USER MOD reduce.3.24.130724 H: found=0, std=0, add=973, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 973 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 Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 20 CYS SG : rot -109:sc= 0.58 USER MOD Single : A 22 THR OG1 : rot 79:sc= 0.961 USER MOD Single : A 25 ASN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 29 HIS : no HD1:sc= 0 X(o=0,f=-0.0083) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 39:sc= -0.532 USER MOD Single : A 34 TYR OH : rot 58:sc= -2.78! USER MOD Single : A 37 MET CE :methyl -105:sc= -0.506 (180deg=-2.66!) USER MOD Single : A 38 HIS : no HD1:sc= -2.04 K(o=-2,f=-5.5) USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=-0.067) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 166:sc= -0.17 (180deg=-0.274) USER MOD Single : A 49 THR OG1 : rot -7:sc= -0.228 USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= 0.147 X(o=0.15,f=0) USER MOD Single : A 70 CYS SG : rot 180:sc= -0.0633 USER MOD Single : A 71 TYR OH : rot 80:sc= -0.98 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 SER OG : rot -100:sc= -0.663 USER MOD Single : A 94 ASN : amide:sc= -0.77 K(o=-0.77,f=-1.5) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 167:sc= 1.16 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 TYR OH : rot 180:sc= -0.14 USER MOD Single : A 107 SER OG : rot -2:sc= 0.561 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 170:sc= -0.188 USER MOD Single : A 117 THR OG1 : rot 128:sc= 2.36 USER MOD Single : A 118 GLN : amide:sc= -0.0591 X(o=-0.059,f=-0.059) USER MOD Single : A 121 GLN : amide:sc= -0.0132 X(o=-0.013,f=0) USER MOD Single : A 124 GLN : amide:sc= -1.27 K(o=-1.3,f=-2.6!) USER MOD Single : A 126 ASN : amide:sc= -0.214 K(o=-0.21,f=-0.95) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot -85:sc= 0.0672 USER MOD Single : A 143 ASN : amide:sc= -0.368 K(o=-0.37,f=0.99) USER MOD ----------------------------------------------------------------- ATOM 63 N VAL A 14 -4.951 7.374 -3.485 1.00 23.14 N ATOM 64 CA VAL A 14 -5.357 8.027 -2.246 1.00 44.41 C ATOM 65 C VAL A 14 -4.299 9.019 -1.776 1.00 4.22 C ATOM 66 O VAL A 14 -3.150 8.649 -1.533 1.00 60.13 O ATOM 67 CB VAL A 14 -5.615 7.000 -1.128 1.00 4.11 C ATOM 68 CG1 VAL A 14 -4.402 6.102 -0.937 1.00 43.13 C ATOM 69 CG2 VAL A 14 -5.975 7.706 0.171 1.00 70.14 C ATOM 0 HA VAL A 14 -6.283 8.561 -2.458 1.00 44.41 H new ATOM 0 HB VAL A 14 -6.458 6.374 -1.421 1.00 4.11 H new ATOM 0 HG11 VAL A 14 -4.603 5.383 -0.143 1.00 43.13 H new ATOM 0 HG12 VAL A 14 -4.194 5.569 -1.865 1.00 43.13 H new ATOM 0 HG13 VAL A 14 -3.539 6.710 -0.666 1.00 43.13 H new ATOM 0 HG21 VAL A 14 -6.154 6.965 0.950 1.00 70.14 H new ATOM 0 HG22 VAL A 14 -5.154 8.357 0.471 1.00 70.14 H new ATOM 0 HG23 VAL A 14 -6.875 8.302 0.024 1.00 70.14 H new ATOM 79 N SER A 15 -4.694 10.282 -1.649 1.00 21.25 N ATOM 80 CA SER A 15 -3.779 11.329 -1.210 1.00 63.11 C ATOM 81 C SER A 15 -4.459 12.264 -0.215 1.00 32.54 C ATOM 82 O SER A 15 -5.637 12.590 -0.358 1.00 14.52 O ATOM 83 CB SER A 15 -3.271 12.128 -2.412 1.00 21.21 C ATOM 84 OG SER A 15 -1.884 11.919 -2.614 1.00 2.12 O ATOM 0 H SER A 15 -5.642 10.605 -1.844 1.00 21.25 H new ATOM 0 HA SER A 15 -2.933 10.853 -0.714 1.00 63.11 H new ATOM 0 HB2 SER A 15 -3.820 11.834 -3.306 1.00 21.21 H new ATOM 0 HB3 SER A 15 -3.463 13.189 -2.255 1.00 21.21 H new ATOM 0 HG SER A 15 -1.584 12.439 -3.389 1.00 2.12 H new ATOM 90 N VAL A 16 -3.708 12.690 0.796 1.00 50.44 N ATOM 91 CA VAL A 16 -4.237 13.588 1.815 1.00 2.34 C ATOM 92 C VAL A 16 -4.410 15.001 1.268 1.00 24.40 C ATOM 93 O VAL A 16 -3.456 15.612 0.787 1.00 20.21 O ATOM 94 CB VAL A 16 -3.318 13.637 3.051 1.00 54.20 C ATOM 95 CG1 VAL A 16 -1.904 14.027 2.650 1.00 62.21 C ATOM 96 CG2 VAL A 16 -3.872 14.602 4.088 1.00 13.31 C ATOM 0 H VAL A 16 -2.732 12.427 0.931 1.00 50.44 H new ATOM 0 HA VAL A 16 -5.210 13.194 2.109 1.00 2.34 H new ATOM 0 HB VAL A 16 -3.282 12.642 3.496 1.00 54.20 H new ATOM 0 HG11 VAL A 