CA ASP A 46 -16.830 5.961 -1.432 1.00 0.00 C ATOM 678 C ASP A 46 -17.778 5.057 -2.213 1.00 0.00 C ATOM 679 O ASP A 46 -18.914 4.823 -1.799 1.00 0.00 O ATOM 680 CB ASP A 46 -17.036 7.416 -1.857 1.00 0.00 C ATOM 681 CG ASP A 46 -18.477 7.865 -1.698 1.00 0.00 C ATOM 682 OD1 ASP A 46 -18.852 8.271 -0.577 1.00 0.00 O ATOM 683 OD2 ASP A 46 -19.229 7.809 -2.692 1.00 0.00 O ATOM 0 H ASP A 46 -14.855 6.281 -2.062 1.00 0.00 H new ATOM 0 HA ASP A 46 -17.052 5.865 -0.369 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -16.389 8.061 -1.262 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -16.734 7.534 -2.898 1.00 0.00 H new ATOM 688 N LYS A 47 -17.306 4.560 -3.350 1.00 0.00 N ATOM 689 CA LYS A 47 -18.107 3.685 -4.196 1.00 0.00 C ATOM 690 C LYS A 47 -17.806 2.220 -3.889 1.00 0.00 C ATOM 691 O LYS A 47 -18.711 1.387 -3.830 1.00 0.00 O ATOM 692 CB LYS A 47 -17.821 3.987 -5.669 1.00 0.00 C ATOM 693 CG LYS A 47 -18.950 3.593 -6.616 1.00 0.00 C ATOM 694 CD LYS A 47 -18.992 2.092 -6.871 1.00 0.00 C ATOM 695 CE LYS A 47 -17.736 1.604 -7.578 1.00 0.00 C ATOM 696 NZ LYS A 47 -17.537 2.281 -8.888 1.00 0.00 N ATOM 0 H LYS A 47 -16.370 4.749 -3.708 1.00 0.00 H new ATOM 0 HA LYS A 47 -19.162 3.868 -3.992 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -17.625 5.054 -5.779 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -16.912 3.463 -5.966 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -19.903 3.915 -6.196 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -18.826 4.117 -7.564 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -19.104 1.565 -5.923 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -19.866 1.850 -7.475 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -16.869 1.782 -6.942 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -17.802 0.527 -7.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -16.822 1.766 -9.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -18.435 2.294 -9.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -17.215 3.257 -8.729 1.00 0.00 H new ATOM 710 N TYR A 48 -16.529 1.920 -3.689 1.00 0.00 N ATOM 711 CA TYR A 48 -16.095 0.558 -3.393 1.00 0.00 C ATOM 712 C TYR A 48 -16.794 -0.006 -2.155 1.00 0.00 C ATOM 713 O TYR A 48 -17.350 -1.101 -2.199 1.00 0.00 O ATOM 714 CB TYR A 48 -14.578 0.516 -3.192 1.00 0.00 C ATOM 715 CG TYR A 48 -13.788 0.430 -4.482 1.00 0.00 C ATOM 716 CD1 TYR A 48 -13.957 1.370 -5.493 1.00 0.00 C ATOM 717 CD2 TYR A 48 -12.867 -0.592 -4.686 1.00 0.00 C ATOM 718 CE1 TYR A 48 -13.232 1.292 -6.668 1.00 0.00 C ATOM 719 CE2 TYR A 48 -12.139 -0.675 -5.857 1.00 0.00 C ATOM 720 CZ TYR A 48 -12.325 0.268 -6.845 1.00 0.00 C ATOM 721 OH TYR A 48 -11.602 0.188 -8.013 1.00 0.00 O ATOM 0 H TYR A 48 -15.772 2.603 -3.726 1.00 0.00 H new ATOM 0 HA TYR A 48 -16.369 -0.063 -4.246 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -14.269 1.408 -2.647 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -14.328 -0.341 -2.567 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -14.666 2.174 -5.358 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -12.718 -1.334 -3.915 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -13.375 2.030 -7.444 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -11.427 -1.475 -5.998 1.00 0.00 H new ATOM 0 HH TYR A 48 -12.086 0.650 -8.729 1.00 0.00 H new ATOM 731 N TYR A 49 -16.768 0.747 -1.056 1.00 0.00 N ATOM 732 CA TYR A 49 -17.387 0.295 0.190 1.00 0.00 C ATOM 733 C TYR A 49 -18.878 0.021 0.005 1.00 0.00 C ATOM 734 O TYR A 49 -19.484 -0.705 0.794 1.00 0.00 O ATOM 735 CB TYR A 49 -17.151 1.317 1.313 1.00 0.00 C ATOM 736 CG TYR A 49 -18.314 2.248 1.585 1.00 0.00 C ATOM 737 CD1 TYR A 49 -18.474 3.424 0.863 1.00 0.00 C ATOM 738 CD2 TYR A 49 -19.248 1.955 2.573 1.00 0.00 C ATOM 739 CE1 TYR A 49 -19.530 4.279 1.115 1.00 0.00 C ATOM 740 CE2 TYR A 49 -20.306 2.804 2.830 1.00 0.00 C ATOM 741 CZ TYR A 49 -20.443 3.964 2.099 1.00 0.00 C ATOM 742 OH TYR A 49 -21.497 4.814 2.352 1.00 0.00 O ATOM 0 H TYR A 49 -16.329 1.666 -1.002 1.00 0.00 H new ATOM 0 HA TYR A 49 -16.915 -0.645 0.476 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -16.914 0.778 2.230 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -16.276 1.916 1.060 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -17.761 3.674 0.092 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -19.144 1.048 3.149 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -19.640 5.189 0.544 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -21.023 2.560 3.600 1.00 0.00 H new ATOM 0 HH TYR A 49 -22.048 4.446 3.074 1.00 0.00 H new ATOM 752 N LEU A 50 -19.463 0.599 -1.038 1.00 0.00 N ATOM 753 CA LEU A 50 -20.881 0.402 -1.319 1.00 0.00 C ATOM 754 C LEU A 50 -21.114 -0.935 -2.012 1.00 0.00 C ATOM 755 O LEU A 50 -22.084 -1.635 -1.725 1.00 0.00 O ATOM 756 CB LEU A 50 -21.420 1.540 -2.188 1.00 0.00 C ATOM 757 CG LEU A 50 -21.575 2.884 -1.476 1.00 0.00 C ATOM 758 CD1 LEU A 50 -21.975 3.967 -2.466 1.00 0.00 C ATOM 759 CD2 LEU A 50 -22.600 2.780 -0.356 1.00 0.00 C ATOM 0 H LEU A 50 -18.980 1.205 -1.701 1.00 0.00 H new ATOM 0 HA LEU A 50 -21.415 0.400 -0.369 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -20.753 1.673 -3.040 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -22.390 1.244 -2.586 1.00 0.00 H new ATOM 0 HG LEU A 50 -20.614 3.155 -1.038 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -22.081 4.917 -1.943 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -21.207 4.060 -3.234 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -22.924 3.702 -2.932 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -22.697 3.746 0.139 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -23.564 2.487 -0.771 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -22.274 2.032 0.367 1.00 0.00 H new ATOM 771 N GLU A 51 -20.214 -1.282 -2.926 1.00 0.00 N ATOM 772 CA GLU A 51 -20.314 -2.531 -3.662 1.00 0.00 C ATOM 773 C GLU A 51 -19.987 -3.718 -2.756 1.00 0.00 C ATOM 774 O GLU A 51 -20.655 -4.752 -2.805 1.00 0.00 O ATOM 775 CB GLU A 51 -19.373 -2.485 -4.874 1.00 0.00 C ATOM 776 CG GLU A 51 -18.642 -3.786 -5.155 1.00 0.00 C ATOM 777 CD GLU A 51 -19.565 -4.886 -5.643 1.00 0.00 C ATOM 778 OE1 GLU A 51 -20.144 -4.731 -6.738 1.00 0.00 O ATOM 779 OE2 GLU A 51 -19.709 -5.900 -4.930 1.00 0.00 O ATOM 0 H GLU A 51 -19.405 -0.712 -3.173 1.00 0.00 H new ATOM 0 HA GLU A 51 -21.337 -2.660 -4.016 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -19.951 -2.210 -5.756 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -18.637 -1.696 -4.717 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -17.869 -3.609 -5.903 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -18.138 -4.117 -4.247 1.00 0.00 H new ATOM 786 N PHE A 52 -18.966 -3.556 -1.921 1.00 0.00 N ATOM 787 CA PHE A 52 -18.553 -4.616 -1.007 1.00 0.00 C ATOM 788 C PHE A 52 -19.565 -4.791 0.120 1.00 0.00 C ATOM 789 O PHE A 52 -19.473 -4.135 1.157 1.00 0.00 O ATOM 790 CB PHE A 52 -17.170 -4.315 -0.427 1.00 0.00 C ATOM 791 CG PHE A 52 -16.038 -4.674 -1.347 1.00 0.00 C ATOM 792 CD1 PHE A 52 -15.648 -3.812 -2.359 1.00 0.00 C ATOM 793 CD2 PHE A 52 -15.363 -5.874 -1.198 1.00 0.00 C ATOM 794 CE1 PHE A 52 -14.605 -4.140 -3.204 1.00 0.00 C ATOM 795 CE2 PHE A 52 -14.320 -6.209 -2.040 1.00 0.00 C ATOM 796 CZ PHE A 52 -13.941 -5.340 -3.045 1.00 0.00 C ATOM 0 H PHE A 52 -18.410 -2.703 -1.858 1.00 0.00 H new ATOM 0 HA PHE A 52 -18.504 -5.546 -1.573 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -17.109 -3.253 -0.188 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -17.052 -4.860 0.510 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -16.165 -2.873 -2.489 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -15.656 -6.557 -0.414 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -14.310 -3.458 -3.988 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -13.802 -7.148 -1.913 1.00 0.00 H new ATOM 0 HZ PHE A 52 -13.127 -5.599 -3.705 1.00 0.00 H new ATOM 806 N GLU A 53 -20.534 -5.675 -0.096 1.00 0.00 N ATOM 807 CA GLU A 53 -21.563 -5.940 0.903 1.00 0.00 C ATOM 808 C GLU A 53 -21.262 -7.229 1.663 1.00 0.00 C ATOM 809 O GLU A 53 -20.650 -8.151 1.124 1.00 0.00 O ATOM 810 CB GLU A 53 -22.937 -6.037 0.238 1.00 0.00 C ATOM 811 CG GLU A 53 -23.313 -4.803 -0.564 1.00 0.00 C ATOM 812 CD GLU A 53 -24.668 -4.932 -1.230 1.00 0.00 C ATOM 813 OE1 GLU A 53 -24.722 -5.429 -2.375 1.00 0.00 O ATOM 814 OE2 GLU A 53 -25.676 -4.537 -0.607 1.00 0.00 O ATOM 0 H GLU A 53 -20.628 -6.220 -0.953 1.00 0.00 H new ATOM 0 HA GLU A 53 -21.568 -5.112 1.612 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -22.953 -6.906 -0.420 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -23.692 -6.205 1.006 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -23.317 -3.934 0.094 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -22.554 -4.623 -1.325 1.00 0.00 H new ATOM 821 N ASP A 54 -21.698 -7.284 2.918 1.00 0.00 N ATOM 822 CA ASP A 54 -21.481 -8.459 3.755 1.00 0.00 C ATOM 823 C ASP A 54 -22.185 -9.681 3.171 1.00 0.00 C ATOM 824 O ASP A 54 -23.367 -9.910 3.429 1.00 0.00 O ATOM 825 CB ASP A 54 -21.984 -8.200 5.175 1.00 0.00 C ATOM 826 CG ASP A 54 -21.737 -9.375 6.099 1.00 0.00 C ATOM 827 OD1 ASP A 54 -20.660 -9.420 6.729 1.00 0.00 O ATOM 828 OD2 ASP A 54 -22.621 -10.253 6.192 1.00 0.00 O ATOM 0 H ASP A 54 -22.204 -6.527 3.378 1.00 0.00 H new ATOM 0 HA ASP A 54 -20.410 -8.658 3.786 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -21.490 -7.315 5.577 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -23.052 -7.983 5.145 1.00 0.00 H new ATOM 833 N THR A 55 -21.452 -10.459 2.379 1.00 0.00 N ATOM 834 CA THR A 55 -22.005 -11.656 1.757 1.00 0.00 C ATOM 835 C THR A 55 -20.989 -12.793 1.757 1.00 0.00 C ATOM 836 O THR A 55 -19.781 -12.561 1.782 1.00 0.00 O ATOM 837 CB THR A 55 -22.454 -11.384 0.308 1.00 0.00 C ATOM 838 OG1 THR A 55 -21.369 -10.836 -0.450 1.00 0.00 O ATOM 839 CG2 THR A 55 -23.636 -10.425 0.277 1.00 0.00 C ATOM 0 H THR A 55 -20.473 -10.281 2.153 1.00 0.00 H new ATOM 0 HA THR A 55 -22.874 -11.946 2.348 1.00 0.00 H new ATOM 0 HB THR A 55 -22.763 -12.331 -0.135 1.00 0.00 H new ATOM 0 HG1 THR A 55 -21.127 -9.958 -0.088 1.00 0.00 H new ATOM 0 HG21 THR A 55 -23.934 -10.249 -0.756 1.00 0.00 H new ATOM 0 HG22 THR A 55 -24.471 -10.859 0.827 1.00 0.00 H new ATOM 0 HG23 THR A 55 -23.350 -9.480 0.738 1.00 0.00 H new ATOM 847 N GLU A 56 -21.490 -14.024 1.731 1.00 0.00 N ATOM 848 CA GLU A 56 -20.626 -15.201 1.730 1.00 0.00 C ATOM 849 C GLU A 56 -20.309 -15.650 0.308 1.00 0.00 C ATOM 850 O GLU A 56 -19.380 -16.426 0.086 1.00 0.00 O ATOM 851 CB GLU A 56 -21.290 -16.343 2.501 1.00 0.00 C ATOM 852 CG GLU A 56 -21.511 -16.038 3.974 1.00 0.00 C ATOM 853 CD GLU A 56 -20.210 -15.830 4.727 1.00 0.00 C ATOM 854 OE1 GLU A 56 -19.728 -14.679 4.772 1.00 0.00 O ATOM 855 OE2 GLU A 56 -19.674 -16.819 5.269 1.00 0.00 O ATOM 0 H GLU A 56 -22.488 -14.233 1.710 1.00 0.00 H new ATOM 0 HA GLU A 56 -19.690 -14.932 2.220 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -22.250 -16.572 2.038 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -20.672 -17.237 2.413 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -22.128 -15.144 4.068 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -22.065 -16.857 4.432 1.00 0.00 