USER MOD reduce.3.24.130724 H: found=0, std=0, add=1145, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1148 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 2 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 99 ASN : amide:sc= -6.56! C(o=-8.2!,f=-13!) USER MOD Set 1.3: A 102 MET CE :methyl 153:sc= -1.61 (180deg=-3.27!) USER MOD Set 2.1: A 28 THR OG1 : rot 180:sc= -2.93! USER MOD Set 2.2: A 39 THR OG1 : rot 160:sc= -5.57! USER MOD Set 3.1: A 3 HIS : no HD1:sc= -2.13 K(o=-2.1,f=-3.9!) USER MOD Set 3.2: A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 154:sc= -0.786 (180deg=-2.22!) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot -129:sc= -1.03 USER MOD Single : A 32 THR OG1 : rot 74:sc= -0.256 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 HIS : no HD1:sc= -1.31 K(o=-1.3,f=-2.4) USER MOD Single : A 43 SER OG : rot 180:sc= 0.0366 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -6.99! C(o=-7!,f=-14!) USER MOD Single : A 51 THR OG1 : rot -64:sc= 1.88 USER MOD Single : A 54 SER OG : rot 180:sc= -0.0131 USER MOD Single : A 55 SER OG : rot 170:sc= 0.0198 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 MET CE :methyl -119:sc= -0.0802 (180deg=-0.389) USER MOD Single : A 59 MET CE :methyl 177:sc= -9.48! (180deg=-9.88!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0.087) USER MOD Single : A 78 ASN : amide:sc= -0.0318 X(o=-0.032,f=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 HIS : no HD1:sc= -0.0044 X(o=-0.0044,f=0) USER MOD Single : A 88 MET CE :methyl 139:sc= -3.34 (180deg=-8.16!) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= -0.155 X(o=-0.16,f=-0.16) USER MOD Single : A 93 ASN :FLIP amide:sc= -0.505 F(o=-1.1,f=-0.51) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.0112 USER MOD Single : A 97 MET CE :methyl -157:sc= -0.118 (180deg=-0.625) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 GLN : amide:sc= -0.326 K(o=-0.33,f=-2.5!) USER MOD Single : A 106 GLN : amide:sc= -0.16 X(o=-0.16,f=0) USER MOD Single : A 109 SER OG : rot 95:sc= 0.0718 USER MOD Single : A 111 TYR OH : rot 180:sc= -1.55! USER MOD Single : A 112 LYS NZ :NH3+ 169:sc= -0.972 (180deg=-1.26) USER MOD Single : B 458 THR OG1 : rot 180:sc= 0 USER MOD Single : B 460 HIS : no HD1:sc= 0 X(o=0,f=-0.016) USER MOD Single : B 462 SER OG : rot 61:sc= 1.22 USER MOD Single : B 465 TYR OH : rot 180:sc= 0 USER MOD Single : B 470 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 477 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 478 MET CE :methyl -139:sc= -2.09! (180deg=-3.76!) USER MOD Single : B 480 THR OG1 : rot 180:sc= 0 USER MOD Single : B 488 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 -7.334 13.638 13.163 1.00 0.00 N ATOM 2 CA PRO A 1 -6.706 13.935 11.849 1.00 0.00 C ATOM 3 C PRO A 1 -5.296 13.360 11.750 1.00 0.00 C ATOM 4 O PRO A 1 -4.834 12.997 10.668 1.00 0.00 O ATOM 5 CB PRO A 1 -6.674 15.453 11.690 1.00 0.00 C ATOM 6 CG PRO A 1 -7.336 15.974 12.924 1.00 0.00 C ATOM 7 CD PRO A 1 -7.252 14.874 13.956 1.00 0.00 C ATOM 0 H2 PRO A 1 -6.849 12.873 13.632 1.00 0.00 H new ATOM 0 H3 PRO A 1 -8.304 13.347 13.044 1.00 0.00 H new ATOM 0 HA PRO A 1 -7.288 13.470 11.053 1.00 0.00 H new ATOM 0 HB2 PRO A 1 -5.652 15.821 11.603 1.00 0.00 H new ATOM 0 HB3 PRO A 1 -7.204 15.769 10.792 1.00 0.00 H new ATOM 0 HG2 PRO A 1 -6.839 16.877 13.279 1.00 0.00 H new ATOM 0 HG3 PRO A 1 -8.374 16.239 12.724 1.00 0.00 H new ATOM 0 HD2 PRO A 1 -6.321 14.926 14.520 1.00 0.00 H new ATOM 0 HD3 PRO A 1 -8.066 14.940 14.678 1.00 0.00 H new ATOM 17 N SER A 2 -4.622 13.283 12.887 1.00 0.00 N ATOM 18 CA SER A 2 -3.264 12.754 12.941 1.00 0.00 C ATOM 19 C SER A 2 -3.249 11.260 12.634 1.00 0.00 C ATOM 20 O SER A 2 -2.276 10.738 12.090 1.00 0.00 O ATOM 21 CB SER A 2 -2.650 13.010 14.318 1.00 0.00 C ATOM 22 OG SER A 2 -2.003 14.270 14.363 1.00 0.00 O ATOM 0 H SER A 2 -4.993 13.581 13.789 1.00 0.00 H new ATOM 0 HA SER A 2 -2.670 13.267 12.185 1.00 0.00 H new ATOM 0 HB2 SER A 2 -3.429 12.970 15.080 1.00 0.00 H new ATOM 0 HB3 SER A 2 -1.934 12.222 14.553 1.00 0.00 H new ATOM 0 HG SER A 2 -1.621 14.410 15.254 1.00 0.00 H new ATOM 28 N HIS A 3 -4.333 10.576 12.987 1.00 0.00 N ATOM 29 CA HIS A 3 -4.444 9.140 12.749 1.00 0.00 C ATOM 30 C HIS A 3 -5.726 8.801 12.004 1.00 0.00 C ATOM 31 O HIS A 3 -6.199 7.667 12.031 1.00 0.00 O ATOM 32 CB HIS A 3 -4.368 8.357 14.060 1.00 0.00 C ATOM 33 CG HIS A 3 -3.393 8.920 15.048 1.00 0.00 C ATOM 34 ND1 HIS A 3 -3.471 10.208 15.535 1.00 0.00 N ATOM 35 CD2 HIS A 3 -2.311 8.361 15.641 1.00 0.00 C ATOM 36 CE1 HIS A 3 -2.481 10.417 16.384 1.00 0.00 C ATOM 37 NE2 HIS A 3 -1.763 9.312 16.466 1.00 0.00 N ATOM 0 H HIS A 3 -5.147 10.992 13.439 1.00 0.00 H new ATOM 0 HA HIS A 3 -3.600 8.847 12.124 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -5.358 8.333 14.515 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -4.093 7.325 13.840 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -1.947 7.355 15.493 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -2.291 11.335 16.920 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -0.935 9.185 17.048 1.00 0.00 H new ATOM 46 N SER A 4 -6.278 9.796 11.342 1.00 0.00 N ATOM 47 CA SER A 4 -7.506 9.622 10.578 1.00 0.00 C ATOM 48 C SER A 4 -7.493 10.511 9.344 1.00 0.00 C ATOM 49 O SER A 4 -6.934 11.608 9.363 1.00 0.00 O ATOM 50 CB SER A 4 -8.727 9.941 11.442 1.00 0.00 C ATOM 51 OG SER A 4 -8.496 11.081 12.251 1.00 0.00 O ATOM 0 H SER A 4 -5.896 10.742 11.315 1.00 0.00 H new ATOM 0 HA SER A 4 -7.567 8.581 10.261 1.00 0.00 H new ATOM 0 HB2 SER A 4 -9.593 10.114 10.803 1.00 0.00 H new ATOM 0 HB3 SER A 4 -8.963 9.085 12.074 1.00 0.00 H new ATOM 0 HG SER A 4 -9.292 11.265 12.792 1.00 0.00 H new ATOM 57 N GLY A 5 -8.105 10.032 8.270 1.00 0.00 N ATOM 58 CA GLY A 5 -8.142 10.798 7.045 1.00 0.00 C ATOM 59 C GLY A 5 -9.050 10.178 6.009 1.00 0.00 C ATOM 60 O GLY A 5 -9.568 9.082 6.209 1.00 0.00 O ATOM 0 H GLY A 5 -8.575 9.128 8.227 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -8.481 11.811 7.262 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -7.134 10.879 6.639 1.00 0.00 H new ATOM 64 N ALA A 6 -9.247 10.880 4.903 1.00 0.00 N ATOM 65 CA ALA A 6 -10.103 10.389 3.835 1.00 0.00 C ATOM 66 C ALA A 6 -9.288 9.975 2.615 1.00 0.00 C ATOM 67 O ALA A 6 -8.516 10.765 2.071 1.00 0.00 O ATOM 68 CB ALA A 6 -11.126 11.449 3.453 1.00 0.00 C ATOM 0 H ALA A 6 -8.826 11.791 4.722 1.00 0.00 H new ATOM 0 HA ALA A 6 -10.626 9.506 4.202 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -11.761 11.070 2.652 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -11.741 11.691 4.320 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -10.610 12.347 3.112 1.00 0.00 H new ATOM 74 N ALA A 7 -9.473 8.731 2.190 1.00 0.00 N ATOM 75 CA ALA A 7 -8.770 8.200 1.031 1.00 0.00 C ATOM 76 C ALA A 7 -9.674 7.260 0.248 1.00 0.00 C ATOM 77 O ALA A 7 -10.560 6.621 0.817 1.00 0.00 O ATOM 78 CB ALA A 7 -7.502 7.479 1.463 1.00 0.00 C ATOM 0 H ALA A 7 -10.108 8.068 2.635 1.00 0.00 H new ATOM 0 HA ALA A 7 -8.491 9.032 0.384 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -6.988 7.088 0.585 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -6.847 8.176 1.986 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -7.761 6.655 2.129 1.00 0.00 H new ATOM 84 N ILE A 8 -9.451 7.174 -1.056 1.00 0.00 N ATOM 85 CA ILE A 8 -10.254 6.306 -1.901 1.00 0.00 C ATOM 86 C ILE A 8 -9.685 4.888 -1.910 1.00 0.00 C ATOM 87 O ILE A 8 -8.520 4.677 -2.247 1.00 0.00 O ATOM 88 CB ILE A 8 -10.350 6.854 -3.348 1.00 0.00 C ATOM 89 CG1 ILE A 8 -11.789 6.734 -3.866 1.00 0.00 C ATOM 90 CG2 ILE A 8 -9.383 6.133 -4.275 1.00 0.00 C ATOM 91 CD1 ILE A 8 -11.926 5.914 -5.134 1.00 0.00 C ATOM 0 H ILE A 8 -8.724 7.693 -1.549 1.00 0.00 H new ATOM 0 HA ILE A 8 -11.261 6.280 -1.484 1.00 0.00 H new ATOM 0 HB ILE A 8 -10.070 7.907 -3.332 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -12.407 6.286 -3.088 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -12.182 7.734 -4.049 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -9.474 6.539 -5.282 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -8.363 6.274 -3.917 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -9.619 5.069 -4.290 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -12.974 5.878 -5.433 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -11.337 6.372 -5.929 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -11.566 4.901 -4.953 1.00 0.00 H new ATOM 103 N PHE A 9 -10.512 3.925 -1.535 1.00 0.00 N ATOM 104 CA PHE A 9 -10.092 2.529 -1.499 1.00 0.00 C ATOM 105 C PHE A 9 -10.892 1.697 -2.492 1.00 0.00 C ATOM 106 O PHE A 9 -12.097 1.892 -2.651 1.00 0.00 O ATOM 107 CB PHE A 9 -10.252 1.959 -0.089 1.00 0.00 C ATOM 108 CG PHE A 9 -9.172 0.987 0.293 1.00 0.00 C ATOM 109 CD1 PHE A 9 -9.202 -0.319 -0.169 1.00 0.00 C ATOM 110 CD2 PHE A 9 -8.127 1.380 1.114 1.00 0.00 C ATOM 111 CE1 PHE A 9 -8.210 -1.215 0.180 1.00 0.00 C ATOM 112 CE2 PHE A 9 -7.132 0.488 1.466 1.00 0.00 C ATOM 113 CZ PHE A 9 -7.174 -0.811 0.999 1.00 0.00 C ATOM 0 H PHE A 9 -11.479 4.082 -1.251 1.00 0.00 H new ATOM 0 HA PHE A 9 -9.040 2.485 -1.780 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -10.260 2.781 0.627 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -11.219 1.462 -0.015 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -10.010 -0.640 -0.809 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -8.090 2.394 1.483 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -8.245 -2.230 -0.187 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -6.322 0.806 2.106 1.00 0.00 H new ATOM 0 HZ PHE A 9 -6.398 -1.510 1.274 1.00 0.00 H new ATOM 123 N GLU A 10 -10.213 0.775 -3.166 1.00 0.00 N ATOM 124 CA GLU A 10 -10.861 -0.081 -4.151 1.00 0.00 C ATOM 125 C GLU A 10 -11.558 0.760 -5.216 1.00 0.00 C ATOM 126 O GLU A 10 -12.525 0.319 -5.836 1.00 0.00 O ATOM 127 CB GLU A 10 -11.873 -1.005 -3.471 1.00 0.00 C ATOM 128 CG GLU A 10 -11.280 -2.331 -3.022 1.00 0.00 C ATOM 129 CD GLU A 10 -12.241 -3.489 -3.204 1.00 0.00 C ATOM 130 OE1 GLU A 10 -13.467 -3.249 -3.212 1.00 0.00 O ATOM 131 OE2 GLU A 10 -11.768 -4.638 -3.338 1.00 0.00 O ATOM 0 H GLU A 10 -9.215 0.602 -3.048 1.00 0.00 H new ATOM 0 HA GLU A 10 -10.095 -0.689 -4.632 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -12.295 -0.494 -2.606 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -12.695 -1.199 -4.160 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -10.369 -2.527 -3.587 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -10.995 -2.261 -1.972 1.00 0.00 H new ATOM 138 N LYS A 11 -11.058 1.977 -5.422 1.00 0.00 N ATOM 139 CA LYS A 11 -11.628 2.881 -6.405 1.00 0.00 C ATOM 140 C LYS A 11 -13.057 3.244 -6.036 1.00 0.00 C ATOM 141 O LYS A 11 -13.951 3.269 -6.882 1.00 0.00 O ATOM 142 CB LYS A 11 -11.559 2.255 -7.795 1.00 0.00 C ATOM 143 CG LYS A 11 -10.211 1.615 -8.086 1.00 0.00 C ATOM 144 CD LYS A 11 -9.077 2.627 -7.988 1.00 0.00 C ATOM 145 CE LYS A 11 -9.298 3.810 -8.919 1.00 0.00 C ATOM 146 NZ LYS A 11 -9.870 4.982 -8.201 1.00 0.00 N ATOM 0 H LYS A 11 -10.257 2.356 -4.917 1.00 0.00 H new ATOM 0 HA LYS A 11 -11.045 3.802 -6.415 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -12.341 1.502 -7.889 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -11.762 3.021 -8.544 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -10.035 0.801 -7.383 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -10.223 1.177 -9.084 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -8.994 2.982 -6.961 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -8.133 2.141 -8.234 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -8.351 4.093 -9.378 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -9.969 3.516 -9.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -9.609 5.856 -8.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -10.906 4.898 -8.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -9.495 5.012 -7.231 1.00 0.00 H new ATOM 160 N VAL A 12 -13.252 3.532 -4.755 1.00 0.00 N ATOM 161 CA VAL A 12 -14.554 3.908 -4.236 1.00 0.00 C ATOM 162 C VAL A 12 -14.396 4.921 -3.103 1.00 0.00 C ATOM 163 O VAL A 12 -13.993 4.567 -1.995 1.00 0.00 O ATOM 164 CB VAL A 12 -15.318 2.664 -3.740 1.00 0.00 C ATOM 165 CG1 VAL A 12 -16.407 3.036 -2.740 1.00 0.00 C ATOM 166 CG2 VAL A 12 -15.909 1.902 -4.916 1.00 0.00 C ATOM 0 H VAL A 12 -12.513 3.511 -4.052 1.00 0.00 H new ATOM 0 HA VAL A 12 -15.129 4.367 -5.040 1.00 0.00 H new ATOM 0 HB VAL A 12 -14.606 2.019 -3.225 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -16.924 2.134 -2.413 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -15.957 3.529 -1.878 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -17.120 3.711 -3.213 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -16.445 1.027 -4.550 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -16.598 2.549 -5.459 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -15.108 1.584 -5.583 1.00 0.00 H new ATOM 176 N SER A 13 -14.702 6.184 -3.401 1.00 0.00 N ATOM 177 CA SER A 13 -14.587 7.275 -2.428 1.00 0.00 C ATOM 178 C SER A 13 -14.965 6.830 -1.018 1.00 0.00 C ATOM 179 O SER A 13 -16.065 6.328 -0.787 1.00 0.00 O ATOM 180 CB SER A 13 -15.469 8.451 -2.851 1.00 0.00 C ATOM 181 OG SER A 13 -16.718 8.000 -3.344 1.00 0.00 O ATOM 0 H SER A 13 -15.035 6.481 -4.318 1.00 0.00 H new ATOM 0 HA SER A 13 -13.542 7.584 -2.409 1.00 0.00 H new ATOM 0 HB2 SER A 13 -15.628 9.114 -2.001 1.00 0.00 H new ATOM 0 HB3 SER A 13 -14.960 9.033 -3.619 1.00 0.00 H new ATOM 0 HG SER A 13 -17.264 8.771 -3.606 1.00 0.00 H new ATOM 187 N GLY A 14 -14.042 7.022 -0.078 1.00 0.00 N ATOM 188 CA GLY A 14 -14.298 6.639 1.299 1.00 0.00 C ATOM 189 C GLY A 14 -13.409 7.364 2.290 1.00 0.00 C ATOM 190 O GLY A 14 -12.808 8.389 1.966 1.00 0.00 O ATOM 0 H GLY A 14 -13.124 7.435 -0.245 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -15.342 6.842 1.539 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -14.150 5.564 1.405 1.00 0.00 H new ATOM 194 N ILE A 15 -13.332 6.828 3.504 1.00 0.00 N ATOM 195 CA ILE A 15 -12.519 7.423 4.559 1.00 0.00 C ATOM 196 C ILE A 15 -11.695 6.367 5.294 1.00 0.00 C ATOM 197 O ILE A 15 -12.100 5.209 5.394 1.00 0.00 O ATOM 198 CB ILE A 15 -13.381 8.192 5.575 1.00 0.00 C ATOM 199 CG1 ILE A 15 -14.173 9.299 4.877 1.00 0.00 C ATOM 200 CG2 ILE A 15 -12.499 8.778 6.663 1.00 0.00 C ATOM 201 CD1 ILE A 15 -15.340 8.787 4.062 1.00 0.00 C ATOM 0 H ILE A 15 -13.825 5.979 3.782 1.00 0.00 H new ATOM 0 HA ILE A 15 -11.843 8.124 4.070 1.00 0.00 H new ATOM 0 HB ILE A 15 -14.089 7.499 6.030 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -14.543 9.998 5.627 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -13.502 9.858 4.224 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -13.116 9.321 7.379 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -11.971 7.974 7.176 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -11.776 9.460 6.217 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -15.855 9.627 3.596 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -14.975 8.111 3.289 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -16.032 8.253 4.713 1.00 0.00 H new ATOM 213 N ILE A 16 -10.537 6.777 5.810 1.00 0.00 N ATOM 214 CA ILE A 16 -9.653 5.867 6.531 1.00 0.00 C ATOM 215 C ILE A 16 -9.573 6.210 8.016 1.00 0.00 C ATOM 216 O ILE A 16 -9.666 7.374 8.406 1.00 0.00 O ATOM 217 CB ILE A 16 -8.211 5.874 5.967 1.00 0.00 C ATOM 218 CG1 ILE A 16 -8.163 6.422 4.536 1.00 0.00 C ATOM 219 CG2 ILE A 16 -7.613 4.477 6.026 1.00 0.00 C ATOM 220 CD1 ILE A 16 -7.290 7.650 4.399 1.00 0.00 C ATOM 0 H ILE A 16 -10.191 7.734 5.741 1.00 0.00 H new ATOM 0 HA ILE A 16 -10.091 4.878 6.398 1.00 0.00 H new ATOM 0 HB ILE A 16 -7.615 6.540 6.591 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -7.793 5.644 3.868 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -9.175 6.665 4.212 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -6.599 4.498 5.626 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -7.588 4.135 7.061 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -8.223 3.795 5.433 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -7.298 7.989 3.363 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -7.673 8.442 5.043 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -6.269 7.405 4.693 1.00 0.00 H new ATOM 232 N ALA A 17 -9.377 5.181 8.832 1.00 0.00 N ATOM 233 CA ALA A 17 -9.253 5.343 10.274 1.00 0.00 C ATOM 234 C ALA A 17 -8.184 4.399 10.815 1.00 0.00 C ATOM 235 O ALA A 17 -8.202 3.204 10.524 1.00 0.00 O ATOM 236 CB ALA A 17 -10.589 5.087 10.956 1.00 0.00 C ATOM 0 H ALA A 17 -9.300 4.215 8.514 1.00 0.00 H new ATOM 0 HA ALA A 17 -8.953 6.369 10.488 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -10.478 5.212 12.033 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -11.329 5.795 10.583 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -10.918 4.070 10.741 1.00 0.00 H new ATOM 242 N ILE A 18 -7.246 4.934 11.590 1.00 0.00 N ATOM 243 CA ILE A 