16 -1.270 14.056 3.536 1.00 62.21 H new ATOM 0 HG12 VAL A 16 -1.510 13.294 1.946 1.00 62.21 H new ATOM 0 HG13 VAL A 16 -1.917 15.011 2.180 1.00 62.21 H new ATOM 0 HG21 VAL A 16 -3.211 14.624 4.954 1.00 13.31 H new ATOM 0 HG22 VAL A 16 -3.939 15.601 3.657 1.00 13.31 H new ATOM 0 HG23 VAL A 16 -4.864 14.273 4.397 1.00 13.31 H new ATOM 106 N ALA A 17 -5.633 15.514 1.345 1.00 32.52 N ATOM 107 CA ALA A 17 -5.931 16.855 0.860 1.00 40.32 C ATOM 108 C ALA A 17 -5.320 17.916 1.769 1.00 41.21 C ATOM 109 O ALA A 17 -5.067 17.666 2.948 1.00 55.42 O ATOM 110 CB ALA A 17 -7.435 17.055 0.750 1.00 73.14 C ATOM 0 H ALA A 17 -6.434 15.021 1.739 1.00 32.52 H new ATOM 0 HA ALA A 17 -5.488 16.963 -0.130 1.00 40.32 H new ATOM 0 HB1 ALA A 17 -7.643 18.061 0.386 1.00 73.14 H new ATOM 0 HB2 ALA A 17 -7.849 16.325 0.054 1.00 73.14 H new ATOM 0 HB3 ALA A 17 -7.892 16.922 1.730 1.00 73.14 H new ATOM 116 N ASP A 18 -5.084 19.100 1.214 1.00 70.33 N ATOM 117 CA ASP A 18 -4.502 20.199 1.975 1.00 15.20 C ATOM 118 C ASP A 18 -5.303 20.463 3.246 1.00 12.13 C ATOM 119 O ASP A 18 -4.738 20.786 4.291 1.00 52.24 O ATOM 120 CB ASP A 18 -4.447 21.466 1.120 1.00 2.32 C ATOM 121 CG ASP A 18 -3.331 21.425 0.095 1.00 24.51 C ATOM 122 OD1 ASP A 18 -2.156 21.307 0.502 1.00 11.11 O ATOM 123 OD2 ASP A 18 -3.632 21.510 -1.114 1.00 45.21 O ATOM 0 H ASP A 18 -5.287 19.323 0.240 1.00 70.33 H new ATOM 0 HA ASP A 18 -3.488 19.916 2.258 1.00 15.20 H new ATOM 0 HB2 ASP A 18 -5.401 21.598 0.609 1.00 2.32 H new ATOM 0 HB3 ASP A 18 -4.310 22.332 1.768 1.00 2.32 H new ATOM 128 N GLU A 19 -6.622 20.324 3.149 1.00 43.01 N ATOM 129 CA GLU A 19 -7.499 20.550 4.291 1.00 34.33 C ATOM 130 C GLU A 19 -7.140 19.619 5.446 1.00 70.22 C ATOM 131 O GLU A 19 -7.098 20.036 6.604 1.00 54.12 O ATOM 132 CB GLU A 19 -8.961 20.340 3.889 1.00 2.40 C ATOM 133 CG GLU A 19 -9.236 18.973 3.286 1.00 15.14 C ATOM 134 CD GLU A 19 -10.256 19.024 2.165 1.00 1.50 C ATOM 135 OE1 GLU A 19 -11.048 19.989 2.128 1.00 12.22 O ATOM 136 OE2 GLU A 19 -10.262 18.101 1.325 1.00 63.21 O ATOM 0 H GLU A 19 -7.106 20.056 2.292 1.00 43.01 H new ATOM 0 HA GLU A 19 -7.364 21.580 4.621 1.00 34.33 H new ATOM 0 HB2 GLU A 19 -9.593 20.474 4.767 1.00 2.40 H new ATOM 0 HB3 GLU A 19 -9.245 21.109 3.170 1.00 2.40 H new ATOM 0 HG2 GLU A 19 -8.304 18.554 2.906 1.00 15.14 H new ATOM 0 HG3 GLU A 19 -9.593 18.301 4.066 1.00 15.14 H new ATOM 143 N CYS A 20 -6.882 18.357 5.122 1.00 61.33 N ATOM 144 CA CYS A 20 -6.527 17.365 6.131 1.00 13.32 C ATOM 145 C CYS A 20 -5.186 17.700 6.775 1.00 43.44 C ATOM 146 O CYS A 20 -5.030 17.613 7.993 1.00 53.03 O ATOM 147 CB CYS A 20 -6.474 15.970 5.508 1.00 25.53 C ATOM 148 SG CYS A 20 -8.094 15.202 5.277 1.00 70.34 S ATOM 0 H CYS A 20 -6.912 17.996 4.168 1.00 61.33 H new ATOM 0 HA CYS A 20 -7.294 17.380 6.905 1.00 13.32 H new ATOM 0 HB2 CYS A 20 -5.973 16.034 4.542 1.00 25.53 H new ATOM 0 HB3 CYS A 20 -5.865 15.324 6.140 1.00 25.53 H new ATOM 0 HG CYS A 20 -8.238 14.228 6.126 1.00 70.34 H new ATOM 154 N VAL A 21 -4.218 18.083 5.948 1.00 63.23 N ATOM 155 CA VAL A 21 -2.888 18.431 6.435 1.00 35.55 C ATOM 156 C VAL A 21 -2.954 19.577 7.438 1.00 45.32 C ATOM 157 O VAL A 21 -2.358 19.511 8.514 1.00 52.51 O ATOM 158 CB VAL A 21 -1.952 18.827 5.279 1.00 61.23 C ATOM 159 CG1 VAL A 21 -0.527 19.001 5.781 1.00 63.42 C ATOM 160 CG2 VAL A 21 -2.012 17.791 4.167 1.00 64.54 C ATOM 0 H VAL A 21 -4.330 18.160 4.937 1.00 63.23 H new ATOM 0 HA VAL A 21 -2.488 17.544 6.927 1.00 35.55 H new ATOM 0 HB VAL A 21 -2.287 19.782 4.874 1.00 61.23 H new ATOM 0 HG11 VAL A 21 0.120 19.281 4.950 1.00 63.42 H new ATOM 0 HG12 VAL A 21 -0.502 19.783 6.540 1.00 63.42 H new ATOM 0 HG13 VAL A 21 -0.177 18.064 6.214 1.00 63.42 H new ATOM 0 HG21 VAL A 21 -1.344 18.087 3.358 1.00 64.54 H new ATOM 0 HG22 VAL A 21 -1.703 16.821 4.556 1.00 64.54 H new ATOM 0 HG23 VAL A 21 -3.032 17.722 3.789 1.00 64.54 H new ATOM 170 N THR A 22 -3.682 20.630 7.078 1.00 24.02 N ATOM 171 CA THR A 22 -3.825 21.793 7.945 1.00 23.42 C ATOM 