H new ATOM 862 N GLU A 57 -21.085 -15.158 -0.653 1.00 0.00 N ATOM 863 CA GLU A 57 -20.885 -15.512 -2.052 1.00 0.00 C ATOM 864 C GLU A 57 -19.965 -14.512 -2.742 1.00 0.00 C ATOM 865 O GLU A 57 -20.073 -13.303 -2.531 1.00 0.00 O ATOM 866 CB GLU A 57 -22.230 -15.573 -2.780 1.00 0.00 C ATOM 867 CG GLU A 57 -22.122 -16.027 -4.227 1.00 0.00 C ATOM 868 CD GLU A 57 -21.516 -17.410 -4.359 1.00 0.00 C ATOM 869 OE1 GLU A 57 -22.226 -18.398 -4.076 1.00 0.00 O ATOM 870 OE2 GLU A 57 -20.333 -17.506 -4.746 1.00 0.00 O ATOM 0 H GLU A 57 -21.858 -14.513 -0.487 1.00 0.00 H new ATOM 0 HA GLU A 57 -20.414 -16.494 -2.088 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -22.893 -16.252 -2.244 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -22.694 -14.587 -2.752 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -23.113 -16.024 -4.680 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -21.515 -15.313 -4.784 1.00 0.00 H new ATOM 877 N ASN A 58 -19.057 -15.025 -3.568 1.00 0.00 N ATOM 878 CA ASN A 58 -18.115 -14.179 -4.293 1.00 0.00 C ATOM 879 C ASN A 58 -18.405 -14.201 -5.791 1.00 0.00 C ATOM 880 O ASN A 58 -18.326 -15.248 -6.433 1.00 0.00 O ATOM 881 CB ASN A 58 -16.678 -14.638 -4.035 1.00 0.00 C ATOM 882 CG ASN A 58 -16.303 -14.582 -2.566 1.00 0.00 C ATOM 883 OD1 ASN A 58 -15.464 -15.354 -2.099 1.00 0.00 O ATOM 884 ND2 ASN A 58 -16.922 -13.669 -1.827 1.00 0.00 N ATOM 0 H ASN A 58 -18.954 -16.023 -3.752 1.00 0.00 H new ATOM 0 HA ASN A 58 -18.233 -13.157 -3.932 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -16.555 -15.658 -4.399 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -15.992 -14.011 -4.605 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -16.709 -13.588 -0.833 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -17.611 -13.049 -2.253 1.00 0.00 H new ATOM 891 N LYS A 59 -18.737 -13.036 -6.338 1.00 0.00 N ATOM 892 CA LYS A 59 -19.038 -12.915 -7.760 1.00 0.00 C ATOM 893 C LYS A 59 -17.769 -12.658 -8.567 1.00 0.00 C ATOM 894 O LYS A 59 -16.700 -12.424 -8.002 1.00 0.00 O ATOM 895 CB LYS A 59 -20.040 -11.783 -7.991 1.00 0.00 C ATOM 896 CG LYS A 59 -21.381 -12.007 -7.309 1.00 0.00 C ATOM 897 CD LYS A 59 -22.279 -10.783 -7.417 1.00 0.00 C ATOM 898 CE LYS A 59 -22.958 -10.693 -8.776 1.00 0.00 C ATOM 899 NZ LYS A 59 -21.984 -10.465 -9.880 1.00 0.00 N ATOM 0 H LYS A 59 -18.804 -12.161 -5.817 1.00 0.00 H new ATOM 0 HA LYS A 59 -19.474 -13.856 -8.096 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -19.610 -10.849 -7.630 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -20.202 -11.666 -9.062 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -21.880 -12.865 -7.760 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -21.219 -12.248 -6.258 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -23.037 -10.819 -6.635 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -21.688 -9.883 -7.247 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -23.510 -11.614 -8.966 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -23.686 -9.882 -8.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -22.422 -9.869 -10.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -21.139 -9.988 -9.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -21.710 -11.378 -10.296 1.00 0.00 H new ATOM 913 N LEU A 60 -17.896 -12.702 -9.890 1.00 0.00 N ATOM 914 CA LEU A 60 -16.760 -12.472 -10.776 1.00 0.00 C ATOM 915 C LEU A 60 -16.482 -10.980 -10.928 1.00 0.00 C ATOM 916 O LEU A 60 -15.447 -10.585 -11.462 1.00 0.00 O ATOM 917 CB LEU A 60 -17.024 -13.095 -12.149 1.00 0.00 C ATOM 918 CG LEU A 60 -17.235 -14.611 -12.145 1.00 0.00 C ATOM 919 CD1 LEU A 60 -17.703 -15.086 -13.512 1.00 0.00 C ATOM 920 CD2 LEU A 60 -15.955 -15.327 -11.742 1.00 0.00 C ATOM 0 H LEU A 60 -18.774 -12.895 -10.372 1.00 0.00 H new ATOM 0 HA LEU A 60 -15.883 -12.944 -10.332 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -17.906 -12.622 -12.582 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -16.184 -12.862 -12.804 1.00 0.00 H new ATOM 0 HG LEU A 60 -18.007 -14.849 -11.413 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -17.848 -16.166 -13.492 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -18.644 -14.598 -13.764 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -16.952 -14.835 -14.261 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -16.124 -16.404 -11.745 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -15.163 -15.082 -12.450 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -15.659 -15.009 -10.742 1.00 0.00 H new ATOM 932 N ILE A 61 -17.415 -10.158 -10.456 1.00 0.00 N ATOM 933 CA ILE A 61 -17.278 -8.708 -10.538 1.00 0.00 C ATOM 934 C ILE A 61 -16.152 -8.210 -9.632 1.00 0.00 C ATOM 935 O ILE A 61 -15.631 -7.107 -9.816 1.00 0.00 O ATOM 936 CB ILE A 61 -18.596 -8.002 -10.153 1.00 0.00 C ATOM 937 CG1 ILE A 61 -18.532 -6.510 -10.494 1.00 0.00 C ATOM 938 CG2 ILE A 61 -18.894 -8.201 -8.673 1.00 0.00 C ATOM 939 CD1 ILE A 61 -18.474 -6.227 -11.979 1.00 0.00 C ATOM 0 H ILE A 61 -18.277 -10.473 -10.011 1.00 0.00 H new ATOM 0 HA ILE A 61 -17.035 -8.465 -11.572 1.00 0.00 H new ATOM 0 HB ILE A 61 -19.405 -8.448 -10.731 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -19.405 -6.012 -10.072 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -17.655 -6.074 -10.016 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -19.826 -7.697 -8.419 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -18.988 -9.266 -8.461 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -18.082 -7.783 -8.079 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -18.430 -5.150 -12.143 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -17.586 -6.695 -12.404 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -19.364 -6.632 -12.462 1.00 0.00 H new ATOM 951 N TYR A 62 -15.774 -9.034 -8.660 1.00 0.00 N ATOM 952 CA TYR A 62 -14.714 -8.678 -7.723 1.00 0.00 C ATOM 953 C TYR A 62 -13.345 -8.687 -8.397 1.00 0.00 C ATOM 954 O TYR A 62 -12.389 -8.106 -7.880 1.00 0.00 O ATOM 955 CB TYR A 62 -14.714 -9.637 -6.532 1.00 0.00 C ATOM 956 CG TYR A 62 -15.881 -9.437 -5.591 1.00 0.00 C ATOM 957 CD1 TYR A 62 -17.127 -9.983 -5.870 1.00 0.00 C ATOM 958 CD2 TYR A 62 -15.734 -8.699 -4.423 1.00 0.00 C ATOM 959 CE1 TYR A 62 -18.194 -9.800 -5.011 1.00 0.00 C ATOM 960 CE2 TYR A 62 -16.796 -8.512 -3.558 1.00 0.00 C ATOM 961 CZ TYR A 62 -18.024 -9.064 -3.856 1.00 0.00 C ATOM 962 OH TYR A 62 -19.083 -8.880 -2.999 1.00 0.00 O ATOM 0 H TYR A 62 -16.186 -9.953 -8.500 1.00 0.00 H new ATOM 0 HA TYR A 62 -14.911 -7.665 -7.371 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -14.729 -10.662 -6.902 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -13.785 -9.512 -5.976 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -17.264 -10.560 -6.773 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -14.774 -8.264 -4.187 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -19.157 -10.231 -5.243 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -16.665 -7.937 -2.654 1.00 0.00 H new ATOM 0 HH TYR A 62 -18.795 -8.340 -2.234 1.00 0.00 H new ATOM 972 N THR A 63 -13.249 -9.345 -9.550 1.00 0.00 N ATOM 973 CA THR A 63 -11.985 -9.418 -10.277 1.00 0.00 C ATOM 974 C THR A 63 -11.654 -8.086 -10.960 1.00 0.00 C ATOM 975 O THR A 63 -10.563 -7.549 -10.768 1.00 0.00 O ATOM 976 CB THR A 63 -11.988 -10.554 -11.322 1.00 0.00 C ATOM 977 OG1 THR A 63 -12.179 -11.816 -10.674 1.00 0.00 O ATOM 978 CG2 THR A 63 -10.684 -10.577 -12.108 1.00 0.00 C ATOM 0 H THR A 63 -14.025 -9.832 -9.998 1.00 0.00 H new ATOM 0 HA THR A 63 -11.214 -9.634 -9.538 1.00 0.00 H new ATOM 0 HB THR A 63 -12.808 -10.372 -12.016 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.181 -12.531 -11.344 1.00 0.00 H new ATOM 0 HG21 THR A 63 -10.713 -11.387 -12.837 1.00 0.00 H new ATOM 0 HG22 THR A 63 -10.555 -9.627 -12.626 1.00 0.00 H new ATOM 0 HG23 THR A 63 -9.850 -10.734 -11.424 1.00 0.00 H new ATOM 986 N PRO A 64 -12.583 -7.523 -11.768 1.00 0.00 N ATOM 987 CA PRO A 64 -12.350 -6.244 -12.447 1.00 0.00 C ATOM 988 C PRO A 64 -12.233 -5.087 -11.461 1.00 0.00 C ATOM 989 O PRO A 64 -11.388 -4.207 -11.621 1.00 0.00 O ATOM 990 CB PRO A 64 -13.585 -6.067 -13.336 1.00 0.00 C ATOM 991 CG PRO A 64 -14.633 -6.921 -12.713 1.00 0.00 C ATOM 992 CD PRO A 64 -13.906 -8.084 -12.101 1.00 0.00 C ATOM 0 HA PRO A 64 -11.414 -6.247 -13.005 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -13.897 -5.023 -13.374 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -13.381 -6.377 -14.361 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -15.190 -6.367 -11.957 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -15.355 -7.259 -13.457 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -14.419 -8.457 -11.215 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -13.825 -8.919 -12.797 1.00 0.00 H new ATOM 1000 N ILE A 65 -13.085 -5.096 -10.438 1.00 0.00 N ATOM 1001 CA ILE A 65 -13.070 -4.047 -9.425 1.00 0.00 C ATOM 1002 C ILE A 65 -11.720 -3.993 -8.713 1.00 0.00 C ATOM 1003 O ILE A 65 -11.143 -2.921 -8.536 1.00 0.00 O ATOM 1004 CB ILE A 65 -14.189 -4.256 -8.383 1.00 0.00 C ATOM 1005 CG1 ILE A 65 -15.561 -4.189 -9.058 1.00 0.00 C ATOM 1006 CG2 ILE A 65 -14.088 -3.216 -7.275 1.00 0.00 C ATOM 1007 CD1 ILE A 65 -16.705 -4.588 -8.151 1.00 0.00 C ATOM 0 H ILE A 65 -13.792 -5.816 -10.290 1.00 0.00 H new ATOM 0 HA ILE A 65 -13.241 -3.102 -9.940 1.00 0.00 H new ATOM 0 HB ILE A 65 -14.069 -5.244 -7.938 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -15.730 -3.174 -9.417 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -15.558 -4.840 -9.932 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -14.885 -3.379 -6.549 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -13.122 -3.306 -6.779 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -14.185 -2.218 -7.703 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -17.645 -4.516 -8.698 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -16.560 -5.614 -7.812 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -16.735 -3.922 -7.289 1.00 0.00 H new ATOM 1019 N PHE A 66 -11.221 -5.159 -8.310 1.00 0.00 N ATOM 1020 CA PHE A 66 -9.938 -5.242 -7.621 1.00 0.00 C ATOM 1021 C PHE A 66 -8.811 -4.717 -8.503 1.00 0.00 C ATOM 1022 O PHE A 66 -7.956 -3.959 -8.047 1.00 0.00 O ATOM 1023 CB PHE A 66 -9.641 -6.685 -7.209 1.00 0.00 C ATOM 1024 CG PHE A 66 -8.356 -6.835 -6.443 1.00 0.00 C ATOM 1025 CD1 PHE A 66 -8.312 -6.581 -5.082 1.00 0.00 C ATOM 1026 CD2 PHE A 66 -7.191 -7.228 -7.085 1.00 0.00 C ATOM 1027 CE1 PHE A 66 -7.132 -6.716 -4.375 1.00 0.00 C ATOM 1028 CE2 PHE A 66 -6.008 -7.364 -6.382 1.00 0.00 C ATOM 1029 CZ PHE A 66 -5.979 -7.109 -5.026 1.00 0.00 C ATOM 0 H PHE A 66 -11.685 -6.057 -8.449 1.00 0.00 H new ATOM 0 HA PHE A 66 -10.000 -4.622 -6.727 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -10.464 -7.058 -6.600 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -9.598 -7.308 -8.102 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -9.210 -6.274 -4.567 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -7.208 -7.430 -8.146 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -7.112 -6.514 -3.314 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -5.107 -7.670 -6.894 1.00 0.00 H new ATOM 0 HZ PHE A 66 -5.056 -7.217 -4.475 