18 -6.171 4.126 12.147 1.00 0.00 C ATOM 244 C ILE A 18 -6.530 3.635 13.549 1.00 0.00 C ATOM 245 O ILE A 18 -6.973 4.411 14.396 1.00 0.00 O ATOM 246 CB ILE A 18 -4.844 4.926 12.182 1.00 0.00 C ATOM 247 CG1 ILE A 18 -3.851 4.364 11.161 1.00 0.00 C ATOM 248 CG2 ILE A 18 -4.235 4.931 13.575 1.00 0.00 C ATOM 249 CD1 ILE A 18 -3.860 5.109 9.842 1.00 0.00 C ATOM 0 H ILE A 18 -7.210 5.921 11.845 1.00 0.00 H new ATOM 0 HA ILE A 18 -6.035 3.258 11.502 1.00 0.00 H new ATOM 0 HB ILE A 18 -5.070 5.958 11.916 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -2.847 4.400 11.584 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -4.083 3.315 10.979 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -3.306 5.501 13.564 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -4.933 5.389 14.276 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -4.029 3.907 13.886 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -3.134 4.659 9.165 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -4.854 5.051 9.398 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -3.599 6.153 10.012 1.00 0.00 H new ATOM 261 N ASN A 19 -6.340 2.340 13.782 1.00 0.00 N ATOM 262 CA ASN A 19 -6.645 1.742 15.069 1.00 0.00 C ATOM 263 C ASN A 19 -5.372 1.464 15.866 1.00 0.00 C ATOM 264 O ASN A 19 -5.029 0.309 16.124 1.00 0.00 O ATOM 265 CB ASN A 19 -7.439 0.448 14.879 1.00 0.00 C ATOM 266 CG ASN A 19 -8.435 0.212 15.997 1.00 0.00 C ATOM 267 OD1 ASN A 19 -8.153 0.486 17.164 1.00 0.00 O ATOM 268 ND2 ASN A 19 -9.608 -0.301 15.646 1.00 0.00 N ATOM 0 H ASN A 19 -5.974 1.686 13.090 1.00 0.00 H new ATOM 0 HA ASN A 19 -7.250 2.452 15.633 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -7.968 0.486 13.927 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -6.749 -0.394 14.827 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -10.318 -0.483 16.355 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -9.799 -0.513 14.667 1.00 0.00 H new ATOM 275 N GLU A 20 -4.677 2.528 16.257 1.00 0.00 N ATOM 276 CA GLU A 20 -3.448 2.394 17.030 1.00 0.00 C ATOM 277 C GLU A 20 -3.747 2.258 18.524 1.00 0.00 C ATOM 278 O GLU A 20 -2.829 2.172 19.340 1.00 0.00 O ATOM 279 CB GLU A 20 -2.536 3.599 16.793 1.00 0.00 C ATOM 280 CG GLU A 20 -1.712 3.499 15.520 1.00 0.00 C ATOM 281 CD GLU A 20 -0.338 4.123 15.668 1.00 0.00 C ATOM 282 OE1 GLU A 20 0.560 3.458 16.225 1.00 0.00 O ATOM 283 OE2 GLU A 20 -0.160 5.278 15.226 1.00 0.00 O ATOM 0 H GLU A 20 -4.944 3.491 16.051 1.00 0.00 H new ATOM 0 HA GLU A 20 -2.942 1.488 16.696 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -3.145 4.502 16.751 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -1.863 3.707 17.644 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -1.603 2.451 15.243 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -2.245 3.991 14.706 1.00 0.00 H new ATOM 290 N ASP A 21 -5.031 2.234 18.878 1.00 0.00 N ATOM 291 CA ASP A 21 -5.435 2.103 20.271 1.00 0.00 C ATOM 292 C ASP A 21 -5.343 0.650 20.715 1.00 0.00 C ATOM 293 O ASP A 21 -4.978 0.356 21.853 1.00 0.00 O ATOM 294 CB ASP A 21 -6.862 2.621 20.464 1.00 0.00 C ATOM 295 CG ASP A 21 -7.044 4.027 19.929 1.00 0.00 C ATOM 296 OD1 ASP A 21 -6.699 4.986 20.651 1.00 0.00 O ATOM 297 OD2 ASP A 21 -7.533 4.170 18.788 1.00 0.00 O ATOM 0 H ASP A 21 -5.806 2.304 18.218 1.00 0.00 H new ATOM 0 HA ASP A 21 -4.759 2.701 20.883 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -7.560 1.951 19.962 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -7.111 2.604 21.525 1.00 0.00 H new ATOM 302 N VAL A 22 -5.669 -0.257 19.800 1.00 0.00 N ATOM 303 CA VAL A 22 -5.616 -1.683 20.085 1.00 0.00 C ATOM 304 C VAL A 22 -4.198 -2.093 20.481 1.00 0.00 C ATOM 305 O VAL A 22 -3.261 -1.308 20.335 1.00 0.00 O ATOM 306 CB VAL A 22 -6.086 -2.509 18.864 1.00 0.00 C ATOM 307 CG1 VAL A 22 -5.027 -2.529 17.768 1.00 0.00 C ATOM 308 CG2 VAL A 22 -6.465 -3.922 19.283 1.00 0.00 C ATOM 0 H VAL A 22 -5.973 -0.027 18.854 1.00 0.00 H new ATOM 0 HA VAL A 22 -6.290 -1.887 20.917 1.00 0.00 H new ATOM 0 HB VAL A 22 -6.974 -2.026 18.455 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -5.388 -3.117 16.924 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -4.824 -1.510 17.439 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -4.111 -2.974 18.156 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -6.792 -4.485 18.409 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -5.600 -4.414 19.728 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -7.274 -3.881 20.012 1.00 0.00 H new ATOM 318 N SER A 23 -4.038 -3.317 20.986 1.00 0.00 N ATOM 319 CA SER A 23 -2.721 -3.801 21.398 1.00 0.00 C ATOM 320 C SER A 23 -1.667 -3.475 20.338 1.00 0.00 C ATOM 321 O SER A 23 -0.797 -2.634 20.563 1.00 0.00 O ATOM 322 CB SER A 23 -2.762 -5.307 21.672 1.00 0.00 C ATOM 323 OG SER A 23 -2.960 -5.570 23.051 1.00 0.00 O ATOM 0 H SER A 23 -4.797 -3.986 21.119 1.00 0.00 H new ATOM 0 HA SER A 23 -2.444 -3.291 22.321 1.00 0.00 H new ATOM 0 HB2 SER A 23 -3.565 -5.763 21.093 1.00 0.00 H new ATOM 0 HB3 SER A 23 -1.830 -5.765 21.341 1.00 0.00 H new ATOM 0 HG SER A 23 -2.984 -6.538 23.199 1.00 0.00 H new ATOM 329 N PRO A 24 -1.734 -4.121 19.157 1.00 0.00 N ATOM 330 CA PRO A 24 -0.785 -3.867 18.075 1.00 0.00 C ATOM 331 C PRO A 24 -1.087 -2.542 17.359 1.00 0.00 C ATOM 332 O PRO A 24 -0.808 -1.470 17.895 1.00 0.00 O ATOM 333 CB PRO A 24 -0.990 -5.074 17.157 1.00 0.00 C ATOM 334 CG PRO A 24 -2.426 -5.417 17.332 1.00 0.00 C ATOM 335 CD PRO A 24 -2.737 -5.135 18.778 1.00 0.00 C ATOM 0 HA PRO A 24 0.245 -3.762 18.417 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -0.761 -4.830 16.120 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -0.344 -5.905 17.439 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -3.055 -4.819 16.672 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -2.612 -6.463 17.088 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -3.753 -4.761 18.904 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -2.650 -6.033 19.389 1.00 0.00 H new ATOM 343 N ALA A 25 -1.660 -2.612 16.152 1.00 0.00 N ATOM 344 CA ALA A 25 -1.995 -1.422 15.383 1.00 0.00 C ATOM 345 C ALA A 25 -2.417 -1.799 13.967 1.00 0.00 C ATOM 346 O ALA A 25 -1.797 -2.654 13.335 1.00 0.00 O ATOM 347 CB ALA A 25 -0.809 -0.482 15.346 1.00 0.00 C ATOM 0 H ALA A 25 -1.900 -3.489 15.690 1.00 0.00 H new ATOM 0 HA ALA A 25 -2.832 -0.918 15.866 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -1.067 0.406 14.769 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -0.544 -0.190 16.362 1.00 0.00 H new ATOM 0 HB3 ALA A 25 0.039 -0.984 14.880 1.00 0.00 H new ATOM 353 N GLU A 26 -3.477 -1.168 13.474 1.00 0.00 N ATOM 354 CA GLU A 26 -3.972 -1.452 12.139 1.00 0.00 C ATOM 355 C GLU A 26 -4.692 -0.246 11.540 1.00 0.00 C ATOM 356 O GLU A 26 -5.039 0.701 12.246 1.00 0.00 O ATOM 357 CB GLU A 26 -4.907 -2.662 12.180 1.00 0.00 C ATOM 358 CG GLU A 26 -6.294 -2.354 12.723 1.00 0.00 C ATOM 359 CD GLU A 26 -7.172 -3.587 12.814 1.00 0.00 C ATOM 360 OE1 GLU A 26 -7.281 -4.313 11.803 1.00 0.00 O ATOM 361 OE2 GLU A 26 -7.749 -3.827 13.895 1.00 0.00 O ATOM 0 H GLU A 26 -4.007 -0.458 13.980 1.00 0.00 H new ATOM 0 HA GLU A 26 -3.117 -1.676 11.501 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -5.004 -3.067 11.173 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -4.452 -3.439 12.794 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -6.201 -1.905 13.712 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -6.776 -1.616 12.081 1.00 0.00 H new ATOM 368 N LEU A 27 -4.921 -0.298 10.231 1.00 0.00 N ATOM 369 CA LEU A 27 -5.605 0.769 9.525 1.00 0.00 C ATOM 370 C LEU A 27 -6.942 0.267 8.985 1.00 0.00 C ATOM 371 O LEU A 27 -6.988 -0.686 8.208 1.00 0.00 O ATOM 372 CB LEU A 27 -4.737 1.288 8.375 1.00 0.00 C ATOM 373 CG LEU A 27 -5.405 2.330 7.476 1.00 0.00 C ATOM 374 CD1 LEU A 27 -4.360 3.225 6.827 1.00 0.00 C ATOM 375 CD2 LEU A 27 -6.259 1.648 6.416 1.00 0.00 C ATOM 0 H LEU A 27 -4.638 -1.078 9.637 1.00 0.00 H new ATOM 0 HA LEU A 27 -5.788 1.587 10.222 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -3.828 1.721 8.793 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -4.433 0.441 7.759 1.00 0.00 H new ATOM 0 HG LEU A 27 -6.053 2.953 8.092 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -4.854 3.960 6.191 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -3.790 3.739 7.601 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -3.686 2.618 6.223 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -6.727 2.403 5.785 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -5.631 1.002 5.803 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.031 1.050 6.900 1.00 0.00 H new ATOM 387 N THR A 28 -8.027 0.907 9.406 1.00 0.00 N ATOM 388 CA THR A 28 -9.363 0.517 8.968 1.00 0.00 C ATOM 389 C THR A 28 -9.988 1.598 8.095 1.00 0.00 C ATOM 390 O THR A 28 -10.022 2.768 8.469 1.00 0.00 O ATOM 391 CB THR A 28 -10.258 0.243 10.177 1.00 0.00 C ATOM 392 OG1 THR A 28 -9.696 -0.765 10.999 1.00 0.00 O ATOM 393 CG2 THR A 28 -11.657 -0.196 9.802 1.00 0.00 C ATOM 0 H THR A 28 -8.008 1.698 10.050 1.00 0.00 H new ATOM 0 HA THR A 28 -9.272 -0.394 8.376 1.00 0.00 H new ATOM 0 HB THR A 28 -10.325 1.193 10.707 1.00 0.00 H new ATOM 0 HG1 THR A 28 -10.282 -0.925 11.768 1.00 0.00 H new ATOM 0 HG21 THR A 28 -12.238 -0.373 10.707 1.00 0.00 H new ATOM 0 HG22 THR A 28 -12.137 0.584 9.210 1.00 0.00 H new ATOM 0 HG23 THR A 28 -11.606 -1.115 9.218 1.00 0.00 H new ATOM 401 N TRP A 29 -10.481 1.197 6.929 1.00 0.00 N ATOM 402 CA TRP A 29 -11.104 2.133 6.000 1.00 0.00 C ATOM 403 C TRP A 29 -12.501 1.674 5.597 1.00 0.00 C ATOM 404 O TRP A 29 -12.742 0.487 5.392 1.00 0.00 O ATOM 405 CB TRP A 29 -10.246 2.307 4.741 1.00 0.00 C ATOM 406 CG TRP A 29 -10.959 3.047 3.646 1.00 0.00 C ATOM 407 CD1 TRP A 29 -10.778 4.350 3.283 1.00 0.00 C ATOM 408 CD2 TRP A 29 -11.979 2.527 2.781 1.00 0.00 C ATOM 409 NE1 TRP A 29 -11.629 4.678 2.256 1.00 0.00 N ATOM 410 CE2 TRP A 29 -12.369 3.571 1.922 1.00 0.00 C ATOM 411 CE3 TRP A 29 -12.600 1.279 2.649 1.00 0.00 C ATOM 412 CZ2 TRP A 29 -13.350 3.404 0.946 1.00 0.00 C ATOM 413 CZ3 TRP A 29 -13.574 1.119 1.681 1.00 0.00 C ATOM 414 CH2 TRP A 29 -13.939 2.176 0.840 1.00 0.00 C ATOM 0 H TRP A 29 -10.462 0.230 6.604 1.00 0.00 H new ATOM 0 HA TRP A 29 -11.185 3.089 6.517 1.00 0.00 H new ATOM 0 HB2 TRP A 29 -9.333 2.843 5.001 1.00 0.00 H new ATOM 0 HB3 TRP A 29 -9.946 1.326 4.374 1.00 0.00 H new ATOM 0 HD1 TRP A 29 -10.068 5.025 3.737 1.00 0.00 H new ATOM 0 HE1 TRP A 29 -11.700 5.594 1.814 1.00 0.00 H new ATOM 0 HE3 TRP A 29 -12.323 0.456 3.292 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 -13.635 4.218 0.296 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 -14.062 0.162 1.572 1.00 0.00 H new ATOM 0 HH2 TRP A 29 -14.702 2.018 0.092 1.00 0.00 H new ATOM 425 N ARG A 30 -13.409 2.632 5.460 1.00 0.00 N ATOM 426 CA ARG A 30 -14.778 2.336 5.046 1.00 0.00 C ATOM 427 C ARG A 30 -15.253 3.349 4.020 1.00 0.00 C ATOM 428 O ARG A 30 -14.814 4.498 4.017 1.00 0.00 O ATOM 429 CB ARG A 30 -15.740 2.350 6.230 1.00 0.00 C ATOM 430 CG ARG A 30 -15.776 1.045 6.995 1.00 0.00 C ATOM 431 CD ARG A 30 -16.707 1.126 8.195 1.00 0.00 C ATOM 432 NE ARG A 30 -16.495 2.345 8.972 1.00 0.00 N ATOM 433 CZ ARG A 30 -15.502 2.506 9.844 1.00 0.00 C ATOM 434 NH1 ARG A 30 -14.628 1.529 10.053 1.00 0.00 N ATOM 435 NH2 ARG A 30 -15.383 3.647 10.509 1.00 0.00 N ATOM 0 H ARG A 30 -13.224 3.621 5.629 1.00 0.00 H new ATOM 0 HA ARG A 30 -14.771 1.337 4.610 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -15.455 3.153 6.910 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -16.743 2.579 5.870 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -16.103 0.243 6.333 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -14.770 0.791 7.330 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -17.742 1.089 7.854 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -16.551 0.257 8.834 1.00 0.00 H new ATOM 0 HE ARG A 30 -17.146 3.118 8.838 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -14.715 0.649 9.544 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -13.869 1.658 10.722 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -16.052 4.401 10.352 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -14.622 3.771 11.177 1.00 0.00 H new ATOM 449 N SER A 31 -16.167 2.924 3.160 1.00 0.00 N ATOM 450 CA SER A 31 -16.714 3.816 2.141 1.00 0.00 C ATOM 451 C SER A 31 -17.246 5.093 2.789 1.00 0.00 C ATOM 452 O SER A 31 -17.377 5.165 4.011 1.00 0.00 O ATOM 453 CB SER A 31 -17.833 3.122 1.362 1.00 0.00 C ATOM 454 OG SER A 31 -17.315 2.401 0.258 1.00 0.00 O ATOM 0 H SER A 31 -16.544 1.977 3.144 1.00 0.00 H new ATOM 0 HA SER A 31 -15.915 4.075 1.447 1.00 0.00 H new ATOM 0 HB2 SER A 31 -18.373 2.443 2.022 1.00 0.00 H new ATOM 0 HB3 SER A 31 -18.550 3.864 1.011 1.00 0.00 H new ATOM 0 HG SER A 31 -17.807 2.647 -0.553 1.00 0.00 H new ATOM 460 N THR A 32 -17.554 6.097 1.975 1.00 0.00 N ATOM 461 CA THR A 32 -18.070 7.356 2.495 1.00 0.00 C ATOM 462 C THR A 32 -19.449 7.161 3.099 1.00 0.00 C ATOM 463 O THR A 32 -19.833 7.848 4.045 1.00 0.00 O ATOM 464 CB THR A 32 -18.128 8.413 1.402 1.00 0.00 C ATOM 465 OG1 THR A 32 -17.157 8.164 0.401 1.00 0.00 O ATOM 466 CG2 THR A 32 -17.911 9.819 1.919 1.00 0.00 C ATOM 0 H THR A 32 -17.456 6.064 0.960 1.00 0.00 H new ATOM 0 HA THR A 32 -17.389 7.699 3.274 1.00 0.00 H new ATOM 0 HB THR A 32 -19.135 8.345 0.991 1.00 0.00 H new ATOM 0 HG1 THR A 32 -17.442 7.405 -0.150 1.00 0.00 H new ATOM 0 HG21 THR A 32 -17.965 10.524 1.089 1.00 0.00 H new ATOM 0 HG22 THR A 32 -18.682 10.061 2.651 1.00 0.00 H new ATOM 0 HG23 THR A 32 -16.930 9.886 2.389 1.00 0.00 H new ATOM 474 N ASP A 33 -20.183 6.214 2.543 1.00 0.00 N ATOM 475 CA ASP A 33 -21.522 5.904 3.013 1.00 0.00 C ATOM 476 C ASP A 33 -22.123 4.786 2.175 1.00 0.00 C ATOM 477 O ASP A 33 -23.276 4.861 1.751 1.00 0.00 O ATOM 478 CB ASP A 33 -22.415 7.146 2.954 1.00 0.00 C ATOM 479 CG ASP A 33 -23.381 7.219 4.120 1.00 0.00 C ATOM 480 OD1 ASP A 33 -22.929 7.078 5.276 1.00 0.00 O ATOM 481 OD2 ASP A 33 -24.590 7.418 3.878 1.00 0.00 O ATOM 0 H ASP A 33 -19.871 5.642 1.759 1.00 0.00 H new ATOM 0 HA ASP A 33 -21.458 5.575 4.050 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -21.790 8.039 2.947 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -22.977 7.142 2.020 1.00 0.00 H new ATOM 486 N GLY A 34 -21.327 3.749 1.932 1.00 0.00 N ATOM 487 CA GLY A 34 -21.801 2.630 1.134 1.00 0.00 C ATOM 488 C GLY A 34 -21.796 1.325 1.900 1.00 0.00 C ATOM 489 O GLY A 34 -21.711 0.250 1.308 1.00 0.00 O ATOM 0 H GLY A 34 -20.369 3.662 2.270 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -22.813 2.839 0.787 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -21.174 2.529 0.248 1.00 0.00 H new ATOM 493 N ASP A 35 -21.879 1.421 3.221 1.00 0.00 N ATOM 494 CA ASP A 35 -21.873 0.244 4.084 1.00 0.00 C ATOM 495 C ASP A 35 -20.740 -0.706 3.715 1.00 0.00 C ATOM 496 O ASP A 35 -20.817 -1.911 3.954 1.00 0.00 O ATOM 497 CB ASP A 35 -23.225 -0.478 4.034 1.00 0.00 C ATOM 498 CG ASP A 35 -23.465 -1.191 2.716 1.00 0.00 C ATOM 499 OD1 ASP A 35 -22.998 -2.340 2.569 1.00 0.00 O ATOM 500 OD2 ASP A 35 -24.120 -0.600 1.832 1.00 0.00 O ATOM 0 H ASP A 35 -21.952 2.307 3.721 1.00 0.00 H new ATOM 0 HA ASP A 35 -21.705 0.584 5.106 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -23.275 -1.202 4.847 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -24.024 0.245 4.201 1.00 0.00 H new ATOM 505 N LYS A 36 -19.682 -0.143 3.150 1.00 0.00 N ATOM 506 CA LYS A 36 -18.518 -0.912 2.764 1.00 0.00 C ATOM 507 C LYS A 36 -17.442 -0.790 3.830 1.00 0.00 C ATOM 508 O LYS A 36 -17.485 0.120 4.656 1.00 0.00 O ATOM 509 CB LYS A 36 -17.973 -0.436 1.422 1.00 0.00 C ATOM 510 CG LYS A 36 -18.732 -1.003 0.242 1.00 0.00 C ATOM 511 CD LYS A 36 -19.657 0.030 -0.366 1.00 0.00 C ATOM 512 CE LYS A 36 -19.099 0.590 -1.665 1.00 0.00 C ATOM 513 NZ LYS A 36 -19.698 -0.071 -2.857 1.00 0.00 N ATOM 0 H LYS A 36 -19.610 0.854 2.949 1.00 0.00 H new ATOM 0 HA LYS A 36 -18.814 -1.956 2.665 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -18.014 0.653 1.385 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -16.923 -0.718 1.341 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -18.027 -1.352 -0.513 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -19.311 -1.869 0.562 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -20.632 -0.420 -0.553 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -19.812 0.843 0.344 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -19.290 1.662 -1.710 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -18.017 0.458 -1.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -19.292 0.339 -3.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -19.494 -1.090 -2.