172 C THR A 22 -4.564 21.434 9.229 1.00 75.42 C ATOM 173 O THR A 22 -4.190 21.873 10.316 1.00 71.23 O ATOM 174 CB THR A 22 -4.577 22.934 7.235 1.00 44.01 C ATOM 175 OG1 THR A 22 -4.271 22.926 5.836 1.00 61.10 O ATOM 176 CG2 THR A 22 -4.203 24.282 7.833 1.00 55.21 C ATOM 0 H THR A 22 -4.182 20.701 6.192 1.00 24.02 H new ATOM 0 HA THR A 22 -2.818 22.130 8.191 1.00 23.42 H new ATOM 0 HB THR A 22 -5.647 22.777 7.374 1.00 44.01 H new ATOM 0 HG1 THR A 22 -4.796 22.228 5.390 1.00 61.10 H new ATOM 0 HG21 THR A 22 -4.746 25.073 7.316 1.00 55.21 H new ATOM 0 HG22 THR A 22 -4.463 24.295 8.891 1.00 55.21 H new ATOM 0 HG23 THR A 22 -3.131 24.445 7.721 1.00 55.21 H new ATOM 184 N ALA A 23 -5.616 20.632 9.096 1.00 51.03 N ATOM 185 CA ALA A 23 -6.407 20.212 10.246 1.00 62.21 C ATOM 186 C ALA A 23 -5.541 19.492 11.274 1.00 63.21 C ATOM 187 O ALA A 23 -5.623 19.767 12.472 1.00 64.02 O ATOM 188 CB ALA A 23 -7.553 19.317 9.800 1.00 75.15 C ATOM 0 H ALA A 23 -5.940 20.260 8.203 1.00 51.03 H new ATOM 0 HA ALA A 23 -6.819 21.104 10.717 1.00 62.21 H new ATOM 0 HB1 ALA A 23 -8.135 19.011 10.669 1.00 75.15 H new ATOM 0 HB2 ALA A 23 -8.194 19.864 9.108 1.00 75.15 H new ATOM 0 HB3 ALA A 23 -7.152 18.434 9.302 1.00 75.15 H new ATOM 194 N LEU A 24 -4.712 18.569 10.799 1.00 22.54 N ATOM 195 CA LEU A 24 -3.830 17.808 11.678 1.00 31.21 C ATOM 196 C LEU A 24 -2.753 18.705 12.278 1.00 2.43 C ATOM 197 O LEU A 24 -2.410 18.579 13.453 1.00 45.11 O ATOM 198 CB LEU A 24 -3.180 16.656 10.908 1.00 12.55 C ATOM 199 CG LEU A 24 -4.139 15.664 10.250 1.00 21.43 C ATOM 200 CD1 LEU A 24 -3.486 15.013 9.041 1.00 62.22 C ATOM 201 CD2 LEU A 24 -4.583 14.607 11.252 1.00 50.33 C ATOM 0 H LEU A 24 -4.632 18.329 9.811 1.00 22.54 H new ATOM 0 HA LEU A 24 -4.431 17.400 12.491 1.00 31.21 H new ATOM 0 HB2 LEU A 24 -2.539 17.079 10.134 1.00 12.55 H new ATOM 0 HB3 LEU A 24 -2.534 16.107 11.593 1.00 12.55 H new ATOM 0 HG LEU A 24 -5.020 16.209 9.912 1.00 21.43 H new ATOM 0 HD11 LEU A 24 -4.183 14.310 8.585 1.00 62.22 H new ATOM 0 HD12 LEU A 24 -3.218 15.780 8.315 1.00 62.22 H new ATOM 0 HD13 LEU A 24 -2.588 14.481 9.355 1.00 62.22 H new ATOM 0 HD21 LEU A 24 -5.265 13.909 10.766 1.00 50.33 H new ATOM 0 HD22 LEU A 24 -3.711 14.066 11.620 1.00 50.33 H new ATOM 0 HD23 LEU A 24 -5.091 15.088 12.088 1.00 50.33 H new ATOM 213 N ASN A 25 -2.225 19.613 11.464 1.00 42.22 N ATOM 214 CA ASN A 25 -1.187 20.534 11.915 1.00 74.30 C ATOM 215 C ASN A 25 -1.671 21.358 13.104 1.00 31.34 C ATOM 216 O ASN A 25 -0.958 21.513 14.096 1.00 34.01 O ATOM 217 CB ASN A 25 -0.769 21.462 10.773 1.00 4.34 C ATOM 218 CG ASN A 25 0.278 20.835 9.872 1.00 15.22 C ATOM 219 OD1 ASN A 25 0.327 19.615 9.716 1.00 43.12 O ATOM 220 ND2 ASN A 25 1.120 21.670 9.274 1.00 21.44 N ATOM 0 H ASN A 25 -2.499 19.731 10.488 1.00 42.22 H new ATOM 0 HA ASN A 25 -0.325 19.946 12.230 1.00 74.30 H new ATOM 0 HB2 ASN A 25 -1.646 21.722 10.180 1.00 4.34 H new ATOM 0 HB3 ASN A 25 -0.378 22.391 11.188 1.00 4.34 H new ATOM 0 HD21 ASN A 25 1.845 21.307 8.655 1.00 21.44 H new ATOM 0 HD22 ASN A 25 1.041 22.674 9.433 1.00 21.44 H new ATOM 227 N ASP A 26 -2.887 21.883 12.998 1.00 44.13 N ATOM 228 CA ASP A 26 -3.467 22.690 14.065 1.00 71.02 C ATOM 229 C ASP A 26 -3.842 21.821 15.261 1.00 24.31 C ATOM 230 O ASP A 26 -3.668 22.222 16.413 1.00 55.55 O ATOM 231 CB ASP A 26 -4.701 23.437 13.555 1.00 22.30 C ATOM 232 CG ASP A 26 -4.517 23.965 12.146 1.00 64.10 C ATOM 233 OD1 ASP A 26 -3.374 24.325 11.792 1.00 54.34 O ATOM 234 OD2 ASP A 26 -5.514 24.017 11.397 1.00 14.23 O ATOM 0 H ASP A 26 -3.490 21.764 12.184 1.00 44.13 H new ATOM 0 HA ASP A 26 -2.719 23.415 14.386 1.00 71.02 H new ATOM 0 HB2 ASP A 26 -5.562 22.769 13.580 1.00 22.30 H new ATOM 0 HB3 ASP A 26 -4.922 24.268 14.225 1.00 22.30 H new ATOM 239 N LEU A 27 -4.356 20.628 14.981 1.00 14.53 N ATOM 240 CA LEU A 27 -4.757 19.702 16.034 1.00 21.24 C ATOM 241 C LEU A 27 -3.590 19.405 16.972 1.00 54.45 C ATOM 242 O LEU A 27 -3.748 19.400 18.192 1.00 32.05 O ATOM 243 CB