1.00 0.00 H new ATOM 1039 N ASN A 67 -8.820 -5.122 -9.770 1.00 0.00 N ATOM 1040 CA ASN A 67 -7.795 -4.695 -10.717 1.00 0.00 C ATOM 1041 C ASN A 67 -7.778 -3.177 -10.855 1.00 0.00 C ATOM 1042 O ASN A 67 -6.731 -2.579 -11.103 1.00 0.00 O ATOM 1043 CB ASN A 67 -8.025 -5.342 -12.085 1.00 0.00 C ATOM 1044 CG ASN A 67 -7.574 -6.791 -12.132 1.00 0.00 C ATOM 1045 OD1 ASN A 67 -7.126 -7.277 -13.171 1.00 0.00 O ATOM 1046 ND2 ASN A 67 -7.691 -7.491 -11.010 1.00 0.00 N ATOM 0 H ASN A 67 -9.525 -5.745 -10.164 1.00 0.00 H new ATOM 0 HA ASN A 67 -6.828 -5.017 -10.332 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -9.085 -5.287 -12.334 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -7.489 -4.774 -12.845 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -7.405 -8.470 -10.987 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -8.067 -7.050 -10.171 1.00 0.00 H new ATOM 1053 N GLU A 68 -8.943 -2.557 -10.691 1.00 0.00 N ATOM 1054 CA GLU A 68 -9.054 -1.107 -10.796 1.00 0.00 C ATOM 1055 C GLU A 68 -8.351 -0.429 -9.624 1.00 0.00 C ATOM 1056 O GLU A 68 -7.622 0.545 -9.805 1.00 0.00 O ATOM 1057 CB GLU A 68 -10.524 -0.686 -10.842 1.00 0.00 C ATOM 1058 CG GLU A 68 -10.723 0.810 -11.028 1.00 0.00 C ATOM 1059 CD GLU A 68 -12.185 1.200 -11.108 1.00 0.00 C ATOM 1060 OE1 GLU A 68 -12.748 1.168 -12.223 1.00 0.00 O ATOM 1061 OE2 GLU A 68 -12.769 1.537 -10.056 1.00 0.00 O ATOM 0 H GLU A 68 -9.820 -3.035 -10.486 1.00 0.00 H new ATOM 0 HA GLU A 68 -8.570 -0.793 -11.721 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -11.019 -1.214 -11.657 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -11.011 -0.997 -9.918 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -10.255 1.341 -10.199 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -10.216 1.129 -11.938 1.00 0.00 H new ATOM 1068 N TYR A 69 -8.577 -0.953 -8.422 1.00 0.00 N ATOM 1069 CA TYR A 69 -7.961 -0.404 -7.218 1.00 0.00 C ATOM 1070 C TYR A 69 -6.441 -0.504 -7.298 1.00 0.00 C ATOM 1071 O TYR A 69 -5.719 0.334 -6.758 1.00 0.00 O ATOM 1072 CB TYR A 69 -8.470 -1.149 -5.982 1.00 0.00 C ATOM 1073 CG TYR A 69 -8.094 -0.488 -4.675 1.00 0.00 C ATOM 1074 CD1 TYR A 69 -8.922 0.465 -4.094 1.00 0.00 C ATOM 1075 CD2 TYR A 69 -6.912 -0.816 -4.023 1.00 0.00 C ATOM 1076 CE1 TYR A 69 -8.583 1.071 -2.899 1.00 0.00 C ATOM 1077 CE2 TYR A 69 -6.566 -0.214 -2.829 1.00 0.00 C ATOM 1078 CZ TYR A 69 -7.404 0.728 -2.271 1.00 0.00 C ATOM 1079 OH TYR A 69 -7.063 1.330 -1.082 1.00 0.00 O ATOM 0 H TYR A 69 -9.182 -1.757 -8.256 1.00 0.00 H new ATOM 0 HA TYR A 69 -8.235 0.648 -7.139 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -9.556 -1.230 -6.039 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -8.074 -2.164 -5.992 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -9.845 0.736 -4.584 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -6.253 -1.554 -4.457 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -9.238 1.809 -2.459 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -5.643 -0.480 -2.335 1.00 0.00 H new ATOM 0 HH TYR A 69 -6.204 0.976 -0.771 1.00 0.00 H new ATOM 1089 N ILE A 70 -5.963 -1.540 -7.975 1.00 0.00 N ATOM 1090 CA ILE A 70 -4.531 -1.757 -8.130 1.00 0.00 C ATOM 1091 C ILE A 70 -3.925 -0.760 -9.113 1.00 0.00 C ATOM 1092 O ILE A 70 -3.053 0.029 -8.752 1.00 0.00 O ATOM 1093 CB ILE A 70 -4.238 -3.191 -8.616 1.00 0.00 C ATOM 1094 CG1 ILE A 70 -4.774 -4.217 -7.612 1.00 0.00 C ATOM 1095 CG2 ILE A 70 -2.744 -3.384 -8.842 1.00 0.00 C ATOM 1096 CD1 ILE A 70 -4.103 -4.157 -6.254 1.00 0.00 C ATOM 0 H ILE A 70 -6.547 -2.244 -8.426 1.00 0.00 H new ATOM 0 HA ILE A 70 -4.076 -1.611 -7.150 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.748 -3.345 -9.567 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.845 -4.060 -7.484 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -4.645 -5.217 -8.026 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -2.556 -4.402 -9.185 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -2.396 -2.677 -9.595 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.209 -3.211 -7.908 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -4.537 -4.913 -5.600 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.035 -4.345 -6.367 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -4.254 -3.170 -5.817 1.00 0.00 H new ATOM 1108 N SER A 71 -4.396 -0.795 -10.353 1.00 0.00 N ATOM 1109 CA SER A 71 -3.890 0.098 -11.390 1.00 0.00 C ATOM 1110 C SER A 71 -4.088 1.564 -11.016 1.00 0.00 C ATOM 1111 O SER A 71 -3.364 2.436 -11.497 1.00 0.00 O ATOM 1112 CB SER A 71 -4.584 -0.194 -12.722 1.00 0.00 C ATOM 1113 OG SER A 71 -5.985 -0.010 -12.617 1.00 0.00 O ATOM 0 H SER A 71 -5.128 -1.432 -10.666 1.00 0.00 H new ATOM 0 HA SER A 71 -2.820 -0.084 -11.488 1.00 0.00 H new ATOM 0 HB2 SER A 71 -4.185 0.462 -13.495 1.00 0.00 H new ATOM 0 HB3 SER A 71 -4.370 -1.217 -13.031 1.00 0.00 H new ATOM 0 HG SER A 71 -6.382 -0.779 -12.158 1.00 0.00 H new ATOM 1119 N LEU A 72 -5.082 1.843 -10.177 1.00 0.00 N ATOM 1120 CA LEU A 72 -5.353 3.215 -9.761 1.00 0.00 C ATOM 1121 C LEU A 72 -4.577 3.587 -8.496 1.00 0.00 C ATOM 1122 O LEU A 72 -3.707 4.458 -8.525 1.00 0.00 O ATOM 1123 CB LEU A 72 -6.861 3.401 -9.532 1.00 0.00 C ATOM 1124 CG LEU A 72 -7.354 4.849 -9.378 1.00 0.00 C ATOM 1125 CD1 LEU A 72 -7.053 5.386 -7.987 1.00 0.00 C ATOM 1126 CD2 LEU A 72 -6.741 5.749 -10.443 1.00 0.00 C ATOM 0 H LEU A 72 -5.707 1.145 -9.775 1.00 0.00 H new ATOM 0 HA LEU A 72 -5.020 3.880 -10.558 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -7.392 2.946 -10.368 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -7.142 2.847 -8.636 1.00 0.00 H new ATOM 0 HG LEU A 72 -8.436 4.847 -9.513 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -7.413 6.412 -7.907 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -7.553 4.767 -7.242 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -5.977 5.364 -7.814 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -7.106 6.768 -10.312 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -5.655 5.737 -10.348 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -7.023 5.387 -11.432 1.00 0.00 H new ATOM 1138 N VAL A 73 -4.889 2.913 -7.393 1.00 0.00 N ATOM 1139 CA VAL A 73 -4.246 3.192 -6.109 1.00 0.00 C ATOM 1140 C VAL A 73 -2.815 2.659 -6.032 1.00 0.00 C ATOM 1141 O VAL A 73 -1.872 3.429 -5.858 1.00 0.00 O ATOM 1142 CB VAL A 73 -5.056 2.609 -4.938 1.00 0.00 C ATOM 1143 CG1 VAL A 73 -4.461 3.043 -3.607 1.00 0.00 C ATOM 1144 CG2 VAL A 73 -6.516 3.027 -5.039 1.00 0.00 C ATOM 0 H VAL A 73 -5.585 2.168 -7.361 1.00 0.00 H new ATOM 0 HA VAL A 73 -4.210 4.279 -6.031 1.00 0.00 H new ATOM 0 HB VAL A 73 -5.008 1.521 -4.993 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -5.048 2.621 -2.791 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -3.433 2.689 -3.535 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -4.476 4.131 -3.539 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -7.074 2.606 -4.203 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -6.586 4.114 -5.011 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -6.935 2.661 -5.976 1.00 0.00 H new ATOM 1154 N GLU A 74 -2.662 1.343 -6.153 1.00 0.00 N ATOM 1155 CA GLU A 74 -1.342 0.715 -6.068 1.00 0.00 C ATOM 1156 C GLU A 74 -0.347 1.371 -7.020 1.00 0.00 C ATOM 1157 O GLU A 74 0.798 1.638 -6.650 1.00 0.00 O ATOM 1158 CB GLU A 74 -1.440 -0.784 -6.362 1.00 0.00 C ATOM 1159 CG GLU A 74 -0.146 -1.540 -6.108 1.00 0.00 C ATOM 1160 CD GLU A 74 -0.288 -3.034 -6.327 1.00 0.00 C ATOM 1161 OE1 GLU A 74 -0.710 -3.733 -5.382 1.00 0.00 O ATOM 1162 OE2 GLU A 74 0.023 -3.503 -7.441 1.00 0.00 O ATOM 0 H GLU A 74 -3.431 0.691 -6.310 1.00 0.00 H new ATOM 0 HA GLU A 74 -0.977 0.855 -5.050 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -2.230 -1.215 -5.747 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -1.734 -0.923 -7.402 1.00 0.00 H new ATOM 0 HG2 GLU A 74 0.631 -1.153 -6.767 1.00 0.00 H new ATOM 0 HG3 GLU A 74 0.182 -1.357 -5.085 1.00 0.00 H new ATOM 1169 N LYS A 75 -0.787 1.632 -8.244 1.00 0.00 N ATOM 1170 CA LYS A 75 0.069 2.253 -9.247 1.00 0.00 C ATOM 1171 C LYS A 75 0.395 3.693 -8.865 1.00 0.00 C ATOM 1172 O LYS A 75 1.510 4.163 -9.085 1.00 0.00 O ATOM 1173 CB LYS A 75 -0.609 2.218 -10.615 1.00 0.00 C ATOM 1174 CG LYS A 75 0.313 2.579 -11.765 1.00 0.00 C ATOM 1175 CD LYS A 75 -0.452 2.678 -13.076 1.00 0.00 C ATOM 1176 CE LYS A 75 0.461 3.061 -14.230 1.00 0.00 C ATOM 1177 NZ LYS A 75 -0.292 3.201 -15.507 1.00 0.00 N ATOM 0 H LYS A 75 -1.732 1.423 -8.567 1.00 0.00 H new ATOM 0 HA LYS A 75 1.000 1.689 -9.296 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -1.012 1.220 -10.785 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -1.454 2.907 -10.609 1.00 0.00 H new ATOM 0 HG2 LYS A 75 0.804 3.529 -11.556 1.00 0.00 H new ATOM 0 HG3 LYS A 75 1.097 1.827 -11.855 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -0.930 1.723 -13.292 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -1.247 3.418 -12.979 1.00 0.00 H new ATOM 0 HE2 LYS A 75 0.964 4.000 -14.000 1.00 0.00 H new ATOM 0 HE3 LYS A 75 1.237 2.304 -14.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 0.364 3.463 -16.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -0.751 2.297 -15.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -1.016 3.941 -15.404 1.00 0.00 H new ATOM 1191 N TYR A 76 -0.587 4.388 -8.294 1.00 0.00 N ATOM 1192 CA TYR A 76 -0.402 5.775 -7.881 1.00 0.00 C ATOM 1193 C TYR A 76 0.797 5.915 -6.946 1.00 0.00 C ATOM 1194 O TYR A 76 1.649 6.783 -7.140 1.00 0.00 O ATOM 1195 CB TYR A 76 -1.666 6.298 -7.194 1.00 0.00 C ATOM 1196 CG TYR A 76 -1.568 7.742 -6.756 1.00 0.00 C ATOM 1197 CD1 TYR A 76 -1.697 8.775 -7.674 1.00 0.00 C ATOM 1198 CD2 TYR A 76 -1.348 8.071 -5.424 1.00 0.00 C ATOM 1199 CE1 TYR A 76 -1.611 10.097 -7.279 1.00 0.00 C ATOM 1200 CE2 TYR A 76 -1.260 9.390 -5.021 1.00 0.00 C ATOM 1201 CZ TYR A 76 -1.392 10.399 -5.951 1.00 0.00 C ATOM 1202 OH TYR A 76 -1.304 11.714 -5.554 1.00 0.00 O ATOM 0 H TYR A 76 -1.517 4.013 -8.108 1.00 0.00 H new ATOM 0 HA TYR A 76 -0.210 6.369 -8.774 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -2.510 6.191 -7.876 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -1.879 5.677 -6.324 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -1.867 8.542 -8.715 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -1.244 7.284 -4.692 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -1.715 10.889 -8.006 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -1.089 9.629 -3.982 1.00 0.00 H new ATOM 0 HH TYR A 76 -1.149 11.754 -4.587 1.00 0.00 H new ATOM 1212 N ILE A 77 0.860 5.055 -5.931 1.00 0.00 N ATOM 1213 CA ILE A 77 1.960 5.086 -4.971 1.00 0.00 C ATOM 1214 C ILE A 77 3.285 4.757 -5.650 1.00 0.00 C ATOM 1215 O ILE A 77 4.312 5.374 -5.364 1.00 0.00 O ATOM 1216 CB ILE A 77 1.734 4.091 -3.812 1.00 0.00 C ATOM 1217 CG1 ILE A 77 0.430 4.406 -3.074 1.00 0.00 C ATOM 1218 CG2 ILE A 77 2.914 4.125 -2.848 1.00 0.00 C ATOM 1219 CD1 ILE A 77 0.068 3.383 -2.015 1.00 0.00 C ATOM 0 H ILE A 77 0.164 4.331 -5.753 1.00 0.00 H new ATOM 0 HA ILE A 77 1.995 6.098 -4.567 1.00 0.00 H new ATOM 0 HB ILE A 77 1.655 3.088 -4.231 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.515 5.386 -2.606 