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -20.728 0.076 -2.855 1.00 0.00 H new ATOM 527 N VAL A 37 -16.478 -1.699 3.815 1.00 0.00 N ATOM 528 CA VAL A 37 -15.404 -1.665 4.793 1.00 0.00 C ATOM 529 C VAL A 37 -14.155 -2.368 4.275 1.00 0.00 C ATOM 530 O VAL A 37 -14.230 -3.277 3.449 1.00 0.00 O ATOM 531 CB VAL A 37 -15.811 -2.328 6.128 1.00 0.00 C ATOM 532 CG1 VAL A 37 -14.971 -1.788 7.276 1.00 0.00 C ATOM 533 CG2 VAL A 37 -17.297 -2.140 6.411 1.00 0.00 C ATOM 0 H VAL A 37 -16.418 -2.463 3.142 1.00 0.00 H new ATOM 0 HA VAL A 37 -15.193 -0.610 4.965 1.00 0.00 H new ATOM 0 HB VAL A 37 -15.623 -3.398 6.038 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -15.274 -2.268 8.206 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -13.918 -1.997 7.086 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -15.118 -0.711 7.359 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -17.551 -2.618 7.357 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -17.524 -1.076 6.470 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -17.880 -2.592 5.609 1.00 0.00 H new ATOM 543 N HIS A 38 -13.010 -1.943 4.789 1.00 0.00 N ATOM 544 CA HIS A 38 -11.727 -2.522 4.417 1.00 0.00 C ATOM 545 C HIS A 38 -10.699 -2.221 5.501 1.00 0.00 C ATOM 546 O HIS A 38 -10.363 -1.064 5.744 1.00 0.00 O ATOM 547 CB HIS A 38 -11.255 -1.964 3.073 1.00 0.00 C ATOM 548 CG HIS A 38 -10.574 -2.980 2.210 1.00 0.00 C ATOM 549 ND1 HIS A 38 -10.646 -2.968 0.832 1.00 0.00 N ATOM 550 CD2 HIS A 38 -9.801 -4.044 2.535 1.00 0.00 C ATOM 551 CE1 HIS A 38 -9.950 -3.981 0.348 1.00 0.00 C ATOM 552 NE2 HIS A 38 -9.427 -4.648 1.360 1.00 0.00 N ATOM 0 H HIS A 38 -12.944 -1.190 5.473 1.00 0.00 H new ATOM 0 HA HIS A 38 -11.842 -3.601 4.318 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -12.112 -1.559 2.536 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -10.571 -1.135 3.253 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -9.530 -4.358 3.532 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -9.829 -4.222 -0.698 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -8.840 -5.478 1.282 1.00 0.00 H new ATOM 561 N THR A 39 -10.211 -3.265 6.159 1.00 0.00 N ATOM 562 CA THR A 39 -9.239 -3.104 7.224 1.00 0.00 C ATOM 563 C THR A 39 -8.037 -4.019 7.020 1.00 0.00 C ATOM 564 O THR A 39 -8.185 -5.177 6.630 1.00 0.00 O ATOM 565 CB THR A 39 -9.885 -3.394 8.579 1.00 0.00 C ATOM 566 OG1 THR A 39 -11.072 -2.639 8.741 1.00 0.00 O ATOM 567 CG2 THR A 39 -8.981 -3.086 9.752 1.00 0.00 C ATOM 0 H THR A 39 -10.475 -4.232 5.971 1.00 0.00 H new ATOM 0 HA THR A 39 -8.891 -2.071 7.203 1.00 0.00 H new ATOM 0 HB THR A 39 -10.095 -4.464 8.575 1.00 0.00 H new ATOM 0 HG1 THR A 39 -11.630 -3.052 9.433 1.00 0.00 H new ATOM 0 HG21 THR A 39 -9.501 -3.314 10.682 1.00 0.00 H new ATOM 0 HG22 THR A 39 -8.077 -3.691 9.684 1.00 0.00 H new ATOM 0 HG23 THR A 39 -8.712 -2.030 9.737 1.00 0.00 H new ATOM 575 N VAL A 40 -6.849 -3.494 7.295 1.00 0.00 N ATOM 576 CA VAL A 40 -5.623 -4.266 7.149 1.00 0.00 C ATOM 577 C VAL A 40 -4.741 -4.126 8.388 1.00 0.00 C ATOM 578 O VAL A 40 -4.643 -3.048 8.974 1.00 0.00 O ATOM 579 CB VAL A 40 -4.824 -3.844 5.895 1.00 0.00 C ATOM 580 CG1 VAL A 40 -5.757 -3.629 4.712 1.00 0.00 C ATOM 581 CG2 VAL A 40 -4.002 -2.592 6.166 1.00 0.00 C ATOM 0 H VAL A 40 -6.710 -2.537 7.620 1.00 0.00 H new ATOM 0 HA VAL A 40 -5.917 -5.309 7.032 1.00 0.00 H new ATOM 0 HB VAL A 40 -4.135 -4.651 5.647 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -5.175 -3.332 3.839 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -6.290 -4.555 4.496 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -6.475 -2.845 4.953 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -3.450 -2.318 5.267 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -4.666 -1.775 6.448 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -3.301 -2.786 6.977 1.00 0.00 H new ATOM 591 N VAL A 41 -4.102 -5.221 8.776 1.00 0.00 N ATOM 592 CA VAL A 41 -3.225 -5.224 9.941 1.00 0.00 C ATOM 593 C VAL A 41 -1.775 -5.427 9.522 1.00 0.00 C ATOM 594 O VAL A 41 -1.487 -6.203 8.613 1.00 0.00 O ATOM 595 CB VAL A 41 -3.620 -6.327 10.941 1.00 0.00 C ATOM 596 CG1 VAL A 41 -2.843 -6.175 12.239 1.00 0.00 C ATOM 597 CG2 VAL A 41 -5.119 -6.299 11.202 1.00 0.00 C ATOM 0 H VAL A 41 -4.174 -6.121 8.301 1.00 0.00 H new ATOM 0 HA VAL A 41 -3.333 -4.254 10.427 1.00 0.00 H new ATOM 0 HB VAL A 41 -3.368 -7.294 10.505 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -3.136 -6.963 12.933 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -1.775 -6.250 12.035 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -3.060 -5.203 12.682 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -5.380 -7.085 11.911 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -5.398 -5.330 11.616 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -5.654 -6.462 10.267 1.00 0.00 H new ATOM 607 N LEU A 42 -0.863 -4.723 10.184 1.00 0.00 N ATOM 608 CA LEU A 42 0.556 -4.824 9.868 1.00 0.00 C ATOM 609 C LEU A 42 1.017 -6.274 9.835 1.00 0.00 C ATOM 610 O LEU A 42 1.905 -6.636 9.063 1.00 0.00 O ATOM 611 CB LEU A 42 1.376 -4.038 10.882 1.00 0.00 C ATOM 612 CG LEU A 42 1.958 -2.731 10.343 1.00 0.00 C ATOM 613 CD1 LEU A 42 1.689 -1.582 11.301 1.00 0.00 C ATOM 614 CD2 LEU A 42 3.450 -2.877 10.080 1.00 0.00 C ATOM 0 H LEU A 42 -1.082 -4.077 10.942 1.00 0.00 H new ATOM 0 HA LEU A 42 0.709 -4.401 8.875 1.00 0.00 H new ATOM 0 HB2 LEU A 42 0.748 -3.814 11.744 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.193 -4.667 11.237 1.00 0.00 H new ATOM 0 HG LEU A 42 1.465 -2.504 9.398 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.113 -0.663 10.895 1.00 0.00 H new ATOM 0 HD12 LEU A 42 0.614 -1.460 11.430 1.00 0.00 H new ATOM 0 HD13 LEU A 42 2.148 -1.798 12.266 1.00 0.00 H new ATOM 0 HD21 LEU A 42 3.846 -1.936 9.697 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.960 -3.134 11.009 1.00 0.00 H new ATOM 0 HD23 LEU A 42 3.615 -3.666 9.346 1.00 0.00 H new ATOM 626 N SER A 43 0.404 -7.102 10.670 1.00 0.00 N ATOM 627 CA SER A 43 0.745 -8.521 10.729 1.00 0.00 C ATOM 628 C SER A 43 0.842 -9.117 9.324 1.00 0.00 C ATOM 629 O SER A 43 1.576 -10.079 9.095 1.00 0.00 O ATOM 630 CB SER A 43 -0.295 -9.284 11.550 1.00 0.00 C ATOM 631 OG SER A 43 -0.658 -8.562 12.714 1.00 0.00 O ATOM 0 H SER A 43 -0.332 -6.818 11.317 1.00 0.00 H new ATOM 0 HA SER A 43 1.718 -8.616 11.212 1.00 0.00 H new ATOM 0 HB2 SER A 43 -1.180 -9.467 10.941 1.00 0.00 H new ATOM 0 HB3 SER A 43 0.104 -10.258 11.833 1.00 0.00 H new ATOM 0 HG SER A 43 -1.325 -9.071 13.220 1.00 0.00 H new ATOM 637 N THR A 44 0.101 -8.530 8.384 1.00 0.00 N ATOM 638 CA THR A 44 0.108 -8.991 7.001 1.00 0.00 C ATOM 639 C THR A 44 0.877 -8.014 6.114 1.00 0.00 C ATOM 640 O THR A 44 1.371 -8.381 5.049 1.00 0.00 O ATOM 641 CB THR A 44 -1.328 -9.154 6.498 1.00 0.00 C ATOM 642 OG1 THR A 44 -1.386 -10.080 5.428 1.00 0.00 O ATOM 643 CG2 THR A 44 -1.960 -7.862 6.025 1.00 0.00 C ATOM 0 H THR A 44 -0.512 -7.733 8.558 1.00 0.00 H new ATOM 0 HA THR A 44 0.609 -9.958 6.956 1.00 0.00 H new ATOM 0 HB THR A 44 -1.889 -9.511 7.362 1.00 0.00 H new ATOM 0 HG1 THR A 44 -2.313 -10.170 5.123 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.977 -8.058 5.684 1.00 0.00 H new ATOM 0 HG22 THR A 44 -1.985 -7.147 6.847 1.00 0.00 H new ATOM 0 HG23 THR A 44 -1.374 -7.450 5.203 1.00 0.00 H new ATOM 651 N ILE A 45 0.965 -6.767 6.569 1.00 0.00 N ATOM 652 CA ILE A 45 1.669 -5.715 5.838 1.00 0.00 C ATOM 653 C ILE A 45 2.785 -5.120 6.698 1.00 0.00 C ATOM 654 O ILE A 45 2.532 -4.614 7.790 1.00 0.00 O ATOM 655 CB ILE A 45 0.690 -4.599 5.378 1.00 0.00 C ATOM 656 CG1 ILE A 45 1.442 -3.303 5.015 1.00 0.00 C ATOM 657 CG2 ILE A 45 -0.373 -4.339 6.440 1.00 0.00 C ATOM 658 CD1 ILE A 45 1.275 -2.173 6.013 1.00 0.00 C ATOM 0 H ILE A 45 0.553 -6.458 7.449 1.00 0.00 H new ATOM 0 HA ILE A 45 2.112 -6.164 4.949 1.00 0.00 H new ATOM 0 HB ILE A 45 0.189 -4.948 4.475 1.00 0.00 H new ATOM 0 HG12 ILE A 45 2.504 -3.530 4.918 1.00 0.00 H new ATOM 0 HG13 ILE A 45 1.099 -2.961 4.039 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -1.047 -3.554 6.096 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -0.941 -5.252 6.618 1.00 0.00 H new ATOM 0 HG23 ILE A 45 0.108 -4.024 7.366 1.00 0.00 H new ATOM 0 HD11 ILE A 45 1.839 -1.303 5.675 1.00 0.00 H new ATOM 0 HD12 ILE A 45 0.220 -1.912 6.094 1.00 0.00 H new ATOM 0 HD13 ILE A 45 1.647 -2.490 6.987 1.00 0.00 H new ATOM 670 N ASP A 46 4.026 -5.192 6.211 1.00 0.00 N ATOM 671 CA ASP A 46 5.161 -4.664 6.968 1.00 0.00 C ATOM 672 C ASP A 46 5.902 -3.564 6.220 1.00 0.00 C ATOM 673 O ASP A 46 7.068 -3.285 6.500 1.00 0.00 O ATOM 674 CB ASP A 46 6.126 -5.791 7.339 1.00 0.00 C ATOM 675 CG ASP A 46 6.697 -5.626 8.734 1.00 0.00 C ATOM 676 OD1 ASP A 46 6.776 -4.474 9.211 1.00 0.00 O ATOM 677 OD2 ASP A 46 7.064 -6.648 9.350 1.00 0.00 O ATOM 0 H ASP A 46 4.268 -5.604 5.310 1.00 0.00 H new ATOM 0 HA ASP A 46 4.756 -4.219 7.877 1.00 0.00 H new ATOM 0 HB2 ASP A 46 5.607 -6.747 7.272 1.00 0.00 H new ATOM 0 HB3 ASP A 46 6.942 -5.820 6.616 1.00 0.00 H new ATOM 682 N LYS A 47 5.214 -2.928 5.291 1.00 0.00 N ATOM 683 CA LYS A 47 5.798 -1.831 4.520 1.00 0.00 C ATOM 684 C LYS A 47 4.711 -0.944 3.923 1.00 0.00 C ATOM 685 O LYS A 47 3.638 -1.420 3.551 1.00 0.00 O ATOM 686 CB LYS A 47 6.718 -2.348 3.405 1.00 0.00 C ATOM 687 CG LYS A 47 7.151 -3.795 3.568 1.00 0.00 C ATOM 688 CD LYS A 47 7.958 -4.267 2.370 1.00 0.00 C ATOM 689 CE LYS A 47 8.153 -5.776 2.384 1.00 0.00 C ATOM 690 NZ LYS A 47 9.587 -6.151 2.247 1.00 0.00 N ATOM 0 H LYS A 47 4.248 -3.148 5.047 1.00 0.00 H new ATOM 0 HA LYS A 47 6.398 -1.240 5.211 1.00 0.00 H new ATOM 0 HB2 LYS A 47 6.206 -2.240 2.449 1.00 0.00 H new ATOM 0 HB3 LYS A 47 7.607 -1.718 3.363 1.00 0.00 H new ATOM 0 HG2 LYS A 47 7.747 -3.899 4.475 1.00 0.00 H new ATOM 0 HG3 LYS A 47 6.272 -4.428 3.690 1.00 0.00 H new ATOM 0 HD2 LYS A 47 7.451 -3.974 1.451 1.00 0.00 H new ATOM 0 HD3 LYS A 47 8.930 -3.774 2.369 1.00 0.00 H new ATOM 0 HE2 LYS A 47 7.758 -6.185 3.314 1.00 0.00 H new ATOM 0 HE3 LYS A 47 7.581 -6.224 1.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 9.678 -7.187 2.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 9.958 -5.783 1.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 10.129 -5.745 3.037 1.00 0.00 H new ATOM 704 N LEU A 48 5.000 0.350 3.838 1.00 0.00 N ATOM 705 CA LEU A 48 4.054 1.315 3.289 1.00 0.00 C ATOM 706 C LEU A 48 4.742 2.227 2.272 1.00 0.00 C ATOM 707 O LEU A 48 5.701 2.925 2.603 1.00 0.00 O ATOM 708 CB LEU A 48 3.449 2.156 4.414 1.00 0.00 C ATOM 709 CG LEU A 48 2.320 3.096 3.985 1.00 0.00 C ATOM 710 CD1 LEU A 48 1.229 2.322 3.260 1.00 0.00 C ATOM 711 CD2 LEU A 48 1.749 3.825 5.192 1.00 0.00 C ATOM 0 H LEU A 48 5.885 0.756 4.143 1.00 0.00 H new ATOM 0 HA LEU A 48 3.259 0.767 2.783 1.00 0.00 H new ATOM 0 HB2 LEU A 48 3.069 1.485 5.185 1.00 0.00 H new ATOM 0 HB3 LEU A 48 4.242 2.749 4.870 1.00 0.00 H new ATOM 0 HG LEU A 48 2.728 3.837 3.298 1.00 0.00 H new ATOM 0 HD11 LEU A 48 0.434 3.006 2.962 1.00 0.00 H new ATOM 0 HD12 LEU A 48 1.648 1.845 2.374 1.00 0.00 H new ATOM 0 HD13 LEU A 48 0.822 1.559 3.924 1.00 0.00 H new ATOM 0 HD21 LEU A 48 0.947 4.489 4.870 1.00 0.00 H new ATOM 0 HD22 LEU A 48 1.355 3.099 5.903 1.00 0.00 H new ATOM 0 HD23 LEU A 48 2.535 4.410 5.669 1.00 0.00 H new ATOM 723 N GLN A 49 4.246 2.221 1.039 1.00 0.00 N ATOM 724 CA GLN A 49 4.812 3.051 -0.023 1.00 0.00 C ATOM 725 C GLN A 49 3.913 4.255 -0.297 1.00 0.00 C ATOM 726 O GLN A 49 2.745 4.101 -0.654 1.00 0.00 O ATOM 727 CB GLN A 49 4.979 2.228 -1.303 1.00 0.00 C ATOM 728 CG GLN A 49 6.362 1.615 -1.455 1.00 0.00 C ATOM 729 CD GLN A 49 6.609 0.483 -0.478 1.00 0.00 C ATOM 730 OE1 GLN A 49 6.291 0.589 0.707 1.00 0.00 O ATOM 731 NE2 GLN A 49 7.180 -0.610 -0.970 1.00 0.00 N ATOM 0 H GLN A 49 3.452 1.650 0.748 1.00 0.00 H new ATOM 0 HA GLN A 49 5.789 3.408 0.303 1.00 0.00 H new ATOM 0 HB2 GLN A 49 4.235 1.432 -1.313 1.00 0.00 H new ATOM 0 HB3 GLN A 49 4.776 2.865 -2.164 1.00 0.00 H new ATOM 0 HG2 GLN A 49 6.481 1.244 -2.473 1.00 0.00 H new ATOM 0 HG3 GLN A 49 7.116 2.388 -1.308 1.00 0.00 H new ATOM 0 HE21 GLN A 49 7.427 -0.655 -1.959 1.00 0.00 H new ATOM 0 HE22 GLN A 49 7.371 -1.404 -0.359 1.00 0.00 H new ATOM 740 N ALA A 50 4.465 5.452 -0.129 1.00 0.00 N ATOM 741 CA ALA A 50 3.715 6.683 -0.359 1.00 0.00 C ATOM 742 C ALA A 50 4.383 7.526 -1.440 1.00 0.00 C ATOM 743 O ALA A 50 5.543 7.301 -1.786 1.00 0.00 O ATOM 744 CB ALA A 50 3.593 7.477 0.935 1.00 0.00 C ATOM 0 H ALA A 50 5.431 5.597 0.166 1.00 0.00 H new ATOM 0 HA ALA A 50 2.715 6.418 -0.701 1.00 0.00 H new ATOM 0 HB1 ALA A 50 3.031 8.392 0.749 1.00 0.00 H new ATOM 0 HB2 ALA A 50 3.072 6.878 1.682 1.00 0.00 H new ATOM 0 HB3 ALA A 50 4.588 7.730 1.302 1.00 0.00 H new ATOM 750 N THR A 51 3.648 8.497 -1.972 1.00 0.00 N ATOM 751 CA THR A 51 4.179 9.369 -3.014 1.00 0.00 C ATOM 752 C THR A 51 5.049 10.469 -2.409 1.00 0.00 C ATOM 753 O THR A 51 5.029 10.693 -1.199 1.00 0.00 O ATOM 754 CB THR A 51 3.039 9.987 -3.829 1.00 0.00 C ATOM 755 OG1 THR A 51 1.789 9.749 -3.208 1.00 0.00 O ATOM 756 CG2 THR A 51 2.959 9.452 -5.244 1.00 0.00 C ATOM 0 H THR A 51 2.686 8.700 -1.700 1.00 0.00 H new ATOM 0 HA THR A 51 4.798 8.765 -3.678 1.00 0.00 H new ATOM 0 HB THR A 51 3.260 11.054 -3.871 1.00 0.00 H new ATOM 0 HG1 THR A 51 1.605 8.786 -3.201 1.00 0.00 H new ATOM 0 HG21 THR A 51 2.131 9.930 -5.767 1.00 0.00 H new ATOM 0 HG22 THR A 51 3.891 9.666 -5.767 1.00 0.00 H new ATOM 0 HG23 THR A 51 2.797 8.374 -5.217 1.00 0.00 H new ATOM 764 N PRO A 52 5.829 11.172 -3.249 1.00 0.00 N ATOM 765 CA PRO A 52 6.710 12.251 -2.792 1.00 0.00 C ATOM 766 C PRO A 52 5.934 13.491 -2.361 1.00 0.00 C ATOM 767 O PRO A 52 4.843 13.759 -2.864 1.00 0.00 O ATOM 768 CB PRO A 52 7.564 12.556 -4.024 1.00 0.00 C ATOM 769 CG PRO A 52 6.718 12.148 -5.180 1.00 0.00 C ATOM 770 CD PRO A 52 5.914 10.968 -4.708 1.00 0.00 C ATOM 0 HA PRO A 52 7.289 11.961 -1.916 1.00 0.00 H new ATOM 0 HB2 PRO A 52 7.822 13.614 -4.075 1.00 0.00 H new ATOM 0 HB3 PRO A 52 8.502 12.000 -4.004 1.00 0.00 H new ATOM 0 HG2 PRO A 52 6.067 12.964 -5.494 1.00 0.00 H new ATOM 0 HG3 PRO A 52 7.333 11.882 -6.040 1.00 0.00 H new ATOM 0 HD2 PRO A 52 4.926 10.945 -5.168 1.00 0.00 H new ATOM 0 HD3 PRO A 52 6.402 10.025 -4.954 1.00 0.00 H new ATOM 778 N ALA A 53 6.505 14.244 -1.427 1.00 0.00 N ATOM 779 CA ALA A 53 5.869 15.457 -0.929 1.00 0.00 C ATOM 780 C ALA A 53 5.850 16.543 -1.998 1.00 0.00 C ATOM 781 O ALA A 53 6.561 17.543 -1.896 1.00 0.00 O ATOM 782 CB ALA A 53 6.583 15.953 0.319 1.00 0.00 C ATOM 0 H ALA A 53 7.407 14.035 -1.000 1.00 0.00 H new ATOM 0 HA ALA A 53 4.837 15.219 -0.672 1.00 0.00 H new ATOM 0 HB1 ALA A 53 6.097 16.860 0.680 1.00 0.00 H new ATOM 0 HB2 ALA A 53 6.540 15.186 1.092 1.00 0.00 H new ATOM 0 HB3 ALA A 53 7.624 16.170 0.081 1.00 0.00 H new ATOM 788 N SER A 54 5.031 16.338 -3.026 1.00 0.00 N ATOM 789 CA SER A 54 4.914 17.298 -4.121 1.00 0.00 C ATOM 790 C SER A 54 4.058 16.737 -5.249 1.00 0.00 C ATOM 791 O SER A 54 3.383 17.481 -5.961 1.00 0.00 O ATOM 792 CB SER A 54 6.297 17.676 -4.657 1.00 0.00 C ATOM 793 OG SER A 54 7.132 16.536 -4.765 1.00 0.00 O ATOM 0 H SER A 54 4.437 15.514 -3.124 1.00 0.00 H new ATOM 0 HA SER A 54 4.430 18.192 -3.729 1.00 0.00 H new ATOM 0 HB2 SER A 54 6.195 18.150 -5.633 1.00 0.00 H new ATOM 0 HB3 SER A 54 6.759 18.408 -3.995 1.00 0.00 H new ATOM 0 HG SER A 54 8.009 16.804 -5.111 1.00 0.00 H new ATOM 799 N SER A 55 4.092 15.421 -5.405 1.00 0.00 N ATOM 800 CA SER A 55 3.322 14.749 -6.446 1.00 0.00 C ATOM 801 C SER A 55 1.842 15.110 -6.353 1.00 0.00 C ATOM 802 O SER A 55 1.280 15.190 -5.261 1.00 0.00 O ATOM 803 CB SER A 55 3.495 13.233 -6.339 1.00 0.00 C ATOM 804 OG SER A 55 2.527 12.552 -7.118 1.00 0.00 O ATOM 0 H SER A 55 4.647 14.794 -4.822 1.00 0.00 H new ATOM 0 HA SER A 55 3.698 15.085 -7.412 1.00 0.00 H new ATOM 0 HB2 SER A 55 4.495 12.954 -6.671 1.00 0.00 H new ATOM 0 HB3 SER A 55 3.408 12.927 -5.297 1.00 0.00 H new ATOM 0 HG SER A 55 2.755 11.600 -7.163 1.00 0.00 H new ATOM 810 N GLU A 56 1.219 15.330 -7.506 1.00 0.00 N ATOM 811 CA GLU A 56 -0.194 15.685 -7.556 1.00 0.00 C ATOM 812 C GLU A 56 -1.078 14.473 -7.268 1.00 0.00 C ATOM 813 O GLU A 56 -2.234 14.620 -6.872 1.00 0.00 O ATOM 814 CB GLU A 56 -0.545 16.271 -8.925 1.00 0.00 C ATOM 815 CG GLU A 56 -0.215 17.749 -9.056 1.00 0.00 C ATOM 816 CD GLU A 56 1.106 17.991 -9.758 1.00 0.00 C ATOM 817 OE1 GLU A 56 1.173 17.779 -10.987 1.00 0.00 O ATOM 818 OE2 GLU A 56 2.074 18.394 -9.079 1.00 0.00 O ATOM 0 H GLU A 56 1.671 15.269 -8.418 1.00 0.00 H new ATOM 0 HA GLU A 56 -0.379 16.434 -6.786 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -0.009 15.718 -9.696 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -1.609 16.127 -9.111 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -1.012 18.248 -9.607 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -0.183 18.200 -8.064 1.00 0.00 H new ATOM 825 N LYS A 57 -0.531 13.278 -7.472 1.00 0.00 N ATOM 826 CA LYS A 57 -1.278 12.047 -7.235 1.00 0.00 C ATOM 827 C LYS A 57 -1.804 11.991 -5.803 1.00 0.00 C ATOM 828 O LYS A 57 -3.004 11.832 -5.580 1.00 0.00 O ATOM 829 CB LYS A 57 -0.399 10.827 -7.523 1.00 0.00 C ATOM 830 CG LYS A 57 -0.999 9.877 -8.547 1.00 0.00 C ATOM 831 CD LYS A 57 0.079 9.156 -9.339 1.00 0.00 C ATOM 832 CE LYS A 57 -0.326 7.726 -9.658 1.00 0.00 C ATOM 833 NZ LYS A 57 -0.847 7.591 -11.046 1.00 0.00 N ATOM 0 H LYS A 57 0.424 13.136 -7.800 1.00 0.00 H new ATOM 0 HA LYS A 57 -2.132 12.035 -7.912 1.00 0.00 H new ATOM 0 HB2 LYS A 57 0.574 11.166 -7.879 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -0.227 10.285 -6.593 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -1.630 9.146 -8.041 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -1.641 10.434 -9.229 1.00 0.00 H new ATOM 0 HD2 LYS A 57 0.273 9.696 -10.266 1.00 0.00 H new ATOM 0 HD3 LYS A 57 1.009 9.154 -8.771 1.00 0.00 H new ATOM 0 HE2 LYS A 57 0.533 7.068 -9.528 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -1.088 7.399 -8.