LEU A 27 -5.279 18.400 15.424 1.00 60.10 C ATOM 244 CG LEU A 27 -6.308 17.634 16.256 1.00 54.13 C ATOM 245 CD1 LEU A 27 -7.693 17.759 15.639 1.00 42.22 C ATOM 246 CD2 LEU A 27 -5.909 16.171 16.383 1.00 54.10 C ATOM 0 H LEU A 27 -4.505 20.280 14.034 1.00 14.53 H new ATOM 0 HA LEU A 27 -5.554 20.171 16.612 1.00 21.24 H new ATOM 0 HB2 LEU A 27 -5.723 18.629 14.455 1.00 60.10 H new ATOM 0 HB3 LEU A 27 -4.429 17.743 15.239 1.00 60.10 H new ATOM 0 HG LEU A 27 -6.337 18.070 17.255 1.00 54.13 H new ATOM 0 HD11 LEU A 27 -8.412 17.208 16.245 1.00 42.22 H new ATOM 0 HD12 LEU A 27 -7.981 18.810 15.601 1.00 42.22 H new ATOM 0 HD13 LEU A 27 -7.680 17.349 14.629 1.00 42.22 H new ATOM 0 HD21 LEU A 27 -6.653 15.641 16.978 1.00 54.10 H new ATOM 0 HD22 LEU A 27 -5.851 15.722 15.391 1.00 54.10 H new ATOM 0 HD23 LEU A 27 -4.937 16.100 16.870 1.00 54.10 H new ATOM 258 N ARG A 28 -2.420 19.162 16.392 1.00 63.51 N ATOM 259 CA ARG A 28 -1.226 18.866 17.175 1.00 32.42 C ATOM 260 C ARG A 28 -0.836 20.059 18.043 1.00 64.43 C ATOM 261 O ARG A 28 -0.172 19.903 19.068 1.00 11.04 O ATOM 262 CB ARG A 28 -0.065 18.490 16.253 1.00 40.11 C ATOM 263 CG ARG A 28 0.785 19.677 15.830 1.00 25.13 C ATOM 264 CD ARG A 28 1.388 19.467 14.450 1.00 24.12 C ATOM 265 NE ARG A 28 1.738 20.731 13.808 1.00 71.15 N ATOM 266 CZ ARG A 28 2.809 21.447 14.129 1.00 2.32 C ATOM 267 NH1 ARG A 28 3.631 21.026 15.080 1.00 5.02 N ATOM 268 NH2 ARG A 28 3.060 22.588 13.499 1.00 62.42 N ATOM 0 H ARG A 28 -2.273 19.164 15.383 1.00 63.51 H new ATOM 0 HA ARG A 28 -1.450 18.022 17.827 1.00 32.42 H new ATOM 0 HB2 ARG A 28 0.569 17.762 16.759 1.00 40.11 H new ATOM 0 HB3 ARG A 28 -0.462 18.003 15.363 1.00 40.11 H new ATOM 0 HG2 ARG A 28 0.175 20.580 15.828 1.00 25.13 H new ATOM 0 HG3 ARG A 28 1.582 19.832 16.557 1.00 25.13 H new ATOM 0 HD2 ARG A 28 2.279 18.844 14.534 1.00 24.12 H new ATOM 0 HD3 ARG A 28 0.679 18.926 13.823 1.00 24.12 H new ATOM 0 HE ARG A 28 1.126 21.083 13.072 1.00 71.15 H new ATOM 0 HH11 ARG A 28 3.441 20.150 15.567 1.00 5.02 H new ATOM 0 HH12 ARG A 28 4.453 21.578 15.325 1.00 5.02 H new ATOM 0 HH21 ARG A 28 2.430 22.916 12.767 1.00 62.42 H new ATOM 0 HH22 ARG A 28 3.883 23.137 13.747 1.00 62.42 H new ATOM 282 N HIS A 29 -1.251 21.250 17.624 1.00 71.33 N ATOM 283 CA HIS A 29 -0.945 22.470 18.362 1.00 22.43 C ATOM 284 C HIS A 29 -2.081 22.828 19.315 1.00 32.43 C ATOM 285 O HIS A 29 -2.205 23.973 19.749 1.00 42.44 O ATOM 286 CB HIS A 29 -0.691 23.626 17.395 1.00 11.42 C ATOM 287 CG HIS A 29 0.372 24.573 17.860 1.00 41.40 C ATOM 288 ND1 HIS A 29 0.108 25.673 18.649 1.00 31.23 N ATOM 289 CD2 HIS A 29 1.708 24.580 17.644 1.00 62.33 C ATOM 290 CE1 HIS A 29 1.235 26.315 18.897 1.00 43.41 C ATOM 291 NE2 HIS A 29 2.222 25.672 18.298 1.00 14.24 N ATOM 0 H HIS A 29 -1.800 21.396 16.777 1.00 71.33 H new ATOM 0 HA HIS A 29 -0.044 22.293 18.949 1.00 22.43 H new ATOM 0 HB2 HIS A 29 -0.406 23.221 16.424 1.00 11.42 H new ATOM 0 HB3 HIS A 29 -1.620 24.178 17.250 1.00 11.42 H new ATOM 0 HD2 HIS A 29 2.266 23.860 17.064 1.00 62.33 H new ATOM 0 HE1 HIS A 29 1.333 27.213 19.489 1.00 43.41 H new ATOM 0 HE2 HIS A 29 3.205 25.943 18.318 1.00 14.24 H new ATOM 299 N LYS A 30 -2.910 21.840 19.637 1.00 0.23 N ATOM 300 CA LYS A 30 -4.036 22.050 20.539 1.00 34.41 C ATOM 301 C LYS A 30 -5.018 23.062 19.958 1.00 41.22 C ATOM 302 O LYS A 30 -5.464 23.978 20.649 1.00 21.14 O ATOM 303 CB LYS A 30 -3.540 22.530 21.905 1.00 55.22 C ATOM 304 CG LYS A 30 -4.605 22.488 22.988 1.00 64.42 C ATOM 305 CD LYS A 30 -4.415 23.604 24.000 1.00 5.45 C ATOM 306 CE LYS A 30 -5.372 23.462 25.173 1.00 14.24 C ATOM 307 NZ LYS A 30 -4.843 24.113 26.404 1.00 53.54 N ATOM 0 H LYS A 30 -2.823 20.886 19.286 1.00 0.23 H new ATOM 0 HA LYS A 30 -4.553 21.098 20.661 1.00 34.41 H new ATOM 0 HB2 LYS A 30 -2.696 21.913 22.213 1.00 55.22 H new ATOM 0 HB3 LYS A 30 -3.171 23.551 21.810 1.00 55.22 H new ATOM 0 HG2 LYS A 30 -5.592 22.573 22.533 1.00 64.42 H new ATOM 0 HG3 LYS A 30 -4.570 21.525 23.497 1.00 64.42 