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.382 4.469 -3.799 1.00 0.00 H new ATOM 0 HG21 ILE A 77 2.741 3.419 -2.036 1.00 0.00 H new ATOM 0 HG22 ILE A 77 3.826 3.851 -3.379 1.00 0.00 H new ATOM 0 HG23 ILE A 77 3.020 5.130 -2.439 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -0.867 3.672 -1.534 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -0.050 2.404 -2.480 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.861 3.336 -1.268 1.00 0.00 H new ATOM 1231 N GLU A 78 3.253 3.781 -6.551 1.00 0.00 N ATOM 1232 CA GLU A 78 4.451 3.357 -7.269 1.00 0.00 C ATOM 1233 C GLU A 78 5.049 4.501 -8.086 1.00 0.00 C ATOM 1234 O GLU A 78 6.246 4.766 -8.012 1.00 0.00 O ATOM 1235 CB GLU A 78 4.126 2.177 -8.188 1.00 0.00 C ATOM 1236 CG GLU A 78 5.346 1.577 -8.865 1.00 0.00 C ATOM 1237 CD GLU A 78 4.998 0.417 -9.778 1.00 0.00 C ATOM 1238 OE1 GLU A 78 4.883 -0.720 -9.275 1.00 0.00 O ATOM 1239 OE2 GLU A 78 4.838 0.646 -10.995 1.00 0.00 O ATOM 0 H GLU A 78 2.409 3.267 -6.802 1.00 0.00 H new ATOM 0 HA GLU A 78 5.189 3.048 -6.529 1.00 0.00 H new ATOM 0 HB2 GLU A 78 3.626 1.402 -7.607 1.00 0.00 H new ATOM 0 HB3 GLU A 78 3.422 2.506 -8.952 1.00 0.00 H new ATOM 0 HG2 GLU A 78 5.852 2.350 -9.443 1.00 0.00 H new ATOM 0 HG3 GLU A 78 6.048 1.237 -8.104 1.00 0.00 H new ATOM 1246 N GLU A 79 4.209 5.179 -8.860 1.00 0.00 N ATOM 1247 CA GLU A 79 4.664 6.282 -9.701 1.00 0.00 C ATOM 1248 C GLU A 79 5.294 7.403 -8.877 1.00 0.00 C ATOM 1249 O GLU A 79 6.418 7.825 -9.148 1.00 0.00 O ATOM 1250 CB GLU A 79 3.497 6.838 -10.522 1.00 0.00 C ATOM 1251 CG GLU A 79 2.908 5.833 -11.499 1.00 0.00 C ATOM 1252 CD GLU A 79 3.942 5.283 -12.459 1.00 0.00 C ATOM 1253 OE1 GLU A 79 4.344 6.019 -13.386 1.00 0.00 O ATOM 1254 OE2 GLU A 79 4.351 4.115 -12.286 1.00 0.00 O ATOM 0 H GLU A 79 3.210 4.985 -8.923 1.00 0.00 H new ATOM 0 HA GLU A 79 5.428 5.887 -10.371 1.00 0.00 H new ATOM 0 HB2 GLU A 79 2.713 7.174 -9.843 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.837 7.714 -11.075 1.00 0.00 H new ATOM 0 HG2 GLU A 79 2.460 5.010 -10.942 1.00 0.00 H new ATOM 0 HG3 GLU A 79 2.107 6.308 -12.066 1.00 0.00 H new ATOM 1261 N GLN A 80 4.566 7.878 -7.870 1.00 0.00 N ATOM 1262 CA GLN A 80 5.049 8.965 -7.019 1.00 0.00 C ATOM 1263 C GLN A 80 6.369 8.613 -6.335 1.00 0.00 C ATOM 1264 O GLN A 80 7.180 9.496 -6.054 1.00 0.00 O ATOM 1265 CB GLN A 80 4.000 9.318 -5.963 1.00 0.00 C ATOM 1266 CG GLN A 80 2.708 9.870 -6.546 1.00 0.00 C ATOM 1267 CD GLN A 80 2.931 11.122 -7.371 1.00 0.00 C ATOM 1268 OE1 GLN A 80 3.142 11.051 -8.582 1.00 0.00 O ATOM 1269 NE2 GLN A 80 2.889 12.276 -6.717 1.00 0.00 N ATOM 0 H GLN A 80 3.640 7.529 -7.622 1.00 0.00 H new ATOM 0 HA GLN A 80 5.225 9.826 -7.664 1.00 0.00 H new ATOM 0 HB2 GLN A 80 3.773 8.427 -5.377 1.00 0.00 H new ATOM 0 HB3 GLN A 80 4.421 10.052 -5.276 1.00 0.00 H new ATOM 0 HG2 GLN A 80 2.239 9.108 -7.168 1.00 0.00 H new ATOM 0 HG3 GLN A 80 2.013 10.092 -5.736 1.00 0.00 H new ATOM 0 HE21 GLN A 80 2.711 12.287 -5.713 1.00 0.00 H new ATOM 0 HE22 GLN A 80 3.035 13.152 -7.219 1.00 0.00 H new ATOM 1278 N LEU A 81 6.583 7.329 -6.068 1.00 0.00 N ATOM 1279 CA LEU A 81 7.805 6.883 -5.406 1.00 0.00 C ATOM 1280 C LEU A 81 8.972 6.829 -6.382 1.00 0.00 C ATOM 1281 O LEU A 81 10.110 7.142 -6.031 1.00 0.00 O ATOM 1282 CB LEU A 81 7.598 5.506 -4.772 1.00 0.00 C ATOM 1283 CG LEU A 81 6.866 5.511 -3.429 1.00 0.00 C ATOM 1284 CD1 LEU A 81 6.557 4.090 -2.986 1.00 0.00 C ATOM 1285 CD2 LEU A 81 7.697 6.229 -2.376 1.00 0.00 C ATOM 0 H LEU A 81 5.929 6.581 -6.299 1.00 0.00 H new ATOM 0 HA LEU A 81 8.041 7.606 -4.625 1.00 0.00 H new ATOM 0 HB2 LEU A 81 7.039 4.883 -5.470 1.00 0.00 H new ATOM 0 HB3 LEU A 81 8.572 5.037 -4.635 1.00 0.00 H new ATOM 0 HG LEU A 81 5.924 6.046 -3.550 1.00 0.00 H new ATOM 0 HD11 LEU A 81 6.036 4.112 -2.029 1.00 0.00 H new ATOM 0 HD12 LEU A 81 5.926 3.606 -3.731 1.00 0.00 H new ATOM 0 HD13 LEU A 81 7.487 3.532 -2.880 1.00 0.00 H new ATOM 0 HD21 LEU A 81 7.163 6.224 -1.426 1.00 0.00 H new ATOM 0 HD22 LEU A 81 8.653 5.719 -2.257 1.00 0.00 H new ATOM 0 HD23 LEU A 81 7.871 7.258 -2.689 1.00 0.00 H new ATOM 1297 N LEU A 82 8.675 6.435 -7.612 1.00 0.00 N ATOM 1298 CA LEU A 82 9.692 6.314 -8.647 1.00 0.00 C ATOM 1299 C LEU A 82 10.184 7.683 -9.100 1.00 0.00 C ATOM 1300 O LEU A 82 11.288 7.808 -9.630 1.00 0.00 O ATOM 1301 CB LEU A 82 9.139 5.519 -9.833 1.00 0.00 C ATOM 1302 CG LEU A 82 8.869 4.022 -9.584 1.00 0.00 C ATOM 1303 CD1 LEU A 82 9.838 3.173 -10.390 1.00 0.00 C ATOM 1304 CD2 LEU A 82 8.973 3.657 -8.107 1.00 0.00 C ATOM 0 H LEU A 82 7.733 6.192 -7.919 1.00 0.00 H new ATOM 0 HA LEU A 82 10.545 5.779 -8.229 1.00 0.00 H new ATOM 0 HB2 LEU A 82 8.208 5.986 -10.154 1.00 0.00 H new ATOM 0 HB3 LEU A 82 9.842 5.607 -10.662 1.00 0.00 H new ATOM 0 HG LEU A 82 7.847 3.821 -9.905 1.00 0.00 H new ATOM 0 HD11 LEU A 82 9.637 2.118 -10.206 1.00 0.00 H new ATOM 0 HD12 LEU A 82 9.712 3.386 -11.452 1.00 0.00 H new ATOM 0 HD13 LEU A 82 10.860 3.405 -10.092 1.00 0.00 H new ATOM 0 HD21 LEU A 82 8.775 2.593 -7.980 1.00 0.00 H new ATOM 0 HD22 LEU A 82 9.976 3.885 -7.746 1.00 0.00 H new ATOM 0 HD23 LEU A 82 8.243 4.232 -7.538 1.00 0.00 H new ATOM 1316 N GLN A 83 9.361 8.705 -8.895 1.00 0.00 N ATOM 1317 CA GLN A 83 9.729 10.064 -9.273 1.00 0.00 C ATOM 1318 C GLN A 83 11.004 10.491 -8.551 1.00 0.00 C ATOM 1319 O GLN A 83 11.670 11.445 -8.953 1.00 0.00 O ATOM 1320 CB GLN A 83 8.589 11.036 -8.956 1.00 0.00 C ATOM 1321 CG GLN A 83 7.362 10.838 -9.832 1.00 0.00 C ATOM 1322 CD GLN A 83 6.275 11.858 -9.556 1.00 0.00 C ATOM 1323 OE1 GLN A 83 6.140 12.353 -8.437 1.00 0.00 O ATOM 1324 NE2 GLN A 83 5.489 12.177 -10.579 1.00 0.00 N ATOM 0 H GLN A 83 8.438 8.619 -8.471 1.00 0.00 H new ATOM 0 HA GLN A 83 9.914 10.084 -10.347 1.00 0.00 H new ATOM 0 HB2 GLN A 83 8.302 10.919 -7.911 1.00 0.00 H new ATOM 0 HB3 GLN A 83 8.950 12.058 -9.075 1.00 0.00 H new ATOM 0 HG2 GLN A 83 7.655 10.900 -10.880 1.00 0.00 H new ATOM 0 HG3 GLN A 83 6.964 9.836 -9.671 1.00 0.00 H new ATOM 0 HE21 GLN A 83 5.636 11.742 -11.490 1.00 0.00 H new ATOM 0 HE22 GLN A 83 4.739 12.856 -10.453 1.00 0.00 H new ATOM 1333 N ARG A 84 11.332 9.775 -7.478 1.00 0.00 N ATOM 1334 CA ARG A 84 12.527 10.065 -6.692 1.00 0.00 C ATOM 1335 C ARG A 84 13.536 8.924 -6.808 1.00 0.00 C ATOM 1336 O ARG A 84 14.746 9.141 -6.726 1.00 0.00 O ATOM 1337 CB ARG A 84 12.153 10.285 -5.223 1.00 0.00 C ATOM 1338 CG ARG A 84 13.336 10.617 -4.328 1.00 0.00 C ATOM 1339 CD ARG A 84 13.977 11.941 -4.710 1.00 0.00 C ATOM 1340 NE ARG A 84 13.014 13.039 -4.714 1.00 0.00 N ATOM 1341 CZ ARG A 84 13.333 14.299 -4.997 1.00 0.00 C ATOM 1342 NH1 ARG A 84 14.586 14.618 -5.295 1.00 0.00 N ATOM 1343 NH2 ARG A 84 12.402 15.241 -4.982 1.00 0.00 N ATOM 0 H ARG A 84 10.784 8.987 -7.133 1.00 0.00 H new ATOM 0 HA ARG A 84 12.983 10.974 -7.083 1.00 0.00 H new ATOM 0 HB2 ARG A 84 11.425 11.094 -5.161 1.00 0.00 H new ATOM 0 HB3 ARG A 84 11.665 9.387 -4.844 1.00 0.00 H new ATOM 0 HG2 ARG A 84 13.006 10.659 -3.290 1.00 0.00 H new ATOM 0 HG3 ARG A 84 14.078 9.821 -4.395 1.00 0.00 H new ATOM 0 HD2 ARG A 84 14.782 12.168 -4.011 1.00 0.00 H new ATOM 0 HD3 ARG A 84 14.429 11.852 -5.698 1.00 0.00 H new ATOM 0 HE ARG A 84 12.042 12.828 -4.487 1.00 0.00 H new ATOM 0 HH11 ARG A 84 15.307 13.896 -5.307 1.00 0.00 H new ATOM 0 HH12 ARG A 84 14.828 15.585 -5.512 1.00 0.00 H new ATOM 0 HH21 ARG A 84 11.437 15.001 -4.753 1.00 0.00 H new ATOM 0 HH22 ARG A 84 12.650 16.206 -5.199 1.00 0.00 H new ATOM 1357 N ILE A 85 13.028 7.710 -7.002 1.00 0.00 N ATOM 1358 CA ILE A 85 13.880 6.530 -7.129 1.00 0.00 C ATOM 1359 C ILE A 85 13.595 5.787 -8.437 1.00 0.00 C ATOM 1360 O ILE A 85 12.657 4.994 -8.511 1.00 0.00 O ATOM 1361 CB ILE A 85 13.670 5.562 -5.947 1.00 0.00 C ATOM 1362 CG1 ILE A 85 13.789 6.311 -4.617 1.00 0.00 C ATOM 1363 CG2 ILE A 85 14.678 4.422 -6.014 1.00 0.00 C ATOM 1364 CD1 ILE A 85 13.380 5.486 -3.414 1.00 0.00 C ATOM 0 H ILE A 85 12.029 7.517 -7.075 1.00 0.00 H new ATOM 0 HA ILE A 85 14.913 6.878 -7.128 1.00 0.00 H new ATOM 0 HB ILE A 85 12.667 5.140 -6.014 1.00 0.00 H new ATOM 0 HG12 ILE A 85 14.820 6.640 -4.487 1.00 0.00 H new ATOM 0 HG13 ILE A 85 13.171 7.208 -4.659 1.00 0.00 H new ATOM 0 HG21 ILE A 85 14.519 3.746 -5.174 1.00 0.00 H new ATOM 0 HG22 ILE A 85 14.549 3.876 -6.949 1.00 0.00 H new ATOM 0 HG23 ILE A 85 15.689 4.827 -5.967 1.00 0.00 H new ATOM 0 HD11 ILE A 85 13.491 6.083 -2.509 1.00 0.00 H new ATOM 0 HD12 ILE A 85 12.340 5.178 -3.521 1.00 0.00 H new ATOM 0 HD13 ILE A 85 14.015 4.602 -3.346 1.00 0.00 H new ATOM 1376 N PRO A 86 14.399 6.034 -9.493 1.00 0.00 N ATOM 1377 CA PRO A 86 14.214 5.378 -10.793 1.00 0.00 C ATOM 1378 C PRO A 86 14.647 3.918 -10.779 1.00 0.00 C ATOM 1379 O PRO A 86 14.405 3.176 -11.732 1.00 0.00 O ATOM 1380 CB PRO A 86 15.106 6.194 -11.729 1.00 0.00 C ATOM 1381 CG PRO A 86 16.179 6.733 -10.850 1.00 0.00 C ATOM 1382 CD PRO A 86 15.543 6.970 -9.506 1.00 0.00 C ATOM 0 HA PRO A 86 13.166 5.355 -11.091 1.00 0.00 H new ATOM 0 HB2 PRO A 86 15.519 5.573 -12.524 1.00 0.00 H new ATOM 0 HB3 PRO A 86 14.547 6.997 -12.210 1.00 0.00 H new ATOM 0 HG2 PRO A 86 17.007 6.028 -10.770 1.00 0.00 H new ATOM 0 HG3 PRO A 86 16.586 7.659 -11.256 1.00 0.00 H new ATOM 0 HD2 PRO A 86 16.238 6.765 -8.692 1.00 0.00 H new ATOM 0 HD3 PRO A 86 15.216 8.004 -9.394 1.00 0.00 H new ATOM 1390 N GLU A 87 15.285 3.514 -9.690 1.00 0.00 N ATOM 1391 CA GLU A 87 15.755 2.142 -9.537 1.00 0.00 C ATOM 1392 C GLU A 87 14.964 1.425 -8.450 1.00 0.00 C ATOM 1393 O GLU A 87 15.370 0.373 -7.957 1.00 0.00 O ATOM 1394 CB GLU A 87 17.246 2.128 -9.191 1.00 0.00 C ATOM 1395 CG GLU A 87 17.566 2.801 -7.867 1.00 0.00 C ATOM 1396 CD GLU A 87 19.046 2.774 -7.541 1.00 0.00 C ATOM 1397 OE1 GLU A 87 19.506 1.772 -6.955 1.00 0.00 O ATOM 1398 OE2 GLU A 87 19.744 3.756 -7.872 1.00 0.00 O ATOM 0 H GLU A 87 15.490 4.119 -8.895 1.00 0.00 H new ATOM 0 HA GLU A 87 15.605 1.620 -10.482 1.00 0.00 H new ATOM 0 HB2 GLU A 87 17.594 1.096 -9.158 1.00 0.00 H new ATOM 0 HB3 GLU A 87 17.800 2.626 -9.986 1.00 0.00 H new ATOM 0 HG2 GLU A 87 17.223 3.835 -7.898 1.00 0.00 H new ATOM 0 HG3 GLU A 87 17.013 2.306 -7.069 1.00 0.00 H new ATOM 1405 N PHE A 88 13.826 2.006 -8.087 1.00 0.00 N ATOM 1406 CA PHE A 88 12.968 1.444 -7.053 1.00 0.00 C ATOM 1407 C PHE A 88 12.441 0.069 -7.447 1.00 0.00 C ATOM 1408 O PHE A 88 12.225 -0.214 -8.626 1.00 0.00 O ATOM 1409 CB PHE A 88 11.792 2.378 -6.783 1.00 0.00 C ATOM 1410 CG PHE A 88 11.048 2.051 -5.520 1.00 0.00 C ATOM 1411 CD1 PHE A 88 11.578 2.383 -4.282 1.00 0.00 C ATOM 1412 CD2 PHE A 88 9.821 1.412 -5.570 1.00 0.00 C ATOM 1413 CE1 PHE A 88 10.897 2.081 -3.119 1.00 0.00 C ATOM 1414 CE2 PHE A 88 9.134 1.108 -4.409 1.00 0.00 C ATOM 1415 CZ PHE A 88 9.673 1.442 -3.182 1.00 0.00 C ATOM 0 H PHE A 88 13.475 2.872 -8.497 1.00 0.00 H new ATOM 0 HA PHE A 88 13.569 1.335 -6.150 1.00 0.00 H new ATOM 0 HB2 PHE A 88 12.158 3.403 -6.725 1.00 0.00 H new ATOM 0 HB3 PHE A 88 11.101 2.333 -7.625 1.00 0.00 H new ATOM 0 HD1 PHE A 88 12.534 2.883 -4.227 1.00 0.00 H new ATOM 0 HD2 PHE A 88 9.395 1.148 -6.527 1.00 0.00 H new ATOM 0 HE1 PHE A 88 11.321 2.344 -2.161 1.00 0.00 H new ATOM 0 HE2 PHE A 88 8.177 0.610 -4.462 1.00 0.00 H new ATOM 0 HZ PHE A 88 9.139 1.204 -2.274 1.00 0.00 H new ATOM 1425 N ASN A 89 12.237 -0.781 -6.445 1.00 