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -1.112 6.601 -11.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -1.682 8.199 -11.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -0.111 7.879 -11.722 1.00 0.00 H new ATOM 847 N MET A 58 -0.901 12.126 -4.835 1.00 0.00 N ATOM 848 CA MET A 58 -1.286 12.094 -3.427 1.00 0.00 C ATOM 849 C MET A 58 -1.928 10.757 -3.072 1.00 0.00 C ATOM 850 O MET A 58 -3.152 10.642 -3.020 1.00 0.00 O ATOM 851 CB MET A 58 -2.260 13.237 -3.127 1.00 0.00 C ATOM 852 CG MET A 58 -2.720 13.287 -1.679 1.00 0.00 C ATOM 853 SD MET A 58 -2.001 14.670 -0.772 1.00 0.00 S ATOM 854 CE MET A 58 -2.766 16.057 -1.607 1.00 0.00 C ATOM 0 H MET A 58 0.097 12.258 -4.998 1.00 0.00 H new ATOM 0 HA MET A 58 -0.388 12.217 -2.821 1.00 0.00 H new ATOM 0 HB2 MET A 58 -1.783 14.184 -3.380 1.00 0.00 H new ATOM 0 HB3 MET A 58 -3.133 13.137 -3.772 1.00 0.00 H new ATOM 0 HG2 MET A 58 -3.807 13.363 -1.649 1.00 0.00 H new ATOM 0 HG3 MET A 58 -2.452 12.354 -1.184 1.00 0.00 H new ATOM 0 HE1 MET A 58 -1.994 16.680 -2.059 1.00 0.00 H new ATOM 0 HE2 MET A 58 -3.437 15.689 -2.383 1.00 0.00 H new ATOM 0 HE3 MET A 58 -3.333 16.647 -0.887 1.00 0.00 H new ATOM 864 N MET A 59 -1.098 9.743 -2.837 1.00 0.00 N ATOM 865 CA MET A 59 -1.603 8.415 -2.500 1.00 0.00 C ATOM 866 C MET A 59 -0.514 7.534 -1.891 1.00 0.00 C ATOM 867 O MET A 59 0.677 7.768 -2.097 1.00 0.00 O ATOM 868 CB MET A 59 -2.182 7.741 -3.747 1.00 0.00 C ATOM 869 CG MET A 59 -1.623 8.274 -5.054 1.00 0.00 C ATOM 870 SD MET A 59 -1.644 7.050 -6.377 1.00 0.00 S ATOM 871 CE MET A 59 0.094 6.968 -6.815 1.00 0.00 C ATOM 0 H MET A 59 -0.081 9.814 -2.873 1.00 0.00 H new ATOM 0 HA MET A 59 -2.388 8.539 -1.754 1.00 0.00 H new ATOM 0 HB2 MET A 59 -1.989 6.670 -3.691 1.00 0.00 H new ATOM 0 HB3 MET A 59 -3.264 7.870 -3.747 1.00 0.00 H new ATOM 0 HG2 MET A 59 -2.201 9.145 -5.362 1.00 0.00 H new ATOM 0 HG3 MET A 59 -0.599 8.612 -4.895 1.00 0.00 H new ATOM 0 HE1 MET A 59 0.240 6.211 -7.585 1.00 0.00 H new ATOM 0 HE2 MET A 59 0.420 7.937 -7.192 1.00 0.00 H new ATOM 0 HE3 MET A 59 0.679 6.706 -5.934 1.00 0.00 H new ATOM 881 N LEU A 60 -0.935 6.512 -1.145 1.00 0.00 N ATOM 882 CA LEU A 60 -0.001 5.586 -0.511 1.00 0.00 C ATOM 883 C LEU A 60 -0.565 4.163 -0.490 1.00 0.00 C ATOM 884 O LEU A 60 -1.755 3.958 -0.247 1.00 0.00 O ATOM 885 CB LEU A 60 0.332 6.035 0.914 1.00 0.00 C ATOM 886 CG LEU A 60 -0.803 6.735 1.657 1.00 0.00 C ATOM 887 CD1 LEU A 60 -0.546 6.723 3.156 1.00 0.00 C ATOM 888 CD2 LEU A 60 -0.965 8.159 1.151 1.00 0.00 C ATOM 0 H LEU A 60 -1.918 6.306 -0.966 1.00 0.00 H new ATOM 0 HA LEU A 60 0.915 5.588 -1.102 1.00 0.00 H new ATOM 0 HB2 LEU A 60 0.638 5.162 1.491 1.00 0.00 H new ATOM 0 HB3 LEU A 60 1.189 6.708 0.875 1.00 0.00 H new ATOM 0 HG LEU A 60 -1.730 6.194 1.466 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -1.365 7.226 3.670 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.477 5.693 3.505 1.00 0.00 H new ATOM 0 HD13 LEU A 60 0.389 7.241 3.369 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -1.778 8.646 1.690 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -0.039 8.711 1.314 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -1.194 8.143 0.086 1.00 0.00 H new ATOM 900 N ARG A 61 0.303 3.184 -0.744 1.00 0.00 N ATOM 901 CA ARG A 61 -0.097 1.780 -0.751 1.00 0.00 C ATOM 902 C ARG A 61 0.754 0.988 0.239 1.00 0.00 C ATOM 903 O ARG A 61 1.948 1.249 0.386 1.00 0.00 O ATOM 904 CB ARG A 61 0.013 1.194 -2.171 1.00 0.00 C ATOM 905 CG ARG A 61 1.340 0.518 -2.499 1.00 0.00 C ATOM 906 CD ARG A 61 1.171 -0.503 -3.615 1.00 0.00 C ATOM 907 NE ARG A 61 2.180 -0.353 -4.660 1.00 0.00 N ATOM 908 CZ ARG A 61 3.394 -0.899 -4.609 1.00 0.00 C ATOM 909 NH1 ARG A 61 3.751 -1.648 -3.574 1.00 0.00 N ATOM 910 NH2 ARG A 61 4.250 -0.702 -5.601 1.00 0.00 N ATOM 0 H ARG A 61 1.290 3.340 -0.948 1.00 0.00 H new ATOM 0 HA ARG A 61 -1.139 1.708 -0.441 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -0.789 0.469 -2.309 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -0.155 1.996 -2.890 1.00 0.00 H new ATOM 0 HG2 ARG A 61 2.071 1.270 -2.797 1.00 0.00 H new ATOM 0 HG3 ARG A 61 1.732 0.027 -1.608 1.00 0.00 H new ATOM 0 HD2 ARG A 61 1.230 -1.508 -3.197 1.00 0.00 H new ATOM 0 HD3 ARG A 61 0.179 -0.398 -4.053 1.00 0.00 H new ATOM 0 HE ARG A 61 1.940 0.204 -5.480 1.00 0.00 H new ATOM 0 HH11 ARG A 61 3.094 -1.809 -2.810 1.00 0.00 H new ATOM 0 HH12 ARG A 61 4.682 -2.063 -3.542 1.00 0.00 H new ATOM 0 HH21 ARG A 61 3.979 -0.133 -6.403 1.00 0.00 H new ATOM 0 HH22 ARG A 61 5.180 -1.120 -5.563 1.00 0.00 H new ATOM 924 N LEU A 62 0.140 0.030 0.920 1.00 0.00 N ATOM 925 CA LEU A 62 0.856 -0.783 1.899 1.00 0.00 C ATOM 926 C LEU A 62 1.160 -2.166 1.355 1.00 0.00 C ATOM 927 O LEU A 62 0.330 -2.804 0.707 1.00 0.00 O ATOM 928 CB LEU A 62 0.082 -0.878 3.216 1.00 0.00 C ATOM 929 CG LEU A 62 -1.044 0.146 3.401 1.00 0.00 C ATOM 930 CD1 LEU A 62 -2.396 -0.484 3.107 1.00 0.00 C ATOM 931 CD2 LEU A 62 -1.016 0.718 4.811 1.00 0.00 C ATOM 0 H LEU A 62 -0.847 -0.204 0.815 1.00 0.00 H new ATOM 0 HA LEU A 62 1.805 -0.286 2.100 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -0.345 -1.878 3.294 1.00 0.00 H new ATOM 0 HB3 LEU A 62 0.788 -0.768 4.040 1.00 0.00 H new ATOM 0 HG LEU A 62 -0.887 0.961 2.694 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -3.181 0.259 3.244 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -2.413 -0.845 2.079 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -2.564 -1.319 3.787 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.822 1.443 4.926 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -1.148 -0.088 5.533 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.059 1.209 4.986 1.00 0.00 H new ATOM 943 N ILE A 63 2.381 -2.598 1.616 1.00 0.00 N ATOM 944 CA ILE A 63 2.875 -3.881 1.161 1.00 0.00 C ATOM 945 C ILE A 63 2.561 -4.993 2.161 1.00 0.00 C ATOM 946 O ILE A 63 2.795 -4.846 3.356 1.00 0.00 O ATOM 947 CB ILE A 63 4.396 -3.786 0.947 1.00 0.00 C ATOM 948 CG1 ILE A 63 4.712 -3.486 -0.514 1.00 0.00 C ATOM 949 CG2 ILE A 63 5.094 -5.044 1.409 1.00 0.00 C ATOM 950 CD1 ILE A 63 4.698 -2.007 -0.821 1.00 0.00 C ATOM 0 H ILE A 63 3.062 -2.062 2.154 1.00 0.00 H new ATOM 0 HA ILE A 63 2.376 -4.129 0.224 1.00 0.00 H new ATOM 0 HB ILE A 63 4.773 -2.962 1.553 1.00 0.00 H new ATOM 0 HG12 ILE A 63 5.692 -3.895 -0.761 1.00 0.00 H new ATOM 0 HG13 ILE A 63 3.986 -3.992 -1.150 1.00 0.00 H new ATOM 0 HG21 ILE A 63 6.167 -4.946 1.245 1.00 0.00 H new ATOM 0 HG22 ILE A 63 4.902 -5.198 2.471 1.00 0.00 H new ATOM 0 HG23 ILE A 63 4.717 -5.897 0.845 1.00 0.00 H new ATOM 0 HD11 ILE A 63 4.929 -1.852 -1.875 1.00 0.00 H new ATOM 0 HD12 ILE A 63 3.711 -1.599 -0.602 1.00 0.00 H new ATOM 0 HD13 ILE A 63 5.443 -1.501 -0.208 1.00 0.00 H new ATOM 962 N GLY A 64 2.057 -6.117 1.659 1.00 0.00 N ATOM 963 CA GLY A 64 1.745 -7.243 2.524 1.00 0.00 C ATOM 964 C GLY A 64 2.975 -8.076 2.847 1.00 0.00 C ATOM 965 O GLY A 64 2.905 -9.303 2.890 1.00 0.00 O ATOM 0 H GLY A 64 1.859 -6.269 0.670 1.00 0.00 H new ATOM 0 HA2 GLY A 64 1.303 -6.876 3.450 1.00 0.00 H new ATOM 0 HA3 GLY A 64 0.998 -7.873 2.042 1.00 0.00 H new ATOM 969 N LYS A 65 4.101 -7.392 3.065 1.00 0.00 N ATOM 970 CA LYS A 65 5.384 -8.024 3.374 1.00 0.00 C ATOM 971 C LYS A 65 5.625 -9.277 2.537 1.00 0.00 C ATOM 972 O LYS A 65 4.806 -9.649 1.698 1.00 0.00 O ATOM 973 CB LYS A 65 5.510 -8.341 4.868 1.00 0.00 C ATOM 974 CG LYS A 65 4.213 -8.759 5.539 1.00 0.00 C ATOM 975 CD LYS A 65 3.859 -10.203 5.222 1.00 0.00 C ATOM 976 CE LYS A 65 4.282 -11.139 6.343 1.00 0.00 C ATOM 977 NZ LYS A 65 3.938 -12.556 6.043 1.00 0.00 N ATOM 0 H LYS A 65 4.147 -6.374 3.031 1.00 0.00 H new ATOM 0 HA LYS A 65 6.157 -7.301 3.113 1.00 0.00 H new ATOM 0 HB2 LYS A 65 6.243 -9.138 4.996 1.00 0.00 H new ATOM 0 HB3 LYS A 65 5.902 -7.462 5.380 1.00 0.00 H new ATOM 0 HG2 LYS A 65 4.304 -8.635 6.618 1.00 0.00 H new ATOM 0 HG3 LYS A 65 3.405 -8.105 5.210 1.00 0.00 H new ATOM 0 HD2 LYS A 65 2.784 -10.288 5.061 1.00 0.00 H new ATOM 0 HD3 LYS A 65 4.345 -10.503 4.293 1.00 0.00 H new ATOM 0 HE2 LYS A 65 5.357 -11.052 6.502 1.00 0.00 H new ATOM 0 HE3 LYS A 65 3.797 -10.836 7.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 4.243 -13.162 6.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 2.910 -12.644 5.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 4.421 -12.853 5.171 1.00 0.00 H new ATOM 991 N VAL A 66 6.771 -9.910 2.748 1.00 0.00 N ATOM 992 CA VAL A 66 7.125 -11.092 2.000 1.00 0.00 C ATOM 993 C VAL A 66 7.938 -12.067 2.844 1.00 0.00 C ATOM 994 O VAL A 66 8.493 -11.697 3.879 1.00 0.00 O ATOM 995 CB VAL A 66 7.924 -10.713 0.756 1.00 0.00 C ATOM 996 CG1 VAL A 66 8.032 -11.889 -0.203 1.00 0.00 C ATOM 997 CG2 VAL A 66 7.306 -9.501 0.070 1.00 0.00 C ATOM 0 H VAL A 66 7.467 -9.618 3.434 1.00 0.00 H new ATOM 0 HA VAL A 66 6.197 -11.582 1.706 1.00 0.00 H new ATOM 0 HB VAL A 66 8.934 -10.447 1.069 1.00 0.00 H new ATOM 0 HG11 VAL A 66 8.606 -11.591 -1.080 1.00 0.00 H new ATOM 0 HG12 VAL A 66 8.534 -12.719 0.294 1.00 0.00 H new ATOM 0 HG13 VAL A 66 7.034 -12.200 -0.511 1.00 0.00 H new ATOM 0 HG21 VAL A 66 7.890 -9.246 -0.815 1.00 0.00 H new ATOM 0 HG22 VAL A 66 6.283 -9.732 -0.225 1.00 0.00 H new ATOM 0 HG23 VAL A 66 7.303 -8.656 0.758 1.00 0.00 H new ATOM 1007 N ASP A 67 8.000 -13.313 2.393 1.00 0.00 N ATOM 1008 CA ASP A 67 8.737 -14.351 3.094 1.00 0.00 C ATOM 1009 C ASP A 67 10.180 -14.419 2.616 1.00 0.00 C ATOM 1010 O ASP A 67 10.692 -15.496 2.307 1.00 0.00 O ATOM 1011 CB ASP A 67 8.053 -15.704 2.900 1.00 0.00 C ATOM 1012 CG ASP A 67 6.568 -15.655 3.206 1.00 0.00 C ATOM 1013 OD1 ASP A 67 5.891 -14.724 2.722 1.00 0.00 O ATOM 1014 OD2 ASP A 67 6.082 -16.550 3.929 1.00 0.00 O ATOM 0 H ASP A 67 7.544 -13.629 1.537 1.00 0.00 H new ATOM 0 HA ASP A 67 8.744 -14.103 4.155 1.00 0.00 H new ATOM 0 HB2 ASP A 67 8.198 -16.036 1.872 1.00 0.00 H new ATOM 0 HB3 ASP A 67 8.529 -16.443 3.544 1.00 0.00 H new ATOM 1019 N GLU A 68 10.842 -13.266 2.574 1.00 0.00 N ATOM 1020 CA GLU A 68 12.235 -13.210 2.152 1.00 0.00 C ATOM 1021 C GLU A 68 13.066 -14.194 2.967 1.00 0.00 C ATOM 1022 O GLU A 68 14.087 -14.700 2.502 1.00 0.00 O ATOM 1023 CB GLU A 68 12.787 -11.793 2.315 1.00 0.00 C ATOM 1024 CG GLU A 68 12.015 -10.745 1.530 1.00 0.00 C ATOM 1025 CD GLU A 68 12.923 -9.722 0.875 1.00 0.00 C ATOM 1026 OE1 GLU A 68 13.232 -8.700 1.524 1.00 0.00 O ATOM 1027 OE2 GLU A 68 13.324 -9.942 -0.287 1.00 0.00 O ATOM 0 H GLU A 68 10.438 -12.364 2.826 1.00 0.00 H new ATOM 0 HA GLU A 68 12.292 -13.484 1.099 1.00 0.00 H new ATOM 0 HB2 GLU A 68 12.774 -11.526 3.372 1.00 0.00 H new ATOM 0 HB3 GLU A 68 13.829 -11.779 1.996 1.00 0.00 H new ATOM 0 HG2 GLU A 68 11.417 -11.238 0.764 1.00 0.00 H new ATOM 0 HG3 GLU A 68 11.321 -10.235 2.197 1.00 0.00 H new ATOM 1034 N SER A 69 12.605 -14.474 4.186 1.00 0.00 N ATOM 1035 CA SER A 69 13.289 -15.411 5.064 1.00 0.00 C ATOM 1036 C SER A 69 12.293 -16.290 5.808 1.00 0.00 C ATOM 1037 O SER A 69 12.593 -16.831 6.872 1.00 0.00 O ATOM 1038 CB SER A 69 14.187 -14.668 6.054 1.00 0.00 C ATOM 1039 OG SER A 69 15.379 -15.392 6.305 1.00 0.00 O ATOM 0 H SER A 69 11.760 -14.063 4.584 1.00 0.00 H new ATOM 0 HA SER A 69 13.914 -16.054 4.444 1.00 0.00 H new ATOM 0 HB2 SER A 69 14.433 -13.683 5.658 1.00 0.00 H new ATOM 0 HB3 SER A 69 13.650 -14.510 6.989 1.00 0.00 H new ATOM 0 HG SER A 69 15.936 -14.895 6.940 1.00 0.00 H new ATOM 1045 N LYS A 70 11.111 -16.436 5.227 1.00 0.00 N ATOM 1046 CA LYS A 70 10.061 -17.262 5.814 1.00 0.00 C ATOM 1047 C LYS A 70 9.436 -18.180 4.762 1.00 0.00 C ATOM 1048 O LYS A 70 8.407 -18.810 5.006 1.00 0.00 O ATOM 1049 CB LYS A 70 8.981 -16.379 6.444 1.00 0.00 C ATOM 1050 CG LYS A 70 8.424 -16.934 7.744 1.00 0.00 C ATOM 1051 CD LYS A 70 9.253 -16.492 8.939 1.00 0.00 C ATOM 1052 CE LYS A 70 10.365 -17.484 9.243 1.00 0.00 C ATOM 1053 NZ LYS A 70 10.825 -17.386 10.656 1.00 0.00 N ATOM 0 H LYS A 70 10.853 -15.992 4.346 1.00 0.00 H new ATOM 0 HA LYS A 70 10.512 -17.882 6.589 1.00 0.00 H new ATOM 0 HB2 LYS A 70 9.396 -15.388 6.630 1.00 0.00 H new ATOM 0 HB3 LYS A 70 8.165 -16.254 5.733 1.00 0.00 H new ATOM 0 HG2 LYS A 70 7.394 -16.601 7.871 1.00 0.00 H new ATOM 0 HG3 LYS A 70 8.403 -18.023 7.697 1.00 0.00 H new ATOM 0 HD2 LYS A 70 9.684 -15.510 8.741 1.00 0.00 H new ATOM 0 HD3 LYS A 70 8.608 -16.388 9.812 1.00 0.00 H new ATOM 0 HE2 LYS A 70 10.013 -18.496 9.045 1.00 0.00 H new ATOM 0 HE3 LYS A 70 11.206 -17.303 8.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 11.583 -18.078 10.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 11.185 -16.427 10.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 10.029 -17.584 11.295 1.00 0.00 H new ATOM 1067 N LYS A 71 10.063 -18.243 3.586 1.00 0.00 N ATOM 1068 CA LYS A 71 9.575 -19.073 2.486 1.00 0.00 C ATOM 1069 C LYS A 71 9.201 -20.474 2.960 1.00 0.00 C ATOM 1070 O LYS A 71 9.624 -20.916 4.028 1.00 0.00 O ATOM 1071 CB LYS A 71 10.637 -19.168 1.390 1.00 0.00 C ATOM 1072 CG LYS A 71 12.040 -19.415 1.924 1.00 0.00 C ATOM 1073 CD LYS A 71 13.030 -18.394 1.386 1.00 0.00 C ATOM 1074 CE LYS A 71 14.466 -18.837 1.611 1.00 0.00 C ATOM 1075 NZ LYS A 71 15.065 -18.193 2.812 1.00 0.00 N ATOM 0 H LYS A 71 10.915 -17.725 3.371 1.00 0.00 H new ATOM 0 HA LYS A 71 8.677 -18.600 2.089 1.00 0.00 H new ATOM 0 HB2 LYS A 71 10.370 -19.973 0.706 1.00 0.00 H new ATOM 0 HB3 LYS A 71 10.634 -18.244 0.812 1.00 0.00 H new ATOM 0 HG2 LYS A 71 12.028 -19.373 3.013 1.00 0.00 H new ATOM 0 HG3 LYS A 71 12.364 -20.418 1.647 1.00 0.00 H new ATOM 0 HD2 LYS A 71 12.857 -18.245 0.320 1.00 0.00 H new ATOM 0 HD3 LYS A 71 12.864 -17.433 1.873 1.00 0.00 H new ATOM 0 HE2 LYS A 71 14.498 -19.920 1.726 1.00 0.00 H new ATOM 0 HE3 LYS A 71 15.063 -18.593 0.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 16.045 -18.522 2.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 15.059 -17.160 2.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 14.511 -18.447 3.655 1.00 0.00 H new ATOM 1089 N ARG A 72 8.408 -21.167 2.150 1.00 0.00 N ATOM 1090 CA ARG A 72 7.975 -22.515 2.466 1.00 0.00 C ATOM 1091 C ARG A 72 8.757 -23.537 1.646 1.00 0.00 C ATOM 1092 O ARG A 72 9.499 -23.174 0.734 1.00 0.00 O ATOM 1093 CB ARG A 72 6.476 -22.670 2.207 1.00 0.00 C ATOM 1094 CG ARG A 72 6.090 -22.511 0.745 1.00 0.00 C ATOM 1095 CD ARG A 72 5.563 -21.115 0.455 1.00 0.00 C ATOM 1096 NE ARG A 72 4.402 -21.142 -0.431 1.00 0.00 N ATOM 1097 CZ ARG A 72 3.166 -21.427 -0.027 1.00 0.00 C ATOM 1098 NH1 ARG A 72 2.927 -21.710 1.248 1.00 0.00 N ATOM 1099 NH2 ARG A 72 2.167 -21.429 -0.899 1.00 0.00 N ATOM 0 H ARG A 72 8.052 -20.810 1.263 1.00 0.00 H new ATOM 0 HA ARG A 72 8.169 -22.696 3.523 1.00 0.00 H new ATOM 0 HB2 ARG A 72 6.156 -23.653 2.554 1.00 0.00 H new ATOM 0 HB3 ARG A 72 5.935 -21.931 2.799 1.00 0.00 H new ATOM 0 HG2 ARG A 72 6.957 -22.712 0.115 1.00 0.00 H new ATOM 0 HG3 ARG A 72 5.330 -23.249 0.486 1.00 0.00 H new ATOM 0 HD2 ARG A 72 5.293 -20.627 1.392 1.00 0.00 H new ATOM 0 HD3 ARG A 72 6.352 -20.517 0.000 1.00 0.00 H new ATOM 0 HE ARG A 72 4.547 -20.930 -1.418 1.00 0.00 H new ATOM 0 HH11 ARG A 72 3.692 -21.710 1.923 1.00 0.00 H new ATOM 0 HH12 ARG A 72 1.978 -21.928 1.553 1.00 0.00 H new ATOM 0 HH21 ARG A 72 2.346 -21.212 -1.880 1.00 0.00 H new ATOM 0 HH22 ARG A 72 1.220 -21.647 -0.589 1.00 0.00 H new ATOM 1113 N LYS A 73 8.587 -24.813 1.973 1.00 0.00 N ATOM 1114 CA LYS A 73 9.279 -25.876 1.260 1.00 0.00 C ATOM 1115 C LYS A 73 8.463 -27.164 1.258 1.00 0.00 C ATOM 1116 O LYS A 73 7.583 -27.359 2.096 1.00 0.00 O ATOM 1117 CB LYS A 73 10.665 -26.132 1.868 1.00 0.00 C ATOM 1118 CG LYS A 73 10.837 -25.591 3.280 1.00 0.00 C ATOM 1119 CD LYS A 73 9.752 -26.107 4.210 1.00 0.00 C ATOM 1120 CE LYS A 73 10.282 -27.185 5.143 1.00 0.00 C ATOM 1121 NZ LYS A 73 11.113 -26.613 6.238 1.00 0.00 N ATOM 0 H LYS A 73 7.978 -25.134 2.725 1.00 0.00 H new ATOM 0 HA LYS A 73 9.405 -25.548 0.228 1.00 0.00 H new ATOM 0 HB2 LYS A 73 10.853 -27.206 1.877 1.00 0.00 H new ATOM 0 HB3 LYS A 73 11.421 -25.682 1.224 1.00 0.00 H new ATOM 0 HG2 LYS A 73 11.815 -25.880 3.665 1.00 0.00 H new ATOM 0 HG3 LYS A 73 10.812 -24.501 3.259 1.00 0.00 H new ATOM 0 HD2 LYS A 73 9.352 -25.281 4.798 1.00 0.00 H new ATOM 0 HD3 LYS A 73 8.927 -26.508 3.621 1.00 0.00 H new ATOM 0 HE2 LYS A 73 9.446 -27.737 5.572 1.00 0.00 H new ATOM 0 HE3 LYS A 73 10.875 -27.899 4.