H new ATOM 0 HD2 LYS A 30 -3.388 23.595 24.364 1.00 5.45 H new ATOM 0 HD3 LYS A 30 -4.573 24.567 23.515 1.00 5.45 H new ATOM 0 HE2 LYS A 30 -6.333 23.905 24.913 1.00 14.24 H new ATOM 0 HE3 LYS A 30 -5.551 22.405 25.370 1.00 14.24 H new ATOM 0 HZ1 LYS A 30 -5.525 23.994 27.180 1.00 53.54 H new ATOM 0 HZ2 LYS A 30 -3.938 23.674 26.668 1.00 53.54 H new ATOM 0 HZ3 LYS A 30 -4.696 25.127 26.225 1.00 53.54 H new ATOM 321 N LYS A 31 -5.352 22.891 18.683 1.00 3.21 N ATOM 322 CA LYS A 31 -6.283 23.788 18.009 1.00 62.14 C ATOM 323 C LYS A 31 -7.705 23.579 18.519 1.00 51.55 C ATOM 324 O LYS A 31 -8.269 24.447 19.186 1.00 62.14 O ATOM 325 CB LYS A 31 -6.234 23.563 16.496 1.00 40.14 C ATOM 326 CG LYS A 31 -7.282 24.351 15.729 1.00 11.44 C ATOM 327 CD LYS A 31 -8.217 23.434 14.959 1.00 42.12 C ATOM 328 CE LYS A 31 -9.565 24.093 14.710 1.00 43.40 C ATOM 329 NZ LYS A 31 -9.992 23.964 13.289 1.00 22.53 N ATOM 0 H LYS A 31 -4.991 22.139 18.096 1.00 3.21 H new ATOM 0 HA LYS A 31 -5.985 24.813 18.228 1.00 62.14 H new ATOM 0 HB2 LYS A 31 -5.245 23.837 16.128 1.00 40.14 H new ATOM 0 HB3 LYS A 31 -6.368 22.501 16.291 1.00 40.14 H new ATOM 0 HG2 LYS A 31 -7.860 24.961 16.423 1.00 11.44 H new ATOM 0 HG3 LYS A 31 -6.790 25.035 15.037 1.00 11.44 H new ATOM 0 HD2 LYS A 31 -7.761 23.165 14.006 1.00 42.12 H new ATOM 0 HD3 LYS A 31 -8.361 22.508 15.516 1.00 42.12 H new ATOM 0 HE2 LYS A 31 -10.316 23.640 15.357 1.00 43.40 H new ATOM 0 HE3 LYS A 31 -9.508 25.148 14.978 1.00 43.40 H new ATOM 0 HZ1 LYS A 31 -10.915 24.426 13.161 1.00 22.53 H new ATOM 0 HZ2 LYS A 31 -9.289 24.419 12.672 1.00 22.53 H new ATOM 0 HZ3 LYS A 31 -10.071 22.957 13.040 1.00 22.53 H new ATOM 343 N SER A 32 -8.279 22.423 18.201 1.00 12.44 N ATOM 344 CA SER A 32 -9.637 22.102 18.626 1.00 41.22 C ATOM 345 C SER A 32 -9.639 20.921 19.591 1.00 31.21 C ATOM 346 O SER A 32 -9.798 21.093 20.800 1.00 54.03 O ATOM 347 CB SER A 32 -10.512 21.785 17.412 1.00 62.05 C ATOM 348 OG SER A 32 -11.476 22.801 17.198 1.00 11.22 O ATOM 0 H SER A 32 -7.825 21.694 17.651 1.00 12.44 H new ATOM 0 HA SER A 32 -10.045 22.971 19.142 1.00 41.22 H new ATOM 0 HB2 SER A 32 -9.886 21.681 16.526 1.00 62.05 H new ATOM 0 HB3 SER A 32 -11.014 20.829 17.561 1.00 62.05 H new ATOM 0 HG SER A 32 -11.073 23.677 17.376 1.00 11.22 H new ATOM 354 N ARG A 33 -9.461 19.721 19.048 1.00 33.12 N ATOM 355 CA ARG A 33 -9.444 18.510 19.860 1.00 60.00 C ATOM 356 C ARG A 33 -9.121 17.287 19.006 1.00 41.51 C ATOM 357 O ARG A 33 -8.054 16.687 19.141 1.00 14.23 O ATOM 358 CB ARG A 33 -10.793 18.317 20.556 1.00 42.44 C ATOM 359 CG ARG A 33 -10.709 17.492 21.829 1.00 60.31 C ATOM 360 CD ARG A 33 -10.021 18.260 22.947 1.00 72.23 C ATOM 361 NE ARG A 33 -9.012 17.451 23.626 1.00 14.31 N ATOM 362 CZ ARG A 33 -9.300 16.541 24.550 1.00 70.14 C ATOM 363 NH1 ARG A 33 -10.560 16.324 24.902 1.00 62.25 N ATOM 364 NH2 ARG A 33 -8.327 15.845 25.123 1.00 65.23 N ATOM 0 H ARG A 33 -9.327 19.561 18.050 1.00 33.12 H new ATOM 0 HA ARG A 33 -8.666 18.621 20.615 1.00 60.00 H new ATOM 0 HB2 ARG A 33 -11.213 19.294 20.794 1.00 42.44 H new ATOM 0 HB3 ARG A 33 -11.483 17.833 19.865 1.00 42.44 H new ATOM 0 HG2 ARG A 33 -11.712 17.207 22.146 1.00 60.31 H new ATOM 0 HG3 ARG A 33 -10.163 16.570 21.631 1.00 60.31 H new ATOM 0 HD2 ARG A 33 -9.553 19.155 22.537 1.00 72.23 H new ATOM 0 HD3 ARG A 33 -10.766 18.593 23.670 1.00 72.23 H new ATOM 0 HE ARG A 33 -8.033 17.592 23.377 1.00 14.31 H new ATOM 0 HH11 ARG A 33 -11.311 16.856 24.463 1.00 62.25 H new ATOM 0 HH12 ARG A 33 -10.778 15.625 25.612 1.00 62.25 H new ATOM 0 HH21 ARG A 33 -7.357 16.008 24.854 1.00 65.23 H new ATOM 0 HH22 ARG A 33 -8.549 15.147 25.832 1.00 65.23 H new ATOM 378 N TYR A 34 -10.049 16.924 18.127 1.00 3.34 N ATOM 379 CA TYR A 34 -9.864 15.772 17.253 1.00 33.24 C ATOM 380 C TYR A 34 -10.503 16.015 15.890 1.00 75.44 C ATOM 381 O TYR A 34 -11.455 16.786 15.765 1.00 31.41 O ATOM 382 CB TYR A 34 -10.463 14.519 17.894 1.00 71.50 C ATOM 383 CG TYR A 34 -11.787 14.764 18.582 