0.00 N ATOM 1426 CA ASN A 89 11.720 -2.125 -6.666 1.00 0.00 C ATOM 1427 C ASN A 89 10.551 -2.401 -5.725 1.00 0.00 C ATOM 1428 O ASN A 89 10.729 -2.963 -4.645 1.00 0.00 O ATOM 1429 CB ASN A 89 12.822 -3.166 -6.454 1.00 0.00 C ATOM 1430 CG ASN A 89 13.948 -3.033 -7.462 1.00 0.00 C ATOM 1431 OD1 ASN A 89 15.110 -3.289 -7.147 1.00 0.00 O ATOM 1432 ND2 ASN A 89 13.610 -2.634 -8.683 1.00 0.00 N ATOM 0 H ASN A 89 12.424 -0.560 -5.467 1.00 0.00 H new ATOM 0 HA ASN A 89 11.370 -2.195 -7.696 1.00 0.00 H new ATOM 0 HB2 ASN A 89 13.226 -3.063 -5.447 1.00 0.00 H new ATOM 0 HB3 ASN A 89 12.392 -4.165 -6.524 1.00 0.00 H new ATOM 0 HD21 ASN A 89 14.326 -2.529 -9.402 1.00 0.00 H new ATOM 0 HD22 ASN A 89 12.634 -2.432 -8.902 1.00 0.00 H new ATOM 1439 N MET A 90 9.357 -1.989 -6.141 1.00 0.00 N ATOM 1440 CA MET A 90 8.154 -2.179 -5.338 1.00 0.00 C ATOM 1441 C MET A 90 7.862 -3.662 -5.121 1.00 0.00 C ATOM 1442 O MET A 90 7.252 -4.043 -4.122 1.00 0.00 O ATOM 1443 CB MET A 90 6.959 -1.501 -6.014 1.00 0.00 C ATOM 1444 CG MET A 90 5.721 -1.425 -5.134 1.00 0.00 C ATOM 1445 SD MET A 90 6.002 -0.483 -3.623 1.00 0.00 S ATOM 1446 CE MET A 90 4.340 -0.395 -2.962 1.00 0.00 C ATOM 0 H MET A 90 9.197 -1.520 -7.033 1.00 0.00 H new ATOM 0 HA MET A 90 8.323 -1.722 -4.363 1.00 0.00 H new ATOM 0 HB2 MET A 90 7.245 -0.492 -6.311 1.00 0.00 H new ATOM 0 HB3 MET A 90 6.713 -2.044 -6.926 1.00 0.00 H new ATOM 0 HG2 MET A 90 4.907 -0.968 -5.697 1.00 0.00 H new ATOM 0 HG3 MET A 90 5.402 -2.434 -4.875 1.00 0.00 H new ATOM 0 HE1 MET A 90 4.350 0.160 -2.024 1.00 0.00 H new ATOM 0 HE2 MET A 90 3.691 0.112 -3.676 1.00 0.00 H new ATOM 0 HE3 MET A 90 3.966 -1.403 -2.783 1.00 0.00 H new ATOM 1456 N ALA A 91 8.301 -4.494 -6.060 1.00 0.00 N ATOM 1457 CA ALA A 91 8.084 -5.934 -5.968 1.00 0.00 C ATOM 1458 C ALA A 91 8.922 -6.544 -4.850 1.00 0.00 C ATOM 1459 O ALA A 91 8.400 -7.235 -3.975 1.00 0.00 O ATOM 1460 CB ALA A 91 8.407 -6.600 -7.297 1.00 0.00 C ATOM 0 H ALA A 91 8.809 -4.196 -6.893 1.00 0.00 H new ATOM 0 HA ALA A 91 7.033 -6.106 -5.733 1.00 0.00 H new ATOM 0 HB1 ALA A 91 8.241 -7.674 -7.215 1.00 0.00 H new ATOM 0 HB2 ALA A 91 7.762 -6.191 -8.075 1.00 0.00 H new ATOM 0 HB3 ALA A 91 9.449 -6.412 -7.554 1.00 0.00 H new ATOM 1466 N ALA A 92 10.225 -6.285 -4.887 1.00 0.00 N ATOM 1467 CA ALA A 92 11.140 -6.804 -3.879 1.00 0.00 C ATOM 1468 C ALA A 92 10.916 -6.126 -2.532 1.00 0.00 C ATOM 1469 O ALA A 92 11.146 -6.722 -1.480 1.00 0.00 O ATOM 1470 CB ALA A 92 12.580 -6.616 -4.333 1.00 0.00 C ATOM 0 H ALA A 92 10.671 -5.717 -5.607 1.00 0.00 H new ATOM 0 HA ALA A 92 10.943 -7.869 -3.756 1.00 0.00 H new ATOM 0 HB1 ALA A 92 13.255 -7.007 -3.572 1.00 0.00 H new ATOM 0 HB2 ALA A 92 12.739 -7.151 -5.269 1.00 0.00 H new ATOM 0 HB3 ALA A 92 12.779 -5.555 -4.483 1.00 0.00 H new ATOM 1476 N PHE A 93 10.463 -4.877 -2.572 1.00 0.00 N ATOM 1477 CA PHE A 93 10.211 -4.114 -1.355 1.00 0.00 C ATOM 1478 C PHE A 93 9.058 -4.716 -0.559 1.00 0.00 C ATOM 1479 O PHE A 93 9.171 -4.930 0.649 1.00 0.00 O ATOM 1480 CB PHE A 93 9.909 -2.652 -1.697 1.00 0.00 C ATOM 1481 CG PHE A 93 9.566 -1.811 -0.498 1.00 0.00 C ATOM 1482 CD1 PHE A 93 10.548 -1.434 0.405 1.00 0.00 C ATOM 1483 CD2 PHE A 93 8.261 -1.401 -0.275 1.00 0.00 C ATOM 1484 CE1 PHE A 93 10.234 -0.664 1.509 1.00 0.00 C ATOM 1485 CE2 PHE A 93 7.941 -0.631 0.827 1.00 0.00 C ATOM 1486 CZ PHE A 93 8.929 -0.262 1.721 1.00 0.00 C ATOM 0 H PHE A 93 10.263 -4.371 -3.435 1.00 0.00 H new ATOM 0 HA PHE A 93 11.109 -4.156 -0.739 1.00 0.00 H new ATOM 0 HB2 PHE A 93 10.774 -2.219 -2.199 1.00 0.00 H new ATOM 0 HB3 PHE A 93 9.080 -2.617 -2.404 1.00 0.00 H new ATOM 0 HD1 PHE A 93 11.570 -1.745 0.244 1.00 0.00 H new ATOM 0 HD2 PHE A 93 7.485 -1.686 -0.970 1.00 0.00 H new ATOM 0 HE1 PHE A 93 11.008 -0.377 2.205 1.00 0.00 H new ATOM 0 HE2 PHE A 93 6.920 -0.318 0.990 1.00 0.00 H new ATOM 0 HZ PHE A 93 8.681 0.339 2.583 1.00 0.00 H new ATOM 1496 N THR A 94 7.950 -4.990 -1.241 1.00 0.00 N ATOM 1497 CA THR A 94 6.778 -5.568 -0.591 1.00 0.00 C ATOM 1498 C THR A 94 7.079 -6.962 -0.051 1.00 0.00 C ATOM 1499 O THR A 94 6.645 -7.318 1.044 1.00 0.00 O ATOM 1500 CB THR A 94 5.579 -5.648 -1.556 1.00 0.00 C ATOM 1501 OG1 THR A 94 5.949 -6.357 -2.744 1.00 0.00 O ATOM 1502 CG2 THR A 94 5.084 -4.256 -1.920 1.00 0.00 C ATOM 0 H THR A 94 7.839 -4.822 -2.241 1.00 0.00 H new ATOM 0 HA THR A 94 6.521 -4.909 0.238 1.00 0.00 H new ATOM 0 HB THR A 94 4.773 -6.183 -1.054 1.00 0.00 H new ATOM 0 HG1 THR A 94 6.410 -5.748 -3.358 1.00 0.00 H new ATOM 0 HG21 THR A 94 4.238 -4.338 -2.602 1.00 0.00 H new ATOM 0 HG22 THR A 94 4.773 -3.733 -1.016 1.00 0.00 H new ATOM 0 HG23 THR A 94 5.887 -3.699 -2.403 1.00 0.00 H new ATOM 1510 N THR A 95 7.824 -7.746 -0.826 1.00 0.00 N ATOM 1511 CA THR A 95 8.182 -9.102 -0.423 1.00 0.00 C ATOM 1512 C THR A 95 8.916 -9.102 0.914 1.00 0.00 C ATOM 1513 O THR A 95 8.605 -9.892 1.806 1.00 0.00 O ATOM 1514 CB THR A 95 9.066 -9.787 -1.481 1.00 0.00 C ATOM 1515 OG1 THR A 95 8.442 -9.710 -2.767 1.00 0.00 O ATOM 1516 CG2 THR A 95 9.310 -11.245 -1.119 1.00 0.00 C ATOM 0 H THR A 95 8.191 -7.466 -1.735 1.00 0.00 H new ATOM 0 HA THR A 95 7.250 -9.659 -0.323 1.00 0.00 H new ATOM 0 HB THR A 95 10.025 -9.269 -1.511 1.00 0.00 H new ATOM 0 HG1 THR A 95 8.527 -8.799 -3.118 1.00 0.00 H new ATOM 0 HG21 THR A 95 9.937 -11.709 -1.881 1.00 0.00 H new ATOM 0 HG22 THR A 95 9.811 -11.301 -0.153 1.00 0.00 H new ATOM 0 HG23 THR A 95 8.357 -11.771 -1.064 1.00 0.00 H new ATOM 1524 N THR A 96 9.890 -8.208 1.047 1.00 0.00 N ATOM 1525 CA THR A 96 10.673 -8.103 2.272 1.00 0.00 C ATOM 1526 C THR A 96 9.866 -7.452 3.389 1.00 0.00 C ATOM 1527 O THR A 96 10.076 -7.737 4.568 1.00 0.00 O ATOM 1528 CB THR A 96 11.963 -7.290 2.042 1.00 0.00 C ATOM 1529 OG1 THR A 96 12.711 -7.859 0.960 1.00 0.00 O ATOM 1530 CG2 THR A 96 12.823 -7.265 3.298 1.00 0.00 C ATOM 0 H THR A 96 10.156 -7.544 0.319 1.00 0.00 H new ATOM 0 HA THR A 96 10.938 -9.118 2.567 1.00 0.00 H new ATOM 0 HB THR A 96 11.681 -6.267 1.795 1.00 0.00 H new ATOM 0 HG1 THR A 96 12.328 -7.565 0.107 1.00 0.00 H new ATOM 0 HG21 THR A 96 13.726 -6.685 3.109 1.00 0.00 H new ATOM 0 HG22 THR A 96 12.263 -6.808 4.114 1.00 0.00 H new ATOM 0 HG23 THR A 96 13.096 -8.284 3.572 1.00 0.00 H new ATOM 1538 N LEU A 97 8.939 -6.576 3.011 1.00 0.00 N ATOM 1539 CA LEU A 97 8.100 -5.882 3.983 1.00 0.00 C ATOM 1540 C LEU A 97 7.277 -6.874 4.800 1.00 0.00 C ATOM 1541 O LEU A 97 7.072 -6.683 5.999 1.00 0.00 O ATOM 1542 CB LEU A 97 7.169 -4.894 3.274 1.00 0.00 C ATOM 1543 CG LEU A 97 6.945 -3.565 4.003 1.00 0.00 C ATOM 1544 CD1 LEU A 97 6.106 -2.628 3.150 1.00 0.00 C ATOM 1545 CD2 LEU A 97 6.282 -3.795 5.353 1.00 0.00 C ATOM 0 H LEU A 97 8.750 -6.330 2.039 1.00 0.00 H new ATOM 0 HA LEU A 97 8.754 -5.333 4.661 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.576 -4.683 2.285 1.00 0.00 H new ATOM 0 HB3 LEU A 97 6.202 -5.375 3.125 1.00 0.00 H new ATOM 0 HG LEU A 97 7.916 -3.101 4.176 1.00 0.00 H new ATOM 0 HD11 LEU A 97 5.956 -1.688 3.682 1.00 0.00 H new ATOM 0 HD12 LEU A 97 6.620 -2.434 2.209 1.00 0.00 H new ATOM 0 HD13 LEU A 97 5.139 -3.089 2.947 1.00 0.00 H new ATOM 0 HD21 LEU A 97 6.133 -2.838 5.853 1.00 0.00 H new ATOM 0 HD22 LEU A 97 5.318 -4.282 5.207 1.00 0.00 H new ATOM 0 HD23 LEU A 97 6.920 -4.430 5.968 1.00 0.00 H new ATOM 1557 N GLN A 98 6.816 -7.937 4.143 1.00 0.00 N ATOM 1558 CA GLN A 98 6.008 -8.961 4.803 1.00 0.00 C ATOM 1559 C GLN A 98 6.686 -9.461 6.074 1.00 0.00 C ATOM 1560 O GLN A 98 6.019 -9.840 7.037 1.00 0.00 O ATOM 1561 CB GLN A 98 5.758 -10.133 3.852 1.00 0.00 C ATOM 1562 CG GLN A 98 5.046 -9.733 2.569 1.00 0.00 C ATOM 1563 CD GLN A 98 4.841 -10.898 1.618 1.00 0.00 C ATOM 1564 OE1 GLN A 98 4.831 -10.724 0.400 1.00 0.00 O ATOM 1565 NE2 GLN A 98 4.669 -12.094 2.170 1.00 0.00 N ATOM 0 H GLN A 98 6.989 -8.112 3.153 1.00 0.00 H new ATOM 0 HA GLN A 98 5.054 -8.511 5.077 1.00 0.00 H new ATOM 0 HB2 GLN A 98 6.712 -10.595 3.599 1.00 0.00 H new ATOM 0 HB3 GLN A 98 5.164 -10.888 4.367 1.00 0.00 H new ATOM 0 HG2 GLN A 98 4.078 -9.299 2.817 1.00 0.00 H new ATOM 0 HG3 GLN A 98 5.623 -8.957 2.066 1.00 0.00 H new ATOM 0 HE21 GLN A 98 4.684 -12.194 3.185 1.00 0.00 H new ATOM 0 HE22 GLN A 98 4.522 -12.912 1.579 1.00 0.00 H new ATOM 1574 N HIS A 99 8.014 -9.464 6.070 1.00 0.00 N ATOM 1575 CA HIS A 99 8.779 -9.911 7.227 1.00 0.00 C ATOM 1576 C HIS A 99 9.206 -8.719 8.078 1.00 0.00 C ATOM 1577 O HIS A 99 9.323 -8.823 9.300 1.00 0.00 O ATOM 1578 CB HIS A 99 10.010 -10.699 6.779 1.00 0.00 C ATOM 1579 CG HIS A 99 9.682 -11.929 5.993 1.00 0.00 C ATOM 1580 ND1 HIS A 99 9.631 -13.188 6.553 1.00 0.00 N ATOM 1581 CD2 HIS A 99 9.388 -12.091 4.682 1.00 0.00 C ATOM 1582 CE1 HIS A 99 9.322 -14.071 5.621 1.00 0.00 C ATOM 1583 NE2 HIS A 99 9.170 -13.431 4.476 1.00 0.00 N ATOM 0 H HIS A 99 8.583 -9.162 5.279 1.00 0.00 H new ATOM 0 HA HIS A 99 8.143 -10.561 7.828 1.00 0.00 H new ATOM 0 HB2 HIS A 99 10.645 -10.051 6.175 1.00 0.00 H new ATOM 0 HB3 HIS A 99 10.588 -10.983 7.658 1.00 0.00 H new ATOM 0 HD2 HIS A 99 9.335 -11.311 3.936 1.00 0.00 H new ATOM 0 HE1 HIS A 99 9.212 -15.135 5.770 1.00 0.00 H new ATOM 0 HE2 HIS A 99 8.930 -13.862 3.583 1.00 0.00 H new ATOM 1592 N HIS A 100 9.427 -7.586 7.421 1.00 0.00 N ATOM 1593 CA HIS A 100 9.846 -6.371 8.108 1.00 0.00 C ATOM 1594 C HIS A 100 8.728 -5.832 8.996 1.00 0.00 C ATOM 1595 O HIS A 100 8.934 -4.889 9.759 1.00 0.00 O ATOM 1596 CB HIS A 100 10.272 -5.305 7.097 1.00 0.00 C ATOM 1597 CG HIS A 100 11.052 -4.180 7.705 1.00 0.00 C ATOM 1598 ND1 HIS A 100 10.467 -3.028 8.188 1.00 0.00 N ATOM 1599 CD2 HIS A 100 12.385 -4.034 7.906 1.00 0.00 C ATOM 1600 CE1 HIS A 100 11.404 -2.224 8.658 1.00 0.00 C ATOM 1601 NE2 HIS A 100 12.575 -2.810 8.500 1.00 0.00 N ATOM 0 H HIS A 100 9.323 -7.484 6.411 1.00 0.00 H new ATOM 0 HA HIS A 100 10.698 -6.620 8.741 1.00 0.00 H new ATOM 0 HB2 HIS A 100 10.874 -5.774 6.319 1.00 0.00 H new ATOM 0 HB3 HIS A 100 9.384 -4.900 6.612 1.00 0.00 H new ATOM 0 HD2 HIS A 100 13.154 -4.747 7.647 1.00 0.00 H new ATOM 0 HE1 HIS A 100 11.239 -1.251 9.097 1.00 0.00 H new ATOM 0 HE2 HIS A 100 13.476 -2.418 8.774 1.00 0.00 H new ATOM 1610 N LYS A 101 7.543 -6.429 8.887 1.00 0.00 N ATOM 1611 CA LYS A 101 6.400 -6.008 9.693 1.00 0.00 C ATOM 1612 C LYS A 101 6.711 -6.135 11.180 1.00 0.00 C ATOM 1613 O LYS A 101 6.111 -5.454 12.012 1.00 0.00 O ATOM 1614 CB LYS A 101 5.163 -6.843 9.355 1.00 0.00 C ATOM 1615 CG LYS A 101 4.668 -6.660 7.930 1.00 0.00 C ATOM 1616 CD LYS A 101 3.266 -7.224 7.745 1.00 0.00 C ATOM 1617 CE LYS A 101 3.230 -8.730 7.954 1.00 0.00 C ATOM 1618 NZ LYS A 101 1.864 -9.287 7.744 1.00 0.00 N ATOM 0 H LYS A 101 7.350 -7.203 8.251 1.00 0.00 H new ATOM 0 HA LYS A 101 6.197 -4.962 9.462 1.00 0.00 H new ATOM 0 HB2 LYS A 101 5.392 -7.896 9.517 1.00 0.00 H new ATOM 0 HB3 LYS A 101 4.360 -6.581 10.045 1.00 0.00 H new ATOM 0 HG2 LYS A 101 4.670 -5.600 7.677 1.00 0.00 H new ATOM 0 HG3 LYS A 101 5.353 -7.154 7.240 1.00 0.00 H new ATOM 0 HD2 LYS A 101 2.585 -6.743 8.448 1.00 0.00 H new ATOM 0 HD3 LYS A 101 2.909 -6.988 6.743 1.00 0.00 H new ATOM 0 HE2 LYS A 101 3.927 -9.209 7.266 1.00 0.00 H new ATOM 0 HE3 LYS A 101 3.567 -8.965 8.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 1.881 -10.316 7.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 1.203 -8.849 8.