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 11.455 -27.380 6.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 11.925 -26.108 5.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 10.540 -25.951 6.799 1.00 0.00 H new ATOM 1135 N ASP A 74 8.765 -28.039 0.305 1.00 0.00 N ATOM 1136 CA ASP A 74 8.066 -29.313 0.184 1.00 0.00 C ATOM 1137 C ASP A 74 9.023 -30.414 -0.263 1.00 0.00 C ATOM 1138 O ASP A 74 9.424 -31.263 0.534 1.00 0.00 O ATOM 1139 CB ASP A 74 6.907 -29.192 -0.808 1.00 0.00 C ATOM 1140 CG ASP A 74 5.587 -28.898 -0.124 1.00 0.00 C ATOM 1141 OD1 ASP A 74 5.609 -28.444 1.040 1.00 0.00 O ATOM 1142 OD2 ASP A 74 4.530 -29.122 -0.751 1.00 0.00 O ATOM 0 H ASP A 74 9.491 -27.889 -0.396 1.00 0.00 H new ATOM 0 HA ASP A 74 7.667 -29.577 1.164 1.00 0.00 H new ATOM 0 HB2 ASP A 74 7.126 -28.399 -1.523 1.00 0.00 H new ATOM 0 HB3 ASP A 74 6.820 -30.119 -1.375 1.00 0.00 H new ATOM 1147 N ASN A 75 9.385 -30.392 -1.541 1.00 0.00 N ATOM 1148 CA ASN A 75 10.297 -31.388 -2.094 1.00 0.00 C ATOM 1149 C ASN A 75 10.668 -31.048 -3.535 1.00 0.00 C ATOM 1150 O ASN A 75 10.859 -31.939 -4.363 1.00 0.00 O ATOM 1151 CB ASN A 75 9.663 -32.778 -2.034 1.00 0.00 C ATOM 1152 CG ASN A 75 10.674 -33.861 -1.710 1.00 0.00 C ATOM 1153 OD1 ASN A 75 11.416 -34.314 -2.582 1.00 0.00 O ATOM 1154 ND2 ASN A 75 10.707 -34.282 -0.451 1.00 0.00 N ATOM 0 H ASN A 75 9.062 -29.696 -2.213 1.00 0.00 H new ATOM 0 HA ASN A 75 11.207 -31.384 -1.493 1.00 0.00 H new ATOM 0 HB2 ASN A 75 8.875 -32.783 -1.281 1.00 0.00 H new ATOM 0 HB3 ASN A 75 9.190 -33.000 -2.991 1.00 0.00 H new ATOM 0 HD21 ASN A 75 11.366 -35.009 -0.174 1.00 0.00 H new ATOM 0 HD22 ASN A 75 10.073 -33.878 0.239 1.00 0.00 H new ATOM 1161 N GLU A 76 10.769 -29.755 -3.828 1.00 0.00 N ATOM 1162 CA GLU A 76 11.119 -29.302 -5.170 1.00 0.00 C ATOM 1163 C GLU A 76 12.595 -28.928 -5.258 1.00 0.00 C ATOM 1164 O GLU A 76 13.185 -28.938 -6.339 1.00 0.00 O ATOM 1165 CB GLU A 76 10.248 -28.107 -5.569 1.00 0.00 C ATOM 1166 CG GLU A 76 9.566 -28.277 -6.916 1.00 0.00 C ATOM 1167 CD GLU A 76 8.772 -27.052 -7.326 1.00 0.00 C ATOM 1168 OE1 GLU A 76 9.045 -25.960 -6.786 1.00 0.00 O ATOM 1169 OE2 GLU A 76 7.877 -27.185 -8.187 1.00 0.00 O ATOM 0 H GLU A 76 10.614 -29.004 -3.156 1.00 0.00 H new ATOM 0 HA GLU A 76 10.936 -30.124 -5.862 1.00 0.00 H new ATOM 0 HB2 GLU A 76 9.488 -27.950 -4.803 1.00 0.00 H new ATOM 0 HB3 GLU A 76 10.866 -27.209 -5.594 1.00 0.00 H new ATOM 0 HG2 GLU A 76 10.318 -28.489 -7.676 1.00 0.00 H new ATOM 0 HG3 GLU A 76 8.901 -29.140 -6.876 1.00 0.00 H new ATOM 1176 N GLY A 77 13.185 -28.598 -4.116 1.00 0.00 N ATOM 1177 CA GLY A 77 14.587 -28.223 -4.083 1.00 0.00 C ATOM 1178 C GLY A 77 14.794 -26.803 -3.596 1.00 0.00 C ATOM 1179 O GLY A 77 15.737 -26.525 -2.854 1.00 0.00 O ATOM 0 H GLY A 77 12.717 -28.583 -3.210 1.00 0.00 H new ATOM 0 HA2 GLY A 77 15.129 -28.910 -3.433 1.00 0.00 H new ATOM 0 HA3 GLY A 77 15.012 -28.327 -5.081 1.00 0.00 H new ATOM 1183 N ASN A 78 13.911 -25.902 -4.013 1.00 0.00 N ATOM 1184 CA ASN A 78 13.998 -24.502 -3.614 1.00 0.00 C ATOM 1185 C ASN A 78 12.870 -24.142 -2.653 1.00 0.00 C ATOM 1186 O ASN A 78 11.854 -24.834 -2.587 1.00 0.00 O ATOM 1187 CB ASN A 78 13.945 -23.595 -4.845 1.00 0.00 C ATOM 1188 CG ASN A 78 15.200 -23.692 -5.689 1.00 0.00 C ATOM 1189 OD1 ASN A 78 16.063 -22.815 -5.642 1.00 0.00 O ATOM 1190 ND2 ASN A 78 15.308 -24.762 -6.469 1.00 0.00 N ATOM 0 H ASN A 78 13.126 -26.117 -4.628 1.00 0.00 H new ATOM 0 HA ASN A 78 14.949 -24.352 -3.103 1.00 0.00 H new ATOM 0 HB2 ASN A 78 13.080 -23.862 -5.453 1.00 0.00 H new ATOM 0 HB3 ASN A 78 13.804 -22.562 -4.526 1.00 0.00 H new ATOM 0 HD21 ASN A 78 16.131 -24.881 -7.060 1.00 0.00 H new ATOM 0 HD22 ASN A 78 14.568 -25.464 -6.476 1.00 0.00 H new ATOM 1197 N GLU A 79 13.054 -23.057 -1.908 1.00 0.00 N ATOM 1198 CA GLU A 79 12.057 -22.609 -0.954 1.00 0.00 C ATOM 1199 C GLU A 79 11.752 -21.128 -1.140 1.00 0.00 C ATOM 1200 O GLU A 79 12.456 -20.267 -0.613 1.00 0.00 O ATOM 1201 CB GLU A 79 12.536 -22.867 0.476 1.00 0.00 C ATOM 1202 CG GLU A 79 13.269 -24.188 0.647 1.00 0.00 C ATOM 1203 CD GLU A 79 14.772 -24.041 0.518 1.00 0.00 C ATOM 1204 OE1 GLU A 79 15.228 -23.478 -0.500 1.00 0.00 O ATOM 1205 OE2 GLU A 79 15.494 -24.489 1.433 1.00 0.00 O ATOM 0 H GLU A 79 13.889 -22.473 -1.950 1.00 0.00 H new ATOM 0 HA GLU A 79 11.142 -23.175 -1.131 1.00 0.00 H new ATOM 0 HB2 GLU A 79 13.195 -22.054 0.781 1.00 0.00 H new ATOM 0 HB3 GLU A 79 11.677 -22.849 1.146 1.00 0.00 H new ATOM 0 HG2 GLU A 79 13.031 -24.607 1.625 1.00 0.00 H new ATOM 0 HG3 GLU A 79 12.911 -24.897 -0.100 1.00 0.00 H new ATOM 1212 N VAL A 80 10.703 -20.838 -1.901 1.00 0.00 N ATOM 1213 CA VAL A 80 10.308 -19.466 -2.163 1.00 0.00 C ATOM 1214 C VAL A 80 8.817 -19.255 -1.922 1.00 0.00 C ATOM 1215 O VAL A 80 8.026 -20.197 -1.980 1.00 0.00 O ATOM 1216 CB VAL A 80 10.661 -19.026 -3.600 1.00 0.00 C ATOM 1217 CG1 VAL A 80 11.759 -17.973 -3.576 1.00 0.00 C ATOM 1218 CG2 VAL A 80 11.075 -20.221 -4.452 1.00 0.00 C ATOM 0 H VAL A 80 10.112 -21.539 -2.347 1.00 0.00 H new ATOM 0 HA VAL A 80 10.872 -18.849 -1.463 1.00 0.00 H new ATOM 0 HB VAL A 80 9.771 -18.588 -4.052 1.00 0.00 H new ATOM 0 HG11 VAL A 80 11.997 -17.672 -4.596 1.00 0.00 H new ATOM 0 HG12 VAL A 80 11.418 -17.105 -3.012 1.00 0.00 H new ATOM 0 HG13 VAL A 80 12.649 -18.386 -3.102 1.00 0.00 H new ATOM 0 HG21 VAL A 80 11.318 -19.883 -5.459 1.00 0.00 H new ATOM 0 HG22 VAL A 80 11.949 -20.699 -4.009 1.00 0.00 H new ATOM 0 HG23 VAL A 80 10.254 -20.937 -4.498 1.00 0.00 H new ATOM 1228 N VAL A 81 8.445 -18.010 -1.651 1.00 0.00 N ATOM 1229 CA VAL A 81 7.060 -17.657 -1.398 1.00 0.00 C ATOM 1230 C VAL A 81 6.421 -17.009 -2.626 1.00 0.00 C ATOM 1231 O VAL A 81 7.056 -16.212 -3.317 1.00 0.00 O ATOM 1232 CB VAL A 81 6.946 -16.694 -0.199 1.00 0.00 C ATOM 1233 CG1 VAL A 81 7.738 -15.421 -0.458 1.00 0.00 C ATOM 1234 CG2 VAL A 81 5.489 -16.371 0.108 1.00 0.00 C ATOM 0 H VAL A 81 9.093 -17.224 -1.601 1.00 0.00 H new ATOM 0 HA VAL A 81 6.530 -18.581 -1.168 1.00 0.00 H new ATOM 0 HB VAL A 81 7.369 -17.190 0.674 1.00 0.00 H new ATOM 0 HG11 VAL A 81 7.645 -14.754 0.399 1.00 0.00 H new ATOM 0 HG12 VAL A 81 8.788 -15.671 -0.612 1.00 0.00 H new ATOM 0 HG13 VAL A 81 7.349 -14.925 -1.347 1.00 0.00 H new ATOM 0 HG21 VAL A 81 5.438 -15.690 0.958 1.00 0.00 H new ATOM 0 HG22 VAL A 81 5.030 -15.901 -0.761 1.00 0.00 H new ATOM 0 HG23 VAL A 81 4.955 -17.291 0.348 1.00 0.00 H new ATOM 1244 N PRO A 82 5.150 -17.340 -2.916 1.00 0.00 N ATOM 1245 CA PRO A 82 4.429 -16.780 -4.063 1.00 0.00 C ATOM 1246 C PRO A 82 4.480 -15.254 -4.083 1.00 0.00 C ATOM 1247 O PRO A 82 5.150 -14.635 -3.257 1.00 0.00 O ATOM 1248 CB PRO A 82 2.984 -17.267 -3.868 1.00 0.00 C ATOM 1249 CG PRO A 82 2.925 -17.801 -2.474 1.00 0.00 C ATOM 1250 CD PRO A 82 4.311 -18.277 -2.156 1.00 0.00 C ATOM 0 HA PRO A 82 4.867 -17.097 -5.009 1.00 0.00 H new ATOM 0 HB2 PRO A 82 2.274 -16.452 -4.006 1.00 0.00 H new ATOM 0 HB3 PRO A 82 2.729 -18.039 -4.594 1.00 0.00 H new ATOM 0 HG2 PRO A 82 2.607 -17.029 -1.773 1.00 0.00 H new ATOM 0 HG3 PRO A 82 2.205 -18.616 -2.398 1.00 0.00 H new ATOM 0 HD2 PRO A 82 4.520 -18.234 -1.087 1.00 0.00 H new ATOM 0 HD3 PRO A 82 4.468 -19.309 -2.470 1.00 0.00 H new ATOM 1258 N LYS A 83 3.772 -14.654 -5.034 1.00 0.00 N ATOM 1259 CA LYS A 83 3.742 -13.201 -5.163 1.00 0.00 C ATOM 1260 C LYS A 83 2.977 -12.559 -4.004 1.00 0.00 C ATOM 1261 O LYS A 83 1.795 -12.838 -3.804 1.00 0.00 O ATOM 1262 CB LYS A 83 3.101 -12.801 -6.493 1.00 0.00 C ATOM 1263 CG LYS A 83 3.710 -13.501 -7.697 1.00 0.00 C ATOM 1264 CD LYS A 83 5.134 -13.032 -7.951 1.00 0.00 C ATOM 1265 CE LYS A 83 5.966 -14.116 -8.618 1.00 0.00 C ATOM 1266 NZ LYS A 83 6.801 -14.859 -7.634 1.00 0.00 N ATOM 0 H LYS A 83 3.212 -15.151 -5.726 1.00 0.00 H new ATOM 0 HA LYS A 83 4.770 -12.841 -5.136 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.035 -13.024 -6.454 1.00 0.00 H new ATOM 0 HB3 LYS A 83 3.197 -11.723 -6.623 1.00 0.00 H new ATOM 0 HG2 LYS A 83 3.704 -14.579 -7.534 1.00 0.00 H new ATOM 0 HG3 LYS A 83 3.099 -13.308 -8.579 1.00 0.00 H new ATOM 0 HD2 LYS A 83 5.119 -12.143 -8.582 1.00 0.00 H new ATOM 0 HD3 LYS A 83 5.598 -12.745 -7.007 1.00 0.00 H new ATOM 0 HE2 LYS A 83 5.307 -14.813 -9.135 1.00 0.00 H new ATOM 0 HE3 LYS A 83 6.610 -13.666 -9.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 7.353 -15.589 -8.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 7.448 -14.198 -7.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 6.186 -15.310 -6.927 1.00 0.00 H new ATOM 1280 N PRO A 84 3.641 -11.686 -3.222 1.00 0.00 N ATOM 1281 CA PRO A 84 3.013 -11.007 -2.083 1.00 0.00 C ATOM 1282 C PRO A 84 1.791 -10.192 -2.490 1.00 0.00 C ATOM 1283 O PRO A 84 1.646 -9.806 -3.649 1.00 0.00 O ATOM 1284 CB PRO A 84 4.110 -10.082 -1.553 1.00 0.00 C ATOM 1285 CG PRO A 84 5.384 -10.664 -2.060 1.00 0.00 C ATOM 1286 CD PRO A 84 5.052 -11.292 -3.384 1.00 0.00 C ATOM 0 HA PRO A 84 2.650 -11.723 -1.346 1.00 0.00 H new ATOM 0 HB2 PRO A 84 3.973 -9.062 -1.911 1.00 0.00 H new ATOM 0 HB3 PRO A 84 4.100 -10.042 -0.464 1.00 0.00 H new ATOM 0 HG2 PRO A 84 6.147 -9.894 -2.173 1.00 0.00 H new ATOM 0 HG3 PRO A 84 5.779 -11.405 -1.365 1.00 0.00 H new ATOM 0 HD2 PRO A 84 5.183 -10.590 -4.207 1.00 0.00 H new ATOM 0 HD3 PRO A 84 5.689 -12.151 -3.594 1.00 0.00 H new ATOM 1294 N GLN A 85 0.916 -9.936 -1.524 1.00 0.00 N ATOM 1295 CA GLN A 85 -0.290 -9.172 -1.765 1.00 0.00 C ATOM 1296 C GLN A 85 -0.254 -7.838 -1.024 1.00 0.00 C ATOM 1297 O GLN A 85 -0.245 -7.800 0.206 1.00 0.00 O ATOM 1298 CB GLN A 85 -1.523 -9.974 -1.344 1.00 0.00 C ATOM 1299 CG GLN A 85 -1.571 -11.372 -1.938 1.00 0.00 C ATOM 1300 CD GLN A 85 -2.474 -11.458 -3.153 1.00 0.00 C ATOM 1301 OE1 GLN A 85 -3.673 -11.712 -3.033 1.00 0.00 O ATOM 1302 NE2 GLN A 85 -1.901 -11.247 -4.332 1.00 0.00 N ATOM 0 H GLN A 85 1.026 -10.252 -0.560 1.00 0.00 H new ATOM 0 HA GLN A 85 -0.348 -8.967 -2.834 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -1.543 -10.049 -0.257 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -2.419 -9.430 -1.643 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -0.563 -11.679 -2.216 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -1.920 -12.073 -1.180 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -0.904 -11.039 -4.385 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -2.458 -11.292 -5.185 1.00 0.00 H new ATOM 1311 N ARG A 86 -0.235 -6.746 -1.781 1.00 0.00 N ATOM 1312 CA ARG A 86 -0.201 -5.408 -1.198 1.00 0.00 C ATOM 1313 C ARG A 86 -1.508 -4.663 -1.466 1.00 0.00 C ATOM 1314 O ARG A 86 -2.262 -5.018 -2.373 1.00 0.00 O ATOM 1315 CB ARG A 86 0.988 -4.617 -1.753 1.00 0.00 C ATOM 1316 CG ARG A 86 0.837 -4.201 -3.207 1.00 0.00 C ATOM 1317 CD ARG A 86 1.094 -5.362 -4.155 1.00 0.00 C ATOM 1318 NE ARG A 86 -0.124 -5.786 -4.843 1.00 0.00 N ATOM 1319 CZ ARG A 86 -0.211 -6.889 -5.582 1.00 0.00 C ATOM 1320 NH1 ARG A 86 0.843 -7.682 -5.733 1.00 0.00 N ATOM 1321 NH2 ARG A 86 -1.357 -7.202 -6.173 1.00 0.00 N ATOM 0 H ARG A 86 -0.243 -6.761 -2.801 1.00 0.00 H new ATOM 0 HA ARG A 86 -0.083 -5.509 -0.119 1.00 0.00 H new ATOM 0 HB2 ARG A 86 1.131 -3.724 -1.145 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.890 -5.220 -1.651 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -0.168 -3.813 -3.372 1.00 0.00 H new ATOM 0 HG3 ARG A 86 1.532 -3.391 -3.428 1.00 0.00 H new ATOM 0 HD2 ARG A 86 1.843 -5.070 -4.891 1.00 0.00 H new ATOM 0 HD3 ARG A 86 1.506 -6.202 -3.596 1.00 0.00 H new ATOM 0 HE ARG A 86 -0.956 -5.202 -4.751 1.00 0.00 H new ATOM 0 HH11 ARG A 86 1.727 -7.447 -5.281 1.00 0.00 H new ATOM 0 HH12 ARG A 86 0.769 -8.526 -6.301 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -2.171 -6.597 -6.061 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -1.424 -8.047 -6.740 1.00 0.00 H new ATOM 1335 N HIS A 87 -1.770 -3.630 -0.671 1.00 0.00 N ATOM 1336 CA HIS A 87 -2.987 -2.834 -0.820 1.00 0.00 C ATOM 1337 C HIS A 87 -2.645 -1.394 -1.188 1.00 0.00 C ATOM 1338 O HIS A 87 -1.652 -0.845 -0.714 1.00 0.00 O ATOM 1339 CB HIS A 87 -3.810 -2.858 0.472 1.00 0.00 C ATOM 1340 CG HIS A 87 -3.716 -4.148 1.227 1.00 0.00 C ATOM 1341 ND1 HIS A 87 -4.386 -5.293 0.849 1.00 0.00 N ATOM 1342 CD2 HIS A 87 -3.024 -4.471 2.346 1.00 0.00 C ATOM 1343 CE1 HIS A 87 -4.111 -6.264 1.703 1.00 0.00 C ATOM 1344 NE2 HIS A 87 -3.287 -5.791 2.619 1.00 0.00 N ATOM 0 H HIS A 87 -1.156 -3.323 0.084 1.00 0.00 H new ATOM 0 HA HIS A 87 -3.580 -3.272 -1.623 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -3.478 -2.045 1.118 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -4.855 -2.666 0.229 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -2.385 -3.813 2.917 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -4.495 -7.272 1.659 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -2.907 -6.321 3.403 1.00 0.00 H new ATOM 1353 N MET A 88 -3.465 -0.788 -2.042 1.00 0.00 N ATOM 1354 CA MET A 88 -3.230 0.585 -2.472 1.00 0.00 C ATOM 1355 C MET A 88 -4.512 1.418 -2.442 1.00 0.00 C ATOM 1356 O MET A 88 -5.590 0.930 -2.781 1.00 0.00 O ATOM 1357 CB MET A 88 -2.626 0.594 -3.881 1.00 0.00 C ATOM 1358 CG MET A 88 -3.641 0.336 -4.986 1.00 0.00 C ATOM 1359 SD MET A 88 -3.034 -0.798 -6.258 1.00 0.00 S ATOM 1360 CE MET A 88 -3.812 -0.134 -7.734 1.00 0.00 C ATOM 0 H MET A 88 -4.293 -1.224 -2.447 1.00 0.00 H new ATOM 0 HA MET A 88 -2.528 1.038 -1.772 1.00 0.00 H new ATOM 0 HB2 MET A 88 -2.150 1.559 -4.056 1.00 0.00 H new ATOM 0 HB3 MET A 88 -1.843 -0.163 -3.936 1.00 0.00 H new ATOM 0 HG2 MET A 88 -4.551 -0.074 -4.547 1.00 0.00 H new ATOM 0 HG3 MET A 88 -3.911 1.284 -5.452 1.00 0.00 H new ATOM 0 HE1 MET A 88 -3.102 -0.155 -8.561 1.00 0.00 H new ATOM 0 HE2 MET A 88 -4.683 -0.737 -7.989 1.00 0.00 H new ATOM 0 HE3 MET A 88 -4.124 0.894 -7.550 1.00 0.00 H new ATOM 1370 N PHE A 89 -4.379 2.685 -2.053 1.00 0.00 N ATOM 1371 CA PHE A 89 -5.517 3.597 -1.998 1.00 0.00 C ATOM 1372 C PHE A 89 -5.054 5.042 -2.188 1.00 0.00 C ATOM 1373 O PHE A 89 -3.948 5.407 -1.789 1.00 0.00 O ATOM 1374 CB PHE A 89 -6.302 3.425 -0.689 1.00 0.00 C ATOM 1375 CG PHE A 89 -5.538 3.744 0.567 1.00 0.00 C ATOM 1376 CD1 PHE A 89 -4.287 3.197 0.809 1.00 0.00 C ATOM 1377 CD2 PHE A 89 -6.091 4.586 1.518 1.00 0.00 C ATOM 1378 CE1 PHE A 89 -3.604 3.486 1.976 1.00 0.00 C ATOM 1379 CE2 PHE A 89 -5.414 4.880 2.685 1.00 0.00 C ATOM 1380 CZ PHE A 89 -4.168 4.329 2.915 1.00 0.00 C ATOM 0 H PHE A 89 -3.492 3.103 -1.771 1.00 0.00 H new ATOM 0 HA PHE A 89 -6.194 3.351 -2.816 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -7.186 4.062 -0.728 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -6.654 2.395 -0.629 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -3.841 2.538 0.078 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -7.065 5.019 1.344 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.631 3.053 2.154 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -5.858 5.539 3.416 1.00 0.00 H new ATOM 0 HZ PHE A 89 -3.636 4.557 3.827 1.00 0.00 H new ATOM 1390 N SER A 90 -5.894 5.851 -2.835 1.00 0.00 N ATOM 1391 CA SER A 90 -5.556 7.246 -3.119 1.00 0.00 C ATOM 1392 C SER A 90 -6.046 8.196 -2.030 1.00 0.00 C ATOM 1393 O SER A 90 -7.048 7.939 -1.367 1.00 0.00 O ATOM 1394 CB SER A 90 -6.148 7.663 -4.466 1.00 0.00 C ATOM 1395 OG SER A 90 -5.598 8.892 -4.907 1.00 0.00 O ATOM 0 H SER A 90 -6.813 5.564 -3.172 1.00 0.00 H new ATOM 0 HA SER A 90 -4.469 7.313 -3.150 1.00 0.00 H new ATOM 0 HB2 SER A 90 -5.954 6.888 -5.207 1.00 0.00 H new ATOM 0 HB3 SER A 90 -7.230 7.756 -4.378 1.00 0.00 H new ATOM 0 HG SER A 90 -5.992 9.135 -5.771 1.00 0.00 H new ATOM 1401 N PHE A 91 -5.324 9.303 -1.862 1.00 0.00 N ATOM 1402 CA PHE A 91 -5.671 10.311 -0.865 1.00 0.00 C ATOM 1403 C PHE A 91 -6.079 11.618 -1.534 1.00 0.00 C ATOM 1404 O PHE A 91 -5.928 11.782 -2.745 1.00 0.00 O ATOM 1405 CB PHE A 91 -4.487 10.564 0.069 1.00 0.00 C ATOM 1406 CG PHE A 91 -4.271 9.472 1.073 1.00 0.00 C ATOM 1407 CD1 PHE A 91 -4.132 8.158 0.662 1.00 0.00 C ATOM 1408 CD2 PHE A 91 -4.209 9.759 2.426 1.00 0.00 C ATOM 1409 CE1 PHE A 91 -3.933 7.150 1.582 1.00 0.00 C ATOM 1410 CE2 PHE A 91 -4.011 8.754 3.353 1.00 0.00 C ATOM 1411 CZ PHE A 91 -3.873 7.447 2.930 1.00 0.00 C ATOM 0 H PHE A 91 -4.491 9.524 -2.407 1.00 0.00 H new ATOM 0 HA PHE A 91 -6.514 9.934 -0.286 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -3.583 10.681 -0.528 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -4.645 11.505 0.596 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -4.180 7.919 -0.390 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -4.317 10.780 2.761 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -3.824 6.128 1.249 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -3.964 8.990 4.406 1.00 0.00 H new ATOM 0 HZ PHE A 91 -3.718 6.658 3.651 1.00 0.00 H new ATOM 1421 N ASN A 92 -6.591 12.549 -0.736 1.00 0.00 N ATOM 1422 CA ASN A 92 -7.014 13.846 -1.250 1.00 0.00 C ATOM 1423 C ASN A 92 -6.644 14.962 -0.278 1.00 0.00 C ATOM 1424 O ASN A 92 -7.393 15.923 -0.105 