1.00 73.45 C ATOM 384 CD1 TYR A 34 -12.983 14.687 17.878 1.00 62.02 C ATOM 385 CD2 TYR A 34 -11.843 15.071 19.936 1.00 63.05 C ATOM 386 CE1 TYR A 34 -14.195 14.911 18.502 1.00 64.01 C ATOM 387 CE2 TYR A 34 -13.050 15.295 20.568 1.00 12.03 C ATOM 388 CZ TYR A 34 -14.223 15.214 19.847 1.00 12.41 C ATOM 389 OH TYR A 34 -15.428 15.437 20.473 1.00 75.22 O ATOM 0 H TYR A 34 -10.936 17.411 18.001 1.00 3.34 H new ATOM 0 HA TYR A 34 -8.794 15.623 17.111 1.00 33.24 H new ATOM 0 HB2 TYR A 34 -10.598 13.757 17.126 1.00 71.50 H new ATOM 0 HB3 TYR A 34 -9.755 14.118 18.619 1.00 71.50 H new ATOM 0 HD1 TYR A 34 -12.964 14.448 16.825 1.00 62.02 H new ATOM 0 HD2 TYR A 34 -10.927 15.136 20.504 1.00 63.05 H new ATOM 0 HE1 TYR A 34 -15.115 14.849 17.940 1.00 64.01 H new ATOM 0 HE2 TYR A 34 -13.075 15.532 21.621 1.00 12.03 H new ATOM 0 HH TYR A 34 -16.003 14.650 20.366 1.00 75.22 H new ATOM 399 N VAL A 35 -9.973 15.350 14.868 1.00 31.30 N ATOM 400 CA VAL A 35 -10.491 15.490 13.513 1.00 55.45 C ATOM 401 C VAL A 35 -10.490 14.152 12.782 1.00 41.31 C ATOM 402 O VAL A 35 -9.452 13.500 12.663 1.00 34.23 O ATOM 403 CB VAL A 35 -9.669 16.508 12.700 1.00 63.42 C ATOM 404 CG1 VAL A 35 -8.199 16.115 12.683 1.00 33.33 C ATOM 405 CG2 VAL A 35 -10.214 16.624 11.284 1.00 21.24 C ATOM 0 H VAL A 35 -9.185 14.709 14.953 1.00 31.30 H new ATOM 0 HA VAL A 35 -11.516 15.850 13.602 1.00 55.45 H new ATOM 0 HB VAL A 35 -9.755 17.483 13.179 1.00 63.42 H new ATOM 0 HG11 VAL A 35 -7.634 16.845 12.104 1.00 33.33 H new ATOM 0 HG12 VAL A 35 -7.818 16.088 13.704 1.00 33.33 H new ATOM 0 HG13 VAL A 35 -8.091 15.130 12.229 1.00 33.33 H new ATOM 0 HG21 VAL A 35 -9.621 17.347 10.724 1.00 21.24 H new ATOM 0 HG22 VAL A 35 -10.160 15.653 10.793 1.00 21.24 H new ATOM 0 HG23 VAL A 35 -11.252 16.955 11.320 1.00 21.24 H new ATOM 415 N ILE A 36 -11.658 13.750 12.294 1.00 72.25 N ATOM 416 CA ILE A 36 -11.791 12.490 11.573 1.00 70.13 C ATOM 417 C ILE A 36 -11.990 12.729 10.080 1.00 51.01 C ATOM 418 O ILE A 36 -12.754 13.606 9.678 1.00 1.20 O ATOM 419 CB ILE A 36 -12.969 11.656 12.109 1.00 34.12 C ATOM 420 CG1 ILE A 36 -12.787 11.377 13.603 1.00 50.15 C ATOM 421 CG2 ILE A 36 -13.093 10.353 11.333 1.00 52.42 C ATOM 422 CD1 ILE A 36 -14.030 11.644 14.423 1.00 25.41 C ATOM 0 H ILE A 36 -12.526 14.278 12.385 1.00 72.25 H new ATOM 0 HA ILE A 36 -10.864 11.938 11.730 1.00 70.13 H new ATOM 0 HB ILE A 36 -13.889 12.225 11.974 1.00 34.12 H new ATOM 0 HG12 ILE A 36 -12.490 10.337 13.737 1.00 50.15 H new ATOM 0 HG13 ILE A 36 -11.972 11.993 13.983 1.00 50.15 H new ATOM 0 HG21 ILE A 36 -13.930 9.775 11.724 1.00 52.42 H new ATOM 0 HG22 ILE A 36 -13.264 10.572 10.279 1.00 52.42 H new ATOM 0 HG23 ILE A 36 -12.174 9.777 11.439 1.00 52.42 H new ATOM 0 HD11 ILE A 36 -13.828 11.425 15.472 1.00 25.41 H new ATOM 0 HD12 ILE A 36 -14.316 12.691 14.319 1.00 25.41 H new ATOM 0 HD13 ILE A 36 -14.842 11.009 14.070 1.00 25.41 H new ATOM 434 N MET A 37 -11.299 11.941 9.263 1.00 42.33 N ATOM 435 CA MET A 37 -11.402 12.065 7.813 1.00 12.53 C ATOM 436 C MET A 37 -11.571 10.697 7.161 1.00 23.11 C ATOM 437 O MET A 37 -11.179 9.676 7.727 1.00 20.23 O ATOM 438 CB MET A 37 -10.162 12.763 7.250 1.00 33.40 C ATOM 439 CG MET A 37 -8.894 11.932 7.363 1.00 72.03 C ATOM 440 SD MET A 37 -7.489 12.888 7.966 1.00 72.35 S ATOM 441 CE MET A 37 -7.339 12.253 9.634 1.00 65.14 C ATOM 0 H MET A 37 -10.662 11.210 9.580 1.00 42.33 H new ATOM 0 HA MET A 37 -12.282 12.666 7.586 1.00 12.53 H new ATOM 0 HB2 MET A 37 -10.336 13.005 6.202 1.00 33.40 H new ATOM 0 HB3 MET A 37 -10.016 13.707 7.775 1.00 33.40 H new ATOM 0 HG2 MET A 37 -9.073 11.093 8.035 1.00 72.03 H new ATOM 0 HG3 MET A 37 -8.651 11.512 6.387 1.00 72.03 H new ATOM 0 HE1 MET A 37 -7.721 12.991 10.340 1.00 65.14 H new ATOM 0 HE2 MET A 37 -7.914 11.332 9.726 1.00 65.14 H new ATOM 0 HE3 MET A 37 -6.291 12.050 9.853 1.00 65.14 H new ATOM 451 N HIS A 38 -12.156 10.683 5.968 1.00 72.02 N ATOM 452 CA HIS A 38 -12.376 9.439 5.239 1.00 72.04 C ATOM 453 C HIS A 38 -11.857 9.549 3.808 1.00 32.31 C ATOM 454 O HIS A 38 -11.614 10.648 3.309 1.00 62.33 O ATOM 455 CB HIS A 38 -13.864 9.086 5.228 1.00 23.51 C ATOM 456 CG HIS A 38 -14.685 9.978 4.349 1.00 31.42 C ATOM 457 ND1 HIS A 38 -14.762 11.343 4.525 1.00 50.24 N ATOM 458 CD2 HIS A 38 -15.467 9.692 3.282 1.00 41.33 C ATOM 459 CE1 HIS A 38 -15.557 11.859 3.604 1.00 0.02 C ATOM 460 NE2 HIS A 38 -15.997 10.878 2.837 1.00 55.21 N ATOM 0 H HIS A 38 -12.486 11.519 5.485 1.00 72.02 H new ATOM 0 HA HIS A 38 -11.826 8.647 5.747 1.00 72.04 H new ATOM 0 HB2 HIS A 38 -13.982 8.054 4.896 1.00 23.51 H new ATOM 0 HB3 HIS A 38 -14.249 9.139 6.246 1.00 23.51 H new ATOM 0 HD2 HIS A 38 -15.642 8.714 2.859 1.00 41.33 H new ATOM 0 HE1 HIS A 38 -15.805 12.905 3.497 1.00 0.02 H new ATOM 0 HE2 HIS A 38 -16.628 10.984 2.043 1.00 55.21 H new ATOM 468 N ILE A 39 -11.689 8.404 3.155 1.00 35.43 N ATOM 469 CA ILE A 39 -11.200 8.372 1.783 1.00 42.02 C ATOM 470 C ILE A 39 -12.342 8.541 0.787 1.00 15.13 C ATOM 471 O ILE A 39 -13.328 7.805 0.826 1.00 32.41 O ATOM 472 CB ILE A 39 -10.460 7.056 1.479 1.00 20.22 C ATOM 473 CG1 ILE A 39 -9.476 6.727 2.604 1.00 43.43 C ATOM 474 CG2 ILE A 39 -9.735 7.151 0.145 1.00 55.02 C ATOM 475 CD1 ILE A 39 -8.712 5.441 2.382 1.00 72.42 C ATOM 0 H ILE A 39 -11.885 7.486 3.555 1.00 35.43 H new ATOM 0 HA ILE A 39 -10.504 9.204 1.678 1.00 42.02 H new ATOM 0 HB ILE A 39 -11.193 6.251 1.415 1.00 20.22 H new ATOM 0 HG12 ILE A 39 -8.767 7.548 2.707 1.00 43.43 H new ATOM 0 HG13 ILE A 39 -10.022 6.658 3.545 1.00 43.43 H new ATOM 0 HG21 ILE A 39 -9.217 6.213 -0.055 1.00 55.02 H new ATOM 0 HG22 ILE A 39 -10.457 7.343 -0.649 1.00 55.02 H new ATOM 0 HG23 ILE A 39 -9.011 7.965 0.182 1.00 55.02 H new ATOM 0 HD11 ILE A 39 -8.034 5.272 3.218 1.00 72.42 H new ATOM 0 HD12 ILE A 39 -9.413 4.609 2.309 1.00 72.42 H new ATOM 0 HD13 ILE A 39 -8.138 5.514 1.458 1.00 72.42 H new ATOM 487 N VAL A 40 -12.203 9.516 -0.106 1.00 23.41 N ATOM 488 CA VAL A 40 -13.222 9.780 -1.114 1.00 43.25 C ATOM 489 C VAL A 40 -12.726 9.408 -2.507 1.00 72.43 C ATOM 490 O VAL A 40 -11.655 9.841 -2.933 1.00 14.00 O ATOM 491 CB VAL A 40 -13.644 11.262 -1.111 1.00 23.51 C ATOM 492 CG1 VAL A 40 -14.726 11.511 -2.150 1.00 41.12 C ATOM 493 CG2 VAL A 40 -14.117 11.677 0.274 1.00 61.11 C ATOM 0 H VAL A 40 -11.394 10.136 -0.151 1.00 23.41 H new ATOM 0 HA VAL A 40 -14.085 9.163 -0.861 1.00 43.25 H new ATOM 0 HB VAL A 40 -12.778 11.870 -1.372 1.00 23.51 H new ATOM 0 HG11 VAL A 40 -15.011 12.563 -2.133 1.00 41.12 H new ATOM 0 HG12 VAL A 40 -14.347 11.254 -3.139 1.00 41.12 H new ATOM 0 HG13 VAL A 40 -15.596 10.895 -1.924 1.00 41.12 H new ATOM 0 HG21 VAL A 40 -14.411 12.726 0.259 1.00 61.11 H new ATOM 0 HG22 VAL A 40 -14.971 11.065 0.566 1.00 61.11 H new ATOM 0 HG23 VAL A 40 -13.308 11.537 0.992 1.00 61.11 H new ATOM 503 N ASP A 41 -13.512 8.602 -3.213 1.00 13.12 N ATOM 504 CA ASP A 41 -13.155 8.172 -4.560 1.00 23.35 C ATOM 505 C ASP A 41 -11.872 7.346 -4.543 1.00 41.24 C ATOM 506 O ASP A 41 -11.246 7.135 -5.582 1.00 11.21 O ATOM 507 CB ASP A 41 -12.984 9.384 -5.477 1.00 35.41 C ATOM 508 CG ASP A 41 -14.031 9.432 -6.573 1.00 32.24 C ATOM 509 OD1 ASP A 41 -14.432 8.353 -7.057 1.00 52.22 O ATOM 510 OD2 ASP A 41 -14.449 10.548 -6.946 1.00 44.22 O ATOM 0 H ASP A 41 -14.401 8.233 -2.875 1.00 13.12 H new ATOM 0 HA ASP A 41 -13.963 7.549 -4.943 1.00 23.35 H new ATOM 0 HB2 ASP A 41 -13.041 10.296 -4.883 1.00 35.41 H new ATOM 0 HB3 ASP A 41 -11.992 9.358 -5.927 1.00 35.41 H new ATOM 515 N GLN A 42 -11.487 6.883 -3.359 1.00 2.45 N ATOM 516 CA GLN A 42 -10.278 6.083 -3.208 1.00 24.31 C ATOM 517 C GLN A 42 -9.095 6.746 -3.907 1.00 32.32 C ATOM 518 O GLN A 42 -8.201 6.069 -4.414 1.00 63.33 O ATOM 519 CB GLN A 42 -10.497 4.678 -3.773 1.00 1.24 C ATOM 520 CG GLN A 42 -11.673 3.947 -3.145 1.00 62.03 C ATOM 521 CD GLN A 42 -12.934 4.045 -3.981 1.00 0.13 C ATOM 522 OE1 GLN A 42 -12.947 3.666 -5.152 1.00 54.33 O ATOM 523 NE2 GLN A 42 -14.003 4.555 -3.381 1.00 54.32 N ATOM 0 H GLN A 