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 1.553 -9.086 6.772 1.00 0.00 H new ATOM 1632 N ASP A 102 7.655 -7.014 11.507 1.00 0.00 N ATOM 1633 CA ASP A 102 8.046 -7.240 12.894 1.00 0.00 C ATOM 1634 C ASP A 102 8.846 -6.061 13.445 1.00 0.00 C ATOM 1635 O ASP A 102 9.221 -6.051 14.617 1.00 0.00 O ATOM 1636 CB ASP A 102 8.866 -8.527 13.010 1.00 0.00 C ATOM 1637 CG ASP A 102 8.076 -9.756 12.598 1.00 0.00 C ATOM 1638 OD1 ASP A 102 7.351 -10.307 13.453 1.00 0.00 O ATOM 1639 OD2 ASP A 102 8.185 -10.166 11.424 1.00 0.00 O ATOM 0 H ASP A 102 8.163 -7.582 10.829 1.00 0.00 H new ATOM 0 HA ASP A 102 7.136 -7.339 13.486 1.00 0.00 H new ATOM 0 HB2 ASP A 102 9.756 -8.445 12.386 1.00 0.00 H new ATOM 0 HB3 ASP A 102 9.207 -8.646 14.038 1.00 0.00 H new ATOM 1644 N GLU A 103 9.103 -5.072 12.595 1.00 0.00 N ATOM 1645 CA GLU A 103 9.863 -3.893 13.002 1.00 0.00 C ATOM 1646 C GLU A 103 9.104 -2.609 12.675 1.00 0.00 C ATOM 1647 O GLU A 103 8.869 -1.776 13.552 1.00 0.00 O ATOM 1648 CB GLU A 103 11.231 -3.883 12.316 1.00 0.00 C ATOM 1649 CG GLU A 103 12.147 -2.771 12.800 1.00 0.00 C ATOM 1650 CD GLU A 103 13.509 -2.806 12.132 1.00 0.00 C ATOM 1651 OE1 GLU A 103 14.401 -3.518 12.641 1.00 0.00 O ATOM 1652 OE2 GLU A 103 13.683 -2.123 11.101 1.00 0.00 O ATOM 0 H GLU A 103 8.797 -5.062 11.622 1.00 0.00 H new ATOM 0 HA GLU A 103 10.005 -3.939 14.082 1.00 0.00 H new ATOM 0 HB2 GLU A 103 11.719 -4.843 12.484 1.00 0.00 H new ATOM 0 HB3 GLU A 103 11.088 -3.782 11.240 1.00 0.00 H new ATOM 0 HG2 GLU A 103 11.676 -1.807 12.607 1.00 0.00 H new ATOM 0 HG3 GLU A 103 12.273 -2.853 13.880 1.00 0.00 H new ATOM 1659 N VAL A 104 8.726 -2.451 11.410 1.00 0.00 N ATOM 1660 CA VAL A 104 7.998 -1.266 10.968 1.00 0.00 C ATOM 1661 C VAL A 104 6.610 -1.206 11.601 1.00 0.00 C ATOM 1662 O VAL A 104 6.103 -2.211 12.099 1.00 0.00 O ATOM 1663 CB VAL A 104 7.860 -1.234 9.430 1.00 0.00 C ATOM 1664 CG1 VAL A 104 6.805 -2.225 8.956 1.00 0.00 C ATOM 1665 CG2 VAL A 104 7.537 0.172 8.945 1.00 0.00 C ATOM 0 H VAL A 104 8.912 -3.130 10.672 1.00 0.00 H new ATOM 0 HA VAL A 104 8.574 -0.398 11.289 1.00 0.00 H new ATOM 0 HB VAL A 104 8.817 -1.530 9.001 1.00 0.00 H new ATOM 0 HG11 VAL A 104 6.728 -2.182 7.870 1.00 0.00 H new ATOM 0 HG12 VAL A 104 7.089 -3.232 9.260 1.00 0.00 H new ATOM 0 HG13 VAL A 104 5.842 -1.971 9.398 1.00 0.00 H new ATOM 0 HG21 VAL A 104 7.445 0.170 7.859 1.00 0.00 H new ATOM 0 HG22 VAL A 104 6.598 0.503 9.389 1.00 0.00 H new ATOM 0 HG23 VAL A 104 8.337 0.851 9.240 1.00 0.00 H new ATOM 1675 N ALA A 105 6.003 -0.022 11.584 1.00 0.00 N ATOM 1676 CA ALA A 105 4.674 0.162 12.153 1.00 0.00 C ATOM 1677 C ALA A 105 3.647 -0.698 11.424 1.00 0.00 C ATOM 1678 O ALA A 105 3.273 -0.406 10.287 1.00 0.00 O ATOM 1679 CB ALA A 105 4.271 1.629 12.094 1.00 0.00 C ATOM 0 H ALA A 105 6.411 0.822 11.183 1.00 0.00 H new ATOM 0 HA ALA A 105 4.704 -0.152 13.196 1.00 0.00 H new ATOM 0 HB1 ALA A 105 3.276 1.751 12.523 1.00 0.00 H new ATOM 0 HB2 ALA A 105 4.986 2.226 12.661 1.00 0.00 H new ATOM 0 HB3 ALA A 105 4.262 1.962 11.056 1.00 0.00 H new ATOM 1685 N GLY A 106 3.195 -1.758 12.086 1.00 0.00 N ATOM 1686 CA GLY A 106 2.217 -2.647 11.487 1.00 0.00 C ATOM 1687 C GLY A 106 0.901 -1.955 11.201 1.00 0.00 C ATOM 1688 O GLY A 106 0.197 -2.311 10.255 1.00 0.00 O ATOM 0 H GLY A 106 3.489 -2.017 13.028 1.00 0.00 H new ATOM 0 HA2 GLY A 106 2.620 -3.052 10.559 1.00 0.00 H new ATOM 0 HA3 GLY A 106 2.042 -3.491 12.154 1.00 0.00 H new ATOM 1692 N ASP A 107 0.568 -0.963 12.020 1.00 0.00 N ATOM 1693 CA ASP A 107 -0.677 -0.219 11.858 1.00 0.00 C ATOM 1694 C ASP A 107 -0.682 0.579 10.555 1.00 0.00 C ATOM 1695 O ASP A 107 -1.699 0.643 9.864 1.00 0.00 O ATOM 1696 CB ASP A 107 -0.892 0.723 13.045 1.00 0.00 C ATOM 1697 CG ASP A 107 -2.152 1.553 12.902 1.00 0.00 C ATOM 1698 OD1 ASP A 107 -3.247 1.026 13.193 1.00 0.00 O ATOM 1699 OD2 ASP A 107 -2.045 2.731 12.502 1.00 0.00 O ATOM 0 H ASP A 107 1.143 -0.655 12.804 1.00 0.00 H new ATOM 0 HA ASP A 107 -1.493 -0.941 11.819 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -0.947 0.139 13.964 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -0.032 1.386 13.140 1.00 0.00 H new ATOM 1704 N ILE A 108 0.454 1.186 10.223 1.00 0.00 N ATOM 1705 CA ILE A 108 0.562 1.981 9.004 1.00 0.00 C ATOM 1706 C ILE A 108 0.478 1.102 7.762 1.00 0.00 C ATOM 1707 O ILE A 108 -0.297 1.381 6.846 1.00 0.00 O ATOM 1708 CB ILE A 108 1.876 2.786 8.969 1.00 0.00 C ATOM 1709 CG1 ILE A 108 1.981 3.680 10.207 1.00 0.00 C ATOM 1710 CG2 ILE A 108 1.955 3.620 7.695 1.00 0.00 C ATOM 1711 CD1 ILE A 108 3.284 4.446 10.299 1.00 0.00 C ATOM 0 H ILE A 108 1.309 1.143 10.778 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.277 2.676 9.007 1.00 0.00 H new ATOM 0 HB ILE A 108 2.714 2.089 8.974 1.00 0.00 H new ATOM 0 HG12 ILE A 108 1.153 4.389 10.203 1.00 0.00 H new ATOM 0 HG13 ILE A 108 1.869 3.064 11.099 1.00 0.00 H new ATOM 0 HG21 ILE A 108 2.889 4.182 7.686 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.919 2.962 6.827 1.00 0.00 H new ATOM 0 HG23 ILE A 108 1.114 4.312 7.661 1.00 0.00 H new ATOM 0 HD11 ILE A 108 3.284 5.057 11.202 1.00 0.00 H new ATOM 0 HD12 ILE A 108 4.117 3.744 10.336 1.00 0.00 H new ATOM 0 HD13 ILE A 108 3.390 5.090 9.426 1.00 0.00 H new ATOM 1723 N PHE A 109 1.270 0.034 7.734 1.00 0.00 N ATOM 1724 CA PHE A 109 1.268 -0.877 6.596 1.00 0.00 C ATOM 1725 C PHE A 109 -0.075 -1.586 6.479 1.00 0.00 C ATOM 1726 O PHE A 109 -0.493 -1.961 5.383 1.00 0.00 O ATOM 1727 CB PHE A 109 2.400 -1.905 6.705 1.00 0.00 C ATOM 1728 CG PHE A 109 2.511 -2.795 5.495 1.00 0.00 C ATOM 1729 CD1 PHE A 109 2.444 -2.261 4.216 1.00 0.00 C ATOM 1730 CD2 PHE A 109 2.677 -4.163 5.637 1.00 0.00 C ATOM 1731 CE1 PHE A 109 2.539 -3.073 3.101 1.00 0.00 C ATOM 1732 CE2 PHE A 109 2.774 -4.981 4.527 1.00 0.00 C ATOM 1733 CZ PHE A 109 2.705 -4.436 3.258 1.00 0.00 C ATOM 0 H PHE A 109 1.917 -0.220 8.481 1.00 0.00 H new ATOM 0 HA PHE A 109 1.433 -0.284 5.697 1.00 0.00 H new ATOM 0 HB2 PHE A 109 3.345 -1.381 6.851 1.00 0.00 H new ATOM 0 HB3 PHE A 109 2.238 -2.522 7.589 1.00 0.00 H new ATOM 0 HD1 PHE A 109 2.316 -1.196 4.090 1.00 0.00 H new ATOM 0 HD2 PHE A 109 2.731 -4.595 6.625 1.00 0.00 H new ATOM 0 HE1 PHE A 109 2.484 -2.644 2.111 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.904 -6.046 4.651 1.00 0.00 H new ATOM 0 HZ PHE A 109 2.781 -5.075 2.390 1.00 0.00 H new ATOM 1743 N ASP A 110 -0.747 -1.766 7.615 1.00 0.00 N ATOM 1744 CA ASP A 110 -2.045 -2.436 7.644 1.00 0.00 C ATOM 1745 C ASP A 110 -2.979 -1.862 6.583 1.00 0.00 C ATOM 1746 O ASP A 110 -3.831 -2.569 6.044 1.00 0.00 O ATOM 1747 CB ASP A 110 -2.683 -2.298 9.028 1.00 0.00 C ATOM 1748 CG ASP A 110 -3.979 -3.076 9.147 1.00 0.00 C ATOM 1749 OD1 ASP A 110 -3.923 -4.267 9.520 1.00 0.00 O ATOM 1750 OD2 ASP A 110 -5.050 -2.496 8.871 1.00 0.00 O ATOM 0 H ASP A 110 -0.413 -1.457 8.528 1.00 0.00 H new ATOM 0 HA ASP A 110 -1.884 -3.492 7.428 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -1.981 -2.648 9.785 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -2.874 -1.245 9.234 1.00 0.00 H new ATOM 1755 N MET A 111 -2.814 -0.578 6.286 1.00 0.00 N ATOM 1756 CA MET A 111 -3.630 0.081 5.273 1.00 0.00 C ATOM 1757 C MET A 111 -3.217 -0.386 3.882 1.00 0.00 C ATOM 1758 O MET A 111 -4.052 -0.769 3.063 1.00 0.00 O ATOM 1759 CB MET A 111 -3.477 1.600 5.378 1.00 0.00 C ATOM 1760 CG MET A 111 -4.234 2.366 4.305 1.00 0.00 C ATOM 1761 SD MET A 111 -3.763 4.105 4.235 1.00 0.00 S ATOM 1762 CE MET A 111 -2.036 3.967 3.774 1.00 0.00 C ATOM 0 H MET A 111 -2.124 0.027 6.731 1.00 0.00 H new ATOM 0 HA MET A 111 -4.674 -0.182 5.440 1.00 0.00 H new ATOM 0 HB2 MET A 111 -3.826 1.925 6.358 1.00 0.00 H new ATOM 0 HB3 MET A 111 -2.419 1.855 5.316 1.00 0.00 H new ATOM 0 HG2 MET A 111 -4.050 1.904 3.335 1.00 0.00 H new ATOM 0 HG3 MET A 111 -5.304 2.290 4.496 1.00 0.00 H new ATOM 0 HE1 MET A 111 -1.798 4.721 3.023 1.00 0.00 H new ATOM 0 HE2 MET A 111 -1.411 4.121 4.654 1.00 0.00 H new ATOM 0 HE3 MET A 111 -1.847 2.975 3.364 1.00 0.00 H new ATOM 1772 N LEU A 112 -1.913 -0.356 3.637 1.00 0.00 N ATOM 1773 CA LEU A 112 -1.351 -0.764 2.358 1.00 0.00 C ATOM 1774 C LEU A 112 -1.591 -2.248 2.091 1.00 0.00 C ATOM 1775 O LEU A 112 -1.578 -2.686 0.943 1.00 0.00 O ATOM 1776 CB LEU A 112 0.147 -0.456 2.320 1.00 0.00 C ATOM 1777 CG LEU A 112 0.504 1.031 2.380 1.00 0.00 C ATOM 1778 CD1 LEU A 112 2.009 1.215 2.493 1.00 0.00 C ATOM 1779 CD2 LEU A 112 -0.030 1.760 1.156 1.00 0.00 C ATOM 0 H LEU A 112 -1.218 -0.049 4.318 1.00 0.00 H new ATOM 0 HA LEU A 112 -1.854 -0.198 1.574 1.00 0.00 H new ATOM 0 HB2 LEU A 112 0.628 -0.964 3.156 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.566 -0.878 1.407 1.00 0.00 H new ATOM 0 HG LEU A 112 0.037 1.459 3.267 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.243 2.279 2.534 1.00 0.00 H new ATOM 0 HD12 LEU A 112 2.368 0.729 3.400 1.00 0.00 H new ATOM 0 HD13 LEU A 112 2.496 0.770 1.626 1.00 0.00 H new ATOM 0 HD21 LEU A 112 0.234 2.816 1.217 1.00 0.00 H new ATOM 0 HD22 LEU A 112 0.407 1.328 0.256 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -1.115 1.659 1.117 1.00 0.00 H new ATOM 1791 N LEU A 113 -1.814 -3.016 3.157 1.00 0.00 N ATOM 1792 CA LEU A 113 -2.048 -4.453 3.032 1.00 0.00 C ATOM 1793 C LEU A 113 -3.116 -4.744 1.983 1.00 0.00 C ATOM 1794 O LEU A 113 -3.124 -5.814 1.374 1.00 0.00 O ATOM 1795 CB LEU A 113 -2.468 -5.055 4.377 1.00 0.00 C ATOM 1796 CG LEU A 113 -1.323 -5.360 5.347 1.00 0.00 C ATOM 1797 CD1 LEU A 113 -1.866 -5.908 6.658 1.00 0.00 C ATOM 1798 CD2 LEU A 113 -0.348 -6.348 4.726 1.00 0.00 C ATOM 0 H LEU A 113 -1.837 -2.667 4.115 1.00 0.00 H new ATOM 0 HA LEU A 113 -1.112 -4.913 2.715 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -3.160 -4.367 4.863 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -3.016 -5.978 4.187 1.00 0.00 H new ATOM 0 HG LEU A 113 -0.792 -4.431 5.553 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -1.038 -6.119 7.335 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -2.529 -5.172 7.113 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -2.421 -6.826 6.466 1.00 0.00 H new ATOM 0 HD21 LEU A 113 0.459 -6.553 5.429 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -0.870 -7.276 4.492 1.00 0.00 H new ATOM 0 HD23 LEU A 113 0.067 -5.924 3.811 1.00 0.00 H new ATOM 1810 N THR A 114 -4.017 -3.788 1.783 1.00 0.00 N ATOM 1811 CA THR A 114 -5.094 -3.932 0.808 1.00 0.00 C ATOM 1812 C THR A 114 -4.564 -4.223 -0.600 1.00 0.00 C ATOM 1813 O THR A 114 -5.346 -4.433 -1.527 1.00 0.00 O ATOM 1814 CB THR A 114 -5.967 -2.666 0.758 1.00 0.00 C ATOM 1815 OG1 THR A 114 -5.160 -1.524 0.444 1.00 0.00 O ATOM 1816 CG2 THR A 114 -6.672 -2.444 2.087 1.00 0.00 C ATOM 0 H THR A 114 -4.023 -2.900 2.286 1.00 0.00 H new ATOM 0 HA THR A 114 -5.693 -4.781 1.137 1.00 0.00 H new ATOM 0 HB THR A 114 -6.720 -2.802 -0.018 1.00 0.00 H new ATOM 0 HG1 THR A 114 -4.738 -1.187 1.262 1.00 0.00 H new ATOM 0 HG21 THR A 114 -7.283 -1.544 2.029 1.00 0.00 H new ATOM 0 HG22 THR A 114 -7.308 -3.301 2.309 1.00 0.00 H new ATOM 0 HG23 THR A 114 -5.930 -2.328 2.877 1.00 0.00 H new ATOM 1824 N PHE A 115 -3.241 -4.235 -0.759 1.00 0.00 N ATOM 1825 CA PHE A 115 -2.633 -4.506 -2.059 1.00 0.00 C ATOM 1826 C PHE A 115 -2.946 -5.926 -2.518 1.00 