1.00 0.00 O ATOM 1425 CB ASN A 92 -8.522 13.851 -1.505 1.00 0.00 C ATOM 1426 CG ASN A 92 -8.941 12.808 -2.523 1.00 0.00 C ATOM 1427 OD1 ASN A 92 -8.562 12.879 -3.692 1.00 0.00 O ATOM 1428 ND2 ASN A 92 -9.727 11.833 -2.083 1.00 0.00 N ATOM 0 H ASN A 92 -6.723 12.429 0.268 1.00 0.00 H new ATOM 0 HA ASN A 92 -6.495 14.023 -2.192 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -9.047 13.670 -0.567 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -8.825 14.838 -1.855 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -10.041 11.103 -2.723 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -10.017 11.814 -1.105 1.00 0.00 H new ATOM 1435 N ASN A 93 -5.482 14.826 0.354 1.00 0.00 N ATOM 1436 CA ASN A 93 -5.008 15.820 1.309 1.00 0.00 C ATOM 1437 C ASN A 93 -3.618 15.456 1.824 1.00 0.00 C ATOM 1438 O ASN A 93 -3.401 14.352 2.325 1.00 0.00 O ATOM 1439 CB ASN A 93 -5.988 15.943 2.478 1.00 0.00 C ATOM 1440 CG ASN A 93 -6.721 17.270 2.481 1.00 0.00 C ATOM 1441 OD1 ASN A 93 -7.980 17.251 2.058 1.00 0.00 O flip ATOM 1442 ND2 ASN A 93 -6.164 18.301 2.858 1.00 0.00 N flip ATOM 0 H ASN A 93 -4.851 14.036 0.221 1.00 0.00 H new ATOM 0 HA ASN A 93 -4.945 16.781 0.799 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -6.713 15.131 2.428 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -5.446 15.828 3.417 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -5.195 18.270 3.175 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -6.671 19.186 2.853 1.00 0.00 H new ATOM 1449 N ARG A 94 -2.681 16.389 1.692 1.00 0.00 N ATOM 1450 CA ARG A 94 -1.308 16.168 2.138 1.00 0.00 C ATOM 1451 C ARG A 94 -1.262 15.772 3.610 1.00 0.00 C ATOM 1452 O ARG A 94 -0.635 14.778 3.976 1.00 0.00 O ATOM 1453 CB ARG A 94 -0.469 17.426 1.911 1.00 0.00 C ATOM 1454 CG ARG A 94 0.974 17.135 1.532 1.00 0.00 C ATOM 1455 CD ARG A 94 1.163 17.126 0.023 1.00 0.00 C ATOM 1456 NE ARG A 94 2.482 17.617 -0.366 1.00 0.00 N ATOM 1457 CZ ARG A 94 2.895 18.867 -0.173 1.00 0.00 C ATOM 1458 NH1 ARG A 94 2.095 19.756 0.405 1.00 0.00 N ATOM 1459 NH2 ARG A 94 4.111 19.231 -0.557 1.00 0.00 N ATOM 0 H ARG A 94 -2.847 17.307 1.279 1.00 0.00 H new ATOM 0 HA ARG A 94 -0.893 15.348 1.551 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -0.929 18.022 1.123 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -0.483 18.030 2.818 1.00 0.00 H new ATOM 0 HG2 ARG A 94 1.627 17.886 1.977 1.00 0.00 H new ATOM 0 HG3 ARG A 94 1.272 16.170 1.943 1.00 0.00 H new ATOM 0 HD2 ARG A 94 1.028 16.112 -0.353 1.00 0.00 H new ATOM 0 HD3 ARG A 94 0.395 17.743 -0.442 1.00 0.00 H new ATOM 0 HE ARG A 94 3.125 16.963 -0.812 1.00 0.00 H new ATOM 0 HH11 ARG A 94 1.159 19.482 0.703 1.00 0.00 H new ATOM 0 HH12 ARG A 94 2.417 20.713 0.551 1.00 0.00 H new ATOM 0 HH21 ARG A 94 4.730 18.553 -1.001 1.00 0.00 H new ATOM 0 HH22 ARG A 94 4.427 20.189 -0.409 1.00 0.00 H new ATOM 1473 N THR A 95 -1.924 16.558 4.452 1.00 0.00 N ATOM 1474 CA THR A 95 -1.950 16.290 5.885 1.00 0.00 C ATOM 1475 C THR A 95 -2.587 14.936 6.178 1.00 0.00 C ATOM 1476 O THR A 95 -2.160 14.225 7.087 1.00 0.00 O ATOM 1477 CB THR A 95 -2.709 17.395 6.620 1.00 0.00 C ATOM 1478 OG1 THR A 95 -2.410 18.663 6.065 1.00 0.00 O ATOM 1479 CG2 THR A 95 -2.394 17.456 8.099 1.00 0.00 C ATOM 0 H THR A 95 -2.449 17.385 4.167 1.00 0.00 H new ATOM 0 HA THR A 95 -0.920 16.269 6.241 1.00 0.00 H new ATOM 0 HB THR A 95 -3.764 17.150 6.499 1.00 0.00 H new ATOM 0 HG1 THR A 95 -2.906 19.357 6.548 1.00 0.00 H new ATOM 0 HG21 THR A 95 -2.966 18.261 8.560 1.00 0.00 H new ATOM 0 HG22 THR A 95 -2.660 16.508 8.567 1.00 0.00 H new ATOM 0 HG23 THR A 95 -1.329 17.642 8.237 1.00 0.00 H new ATOM 1487 N VAL A 96 -3.606 14.581 5.404 1.00 0.00 N ATOM 1488 CA VAL A 96 -4.289 13.308 5.588 1.00 0.00 C ATOM 1489 C VAL A 96 -3.323 12.146 5.385 1.00 0.00 C ATOM 1490 O VAL A 96 -3.239 11.242 6.216 1.00 0.00 O ATOM 1491 CB VAL A 96 -5.480 13.162 4.618 1.00 0.00 C ATOM 1492 CG1 VAL A 96 -6.055 11.750 4.659 1.00 0.00 C ATOM 1493 CG2 VAL A 96 -6.556 14.189 4.942 1.00 0.00 C ATOM 0 H VAL A 96 -3.976 15.155 4.646 1.00 0.00 H new ATOM 0 HA VAL A 96 -4.669 13.288 6.609 1.00 0.00 H new ATOM 0 HB VAL A 96 -5.117 13.344 3.607 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -6.893 11.678 3.965 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -5.284 11.035 4.373 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -6.400 11.527 5.669 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -7.390 14.074 4.249 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -6.908 14.037 5.962 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -6.142 15.193 4.847 1.00 0.00 H new ATOM 1503 N MET A 97 -2.596 12.176 4.275 1.00 0.00 N ATOM 1504 CA MET A 97 -1.637 11.125 3.968 1.00 0.00 C ATOM 1505 C MET A 97 -0.445 11.190 4.915 1.00 0.00 C ATOM 1506 O MET A 97 0.051 10.162 5.372 1.00 0.00 O ATOM 1507 CB MET A 97 -1.164 11.238 2.516 1.00 0.00 C ATOM 1508 CG MET A 97 -0.592 12.602 2.163 1.00 0.00 C ATOM 1509 SD MET A 97 0.271 12.603 0.580 1.00 0.00 S ATOM 1510 CE MET A 97 1.706 11.606 0.977 1.00 0.00 C ATOM 0 H MET A 97 -2.653 12.915 3.575 1.00 0.00 H new ATOM 0 HA MET A 97 -2.133 10.163 4.101 1.00 0.00 H new ATOM 0 HB2 MET A 97 -0.406 10.477 2.330 1.00 0.00 H new ATOM 0 HB3 MET A 97 -2.002 11.023 1.853 1.00 0.00 H new ATOM 0 HG2 MET A 97 -1.399 13.334 2.133 1.00 0.00 H new ATOM 0 HG3 MET A 97 0.095 12.918 2.948 1.00 0.00 H new ATOM 0 HE1 MET A 97 2.513 11.836 0.281 1.00 0.00 H new ATOM 0 HE2 MET A 97 2.031 11.825 1.994 1.00 0.00 H new ATOM 0 HE3 MET A 97 1.448 10.550 0.898 1.00 0.00 H new ATOM 1520 N ASP A 98 0.008 12.405 5.208 1.00 0.00 N ATOM 1521 CA ASP A 98 1.143 12.600 6.102 1.00 0.00 C ATOM 1522 C ASP A 98 0.796 12.204 7.531 1.00 0.00 C ATOM 1523 O ASP A 98 1.602 11.577 8.218 1.00 0.00 O ATOM 1524 CB ASP A 98 1.607 14.057 6.061 1.00 0.00 C ATOM 1525 CG ASP A 98 3.072 14.207 6.422 1.00 0.00 C ATOM 1526 OD1 ASP A 98 3.438 13.873 7.569 1.00 0.00 O ATOM 1527 OD2 ASP A 98 3.853 14.659 5.559 1.00 0.00 O ATOM 0 H ASP A 98 -0.393 13.268 4.840 1.00 0.00 H new ATOM 0 HA ASP A 98 1.953 11.956 5.758 1.00 0.00 H new ATOM 0 HB2 ASP A 98 1.438 14.461 5.063 1.00 0.00 H new ATOM 0 HB3 ASP A 98 1.003 14.647 6.750 1.00 0.00 H new ATOM 1532 N ASN A 99 -0.400 12.574 7.981 1.00 0.00 N ATOM 1533 CA ASN A 99 -0.828 12.252 9.337 1.00 0.00 C ATOM 1534 C ASN A 99 -0.788 10.747 9.571 1.00 0.00 C ATOM 1535 O ASN A 99 -0.208 10.278 10.550 1.00 0.00 O ATOM 1536 CB ASN A 99 -2.241 12.782 9.588 1.00 0.00 C ATOM 1537 CG ASN A 99 -2.251 14.259 9.934 1.00 0.00 C ATOM 1538 OD1 ASN A 99 -1.256 14.803 10.412 1.00 0.00 O ATOM 1539 ND2 ASN A 99 -3.380 14.915 9.693 1.00 0.00 N ATOM 0 H ASN A 99 -1.084 13.093 7.431 1.00 0.00 H new ATOM 0 HA ASN A 99 -0.141 12.731 10.034 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -2.852 12.615 8.701 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -2.699 12.218 10.401 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -3.447 15.910 9.905 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -4.181 14.423 9.296 1.00 0.00 H new ATOM 1546 N ILE A 100 -1.387 9.989 8.659 1.00 0.00 N ATOM 1547 CA ILE A 100 -1.387 8.543 8.770 1.00 0.00 C ATOM 1548 C ILE A 100 -0.026 7.974 8.390 1.00 0.00 C ATOM 1549 O ILE A 100 0.461 7.041 9.023 1.00 0.00 O ATOM 1550 CB ILE A 100 -2.484 7.887 7.909 1.00 0.00 C ATOM 1551 CG1 ILE A 100 -3.863 8.185 8.499 1.00 0.00 C ATOM 1552 CG2 ILE A 100 -2.250 6.387 7.793 1.00 0.00 C ATOM 1553 CD1 ILE A 100 -4.992 7.505 7.762 1.00 0.00 C ATOM 0 H ILE A 100 -1.875 10.353 7.841 1.00 0.00 H new ATOM 0 HA ILE A 100 -1.601 8.310 9.813 1.00 0.00 H new ATOM 0 HB ILE A 100 -2.442 8.309 6.905 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -3.879 7.870 9.542 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -4.029 9.262 8.488 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -3.035 5.943 7.181 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -1.281 6.205 7.328 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -2.266 5.938 8.786 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -5.941 7.760 8.234 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -5.002 7.838 6.724 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -4.849 6.425 7.795 1.00 0.00 H new ATOM 1565 N LYS A 101 0.588 8.539 7.349 1.00 0.00 N ATOM 1566 CA LYS A 101 1.895 8.070 6.901 1.00 0.00 C ATOM 1567 C LYS A 101 2.872 8.088 8.061 1.00 0.00 C ATOM 1568 O LYS A 101 3.561 7.104 8.325 1.00 0.00 O ATOM 1569 CB LYS A 101 2.420 8.928 5.744 1.00 0.00 C ATOM 1570 CG LYS A 101 3.851 8.605 5.341 1.00 0.00 C ATOM 1571 CD LYS A 101 4.843 9.539 6.014 1.00 0.00 C ATOM 1572 CE LYS A 101 4.990 10.843 5.246 1.00 0.00 C ATOM 1573 NZ LYS A 101 6.206 11.596 5.658 1.00 0.00 N ATOM 0 H LYS A 101 0.204 9.313 6.807 1.00 0.00 H new ATOM 0 HA LYS A 101 1.791 7.048 6.538 1.00 0.00 H new ATOM 0 HB2 LYS A 101 1.770 8.793 4.880 1.00 0.00 H new ATOM 0 HB3 LYS A 101 2.360 9.979 6.027 1.00 0.00 H new ATOM 0 HG2 LYS A 101 4.082 7.574 5.608 1.00 0.00 H new ATOM 0 HG3 LYS A 101 3.952 8.684 4.259 1.00 0.00 H new ATOM 0 HD2 LYS A 101 4.513 9.750 7.031 1.00 0.00 H new ATOM 0 HD3 LYS A 101 5.813 9.048 6.089 1.00 0.00 H new ATOM 0 HE2 LYS A 101 5.039 10.632 4.178 1.00 0.00 H new ATOM 0 HE3 LYS A 101 4.107 11.462 5.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 6.270 12.478 5.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 6.149 11.820 6.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 7.051 11.016 5.479 1.00 0.00 H new ATOM 1587 N MET A 102 2.898 9.205 8.765 1.00 0.00 N ATOM 1588 CA MET A 102 3.764 9.350 9.925 1.00 0.00 C ATOM 1589 C MET A 102 3.375 8.328 10.985 1.00 0.00 C ATOM 1590 O MET A 102 4.222 7.808 11.711 1.00 0.00 O ATOM 1591 CB MET A 102 3.672 10.768 10.495 1.00 0.00 C ATOM 1592 CG MET A 102 2.338 11.100 11.147 1.00 0.00 C ATOM 1593 SD MET A 102 2.473 12.424 12.364 1.00 0.00 S ATOM 1594 CE MET A 102 0.820 13.111 12.302 1.00 0.00 C ATOM 0 H MET A 102 2.330 10.026 8.555 1.00 0.00 H new ATOM 0 HA MET A 102 4.795 9.174 9.618 1.00 0.00 H new ATOM 0 HB2 MET A 102 4.465 10.903 11.231 1.00 0.00 H new ATOM 0 HB3 MET A 102 3.857 11.482 9.692 1.00 0.00 H new ATOM 0 HG2 MET A 102 1.623 11.391 10.377 1.00 0.00 H new ATOM 0 HG3 MET A 102 1.941 10.207 11.629 1.00 0.00 H new ATOM 0 HE1 MET A 102 0.582 13.573 13.260 1.00 0.00 H new ATOM 0 HE2 MET A 102 0.768 13.862 11.514 1.00 0.00 H new ATOM 0 HE3 MET A 102 0.103 12.316 12.094 1.00 0.00 H new ATOM 1604 N THR A 103 2.079 8.042 11.050 1.00 0.00 N ATOM 1605 CA THR A 103 1.549 7.081 11.993 1.00 0.00 C ATOM 1606 C THR A 103 1.992 5.676 11.610 1.00 0.00 C ATOM 1607 O THR A 103 2.564 4.951 12.421 1.00 0.00 O ATOM 1608 CB THR A 103 0.018 7.172 12.002 1.00 0.00 C ATOM 1609 OG1 THR A 103 -0.432 8.036 13.029 1.00 0.00 O ATOM 1610 CG2 THR A 103 -0.672 5.844 12.186 1.00 0.00 C ATOM 0 H THR A 103 1.374 8.471 10.450 1.00 0.00 H new ATOM 0 HA THR A 103 1.928 7.303 12.991 1.00 0.00 H new ATOM 0 HB THR A 103 -0.243 7.558 11.017 1.00 0.00 H new ATOM 0 HG1 THR A 103 -1.411 8.080 13.014 1.00 0.00 H new ATOM 0 HG21 THR A 103 -1.752 5.991 12.181 1.00 0.00 H new ATOM 0 HG22 THR A 103 -0.394 5.174 11.373 1.00 0.00 H new ATOM 0 HG23 THR A 103 -0.370 5.406 13.137 1.00 0.00 H new ATOM 1618 N LEU A 104 1.725 5.310 10.360 1.00 0.00 N ATOM 1619 CA LEU A 104 2.088 3.998 9.849 1.00 0.00 C ATOM 1620 C LEU A 104 3.593 3.836 9.815 1.00 0.00 C ATOM 1621 O LEU A 104 4.120 2.751 10.049 1.00 0.00 O ATOM 1622 CB LEU A 104 1.494 3.789 8.454 1.00 0.00 C ATOM 1623 CG LEU A 104 0.153 3.046 8.427 1.00 0.00 C ATOM 1624 CD1 LEU A 104 -0.845 3.755 7.516 1.00 0.00 C ATOM 1625 CD2 LEU A 104 0.358 1.603 7.986 1.00 0.00 C ATOM 0 H LEU A 104 1.256 5.909 9.681 1.00 0.00 H new ATOM 0 HA LEU A 104 1.679 3.241 10.518 1.00 0.00 H new ATOM 0 HB2 LEU A 104 1.363 4.762 7.982 1.00 0.00 H new ATOM 0 HB3 LEU A 104 2.212 3.235 7.849 1.00 0.00 H new ATOM 0 HG LEU A 104 -0.259 3.044 9.436 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -1.788 3.208 7.514 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -1.014 4.768 7.880 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -0.447 3.795 6.502 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -0.602 1.087 7.971 1.00 0.00 H new ATOM 0 HD22 LEU A 104 0.794 1.586 6.987 1.00 0.00 H new ATOM 0 HD23 LEU A 104 1.029 1.101 8.683 1.00 0.00 H new ATOM 1637 N GLN A 105 4.280 4.927 9.536 1.00 0.00 N ATOM 1638 CA GLN A 105 5.728 4.922 9.484 1.00 0.00 C ATOM 1639 C GLN A 105 6.308 4.435 10.807 1.00 0.00 C ATOM 1640 O GLN A 105 7.349 3.779 10.837 1.00 0.00 O ATOM 1641 CB GLN A 105 6.223 6.331 9.189 1.00 0.00 C ATOM 1642 CG GLN A 105 6.692 6.527 7.756 1.00 0.00 C ATOM 1643 CD GLN A 105 7.955 7.362 7.665 1.00 0.00 C ATOM 1644 OE1 GLN A 105 8.684 7.514 8.645 1.00 0.00 O ATOM 1645 NE2 GLN A 105 8.219 7.909 6.485 1.00 0.00 N ATOM 0 H GLN A 105 3.855 5.833 9.341 1.00 0.00 H new ATOM 0 HA GLN A 105 6.054 4.245 8.695 1.00 0.00 H new ATOM 0 HB2 GLN A 105 5.422 7.039 9.400 1.00 0.00 H new ATOM 0 HB3 GLN A 105 7.044 6.567 9.866 1.00 0.00 H new ATOM 0 HG2 GLN A 105 6.871 5.553 7.300 1.00 0.00 H new ATOM 0 HG3 GLN A 105 5.901 7.008 7.181 1.00 0.00 H new ATOM 0 HE21 GLN A 105 7.587 7.757 5.699 1.00 0.00 H new ATOM 0 HE22 GLN A 105 9.054 8.482 6.364 1.00 0.00 H new ATOM 1654 N GLN A 106 5.624 4.760 11.900 1.00 0.00 N ATOM 1655 CA GLN A 106 6.069 4.353 13.220 1.00 0.00 C ATOM 1656 C GLN A 106 5.730 2.896 13.476 1.00 0.00 C ATOM 1657 O GLN A 106 6.567 2.122 13.940 1.00 0.00 O ATOM 1658 CB GLN A 106 5.442 5.239 14.298 1.00 0.00 C ATOM 1659 CG GLN A 106 6.339 5.457 15.505 1.00 0.00 C ATOM 1660 CD GLN A 106 5.568 5.906 16.731 1.00 0.00 C ATOM 1661 OE1 GLN A 106 5.671 7.057 17.156 1.00 0.00 O ATOM 1662 NE2 GLN A 106 4.790 4.997 17.306 1.00 0.00 N ATOM 0 H GLN A 106 4.761 5.304 11.893 1.00 0.00 H new ATOM 0 HA GLN A 106 7.152 4.469 13.262 1.00 0.00 H new ATOM 0 HB2 GLN A 106 5.193 6.206 13.862 1.00 0.00 H new ATOM 0 HB3 GLN A 106 4.506 4.788 14.628 1.00 0.00 H new ATOM 0 HG2 GLN A 106 6.868 4.531 15.732 1.00 0.00 H new ATOM 0 HG3 GLN A 106 7.094 6.204 15.262 1.00 0.00 H new ATOM 0 HE21 GLN A 106 4.735 4.055 16.919 1.00 0.00 H new ATOM 0 HE22 GLN A 106 4.247 5.241 18.134 1.00 0.00 H new ATOM 1671 N ILE A 107 4.496 2.528 13.161 1.00 0.00 N ATOM 1672 CA ILE A 107 4.040 1.165 13.347 1.00 0.00 C ATOM 1673 C ILE A 107 4.835 0.231 12.450 1.00 0.00 C ATOM 1674 O ILE A 107 5.370 -0.780 12.905 1.00 0.00 O ATOM 1675 CB ILE A 107 2.540 1.025 13.037 1.00 0.00 C ATOM 1676 CG1 ILE A 107 1.796 2.321 13.373 1.00 0.00 C ATOM 1677 CG2 ILE A 107 1.956 -0.148 13.812 1.00 0.00 C ATOM 1678 CD1 ILE A 107 0.302 2.152 13.523 1.00 0.00 C ATOM 0 H ILE A 107 3.794 3.159 12.775 1.00 0.00 H new ATOM 0 HA ILE A 107 4.196 0.898 14.392 1.00 0.00 H new ATOM 0 HB ILE A 107 2.419 0.834 11.971 1.00 0.00 H new ATOM 0 HG12 ILE A 107 2.200 2.730 14.299 1.00 0.00 H new ATOM 0 HG13 ILE A 107 1.991 3.053 12.590 1.00 0.00 H new ATOM 0 HG21 ILE A 107 0.894 -0.240 13.587 1.00 0.00 H new ATOM 0 HG22 ILE A 107 2.469 -1.066 13.524 1.00 0.00 H new ATOM 0 HG23 ILE A 107 2.087 0.021 14.881 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -0.151 3.115 13.760 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -0.117 1.774 12.590 1.00 0.00 H new ATOM 0 HD13 ILE A 107 0.095 1.445 14.327 1.00 0.00 H new ATOM 1690 N ILE A 108 4.943 0.599 11.176 1.00 0.00 N ATOM 1691 CA ILE A 108 5.713 -0.185 10.222 1.00 0.00 C ATOM 1692 C ILE A 108 7.116 -0.385 10.765 1.00 0.00 C ATOM 1693 O ILE A 108 7.715 -1.452 10.629 1.00 0.00 O ATOM 1694 CB ILE A 108 5.762 0.505 8.840 1.00 0.00 C ATOM 1695 CG1 ILE A 108 5.692 -0.536 7.722 1.00 0.00 C ATOM 1696 CG2 ILE A 108 7.005 1.373 8.688 1.00 0.00 C ATOM 1697 CD1 ILE A 108 4.285 -0.802 7.231 1.00 0.00 C ATOM 0 H ILE A 108 4.507 1.434 10.784 1.00 0.00 H new ATOM 0 HA ILE A 108 5.229 -1.152 10.087 1.00 0.00 H new ATOM 0 HB ILE A 108 4.894 1.160 8.765 1.00 0.00 H new ATOM 0 HG12 ILE A 108 6.303 -0.199 6.884 1.00 0.00 H new ATOM 0 HG13 ILE A 108 6.126 -1.470 8.078 1.00 0.00 H new ATOM 0 HG21 ILE A 108 7.004 1.841 7.704 1.00 0.00 H new ATOM 0 HG22 ILE A 108 7.006 2.145 9.457 1.00 0.00 H new ATOM 0 HG23 ILE A 108 7.896 0.754 8.794 1.00 0.00 H new ATOM 0 HD11 ILE A 108 4.311 -1.550 6.439 1.00 0.00 H new ATOM 0 HD12 ILE A 108 3.675 -1.169 8.056 1.00 0.00 H new ATOM 0 HD13 ILE A 108 3.854 0.121 6.844 1.00 0.00 H new ATOM 1709 N SER A 109 7.609 0.658 11.416 1.00 0.00 N ATOM 1710 CA SER A 109 8.923 0.623 12.032 1.00 0.00 C ATOM 1711 C SER A 109 8.902 -0.340 13.212 1.00 0.00 C ATOM 1712 O SER A 109 9.877 -1.046 13.472 1.00 0.00 O ATOM 1713 CB SER A 109 9.337 2.020 12.497 1.00 0.00 C ATOM 1714 OG SER A 109 10.116 2.677 11.511 1.00 0.00 O ATOM 0 H SER A 109 7.114 1.543 11.531 1.00 0.00 H new ATOM 0 HA SER A 109 9.651 0.280 11.297 1.00 0.00 H new ATOM 0 HB2 SER A 109 8.448 2.612 12.716 1.00 0.00 H new ATOM 0 HB3 SER A 109 9.906 1.944 13.423 1.00 0.00 H new ATOM 0 HG SER A 109 9.536 3.243 10.960 1.00 0.00 H new ATOM 1720 N ARG A 110 7.772 -0.369 13.919 1.00 0.00 N