0.00 C ATOM 1827 O PHE A 115 -3.118 -6.177 -3.711 1.00 0.00 O ATOM 1828 CB PHE A 115 -1.113 -4.307 -2.002 1.00 0.00 C ATOM 1829 CG PHE A 115 -0.674 -2.866 -1.978 1.00 0.00 C ATOM 1830 CD1 PHE A 115 -1.322 -1.911 -2.748 1.00 0.00 C ATOM 1831 CD2 PHE A 115 0.396 -2.468 -1.189 1.00 0.00 C ATOM 1832 CE1 PHE A 115 -0.914 -0.591 -2.730 1.00 0.00 C ATOM 1833 CE2 PHE A 115 0.809 -1.150 -1.169 1.00 0.00 C ATOM 1834 CZ PHE A 115 0.153 -0.211 -1.940 1.00 0.00 C ATOM 0 H PHE A 115 -2.574 -4.061 -0.008 1.00 0.00 H new ATOM 0 HA PHE A 115 -3.055 -3.801 -2.775 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -0.727 -4.807 -1.114 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -0.662 -4.797 -2.865 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -2.156 -2.203 -3.369 1.00 0.00 H new ATOM 0 HD2 PHE A 115 0.912 -3.198 -0.583 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -1.429 0.142 -3.333 1.00 0.00 H new ATOM 0 HE2 PHE A 115 1.644 -0.854 -0.551 1.00 0.00 H new ATOM 0 HZ PHE A 115 0.474 0.820 -1.925 1.00 0.00 H new ATOM 1844 N THR A 116 -3.019 -6.853 -1.566 1.00 0.00 N ATOM 1845 CA THR A 116 -3.309 -8.249 -1.880 1.00 0.00 C ATOM 1846 C THR A 116 -4.186 -8.893 -0.810 1.00 0.00 C ATOM 1847 O THR A 116 -5.043 -9.721 -1.116 1.00 0.00 O ATOM 1848 CB THR A 116 -2.015 -9.074 -2.023 1.00 0.00 C ATOM 1849 OG1 THR A 116 -1.224 -8.955 -0.836 1.00 0.00 O ATOM 1850 CG2 THR A 116 -1.205 -8.614 -3.226 1.00 0.00 C ATOM 0 H THR A 116 -2.882 -6.663 -0.573 1.00 0.00 H new ATOM 0 HA THR A 116 -3.844 -8.248 -2.830 1.00 0.00 H new ATOM 0 HB THR A 116 -2.293 -10.117 -2.172 1.00 0.00 H new ATOM 0 HG1 THR A 116 -0.405 -9.484 -0.935 1.00 0.00 H new ATOM 0 HG21 THR A 116 -0.297 -9.212 -3.304 1.00 0.00 H new ATOM 0 HG22 THR A 116 -1.798 -8.735 -4.132 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.938 -7.564 -3.105 1.00 0.00 H new ATOM 1858 N ASP A 117 -3.963 -8.511 0.445 1.00 0.00 N ATOM 1859 CA ASP A 117 -4.731 -9.056 1.560 1.00 0.00 C ATOM 1860 C ASP A 117 -6.215 -8.732 1.413 1.00 0.00 C ATOM 1861 O ASP A 117 -6.679 -7.679 1.855 1.00 0.00 O ATOM 1862 CB ASP A 117 -4.202 -8.507 2.886 1.00 0.00 C ATOM 1863 CG ASP A 117 -2.756 -8.893 3.134 1.00 0.00 C ATOM 1864 OD1 ASP A 117 -1.860 -8.219 2.584 1.00 0.00 O ATOM 1865 OD2 ASP A 117 -2.521 -9.867 3.880 1.00 0.00 O ATOM 0 H ASP A 117 -3.257 -7.826 0.715 1.00 0.00 H new ATOM 0 HA ASP A 117 -4.616 -10.140 1.552 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -4.291 -7.421 2.888 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -4.820 -8.879 3.703 1.00 0.00 H new ATOM 1870 N PHE A 118 -6.954 -9.647 0.790 1.00 0.00 N ATOM 1871 CA PHE A 118 -8.386 -9.465 0.577 1.00 0.00 C ATOM 1872 C PHE A 118 -9.118 -9.312 1.905 1.00 0.00 C ATOM 1873 O PHE A 118 -10.170 -8.676 1.976 1.00 0.00 O ATOM 1874 CB PHE A 118 -8.960 -10.652 -0.200 1.00 0.00 C ATOM 1875 CG PHE A 118 -10.383 -10.455 -0.636 1.00 0.00 C ATOM 1876 CD1 PHE A 118 -10.672 -9.787 -1.814 1.00 0.00 C ATOM 1877 CD2 PHE A 118 -11.432 -10.935 0.133 1.00 0.00 C ATOM 1878 CE1 PHE A 118 -11.980 -9.601 -2.219 1.00 0.00 C ATOM 1879 CE2 PHE A 118 -12.743 -10.751 -0.267 1.00 0.00 C ATOM 1880 CZ PHE A 118 -13.016 -10.083 -1.445 1.00 0.00 C ATOM 0 H PHE A 118 -6.583 -10.524 0.423 1.00 0.00 H new ATOM 0 HA PHE A 118 -8.530 -8.554 -0.004 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -8.341 -10.833 -1.079 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -8.900 -11.545 0.422 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -9.866 -9.407 -2.423 1.00 0.00 H new ATOM 0 HD2 PHE A 118 -11.223 -11.458 1.054 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -12.191 -9.079 -3.140 1.00 0.00 H new ATOM 0 HE2 PHE A 118 -13.552 -11.129 0.341 1.00 0.00 H new ATOM 0 HZ PHE A 118 -14.039 -9.938 -1.760 1.00 0.00 H new ATOM 1890 N LEU A 119 -8.556 -9.899 2.957 1.00 0.00 N ATOM 1891 CA LEU A 119 -9.156 -9.827 4.283 1.00 0.00 C ATOM 1892 C LEU A 119 -9.186 -8.389 4.789 1.00 0.00 C ATOM 1893 O LEU A 119 -10.166 -7.954 5.392 1.00 0.00 O ATOM 1894 CB LEU A 119 -8.382 -10.709 5.268 1.00 0.00 C ATOM 1895 CG LEU A 119 -8.349 -12.200 4.922 1.00 0.00 C ATOM 1896 CD1 LEU A 119 -7.404 -12.941 5.856 1.00 0.00 C ATOM 1897 CD2 LEU A 119 -9.748 -12.797 4.995 1.00 0.00 C ATOM 0 H LEU A 119 -7.686 -10.430 2.916 1.00 0.00 H new ATOM 0 HA LEU A 119 -10.181 -10.190 4.209 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -7.357 -10.344 5.329 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -8.822 -10.592 6.258 1.00 0.00 H new ATOM 0 HG LEU A 119 -7.982 -12.309 3.901 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -7.392 -14.000 5.597 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -6.399 -12.532 5.756 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -7.743 -12.823 6.885 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -9.705 -13.857 4.746 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -10.143 -12.677 6.004 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -10.400 -12.284 4.287 1.00 0.00 H new ATOM 1909 N ALA A 120 -8.106 -7.656 4.537 1.00 0.00 N ATOM 1910 CA ALA A 120 -8.009 -6.268 4.969 1.00 0.00 C ATOM 1911 C ALA A 120 -8.840 -5.354 4.076 1.00 0.00 C ATOM 1912 O ALA A 120 -9.361 -4.336 4.527 1.00 0.00 O ATOM 1913 CB ALA A 120 -6.555 -5.822 4.979 1.00 0.00 C ATOM 0 H ALA A 120 -7.287 -8.001 4.036 1.00 0.00 H new ATOM 0 HA ALA A 120 -8.407 -6.199 5.981 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -6.495 -4.783 5.303 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -5.987 -6.450 5.665 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -6.140 -5.913 3.975 1.00 0.00 H new ATOM 1919 N PHE A 121 -8.958 -5.729 2.807 1.00 0.00 N ATOM 1920 CA PHE A 121 -9.720 -4.946 1.842 1.00 0.00 C ATOM 1921 C PHE A 121 -11.203 -4.928 2.208 1.00 0.00 C ATOM 1922 O PHE A 121 -11.808 -3.862 2.354 1.00 0.00 O ATOM 1923 CB PHE A 121 -9.526 -5.528 0.436 1.00 0.00 C ATOM 1924 CG PHE A 121 -9.766 -4.548 -0.681 1.00 0.00 C ATOM 1925 CD1 PHE A 121 -9.202 -3.281 -0.647 1.00 0.00 C ATOM 1926 CD2 PHE A 121 -10.549 -4.898 -1.770 1.00 0.00 C ATOM 1927 CE1 PHE A 121 -9.414 -2.384 -1.677 1.00 0.00 C ATOM 1928 CE2 PHE A 121 -10.764 -4.005 -2.804 1.00 0.00 C ATOM 1929 CZ PHE A 121 -10.196 -2.746 -2.757 1.00 0.00 C ATOM 0 H PHE A 121 -8.534 -6.573 2.422 1.00 0.00 H new ATOM 0 HA PHE A 121 -9.355 -3.919 1.859 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -8.510 -5.914 0.353 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -10.200 -6.375 0.311 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -8.590 -2.992 0.195 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -10.997 -5.880 -1.812 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -8.969 -1.401 -1.638 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -11.375 -4.291 -3.647 1.00 0.00 H new ATOM 0 HZ PHE A 121 -10.363 -2.047 -3.563 1.00 0.00 H new ATOM 1939 N LYS A 122 -11.780 -6.116 2.370 1.00 0.00 N ATOM 1940 CA LYS A 122 -13.190 -6.244 2.720 1.00 0.00 C ATOM 1941 C LYS A 122 -13.464 -5.665 4.106 1.00 0.00 C ATOM 1942 O LYS A 122 -14.434 -4.935 4.301 1.00 0.00 O ATOM 1943 CB LYS A 122 -13.617 -7.714 2.668 1.00 0.00 C ATOM 1944 CG LYS A 122 -15.085 -7.940 2.998 1.00 0.00 C ATOM 1945 CD LYS A 122 -15.434 -9.420 2.995 1.00 0.00 C ATOM 1946 CE LYS A 122 -16.908 -9.646 3.294 1.00 0.00 C ATOM 1947 NZ LYS A 122 -17.785 -9.006 2.274 1.00 0.00 N ATOM 0 H LYS A 122 -11.291 -7.005 2.264 1.00 0.00 H new ATOM 0 HA LYS A 122 -13.773 -5.679 1.993 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -13.414 -8.106 1.672 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -13.005 -8.285 3.366 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -15.309 -7.514 3.976 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -15.707 -7.417 2.272 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -15.188 -9.851 2.024 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -14.827 -9.939 3.737 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -17.112 -10.716 3.328 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -17.144 -9.245 4.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -18.585 -9.636 2.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -18.145 -8.103 2.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -17.239 -8.832 1.406 1.00 0.00 H new ATOM 1961 N GLU A 123 -12.603 -5.996 5.064 1.00 0.00 N ATOM 1962 CA GLU A 123 -12.758 -5.509 6.432 1.00 0.00 C ATOM 1963 C GLU A 123 -12.681 -3.986 6.486 1.00 0.00 C ATOM 1964 O GLU A 123 -13.333 -3.353 7.317 1.00 0.00 O ATOM 1965 CB GLU A 123 -11.684 -6.117 7.337 1.00 0.00 C ATOM 1966 CG GLU A 123 -11.808 -5.701 8.795 1.00 0.00 C ATOM 1967 CD GLU A 123 -13.122 -6.135 9.415 1.00 0.00 C ATOM 1968 OE1 GLU A 123 -13.199 -7.284 9.900 1.00 0.00 O ATOM 1969 OE2 GLU A 123 -14.074 -5.327 9.414 1.00 0.00 O ATOM 0 H GLU A 123 -11.792 -6.598 4.919 1.00 0.00 H new ATOM 0 HA GLU A 123 -13.742 -5.815 6.787 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -11.739 -7.204 7.272 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -10.701 -5.825 6.967 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -10.983 -6.131 9.363 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -11.716 -4.617 8.869 1.00 0.00 H new ATOM 1976 N MET A 124 -11.881 -3.404 5.597 1.00 0.00 N ATOM 1977 CA MET A 124 -11.720 -1.954 5.550 1.00 0.00 C ATOM 1978 C MET A 124 -13.025 -1.269 5.161 1.00 0.00 C ATOM 1979 O MET A 124 -13.445 -0.303 5.801 1.00 0.00 O ATOM 1980 CB MET A 124 -10.618 -1.572 4.559 1.00 0.00 C ATOM 1981 CG MET A 124 -10.392 -0.072 4.444 1.00 0.00 C ATOM 1982 SD MET A 124 -9.100 0.347 3.257 1.00 0.00 S ATOM 1983 CE MET A 124 -9.839 -0.231 1.732 1.00 0.00 C ATOM 0 H MET A 124 -11.335 -3.913 4.901 1.00 0.00 H new ATOM 0 HA MET A 124 -11.438 -1.617 6.547 1.00 0.00 H new ATOM 0 HB2 MET A 124 -9.686 -2.049 4.864 1.00 0.00 H new ATOM 0 HB3 MET A 124 -10.872 -1.969 3.576 1.00 0.00 H new ATOM 0 HG2 MET A 124 -11.323 0.410 4.147 1.00 0.00 H new ATOM 0 HG3 MET A 124 -10.125 0.327 5.422 1.00 0.00 H new ATOM 0 HE1 MET A 124 -9.569 0.442 0.919 1.00 0.00 H new ATOM 0 HE2 MET A 124 -9.475 -1.234 1.509 1.00 0.00 H new ATOM 0 HE3 MET A 124 -10.923 -0.254 1.839 1.00 0.00 H new ATOM 1993 N PHE A 125 -13.665 -1.772 4.109 1.00 0.00 N ATOM 1994 CA PHE A 125 -14.921 -1.201 3.636 1.00 0.00 C ATOM 1995 C PHE A 125 -16.054 -1.443 4.629 1.00 0.00 C ATOM 1996 O PHE A 125 -16.796 -0.523 4.972 1.00 0.00 O ATOM 1997 CB PHE A 125 -15.288 -1.782 2.270 1.00 0.00 C ATOM 1998 CG PHE A 125 -14.292 -1.450 1.195 1.00 0.00 C ATOM 1999 CD1 PHE A 125 -13.938 -0.135 0.943 1.00 0.00 C ATOM 2000 CD2 PHE A 125 -13.709 -2.454 0.441 1.00 0.00 C ATOM 2001 CE1 PHE A 125 -13.020 0.173 -0.042 1.00 0.00 C ATOM 2002 CE2 PHE A 125 -12.790 -2.152 -0.545 1.00 0.00 C ATOM 2003 CZ PHE A 125 -12.444 -0.837 -0.787 1.00 0.00 C ATOM 0 H PHE A 125 -13.335 -2.572 3.569 1.00 0.00 H new ATOM 0 HA PHE A 125 -14.780 -0.124 3.541 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -15.373 -2.865 2.355 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -16.268 -1.408 1.975 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -14.385 0.659 1.523 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -13.976 -3.484 0.626 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -12.753 