ATOM 1721 CA ARG A 110 7.610 -1.254 15.066 1.00 0.00 C ATOM 1722 C ARG A 110 7.617 -2.712 14.623 1.00 0.00 C ATOM 1723 O ARG A 110 8.304 -3.548 15.210 1.00 0.00 O ATOM 1724 CB ARG A 110 6.303 -0.948 15.802 1.00 0.00 C ATOM 1725 CG ARG A 110 6.237 0.454 16.384 1.00 0.00 C ATOM 1726 CD ARG A 110 5.493 0.468 17.710 1.00 0.00 C ATOM 1727 NE ARG A 110 5.484 1.796 18.319 1.00 0.00 N ATOM 1728 CZ ARG A 110 6.512 2.312 18.988 1.00 0.00 C ATOM 1729 NH1 ARG A 110 7.633 1.617 19.135 1.00 0.00 N ATOM 1730 NH2 ARG A 110 6.421 3.527 19.510 1.00 0.00 N ATOM 0 H ARG A 110 6.958 0.211 13.716 1.00 0.00 H new ATOM 0 HA ARG A 110 8.447 -1.084 15.743 1.00 0.00 H new ATOM 0 HB2 ARG A 110 5.469 -1.084 15.113 1.00 0.00 H new ATOM 0 HB3 ARG A 110 6.173 -1.671 16.607 1.00 0.00 H new ATOM 0 HG2 ARG A 110 7.247 0.838 16.527 1.00 0.00 H new ATOM 0 HG3 ARG A 110 5.740 1.120 15.679 1.00 0.00 H new ATOM 0 HD2 ARG A 110 4.467 0.134 17.554 1.00 0.00 H new ATOM 0 HD3 ARG A 110 5.958 -0.241 18.394 1.00 0.00 H new ATOM 0 HE ARG A 110 4.640 2.361 18.226 1.00 0.00 H new ATOM 0 HH11 ARG A 110 7.710 0.682 18.734 1.00 0.00 H new ATOM 0 HH12 ARG A 110 8.418 2.018 19.649 1.00 0.00 H new ATOM 0 HH21 ARG A 110 5.563 4.067 19.399 1.00 0.00 H new ATOM 0 HH22 ARG A 110 7.209 3.922 20.023 1.00 0.00 H new ATOM 1744 N TYR A 111 6.846 -3.011 13.581 1.00 0.00 N ATOM 1745 CA TYR A 111 6.764 -4.369 13.058 1.00 0.00 C ATOM 1746 C TYR A 111 8.084 -4.785 12.419 1.00 0.00 C ATOM 1747 O TYR A 111 8.415 -5.970 12.369 1.00 0.00 O ATOM 1748 CB TYR A 111 5.629 -4.477 12.038 1.00 0.00 C ATOM 1749 CG TYR A 111 4.260 -4.606 12.667 1.00 0.00 C ATOM 1750 CD1 TYR A 111 3.566 -3.485 13.108 1.00 0.00 C ATOM 1751 CD2 TYR A 111 3.662 -5.851 12.821 1.00 0.00 C ATOM 1752 CE1 TYR A 111 2.315 -3.602 13.683 1.00 0.00 C ATOM 1753 CE2 TYR A 111 2.412 -5.975 13.394 1.00 0.00 C ATOM 1754 CZ TYR A 111 1.743 -4.848 13.823 1.00 0.00 C ATOM 1755 OH TYR A 111 0.498 -4.969 14.393 1.00 0.00 O ATOM 0 H TYR A 111 6.270 -2.331 13.084 1.00 0.00 H new ATOM 0 HA TYR A 111 6.558 -5.042 13.890 1.00 0.00 H new ATOM 0 HB2 TYR A 111 5.643 -3.596 11.396 1.00 0.00 H new ATOM 0 HB3 TYR A 111 5.808 -5.341 11.398 1.00 0.00 H new ATOM 0 HD1 TYR A 111 4.012 -2.507 12.999 1.00 0.00 H new ATOM 0 HD2 TYR A 111 4.184 -6.736 12.487 1.00 0.00 H new ATOM 0 HE1 TYR A 111 1.788 -2.722 14.021 1.00 0.00 H new ATOM 0 HE2 TYR A 111 1.960 -6.950 13.506 1.00 0.00 H new ATOM 0 HH TYR A 111 0.239 -5.914 14.416 1.00 0.00 H new ATOM 1765 N LYS A 112 8.838 -3.803 11.935 1.00 0.00 N ATOM 1766 CA LYS A 112 10.125 -4.068 11.303 1.00 0.00 C ATOM 1767 C LYS A 112 11.212 -4.275 12.353 1.00 0.00 C ATOM 1768 O LYS A 112 12.175 -5.007 12.128 1.00 0.00 O ATOM 1769 CB LYS A 112 10.509 -2.914 10.375 1.00 0.00 C ATOM 1770 CG LYS A 112 9.621 -2.800 9.147 1.00 0.00 C ATOM 1771 CD LYS A 112 10.245 -3.487 7.943 1.00 0.00 C ATOM 1772 CE LYS A 112 9.970 -2.719 6.660 1.00 0.00 C ATOM 1773 NZ LYS A 112 9.919 -3.619 5.475 1.00 0.00 N ATOM 0 H LYS A 112 8.580 -2.817 11.969 1.00 0.00 H new ATOM 0 HA LYS A 112 10.033 -4.981 10.715 1.00 0.00 H new ATOM 0 HB2 LYS A 112 10.464 -1.979 10.934 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.543 -3.045 10.055 1.00 0.00 H new ATOM 0 HG2 LYS A 112 8.648 -3.245 9.357 1.00 0.00 H new ATOM 0 HG3 LYS A 112 9.448 -1.748 8.918 1.00 0.00 H new ATOM 0 HD2 LYS A 112 11.321 -3.577 8.091 1.00 0.00 H new ATOM 0 HD3 LYS A 112 9.850 -4.499 7.855 1.00 0.00 H new ATOM 0 HE2 LYS A 112 9.024 -2.186 6.752 1.00 0.00 H new ATOM 0 HE3 LYS A 112 10.746 -1.968 6.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 9.549 -3.095 4.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 10.876 -3.965 5.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 9.296 -4.427 5.679 1.00 0.00 H new ATOM 1787 N ASP A 113 11.051 -3.625 13.503 1.00 0.00 N ATOM 1788 CA ASP A 113 12.019 -3.740 14.587 1.00 0.00 C ATOM 1789 C ASP A 113 11.801 -5.026 15.376 1.00 0.00 C ATOM 1790 O ASP A 113 12.756 -5.657 15.830 1.00 0.00 O ATOM 1791 CB ASP A 113 11.918 -2.532 15.520 1.00 0.00 C ATOM 1792 CG ASP A 113 12.996 -2.532 16.586 1.00 0.00 C ATOM 1793 OD1 ASP A 113 13.158 -3.567 17.266 1.00 0.00 O ATOM 1794 OD2 ASP A 113 13.679 -1.498 16.741 1.00 0.00 O ATOM 0 H ASP A 113 10.260 -3.014 13.707 1.00 0.00 H new ATOM 0 HA ASP A 113 13.016 -3.769 14.148 1.00 0.00 H new ATOM 0 HB2 ASP A 113 11.991 -1.616 14.933 1.00 0.00 H new ATOM 0 HB3 ASP A 113 10.938 -2.527 15.998 1.00 0.00 H new ATOM 1799 N ALA A 114 10.539 -5.409 15.536 1.00 0.00 N ATOM 1800 CA ALA A 114 10.195 -6.620 16.271 1.00 0.00 C ATOM 1801 C ALA A 114 10.786 -7.856 15.600 1.00 0.00 C ATOM 1802 O ALA A 114 11.476 -8.650 16.239 1.00 0.00 O ATOM 1803 CB ALA A 114 8.684 -6.753 16.389 1.00 0.00 C ATOM 0 H ALA A 114 9.737 -4.898 15.166 1.00 0.00 H new ATOM 0 HA ALA A 114 10.622 -6.543 17.271 1.00 0.00 H new ATOM 0 HB1 ALA A 114 8.441 -7.661 16.940 1.00 0.00 H new ATOM 0 HB2 ALA A 114 8.283 -5.889 16.919 1.00 0.00 H new ATOM 0 HB3 ALA A 114 8.244 -6.804 15.393 1.00 0.00 H new ATOM 1809 N ASP A 115 10.510 -8.011 14.309 1.00 0.00 N ATOM 1810 CA ASP A 115 11.015 -9.150 13.552 1.00 0.00 C ATOM 1811 C ASP A 115 12.537 -9.112 13.461 1.00 0.00 C ATOM 1812 O ASP A 115 13.102 -7.998 13.474 1.00 0.00 O ATOM 1813 CB ASP A 115 10.409 -9.164 12.147 1.00 0.00 C ATOM 1814 CG ASP A 115 8.972 -9.647 12.143 1.00 0.00 C ATOM 1815 OD1 ASP A 115 8.066 -8.816 12.363 1.00 0.00 O ATOM 1816 OD2 ASP A 115 8.753 -10.856 11.918 1.00 0.00 O ATOM 1817 OXT ASP A 115 13.151 -10.196 13.379 1.00 0.00 O ATOM 0 H ASP A 115 9.940 -7.363 13.766 1.00 0.00 H new ATOM 0 HA ASP A 115 10.723 -10.060 14.076 1.00 0.00 H new ATOM 0 HB2 ASP A 115 10.453 -8.160 11.725 1.00 0.00 H new ATOM 0 HB3 ASP A 115 11.008 -9.807 11.502 1.00 0.00 H new TER 1822 ASP A 115 ATOM 1823 N GLY B 456 -3.694 -5.723 -45.494 1.00 0.00 N ATOM 1824 CA GLY B 456 -3.082 -6.113 -44.194 1.00 0.00 C ATOM 1825 C GLY B 456 -2.572 -4.919 -43.412 1.00 0.00 C ATOM 1826 O GLY B 456 -1.429 -4.912 -42.953 1.00 0.00 O ATOM 0 HA2 GLY B 456 -3.819 -6.648 -43.595 1.00 0.00 H new ATOM 0 HA3 GLY B 456 -2.258 -6.803 -44.376 1.00 0.00 H new ATOM 1832 N PHE B 457 -3.420 -3.908 -43.259 1.00 0.00 N ATOM 1833 CA PHE B 457 -3.048 -2.703 -42.526 1.00 0.00 C ATOM 1834 C PHE B 457 -3.726 -2.666 -41.161 1.00 0.00 C ATOM 1835 O PHE B 457 -4.925 -2.405 -41.058 1.00 0.00 O ATOM 1836 CB PHE B 457 -3.424 -1.456 -43.330 1.00 0.00 C ATOM 1837 CG PHE B 457 -2.304 -0.932 -44.183 1.00 0.00 C ATOM 1838 CD1 PHE B 457 -2.133 -1.388 -45.481 1.00 0.00 C ATOM 1839 CD2 PHE B 457 -1.424 0.016 -43.688 1.00 0.00 C ATOM 1840 CE1 PHE B 457 -1.103 -0.908 -46.268 1.00 0.00 C ATOM 1841 CE2 PHE B 457 -0.392 0.500 -44.470 1.00 0.00 C ATOM 1842 CZ PHE B 457 -0.232 0.037 -45.762 1.00 0.00 C ATOM 0 H PHE B 457 -4.369 -3.899 -43.632 1.00 0.00 H new ATOM 0 HA PHE B 457 -1.969 -2.718 -42.375 1.00 0.00 H new ATOM 0 HB2 PHE B 457 -4.277 -1.688 -43.967 1.00 0.00 H new ATOM 0 HB3 PHE B 457 -3.743 -0.673 -42.642 1.00 0.00 H new ATOM 0 HD1 PHE B 457 -2.812 -2.126 -45.882 1.00 0.00 H new ATOM 0 HD2 PHE B 457 -1.546 0.381 -42.679 1.00 0.00 H new ATOM 0 HE1 PHE B 457 -0.979 -1.271 -47.277 1.00 0.00 H new ATOM 0 HE2 PHE B 457 0.288 1.239 -44.072 1.00 0.00 H new ATOM 0 HZ PHE B 457 0.573 0.414 -46.375 1.00 0.00 H new ATOM 1852 N THR B 458 -2.951 -2.928 -40.114 1.00 0.00 N ATOM 1853 CA THR B 458 -3.476 -2.924 -38.753 1.00 0.00 C ATOM 1854 C THR B 458 -2.356 -2.715 -37.737 1.00 0.00 C ATOM 1855 O THR B 458 -1.216 -3.119 -37.966 1.00 0.00 O ATOM 1856 CB THR B 458 -4.206 -4.236 -38.463 1.00 0.00 C ATOM 1857 OG1 THR B 458 -3.378 -5.347 -38.760 1.00 0.00 O ATOM 1858 CG2 THR B 458 -5.488 -4.396 -39.251 1.00 0.00 C ATOM 0 H THR B 458 -1.957 -3.146 -40.182 1.00 0.00 H new ATOM 0 HA THR B 458 -4.180 -2.097 -38.664 1.00 0.00 H new ATOM 0 HB THR B 458 -4.453 -4.199 -37.402 1.00 0.00 H new ATOM 0 HG1 THR B 458 -3.862 -6.177 -38.566 1.00 0.00 H new ATOM 0 HG21 THR B 458 -5.955 -5.348 -38.997 1.00 0.00 H new ATOM 0 HG22 THR B 458 -6.169 -3.581 -39.007 1.00 0.00 H new ATOM 0 HG23 THR B 458 -5.265 -4.374 -40.318 1.00 0.00 H new ATOM 1866 N PRO B 459 -2.667 -2.078 -36.595 1.00 0.00 N ATOM 1867 CA PRO B 459 -1.681 -1.818 -35.542 1.00 0.00 C ATOM 1868 C PRO B 459 -1.257 -3.091 -34.818 1.00 0.00 C ATOM 1869 O PRO B 459 -1.890 -4.137 -34.959 1.00 0.00 O ATOM 1870 CB PRO B 459 -2.420 -0.880 -34.586 1.00 0.00 C ATOM 1871 CG PRO B 459 -3.862 -1.191 -34.791 1.00 0.00 C ATOM 1872 CD PRO B 459 -4.004 -1.563 -36.241 1.00 0.00 C ATOM 0 HA PRO B 459 -0.758 -1.398 -35.943 1.00 0.00 H new ATOM 0 HB2 PRO B 459 -2.121 -1.052 -33.552 1.00 0.00 H new ATOM 0 HB3 PRO B 459 -2.204 0.165 -34.810 1.00 0.00 H new ATOM 0 HG2 PRO B 459 -4.180 -2.009 -34.145 1.00 0.00 H new ATOM 0 HG3 PRO B 459 -4.485 -0.331 -34.546 1.00 0.00 H new ATOM 0 HD2 PRO B 459 -4.777 -2.317 -36.388 1.00 0.00 H new ATOM 0 HD3 PRO B 459 -4.278 -0.703 -36.852 1.00 0.00 H new ATOM 1880 N HIS B 460 -0.181 -2.995 -34.043 1.00 0.00 N ATOM 1881 CA HIS B 460 0.327 -4.139 -33.296 1.00 0.00 C ATOM 1882 C HIS B 460 -0.066 -4.047 -31.826 1.00 0.00 C ATOM 1883 O HIS B 460 0.704 -3.562 -30.996 1.00 0.00 O ATOM 1884 CB HIS B 460 1.849 -4.223 -33.426 1.00 0.00 C ATOM 1885 CG HIS B 460 2.309 -4.764 -34.744 1.00 0.00 C ATOM 1886 ND1 HIS B 460 3.167 -5.837 -34.859 1.00 0.00 N ATOM 1887 CD2 HIS B 460 2.024 -4.375 -36.009 1.00 0.00 C ATOM 1888 CE1 HIS B 460 3.392 -6.084 -36.138 1.00 0.00 C ATOM 1889 NE2 HIS B 460 2.709 -5.211 -36.856 1.00 0.00 N ATOM 0 H HIS B 460 0.355 -2.137 -33.916 1.00 0.00 H new ATOM 0 HA HIS B 460 -0.117 -5.042 -33.715 1.00 0.00 H new ATOM 0 HB2 HIS B 460 2.273 -3.229 -33.283 1.00 0.00 H new ATOM 0 HB3 HIS B 460 2.239 -4.854 -32.628 1.00 0.00 H new ATOM 0 HD2 HIS B 460 1.378 -3.559 -36.298 1.00 0.00 H new ATOM 0 HE1 HIS B 460 4.026 -6.866 -36.529 1.00 0.00 H new ATOM 0 HE2 HIS B 460 2.693 -5.165 -37.875 1.00 0.00 H new ATOM 1898 N ASP B 461 -1.268 -4.517 -31.509 1.00 0.00 N ATOM 1899 CA ASP B 461 -1.764 -4.488 -30.138 1.00 0.00 C ATOM 1900 C ASP B 461 -0.909 -5.367 -29.232 1.00 0.00 C ATOM 1901 O ASP B 461 -0.224 -6.277 -29.699 1.00 0.00 O ATOM 1902 CB ASP B 461 -3.221 -4.950 -30.091 1.00 0.00 C ATOM 1903 CG ASP B 461 -4.038 -4.184 -29.069 1.00 0.00 C ATOM 1904 OD1 ASP B 461 -3.482 -3.832 -28.007 1.00 0.00 O ATOM 1905 OD2 ASP B 461 -5.234 -3.936 -29.330 1.00 0.00 O ATOM 0 H ASP B 461 -1.917 -4.923 -32.183 1.00 0.00 H new ATOM 0 HA ASP B 461 -1.705 -3.461 -29.778 1.00 0.00 H new ATOM 0 HB2 ASP B 461 -3.670 -4.827 -31.077 1.00 0.00 H new ATOM 0 HB3 ASP B 461 -3.255 -6.014 -29.855 1.00 0.00 H new ATOM 1910 N SER B 462 -0.954 -5.090 -27.933 1.00 0.00 N ATOM 1911 CA SER B 462 -0.184 -5.856 -26.960 1.00 0.00 C ATOM 1912 C SER B 462 -0.496 -5.401 -25.539 1.00 0.00 C ATOM 1913 O SER B 462 -0.620 -6.219 -24.627 1.00 0.00 O ATOM 1914 CB SER B 462 1.314 -5.713 -27.237 1.00 0.00 C ATOM 1915 OG SER B 462 1.744 -6.645 -28.214 1.00 0.00 O ATOM 0 H SER B 462 -1.516 -4.340 -27.530 1.00 0.00 H new ATOM 0 HA SER B 462 -0.466 -6.905 -27.056 1.00 0.00 H new ATOM 0 HB2 SER B 462 1.529 -4.700 -27.577 1.00 0.00 H new ATOM 0 HB3 SER B 462 1.874 -5.865 -26.314 1.00 0.00 H new ATOM 0 HG SER B 462 1.268 -6.481 -29.055 1.00 0.00 H new ATOM 1921 N ALA B 463 -0.622 -4.090 -25.357 1.00 0.00 N ATOM 1922 CA ALA B 463 -0.920 -3.526 -24.046 1.00 0.00 C ATOM 1923 C ALA B 463 -2.357 -3.016 -23.981 1.00 0.00 C ATOM 1924 O ALA B 463 -2.622 -1.846 -24.254 1.00 0.00 O ATOM 1925 CB ALA B 463 0.055 -2.404 -23.722 1.00 0.00 C ATOM 0 H ALA B 463 -0.522 -3.399 -26.101 1.00 0.00 H new ATOM 0 HA ALA B 463 -0.809 -4.316 -23.303 1.00 0.00 H new ATOM 0 HB1 ALA B 463 -0.178 -1.991 -22.741 1.00 0.00 H new ATOM 0 HB2 ALA B 463 1.072 -2.796 -23.719 1.00 0.00 H new ATOM 0 HB3 ALA B 463 -0.029 -1.620 -24.475 1.00 0.00 H new ATOM 1931 N PRO B 464 -3.308 -3.893 -23.617 1.00 0.00 N ATOM 1932 CA PRO B 464 -4.725 -3.526 -23.517 1.00 0.00 C ATOM 1933 C PRO B 464 -4.997 -2.583 -22.350 1.00 0.00 C ATOM 1934 O PRO B 464 -4.070 -2.045 -21.744 1.00 0.00 O ATOM 1935 CB PRO B 464 -5.427 -4.867 -23.295 1.00 0.00 C ATOM 1936 CG PRO B 464 -4.390 -5.741 -22.678 1.00 0.00 C ATOM 1937 CD PRO B 464 -3.078 -5.310 -23.274 1.00 0.00 C ATOM 0 HA PRO B 464 -5.070 -2.992 -24.402 1.00 0.00 H new ATOM 0 HB2 PRO B 464 -6.292 -4.757 -22.641 1.00 0.00 H new ATOM 0 HB3 PRO B 464 -5.789 -5.285 -24.235 1.00 0.00 H new ATOM 0 HG2 PRO B 464 -4.381 -5.631 -21.594 1.00 0.00 H new ATOM 0 HG3 PRO B 464 -4.589 -6.792 -22.890 1.00 0.00 H new ATOM 0 HD2 PRO B 464 -2.258 -5.424 -22.565 1.00 0.00 H new ATOM 0 HD3 PRO B 464 -2.823 -5.900 -24.154 1.00 0.00 H new ATOM 1945 N TYR B 465 -6.275 -2.386 -22.041 1.00 0.00 N ATOM 1946 CA TYR B 465 -6.670 -1.507 -20.946 1.00 0.00 C ATOM 1947 C TYR B 465 -6.962 -2.310 -19.683 1.00 0.00 C ATOM 1948 O TYR B 465 -7.864 -1.972 -18.915 1.00 0.00 O ATOM 1949 CB TYR B 465 -7.901 -0.689 -21.341 1.00 0.00 C ATOM 1950 CG TYR B 465 -9.126 -1.532 -21.617 1.00 0.00 C ATOM 1951 CD1 TYR B 465 -9.341 -2.090 -22.870 1.00 0.00 C ATOM 1952 CD2 TYR B 465 -10.067 -1.768 -20.623 1.00 0.00 C ATOM 1953 CE1 TYR B 465 -10.459 -2.860 -23.126 1.00 0.00 C ATOM 1954 CE2 TYR B 465 -11.188 -2.538 -20.870 1.00 0.00 C ATOM 1955 CZ TYR B 465 -11.379 -3.081 -22.123 1.00 0.00 C ATOM 1956 OH TYR B 465 -12.494 -3.848 -22.374 1.00 0.00 O ATOM 0 H TYR B 465 -7.054 -2.823 -22.533 1.00 0.00 H new ATOM 0 HA TYR B 465 -5.842 -0.828 -20.740 1.00 0.00 H new ATOM 0 HB2 TYR B 465 -8.129 0.017 -20.543 1.00 0.00 H new ATOM 0 HB3 TYR B 465 -7.667 -0.102 -22.229 1.00 0.00 H new ATOM 0 HD1 TYR B 465 -8.622 -1.919 -23.658 1.00 0.00 H new ATOM 0 HD2 TYR B 465 -9.920 -1.343 -19.641 1.00 0.00 H new ATOM 0 HE1 TYR B 465 -10.612 -3.287 -24.106 1.00 0.00 H new ATOM 0 HE2 TYR B 465 -11.910 -2.713 -20.086 1.00 0.00 H new ATOM 0 HH TYR B 465 -13.040 -3.907 -21.562 1.00 0.00 H new ATOM 1966 N GLY B 466 -6.194 -3.374 -19.472 1.00 0.00 N ATOM 1967 CA GLY B 466 -6.387 -4.208 -18.301 1.00 0.00 C ATOM 1968 C GLY B 466 -7.078 -5.517 -18.627 1.00 0.00 C ATOM 1969 O GLY B 466 -8.277 -5.541 -18.907 1.00 0.00 O ATOM 0 H GLY B 466 -5.441 -3.673 -20.092 1.00 0.00 H new ATOM 0 HA2 GLY B 466 -5.420 -4.416 -17.844 1.00 0.00 H new ATOM 0 HA3 GLY B 466 -6.977 -3.663 -17.564 1.00 0.00 H new ATOM 1973 N ALA B 467 -6.321 -6.608 -18.592 1.00 0.00 N ATOM 1974 CA ALA B 467 -6.867 -7.927 -18.887 1.00 0.00 C ATOM 1975 C ALA B 467 -7.073 -8.734 -17.610 1.00 0.00 C ATOM 1976 O ALA B 467 -8.155 -9.271 -17.371 1.00 0.00 O ATOM 1977 CB ALA B 467 -5.951 -8.675 -19.844 1.00 0.00 C ATOM 0 H ALA B 467 -5.327 -6.605 -18.362 1.00 0.00 H new ATOM 0 HA ALA B 467 -7.839 -7.793 -19.362 1.00 0.00 H new ATOM 0 HB1 ALA B 467 -6.371 -9.658 -20.056 1.00 0.00 H new ATOM 0 HB2 ALA B 467 -5.858 -8.113 -20.773 1.00 0.00 H new ATOM 0 HB3 ALA B 467 -4.967 -8.791 -19.390 1.00 0.00 H new ATOM 1983 N LEU B 468 -6.028 -8.816 -16.792 1.00 0.00 N ATOM 1984 CA LEU B 468 -6.095 -9.559 -15.539 1.00 0.00 C ATOM 1985 C LEU B 468 -5.373 -8.810 -14.424 1.00 0.00 C ATOM 1986 O LEU B 468 -4.250 -9.156 -14.056 1.00 0.00 O ATOM 1987 CB LEU B 468 -5.486 -10.951 -15.714 1.00 0.00 C ATOM 1988 CG LEU B 468 -5.843 -11.957 -14.619 1.00 0.00 C ATOM 1989 CD1 LEU B 468 -5.665 -13.380 -15.123 1.00 0.00 C ATOM 1990 CD2 LEU B 468 -4.993 -11.717 -13.380 1.00 0.00 C ATOM 0 H LEU B 468 -5.125 -8.377 -16.975 1.00 0.00 H new ATOM 0 HA LEU B 468 -7.144 -9.662 -15.262 1.00 0.00 H new ATOM 0 HB2 LEU B 468 -5.808 -11.353 -16.675 1.00 0.00 H new ATOM 0 HB3 LEU B 468 -4.401 -10.853 -15.757 1.00 0.00 H new ATOM 0 HG LEU B 468 -6.890 -11.818 -14.350 1.00 0.00 H new ATOM 0 HD11 LEU B 468 -5.924 -14.082 -14.330 1.00 0.00 H new ATOM 0 HD12 LEU B 468 -6.316 -13.546 -15.981 1.00 0.00 H new ATOM 0 HD13 LEU B 468 -4.627 -13.534 -15.419 1.00 0.00 H new ATOM 0 HD21 LEU B 468 -5.259 -12.441 -12.610 1.00 0.00 H new ATOM 0 HD22 LEU B 468 -3.939 -11.829 -13.635 1.00 0.00 H new ATOM 0 HD23 LEU B 468 -5.171 -10.709 -13.007 1.00 0.00 H new ATOM 2002 N ASP B 469 -6.025 -7.783 -13.888 1.00 0.00 N ATOM 2003 CA ASP B 469 -5.444 -6.985 -12.814 1.00 0.00 C ATOM 2004 C ASP B 469 -4.132 -6.346 -13.258 1.00 0.00 C ATOM 2005 O ASP B 469 -3.150 -6.338 -12.516 1.00 0.00 O ATOM 2006 CB ASP B 469 -5.211 -7.854 -11.576 1.00 0.00 C ATOM 2007 CG ASP B 469 -6.467 -8.026 -10.745 1.00 0.00 C ATOM 2008 OD1 ASP B 469 -7.489 -8.479 -11.302 1.00 0.00 O ATOM 2009 OD2 ASP B 469 -6.428 -7.708 -9.538 1.00 0.00 O ATOM 0 H ASP B 469 -6.956 -7.484 -14.180 1.00 0.00 H new ATOM 0 HA ASP B 469 -6.146 -6.189 -12.564 1.00 0.00 H new ATOM 0 HB2 ASP B 469 -4.847 -8.833 -11.886 1.00 0.00 H new ATOM 0 HB3 ASP B 469 -4.431 -7.404 -10.962 1.00 0.00 H new ATOM 2014 N MET B 470 -4.124 -5.809 -14.475 1.00 0.00 N ATOM 2015 CA MET B 470 -2.933 -5.166 -15.019 1.00 0.00 C ATOM 2016 C MET B 470 -2.894 -3.679 -14.675 1.00 0.00 C ATOM 2017 O MET B 470 -2.115 -2.923 -15.249 1.00 0.00 O ATOM 2018 CB MET B 470 -2.875 -5.352 -16.536 1.00 0.00 C ATOM 2019 CG MET B 470 -2.157 -6.620 -16.967 1.00 0.00 C ATOM 2020 SD MET B 470 -1.327 -6.443 -18.558 1.00 0.00 S ATOM 2021 CE MET B 470 -0.691 -8.100 -18.795 1.00 0.00 C ATOM 0 H MET B 470 -4.928 -5.807 -15.102 1.00 0.00 H new ATOM 0 HA MET B 470 -2.064 -5.641 -14.565 1.00 0.00 H new ATOM 0 HB2 MET B 470 -3.891 -5.368 -16.931 1.00 0.00 H new ATOM 0 HB3 MET B 470 -2.374 -4.492 -16.980 1.00 0.00 H new ATOM 0 HG2 MET B 470 -1.424 -6.894 -16.208 1.00 0.00 H new ATOM 0 HG3 MET B 470 -2.876 -7.438 -17.026 1.00 0.00 H new ATOM 0 HE1 MET B 470 -0.151 -8.151 -19.740 1.00 0.00 H new ATOM 0 HE2 MET B 470 -0.016 -8.351 -17.977 1.00 0.00 H new ATOM 0 HE3 MET B 470 -1.519 -8.809 -18.812 1.00 0.00 H new ATOM 2031 N ALA B 471 -3.730 -3.260 -13.735 1.00 0.00 N ATOM 2032 CA ALA B 471 -3.760 -1.864 -13.322 1.00 0.00 C ATOM 2033 C ALA B 471 -3.006 -1.664 -12.023 1.00 0.00 C ATOM 2034 O ALA B 471 -2.681 -0.536 -11.658 1.00 0.00 O ATOM 2035 CB ALA B 471 -5.192 -1.368 -13.200 1.00 0.00 C ATOM 0 H ALA B 471 -4.393 -3.863 -13.247 1.00 0.00 H new ATOM 0 HA ALA B 471 -3.261 -1.275 -14.092 1.00 0.00 H new ATOM 0 HB1 ALA B 471 -5.190 -0.323 -12.890 1.00 0.00 H new ATOM 0 HB2 ALA B 471 -5.692 -1.460 -14.164 1.00 0.00 H new ATOM 0 HB3 ALA B 471 -5.722 -1.965 -12.458 1.00 0.00 H new ATOM 2041 N ASP B 472 -2.721 -2.756 -11.328 1.00 0.00 N ATOM 2042 CA ASP B 472 -1.995 -2.671 -10.079 1.00 0.00 C ATOM 2043 C ASP B 472 -0.499 -2.734 -10.321 1.00 0.00 C ATOM 2044 O ASP B 472 0.285 -2.185 -9.551 1.00 0.00 O ATOM 2045 CB ASP B 472 -2.437 -3.773 -9.113 1.00 0.00 C ATOM 2046 CG ASP B 472 -1.662 -3.752 -7.809 1.00 0.00 C ATOM 2047 OD1 ASP B 472 -1.135 -2.678 -7.449 1.00 0.00 O ATOM 2048 OD2 ASP B 472 -1.581 -4.809 -7.149 1.00 0.00 O ATOM 0 H ASP B 472 -2.981 -3.702 -11.609 1.00 0.00 H new ATOM 0 HA ASP B 472 -2.225 -1.709 -9.620 1.00 0.00 H new ATOM 0 HB2 ASP B 472 -3.500 -3.660 -8.901 1.00 0.00 H new ATOM 0 HB3 ASP B 472 -2.309 -4.744 -9.592 1.00 0.00 H new ATOM 2053 N PHE B 473 -0.103 -3.388 -11.401 1.00 0.00 N ATOM 2054 CA PHE B 473 1.307 -3.490 -11.728 1.00 0.00 C ATOM 2055 C PHE B 473 1.824 -2.151 -12.256 1.00 0.00 C ATOM 2056 O PHE B 473 2.914 -1.713 -11.887 1.00 0.00 O ATOM 2057 CB PHE B 473 1.552 -4.634 -12.726 1.00 0.00 C ATOM 2058 CG PHE B 473 1.566 -4.218 -14.168 1.00 0.00 C ATOM 2059 CD1 PHE B 473 0.445 -3.652 -14.744 1.00 0.00 C ATOM 2060 CD2 PHE B 473 2.698 -4.400 -14.945 1.00 0.00 C ATOM 2061 CE1 PHE B 473 0.452 -3.271 -16.075 1.00 0.00 C ATOM 2062 CE2 PHE B 473 2.713 -4.023 -16.273 1.00 0.00 C ATOM 2063 CZ PHE B 473 1.588 -3.457 -16.839 1.00 0.00 C ATOM 0 H PHE B 473 -0.731 -3.851 -12.058 1.00 0.00 H new ATOM 0 HA PHE B 473 1.866 -3.728 -10.823 1.00 0.00 H new ATOM 0 HB2 PHE B 473 2.505 -5.106 -12.489 1.00 0.00 H new ATOM 0 HB3 PHE B 473 0.779 -5.390 -12.588 1.00 0.00 H new ATOM 0 HD1 PHE B 473 -0.445 -3.505 -14.150 1.00 0.00 H new ATOM 0 HD2 PHE B 473 3.580 -4.842 -14.506 1.00 0.00 H new ATOM 0 HE1 PHE B 473 -0.429 -2.829 -16.516 1.00 0.00 H new ATOM 0 HE2 PHE B 473 3.602 -4.170 -16.868 1.00 0.00 H new ATOM 0 HZ PHE B 473 1.596 -3.160 -17.877 1.00 0.00 H new ATOM 2073 N GLU B 474 1.027 -1.487 -13.096 1.00 0.00 N ATOM 2074 CA GLU B 474 1.411 -0.186 -13.629 1.00 0.00 C ATOM 2075 C GLU B 474 1.343 0.863 -12.533 1.00 0.00 C ATOM 2076 O GLU B 474 2.232 1.703 -12.393 1.00 0.00 O ATOM 2077 CB GLU B 474 0.508 0.207 -14.800 1.00 0.00 C ATOM 2078 CG GLU B 474 1.062 -0.195 -16.157 1.00 0.00 C ATOM 2079 CD GLU B 474 1.646 0.978 -16.920 1.00 0.00 C ATOM 2080 OE1 GLU B 474 2.519 1.674 -16.361 1.00 0.00 O ATOM 2081 OE2 GLU B 474 1.230 1.200 -18.076 1.00 0.00 O ATOM 0 H GLU B 474 0.121 -1.828 -13.417 1.00 0.00 H new ATOM 0 HA GLU B 474 2.435 -0.249 -13.996 1.00 0.00 H new ATOM 0 HB2 GLU B 474 -0.470 -0.255 -14.665 1.00 0.00 H new ATOM 0 HB3 GLU B 474 0.356 1.286 -14.784 1.00 0.00 H new ATOM 0 HG2 GLU B 474 1.832 -0.954 -16.020 1.00 0.00 H new ATOM 0 HG3 GLU B 474 0.268 -0.650 -16.749 1.00 0.00 H new ATOM 2088 N PHE B 475 0.272 0.794 -11.757 1.00 0.00 N ATOM 2089 CA PHE B 475 0.050 1.715 -10.658 1.00 0.00 C ATOM 2090 C PHE B 475 1.100 1.500 -9.578 1.00 0.00 C ATOM 2091 O PHE B 475 1.471 2.434 -8.874 1.00 0.00 O ATOM 2092 CB PHE B 475 -1.382 1.512 -10.133 1.00 0.00 C ATOM 2093 CG PHE B 475 -1.664 1.989 -8.734 1.00 0.00 C ATOM 2094 CD1 PHE B 475 -1.047 1.401 -7.641 1.00 0.00 C ATOM 2095 CD2 PHE B 475 -2.582 3.005 -8.514 1.00 0.00 C ATOM 2096 CE1 PHE B 475 -1.334 1.823 -6.359 1.00 0.00 C ATOM 2097 CE2 PHE B 475 -2.877 3.426 -7.234 1.00 0.00 C ATOM 2098 CZ PHE B 475 -2.252 2.836 -6.156 1.00 0.00 C ATOM 0 H PHE B 475 -0.465 0.099 -11.873 1.00 0.00 H new ATOM 0 HA PHE B 475 0.150 2.748 -10.992 1.00 0.00 H new ATOM 0 HB2 PHE B 475 -2.068 2.021 -10.810 1.00 0.00 H new ATOM 0 HB3 PHE B 475 -1.615 0.448 -10.183 1.00 0.00 H new ATOM 0 HD1 PHE B 475 -0.334 0.604 -7.794 1.00 0.00 H new ATOM 0 HD2 PHE B 475 -3.072 3.472 -9.355 1.00 0.00 H new ATOM 0 HE1 PHE B 475 -0.842 1.362 -5.515 1.00 0.00 H new ATOM 0 HE2 PHE B 475 -3.596 4.216 -7.077 1.00 0.00 H new ATOM 0 HZ PHE B 475 -2.480 3.165 -5.153 1.00 0.00 H new ATOM 2108 N GLU B 476 1.594 0.270 -9.461 1.00 0.00 N ATOM 2109 CA GLU B 476 2.613 -0.031 -8.469 1.00 0.00 C ATOM 2110 C GLU B 476 3.931 0.643 -8.825 1.00 0.00 C ATOM 2111 O GLU B 476 4.727 0.963 -7.942 1.00 0.00 O ATOM 2112 CB GLU B 476 2.823 -1.533 -8.316 1.00 0.00 C ATOM 2113 CG GLU B 476 1.827 -2.200 -7.379 1.00 0.00 C ATOM 2114 CD GLU B 476 1.630 -3.672 -7.685 1.00 0.00 C ATOM 2115 OE1 GLU B 476 2.234 -4.164 -8.661 1.00 0.00 O ATOM 2116 OE2 GLU B 476 0.873 -4.335 -6.945 1.00 0.00 O ATOM 0 H GLU B 476 1.307 -0.523 -10.035 1.00 0.00 H new ATOM 0 HA GLU B 476 2.260 0.361 -7.515 1.00 0.00 H new ATOM 0 HB2 GLU B 476 2.754 -2.002 -9.298 1.00 0.00 H new ATOM 0 HB3 GLU B 476 3.832 -1.714 -7.946 1.00 0.00 H new ATOM 0 HG2 GLU B 476 2.172 -2.090 -6.351 1.00 0.00 H new ATOM 0 HG3 GLU B 476 0.868 -1.687 -7.450 1.00 0.00 H new ATOM 2123 N GLN B 477 4.157 0.876 -10.116 1.00 0.00 N ATOM 2124 CA GLN B 477 5.386 1.538 -10.555 1.00 0.00 C ATOM 2125 C GLN B 477 5.461 2.921 -9.944 1.00 0.00 C ATOM 2126 O GLN B 477 6.506 3.328 -9.436 1.00 0.00 O ATOM 2127 CB GLN B 477 5.456 1.616 -12.081 1.00 0.00 C ATOM 2128 CG GLN B 477 6.216 0.462 -12.715 1.00 0.00 C ATOM 2129 CD GLN B 477 7.656 0.817 -13.031 1.00 0.00 C ATOM 2130 OE1 GLN B 477 8.565 0.517 -12.258 1.00 0.00 O ATOM 2131 NE2 GLN B 477 7.869 1.459 -14.174 1.00 0.00 N ATOM 0 H GLN B 477 3.516 0.621 -10.868 1.00 0.00 H new ATOM 0 HA GLN B 477 6.240 0.951 -10.218 1.00 0.00 H new ATOM 0 HB2 GLN B 477 4.443 1.637 -12.482 1.00 0.00 H new ATOM 0 HB3 GLN B 477 5.932 2.554 -12.367 1.00 0.00 H new ATOM 0 HG2 GLN B 477 6.196 -0.395 -12.042 1.00 0.00 H new ATOM 0 HG3 GLN B 477 5.711 0.159 -13.632 1.00 0.00 H new ATOM 0 HE21 GLN B 477 7.084 1.687 -14.785 1.00 0.00 H new ATOM 0 HE22 GLN B 477 8.817 1.724 -14.441 1.00 0.00 H new ATOM 2140 N MET B 478 4.333 3.621 -9.931 1.00 0.00 N ATOM 2141 CA MET B 478 4.284 4.926 -9.302 1.00 0.00 C ATOM 2142 C MET B 478 4.308 4.734 -7.786 1.00 0.00 C ATOM 2143 O MET B 478 4.231 5.694 -7.019 1.00 0.00 O ATOM 2144 CB MET B 478 3.022 5.680 -9.720 1.00 0.00 C ATOM 2145 CG MET B 478 3.233 6.606 -10.905 1.00 0.00 C ATOM 2146 SD MET B 478 4.399 7.935 -10.549 1.00 0.00 S ATOM 2147 CE MET B 478 3.808 8.489 -8.950 1.00 0.00 C ATOM 0 H MET B 478 3.454 3.309 -10.344 1.00 0.00 H new ATOM 0 HA MET B 478 5.144 5.516 -9.617 1.00 0.00 H new ATOM 0 HB2 MET B 478 2.243 4.959 -9.967 1.00 0.00 H new ATOM 0 HB3 MET B 478 2.660 6.263 -8.873 1.00 0.00 H new ATOM 0 HG2 MET B 478 3.597 6.027 -11.754 1.00 0.00 H new ATOM 0 HG3 MET B 478 2.276 7.037 -11.200 1.00 0.00 H new ATOM 0 HE1 MET B 478 3.839 9.578 -8.908 1.00 0.00 H new ATOM 0 HE2 MET B 478 2.783 8.149 -8.803 1.00 0.00 H new ATOM 0 HE3 MET B 478 4.443 8.078 -8.165 1.00 0.00 H new ATOM 2157 N PHE B 479 4.400 3.465 -7.373 1.00 0.00 N ATOM 2158 CA PHE B 479 4.418 3.099 -5.972 1.00 0.00 C ATOM 2159 C PHE B 479 5.662 2.297 -5.606 1.00 0.00 C ATOM 2160 O PHE B 479 5.611 1.436 -4.727 1.00 0.00 O ATOM 2161 CB PHE B 479 3.185 2.276 -5.643 1.00 0.00 C ATOM 2162 CG PHE B 479 2.045 3.118 -5.187 1.00 0.00 C ATOM 2163 CD1 PHE B 479 1.939 3.492 -3.865 1.00 0.00 C ATOM 2164 CD2 PHE B 479 1.088 3.549 -6.081 1.00 0.00 C ATOM 2165 CE1 PHE B 479 0.895 4.279 -3.443 1.00 0.00 C ATOM 2166 CE2 PHE B 479 0.042 4.335 -5.664 1.00 0.00 C ATOM 2167 CZ PHE B 479 -0.057 4.701 -4.341 1.00 0.00 C ATOM 0 H PHE B 479 4.464 2.670 -8.009 1.00 0.00 H new ATOM 0 HA PHE B 479 4.428 4.023 -5.393 1.00 0.00 H new ATOM 0 HB2 PHE B 479 2.885 1.709 -6.524 1.00 0.00 H new ATOM 0 HB3 PHE B 479 3.432 1.552 -4.867 1.00 0.00 H new ATOM 0 HD1 PHE B 479 2.683 3.164 -3.154 1.00 0.00 H new ATOM 0 HD2 PHE B 479 1.162 3.265 -7.120 1.00 0.00 H new ATOM 0 HE1 PHE B 479 0.822 4.567 -2.405 1.00 0.00 H new ATOM 0 HE2 PHE B 479 -0.702 4.666 -6.373 1.00 0.00 H new ATOM 0 HZ PHE B 479 -0.879 5.317 -4.009 1.00 0.00 H new ATOM 2177 N THR B 480 6.779 2.571 -6.266 1.00 0.00 N ATOM 2178 CA THR B 480 8.004 1.855 -5.972 1.00 0.00 C ATOM 2179 C THR B 480 9.070 2.824 -5.480 1.00 0.00 C ATOM 2180 O THR B 480 9.665 3.572 -6.255 1.00 0.00 O ATOM 2181 CB THR B 480 8.500 1.109 -7.211 1.00 0.00 C ATOM 2182 OG1 THR B 480 9.729 0.457 -6.945 1.00 0.00 O ATOM 2183 CG2 THR B 480 8.708 2.010 -8.409 1.00 0.00 C ATOM 0 H THR B 480 6.859 3.276 -6.999 1.00 0.00 H new ATOM 0 HA THR B 480 7.800 1.125 -5.188 1.00 0.00 H new ATOM 0 HB THR B 480 7.715 0.391 -7.449 1.00 0.00 H new ATOM 0 HG1 THR B 480 10.029 -0.016 -7.749 1.00 0.00 H new ATOM 0 HG21 THR B 480 9.060 1.417 -9.253 1.00 0.00 H new ATOM 0 HG22 THR B 480 7.765 2.490 -8.671 1.00 0.00 H new ATOM 0 HG23 THR B 480 9.449 2.772 -8.167 1.00 0.00 H new ATOM 2191 N ASP B 481 9.286 2.798 -4.165 1.00 0.00 N ATOM 2192 CA ASP B 481 10.259 3.664 -3.510 1.00 0.00 C ATOM 2193 C ASP B 481 10.119 5.108 -3.984 1.00 0.00 C ATOM 2194 O ASP B 481 10.855 5.560 -4.862 1.00 0.00 O ATOM 2195 CB ASP B 481 11.678 3.158 -3.767 1.00 0.00 C ATOM 2196 CG ASP B 481 12.642 3.553 -2.666 1.00 0.00 C ATOM 2197 OD1 ASP B 481 12.667 4.747 -2.299 1.00 0.00 O ATOM 2198 OD2 ASP B 481 13.372 2.669 -2.171 1.00 0.00 O ATOM 0 H ASP B 481 8.791 2.176 -3.527 1.00 0.00 H new ATOM 0 HA ASP B 481 10.063 3.640 -2.438 1.00 0.00 H new ATOM 0 HB2 ASP B 481 11.662 2.072 -3.860 1.00 0.00 H new ATOM 0 HB3 ASP B 481 12.035 3.554 -4.718 1.00 0.00 H new ATOM 2203 N ALA B 482 9.168 5.826 -3.395 1.00 0.00 N ATOM 2204 CA ALA B 482 8.925 7.218 -3.752 1.00 0.00 C ATOM 2205 C ALA B 482 9.194 8.141 -2.568 1.00 0.00 C ATOM 2206 O ALA B 482 8.575 9.198 -2.440 1.00 0.00 O ATOM 2207 CB ALA B 482 7.497 7.392 -4.245 1.00 0.00 C ATOM 0 H ALA B 482 8.552 5.465 -2.667 1.00 0.00 H new ATOM 0 HA ALA B 482 9.611 7.489 -4.554 1.00 0.00 H new ATOM 0 HB1 ALA B 482 7.328 8.436 -4.509 1.00 0.00 H new ATOM 0 HB2 ALA B 482 7.336 6.766 -5.122 1.00 0.00 H new ATOM 0 HB3 ALA B 482 6.802 7.099 -3.458 1.00 0.00 H new ATOM 2213 N LEU B 483 10.119 7.735 -1.705 1.00 0.00 N ATOM 2214 CA LEU B 483 10.468 8.526 -0.531 1.00 0.00 C ATOM 2215 C LEU B 483 11.926 8.306 -0.139 1.00 0.00 C ATOM 2216 O LEU B 483 12.282 8.390 1.037 1.00 0.00 O ATOM 2217 CB LEU B 483 9.552 8.168 0.641 1.00 0.00 C ATOM 2218 CG LEU B 483 9.301 6.670 0.833 1.00 0.00 C ATOM 2219 CD1 LEU B 483 10.232 6.103 1.893 1.00 0.00 C ATOM 2220 CD2 LEU B 483 7.847 6.416 1.206 1.00 0.00 C ATOM 0 H LEU B 483 10.640 6.863 -1.796 1.00 0.00 H new ATOM 0 HA LEU B 483 10.334 9.579 -0.780 1.00 0.00 H new ATOM 0 HB2 LEU B 483 9.986 8.569 1.557 1.00 0.00 H new ATOM 0 HB3 LEU B 483 8.593 8.666 0.498 1.00 0.00 H new ATOM 0 HG LEU B 483 9.507 6.164 -0.110 1.00 0.00 H new ATOM 0 HD11 LEU B 483 10.038 5.037 2.015 1.00 0.00 H new ATOM 0 HD12 LEU B 483 11.267 6.251 1.585 1.00 0.00 H new ATOM 0 HD13 LEU B 483 10.059 6.614 2.840 1.00 0.00 H new ATOM 0 HD21 LEU B 483 7.687 5.346 1.338 1.00 0.00 H new ATOM 0 HD22 LEU B 483 7.614 6.936 2.135 1.00 0.00 H new ATOM 0 HD23 LEU B 483 7.198 6.784 0.412 1.00 0.00 H new ATOM 2232 N GLY B 484 12.765 8.025 -1.131 1.00 0.00 N ATOM 2233 CA GLY B 484 14.174 7.798 -0.868 1.00 0.00 C ATOM 2234 C GLY B 484 14.944 9.090 -0.681 1.00 0.00 C ATOM 2235 O GLY B 484 15.821 9.179 0.179 1.00 0.00 O ATOM 0 H GLY B 484 12.494 7.951 -2.112 1.00 0.00 H new ATOM 0 HA2 GLY B 484 14.279 7.183 0.026 1.00 0.00 H new ATOM 0 HA3 GLY B 484 14.609 7.236 -1.694 1.00 0.00 H new ATOM 2239 N ILE B 485 14.616 10.093 -1.489 1.00 0.00 N ATOM 2240 CA ILE B 485 15.283 11.387 -1.409 1.00 0.00 C ATOM 2241 C ILE B 485 14.330 12.519 -1.782 1.00 0.00 C ATOM 2242 O ILE B 485 14.429 13.099 -2.864 1.00 0.00 O ATOM 2243 CB ILE B 485 16.520 11.445 -2.328 1.00 0.00 C ATOM 2244 CG1 ILE B 485 16.171 10.941 -3.734 1.00 0.00 C ATOM 2245 CG2 ILE B 485 17.665 10.639 -1.730 1.00 0.00 C ATOM 2246 CD1 ILE B 485 16.023 9.436 -3.830 1.00 0.00 C ATOM 0 H ILE B 485 13.893 10.034 -2.206 1.00 0.00 H new ATOM 0 HA ILE B 485 15.606 11.512 -0.375 1.00 0.00 H new ATOM 0 HB ILE B 485 16.842 12.483 -2.411 1.00 0.00 H new ATOM 0 HG12 ILE B 485 15.240 11.409 -4.056 1.00 0.00 H new ATOM 0 HG13 ILE B 485 16.947 11.265 -4.428 1.00 0.00 H new ATOM 0 HG21 ILE B 485 18.530 10.690 -2.391 1.00 0.00 H new ATOM 0 HG22 ILE B 485 17.928 11.049 -0.755 1.00 0.00 H new ATOM 0 HG23 ILE B 485 17.357 9.600 -1.615 1.00 0.00 H new ATOM 0 HD11 ILE B 485 15.776 9.159 -4.855 1.00 0.00 H new ATOM 0 HD12 ILE B 485 16.960 8.959 -3.541 1.00 0.00 H new ATOM 0 HD13 ILE B 485 15.227 9.105 -3.163 1.00 0.00 H new ATOM 2258 N ASP B 486 13.405 12.828 -0.878 1.00 0.00 N ATOM 2259 CA ASP B 486 12.433 13.889 -1.111 1.00 0.00 C ATOM 2260 C ASP B 486 13.131 15.227 -1.335 1.00 0.00 C ATOM 2261 O ASP B 486 14.251 15.440 -0.871 1.00 0.00 O ATOM 2262 CB ASP B 486 11.470 13.996 0.072 1.00 0.00 C ATOM 2263 CG ASP B 486 12.181 14.329 1.369 1.00 0.00 C ATOM 2264 OD1 ASP B 486 12.883 13.446 1.906 1.00 0.00 O ATOM 2265 OD2 ASP B 486 12.038 15.474 1.847 1.00 0.00 O ATOM 0 H ASP B 486 13.309 12.358 0.022 1.00 0.00 H new ATOM 0 HA ASP B 486 11.868 13.639 -2.009 1.00 0.00 H new ATOM 0 HB2 ASP B 486 10.725 14.763 -0.138 1.00 0.00 H new ATOM 0 HB3 ASP B 486 10.934 13.054 0.187 1.00 0.00 H new ATOM 2270 N GLU B 487 12.461 16.125 -2.051 1.00 0.00 N ATOM 2271 CA GLU B 487 13.016 17.443 -2.337 1.00 0.00 C ATOM 2272 C GLU B 487 11.937 18.517 -2.256 1.00 0.00 C ATOM 2273 O GLU B 487 10.745 18.221 -2.338 1.00 0.00 O ATOM 2274 CB GLU B 487 13.663 17.457 -3.723 1.00 0.00 C ATOM 2275 CG GLU B 487 15.088 16.928 -3.734 1.00 0.00 C ATOM 2276 CD GLU B 487 16.120 18.030 -3.593 1.00 0.00 C ATOM 2277 OE1 GLU B 487 16.470 18.651 -4.618 1.00 0.00 O ATOM 2278 OE2 GLU B 487 16.578 18.272 -2.456 1.00 0.00 O ATOM 0 H GLU B 487 11.533 15.964 -2.443 1.00 0.00 H new ATOM 0 HA GLU B 487 13.776 17.660 -1.587 1.00 0.00 H new ATOM 0 HB2 GLU B 487 13.057 16.859 -4.404 1.00 0.00 H new ATOM 0 HB3 GLU B 487 13.660 18.477 -4.106 1.00 0.00 H new ATOM 0 HG2 GLU B 487 15.212 16.213 -2.921 1.00 0.00 H new ATOM 0 HG3 GLU B 487 15.264 16.387 -4.664 1.00 0.00 H new ATOM 2285 N TYR B 488 12.363 19.766 -2.094 1.00 0.00 N ATOM 2286 CA TYR B 488 11.432 20.885 -2.002 1.00 0.00 C ATOM 2287 C TYR B 488 12.152 22.211 -2.226 1.00 0.00 C ATOM 2288 O TYR B 488 12.609 22.849 -1.278 1.00 0.00 O ATOM 2289 CB TYR B 488 10.742 20.890 -0.637 1.00 0.00 C ATOM 2290 CG TYR B 488 9.301 21.346 -0.688 1.00 0.00 C ATOM 2291 CD1 TYR B 488 8.341 20.601 -1.362 1.00 0.00 C ATOM 2292 CD2 TYR B 488 8.901 22.520 -0.064 1.00 0.00 C ATOM 2293 CE1 TYR B 488 7.023 21.014 -1.411 1.00 0.00 C ATOM 2294 CE2 TYR B 488 7.585 22.939 -0.108 1.00 0.00 C ATOM 2295 CZ TYR B 488 6.650 22.183 -0.783 1.00 0.00 C ATOM 2296 OH TYR B 488 5.339 22.597 -0.830 1.00 0.00 O ATOM 0 H TYR B 488 13.346 20.028 -2.024 1.00 0.00 H new ATOM 0 HA TYR B 488 10.679 20.765 -2.781 1.00 0.00 H new ATOM 0 HB2 TYR B 488 10.782 19.886 -0.216 1.00 0.00 H new ATOM 0 HB3 TYR B 488 11.297 21.541 0.039 1.00 0.00 H new ATOM 0 HD1 TYR B 488 8.629 19.685 -1.855 1.00 0.00 H new ATOM 0 HD2 TYR B 488 9.631 23.116 0.465 1.00 0.00 H new ATOM 0 HE1 TYR B 488 6.289 20.424 -1.939 1.00 0.00 H new ATOM 0 HE2 TYR B 488 7.290 23.854 0.384 1.00 0.00 H new ATOM 0 HH TYR B 488 5.244 23.439 -0.337 1.00 0.00 H new ATOM 2306 N GLY B 489 12.249 22.620 -3.487 1.00 0.00 N ATOM 2307 CA GLY B 489 12.914 23.867 -3.813 1.00 0.00 C ATOM 2308 C GLY B 489 12.860 24.184 -5.294 1.00 0.00 C ATOM 2309 O GLY B 489 11.904 23.820 -5.979 1.00 0.00 O ATOM 0 H GLY B 489 11.879 22.110 -4.289 1.00 0.00 H new ATOM 0 HA2 GLY B 489 12.450 24.679 -3.254 1.00 0.00 H new ATOM 0 HA3 GLY B 489 13.955 23.814 -3.494 1.00 0.00 H new ATOM 2313 N GLY B 490 13.888 24.865 -5.790 1.00 0.00 N ATOM 2314 CA GLY B 490 13.933 25.219 -7.196 1.00 0.00 C ATOM 2315 C GLY B 490 13.543 26.663 -7.444 1.00 0.00 C ATOM 2316 O GLY B 490 14.436 27.472 -7.773 1.00 0.00 O ATOM 2317 OXT GLY B 490 12.343 26.985 -7.310 1.00 0.00 O ATOM 0 H GLY B 490 14.690 25.178 -5.243 1.00 0.00 H new ATOM 0 HA2 GLY B 490 14.939 25.047 -7.579 1.00 0.00 H new ATOM 0 HA3 GLY B 490 13.263 24.564 -7.754 1.00 0.00 H new TER 2321 GLY B 490