1.203 -0.229 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -12.342 -2.944 -1.127 1.00 0.00 H new ATOM 0 HZ PHE A 125 -11.725 -0.599 -1.557 1.00 0.00 H new ATOM 2013 N LEU A 126 -16.184 -2.686 5.085 1.00 0.00 N ATOM 2014 CA LEU A 126 -17.231 -3.044 6.038 1.00 0.00 C ATOM 2015 C LEU A 126 -17.124 -2.210 7.312 1.00 0.00 C ATOM 2016 O LEU A 126 -18.133 -1.874 7.931 1.00 0.00 O ATOM 2017 CB LEU A 126 -17.154 -4.537 6.375 1.00 0.00 C ATOM 2018 CG LEU A 126 -17.970 -5.454 5.460 1.00 0.00 C ATOM 2019 CD1 LEU A 126 -17.513 -5.327 4.014 1.00 0.00 C ATOM 2020 CD2 LEU A 126 -17.867 -6.899 5.925 1.00 0.00 C ATOM 0 H LEU A 126 -15.579 -3.460 4.811 1.00 0.00 H new ATOM 0 HA LEU A 126 -18.195 -2.834 5.575 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -16.110 -4.848 6.338 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -17.493 -4.680 7.401 1.00 0.00 H new ATOM 0 HG LEU A 126 -19.014 -5.144 5.514 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -18.108 -5.989 3.385 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -17.641 -4.297 3.681 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -16.462 -5.604 3.939 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -18.453 -7.537 5.263 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -16.824 -7.215 5.903 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -18.250 -6.982 6.942 1.00 0.00 H new ATOM 2032 N ASP A 127 -15.896 -1.877 7.698 1.00 0.00 N ATOM 2033 CA ASP A 127 -15.663 -1.076 8.895 1.00 0.00 C ATOM 2034 C ASP A 127 -16.146 0.356 8.689 1.00 0.00 C ATOM 2035 O ASP A 127 -16.829 0.921 9.545 1.00 0.00 O ATOM 2036 CB ASP A 127 -14.176 -1.079 9.257 1.00 0.00 C ATOM 2037 CG ASP A 127 -13.869 -0.202 10.454 1.00 0.00 C ATOM 2038 OD1 ASP A 127 -13.958 -0.703 11.595 1.00 0.00 O ATOM 2039 OD2 ASP A 127 -13.542 0.986 10.252 1.00 0.00 O ATOM 0 H ASP A 127 -15.048 -2.149 7.200 1.00 0.00 H new ATOM 0 HA ASP A 127 -16.228 -1.519 9.715 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -13.859 -2.100 9.468 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -13.596 -0.735 8.400 1.00 0.00 H new ATOM 2044 N TYR A 128 -15.787 0.937 7.548 1.00 0.00 N ATOM 2045 CA TYR A 128 -16.184 2.302 7.222 1.00 0.00 C ATOM 2046 C TYR A 128 -17.701 2.417 7.137 1.00 0.00 C ATOM 2047 O TYR A 128 -18.275 3.452 7.478 1.00 0.00 O ATOM 2048 CB TYR A 128 -15.549 2.736 5.898 1.00 0.00 C ATOM 2049 CG TYR A 128 -15.880 4.156 5.495 1.00 0.00 C ATOM 2050 CD1 TYR A 128 -15.335 5.238 6.176 1.00 0.00 C ATOM 2051 CD2 TYR A 128 -16.734 4.415 4.429 1.00 0.00 C ATOM 2052 CE1 TYR A 128 -15.632 6.537 5.806 1.00 0.00 C ATOM 2053 CE2 TYR A 128 -17.035 5.710 4.054 1.00 0.00 C ATOM 2054 CZ TYR A 128 -16.482 6.767 4.744 1.00 0.00 C ATOM 2055 OH TYR A 128 -16.779 8.059 4.373 1.00 0.00 O ATOM 0 H TYR A 128 -15.220 0.482 6.832 1.00 0.00 H new ATOM 0 HA TYR A 128 -15.832 2.960 8.017 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -14.467 2.634 5.975 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -15.878 2.059 5.110 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -14.669 5.062 7.008 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -17.169 3.590 3.885 1.00 0.00 H new ATOM 0 HE1 TYR A 128 -15.201 7.367 6.346 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -17.701 5.893 3.224 1.00 0.00 H new ATOM 0 HH TYR A 128 -17.390 8.047 3.607 1.00 0.00 H new ATOM 2065 N ARG A 129 -18.345 1.348 6.678 1.00 0.00 N ATOM 2066 CA ARG A 129 -19.797 1.326 6.545 1.00 0.00 C ATOM 2067 C ARG A 129 -20.472 1.418 7.910 1.00 0.00 C ATOM 2068 O ARG A 129 -21.411 2.192 8.098 1.00 0.00 O ATOM 2069 CB ARG A 129 -20.244 0.048 5.829 1.00 0.00 C ATOM 2070 CG ARG A 129 -21.750 -0.047 5.637 1.00 0.00 C ATOM 2071 CD ARG A 129 -22.149 -1.369 5.002 1.00 0.00 C ATOM 2072 NE ARG A 129 -21.779 -2.509 5.835 1.00 0.00 N ATOM 2073 CZ ARG A 129 -21.821 -3.772 5.419 1.00 0.00 C ATOM 2074 NH1 ARG A 129 -22.218 -4.056 4.184 1.00 0.00 N ATOM 2075 NH2 ARG A 129 -21.470 -4.754 6.238 1.00 0.00 N ATOM 0 H ARG A 129 -17.883 0.485 6.392 1.00 0.00 H new ATOM 0 HA ARG A 129 -20.095 2.192 5.954 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -19.758 -0.002 4.855 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -19.904 -0.816 6.399 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -22.248 0.060 6.601 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -22.090 0.777 5.009 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -23.225 -1.379 4.831 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -21.671 -1.462 4.027 1.00 0.00 H new ATOM 0 HE ARG A 129 -21.471 -2.327 6.790 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -22.492 -3.305 3.551 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -22.249 -5.025 3.868 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -21.167 -4.542 7.189 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -21.503 -5.722 5.917 1.00 0.00 H new ATOM 2089 N ALA A 130 -19.988 0.623 8.859 1.00 0.00 N ATOM 2090 CA ALA A 130 -20.545 0.615 10.207 1.00 0.00 C ATOM 2091 C ALA A 130 -20.364 1.968 10.886 1.00 0.00 C ATOM 2092 O ALA A 130 -21.191 2.380 11.700 1.00 0.00 O ATOM 2093 CB ALA A 130 -19.900 -0.486 11.035 1.00 0.00 C ATOM 0 H ALA A 130 -19.212 -0.024 8.720 1.00 0.00 H new ATOM 0 HA ALA A 130 -21.615 0.419 10.131 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -20.324 -0.482 12.039 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -20.088 -1.452 10.566 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -18.825 -0.314 11.094 1.00 0.00 H new ATOM 2099 N GLU A 131 -19.280 2.657 10.546 1.00 0.00 N ATOM 2100 CA GLU A 131 -18.995 3.964 11.128 1.00 0.00 C ATOM 2101 C GLU A 131 -20.014 5.000 10.663 1.00 0.00 C ATOM 2102 O GLU A 131 -20.211 6.027 11.314 1.00 0.00 O ATOM 2103 CB GLU A 131 -17.580 4.413 10.753 1.00 0.00 C ATOM 2104 CG GLU A 131 -17.153 5.706 11.429 1.00 0.00 C ATOM 2105 CD GLU A 131 -15.714 6.075 11.129 1.00 0.00 C ATOM 2106 OE1 GLU A 131 -15.476 6.757 10.110 1.00 0.00 O ATOM 2107 OE2 GLU A 131 -14.825 5.683 11.914 1.00 0.00 O ATOM 0 H GLU A 131 -18.586 2.334 9.872 1.00 0.00 H new ATOM 0 HA GLU A 131 -19.065 3.877 12.212 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -16.875 3.625 11.018 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.523 4.542 9.672 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -17.807 6.515 11.103 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -17.281 5.607 12.507 1.00 0.00 H new ATOM 2114 N LYS A 132 -20.662 4.721 9.537 1.00 0.00 N ATOM 2115 CA LYS A 132 -21.661 5.629 8.982 1.00 0.00 C ATOM 2116 C LYS A 132 -22.885 5.716 9.887 1.00 0.00 C ATOM 2117 O LYS A 132 -23.638 6.689 9.835 1.00 0.00 O ATOM 2118 CB LYS A 132 -22.080 5.170 7.584 1.00 0.00 C ATOM 2119 CG LYS A 132 -20.929 5.111 6.590 1.00 0.00 C ATOM 2120 CD LYS A 132 -20.368 6.494 6.295 1.00 0.00 C ATOM 2121 CE LYS A 132 -21.362 7.350 5.526 1.00 0.00 C ATOM 2122 NZ LYS A 132 -20.827 8.712 5.253 1.00 0.00 N ATOM 0 H LYS A 132 -20.514 3.873 8.990 1.00 0.00 H new ATOM 0 HA LYS A 132 -21.212 6.620 8.913 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -22.537 4.183 7.657 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -22.844 5.847 7.202 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -20.138 4.475 6.987 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -21.272 4.652 5.663 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -20.109 6.989 7.231 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -19.448 6.398 5.719 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -21.609 6.861 4.583 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -22.288 7.431 6.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -21.534 9.264 4.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -20.615 9.188 6.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -19.957 8.636 4.688 1.00 0.00 H new ATOM 2136 N GLU A 133 -23.082 4.694 10.715 1.00 0.00 N ATOM 2137 CA GLU A 133 -24.220 4.660 11.626 1.00 0.00 C ATOM 2138 C GLU A 133 -24.067 5.705 12.727 1.00 0.00 C ATOM 2139 O GLU A 133 -25.053 6.148 13.317 1.00 0.00 O ATOM 2140 CB GLU A 133 -24.370 3.269 12.245 1.00 0.00 C ATOM 2141 CG GLU A 133 -24.611 2.170 11.223 1.00 0.00 C ATOM 2142 CD GLU A 133 -25.885 2.380 10.428 1.00 0.00 C ATOM 2143 OE1 GLU A 133 -26.955 1.938 10.894 1.00 0.00 O ATOM 2144 OE2 GLU A 133 -25.811 2.987 9.339 1.00 0.00 O ATOM 0 H GLU A 133 -22.469 3.881 10.773 1.00 0.00 H new ATOM 0 HA GLU A 133 -25.117 4.890 11.051 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -23.470 3.034 12.813 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -25.199 3.283 12.953 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -23.764 2.124 10.539 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -24.661 1.209 11.734 1.00 0.00 H new ATOM 2151 N GLY A 134 -22.824 6.094 12.998 1.00 0.00 N ATOM 2152 CA GLY A 134 -22.563 7.084 14.027 1.00 0.00 C ATOM 2153 C GLY A 134 -21.751 6.523 15.179 1.00 0.00 C ATOM 2154 O GLY A 134 -20.869 7.196 15.712 1.00 0.00 O ATOM 0 H GLY A 134 -21.993 5.741 12.523 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -22.031 7.928 13.588 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -23.510 7.467 14.407 1.00 0.00 H new ATOM 2158 N ARG A 135 -22.052 5.286 15.562 1.00 0.00 N ATOM 2159 CA ARG A 135 -21.346 4.629 16.657 1.00 0.00 C ATOM 2160 C ARG A 135 -21.087 3.162 16.329 1.00 0.00 C ATOM 2161 O ARG A 135 -20.122 2.568 16.811 1.00 0.00 O ATOM 2162 CB ARG A 135 -22.154 4.742 17.953 1.00 0.00 C ATOM 2163 CG ARG A 135 -21.488 4.077 19.147 1.00 0.00 C ATOM 2164 CD ARG A 135 -22.344 4.190 20.400 1.00 0.00 C ATOM 2165 NE ARG A 135 -21.748 3.490 21.535 1.00 0.00 N ATOM 2166 CZ ARG A 135 -22.319 3.406 22.734 1.00 0.00 C ATOM 2167 NH1 ARG A 135 -23.496 3.978 22.953 1.00 0.00 N ATOM 2168 NH2 ARG A 135 -21.713 2.749 23.713 1.00 0.00 N ATOM 0 H ARG A 135 -22.781 4.718 15.130 1.00 0.00 H new ATOM 0 HA ARG A 135 -20.386 5.128 16.793 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -22.317 5.796 18.179 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -23.136 4.294 17.799 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -21.305 3.026 18.924 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -20.517 4.538 19.326 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -22.479 5.242 20.653 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -23.334 3.780 20.201 1.00 0.00 H new ATOM 0 HE ARG A 135 -20.843 3.040 21.401 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -23.965 4.483 22.201 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -23.932 3.912 23.873 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -20.809 2.308 23.547 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -22.151 2.685 24.632 1.00 0.00 H new ATOM 2182 N GLY A 136 -21.955 2.584 15.505 1.00 0.00 N ATOM 2183 CA GLY A 136 -21.807 1.191 15.126 1.00 0.00 C ATOM 2184 C GLY A 136 -23.023 0.360 15.484 1.00 0.00 C ATOM 2185 O GLY A 136 -23.936 0.248 14.638 1.00 0.00 O ATOM 2186 OXT GLY A 136 -23.065 -0.178 16.611 1.00 0.00 O ATOM 0 H GLY A 136 -22.759 3.056 15.092 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -21.630 1.127 14.052 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -20.929 0.775 15.619 1.00 0.00 H new TER 2190 GLY A 136