42 -11.995 7.048 -2.490 1.00 2.45 H new ATOM 0 HA GLN A 42 -10.053 6.009 -2.144 1.00 24.31 H new ATOM 0 HB2 GLN A 42 -10.656 4.749 -4.849 1.00 1.24 H new ATOM 0 HB3 GLN A 42 -9.592 4.090 -3.623 1.00 1.24 H new ATOM 0 HG2 GLN A 42 -11.413 2.897 -3.008 1.00 62.03 H new ATOM 0 HG3 GLN A 42 -11.865 4.359 -2.154 1.00 62.03 H new ATOM 0 HE21 GLN A 42 -13.947 4.856 -2.408 1.00 54.32 H new ATOM 0 HE22 GLN A 42 -14.881 4.645 -3.893 1.00 54.32 H new ATOM 532 N LYS A 43 -9.097 8.074 -3.930 1.00 51.21 N ATOM 533 CA LYS A 43 -8.025 8.830 -4.566 1.00 3.32 C ATOM 534 C LYS A 43 -7.748 10.124 -3.807 1.00 41.54 C ATOM 535 O LYS A 43 -6.594 10.510 -3.619 1.00 31.21 O ATOM 536 CB LYS A 43 -8.387 9.146 -6.019 1.00 32.22 C ATOM 537 CG LYS A 43 -7.198 9.111 -6.964 1.00 34.14 C ATOM 538 CD LYS A 43 -7.598 9.498 -8.377 1.00 72.25 C ATOM 539 CE LYS A 43 -6.380 9.708 -9.263 1.00 41.44 C ATOM 540 NZ LYS A 43 -5.897 8.430 -9.856 1.00 12.14 N ATOM 0 H LYS A 43 -9.830 8.650 -3.515 1.00 51.21 H new ATOM 0 HA LYS A 43 -7.123 8.218 -4.548 1.00 3.32 H new ATOM 0 HB2 LYS A 43 -9.134 8.431 -6.362 1.00 32.22 H new ATOM 0 HB3 LYS A 43 -8.847 10.133 -6.064 1.00 32.22 H new ATOM 0 HG2 LYS A 43 -6.426 9.791 -6.604 1.00 34.14 H new ATOM 0 HG3 LYS A 43 -6.765 8.111 -6.968 1.00 34.14 H new ATOM 0 HD2 LYS A 43 -8.230 8.719 -8.804 1.00 72.25 H new ATOM 0 HD3 LYS A 43 -8.192 10.411 -8.351 1.00 72.25 H new ATOM 0 HE2 LYS A 43 -6.628 10.408 -10.061 1.00 41.44 H new ATOM 0 HE3 LYS A 43 -5.580 10.162 -8.678 1.00 41.44 H new ATOM 0 HZ1 LYS A 43 -5.066 8.616 -10.453 1.00 12.14 H new ATOM 0 HZ2 LYS A 43 -5.636 7.771 -9.095 1.00 12.14 H new ATOM 0 HZ3 LYS A 43 -6.651 8.009 -10.435 1.00 12.14 H new ATOM 554 N SER A 44 -8.813 10.790 -3.373 1.00 53.34 N ATOM 555 CA SER A 44 -8.685 12.042 -2.637 1.00 45.43 C ATOM 556 C SER A 44 -9.346 11.937 -1.267 1.00 14.33 C ATOM 557 O SER A 44 -10.514 11.562 -1.156 1.00 61.44 O ATOM 558 CB SER A 44 -9.309 13.192 -3.431 1.00 21.31 C ATOM 559 OG SER A 44 -8.364 14.221 -3.666 1.00 52.34 O ATOM 0 H SER A 44 -9.775 10.483 -3.518 1.00 53.34 H new ATOM 0 HA SER A 44 -7.623 12.243 -2.494 1.00 45.43 H new ATOM 0 HB2 SER A 44 -9.688 12.818 -4.382 1.00 21.31 H new ATOM 0 HB3 SER A 44 -10.162 13.595 -2.884 1.00 21.31 H new ATOM 0 HG SER A 44 -8.787 14.943 -4.176 1.00 52.34 H new ATOM 565 N ILE A 45 -8.592 12.272 -0.225 1.00 70.23 N ATOM 566 CA ILE A 45 -9.105 12.216 1.138 1.00 1.30 C ATOM 567 C ILE A 45 -9.906 13.469 1.475 1.00 12.13 C ATOM 568 O ILE A 45 -9.456 14.589 1.237 1.00 4.23 O ATOM 569 CB ILE A 45 -7.965 12.058 2.162 1.00 15.11 C ATOM 570 CG1 ILE A 45 -7.126 10.821 1.836 1.00 5.42 C ATOM 571 CG2 ILE A 45 -8.530 11.965 3.572 1.00 44.40 C ATOM 572 CD1 ILE A 45 -5.884 10.692 2.690 1.00 44.40 C ATOM 0 H ILE A 45 -7.624 12.585 -0.299 1.00 70.23 H new ATOM 0 HA ILE A 45 -9.757 11.344 1.195 1.00 1.30 H new ATOM 0 HB ILE A 45 -7.321 12.936 2.106 1.00 15.11 H new ATOM 0 HG12 ILE A 45 -7.741 9.930 1.966 1.00 5.42 H new ATOM 0 HG13 ILE A 45 -6.834 10.856 0.787 1.00 5.42 H new ATOM 0 HG21 ILE A 45 -7.713 11.854 4.285 1.00 44.40 H new ATOM 0 HG22 ILE A 45 -9.090 12.872 3.800 1.00 44.40 H new ATOM 0 HG23 ILE A 45 -9.193 11.103 3.642 1.00 44.40 H new ATOM 0 HD11 ILE A 45 -5.338 9.793 2.404 1.00 44.40 H new ATOM 0 HD12 ILE A 45 -5.248 11.565 2.542 1.00 44.40 H new ATOM 0 HD13 ILE A 45 -6.170 10.625 3.740 1.00 44.40 H new ATOM 584 N ALA A 46 -11.096 13.271 2.033 1.00 52.42 N ATOM 585 CA ALA A 46 -11.959 14.385 2.407 1.00 51.01 C ATOM 586 C ALA A 46 -12.456 14.237 3.841 1.00 23.01 C ATOM 587 O ALA A 46 -12.605 13.124 4.345 1.00 24.15 O ATOM 588 CB ALA A 46 -13.135 14.487 1.447 1.00 51.11 C ATOM 0 H ALA A 46 -11.484 12.350 2.236 1.00 52.42 H new ATOM 0 HA ALA A 46 -11.373 15.302 2.346 1.00 51.01 H new ATOM 0 HB1 ALA A 46 -13.771 15.323 1.738 1.00 51.11 H new ATOM 0 HB2 ALA A 46 -12.765 14.648 0.434 1.00 51.11 H new ATOM 0 HB3 ALA A 46 -13.713 13.563 1.480 1.00 51.11 H new ATOM 594 N VAL A 47 -12.710 15.367 4.494 1.00 72.41 N ATOM 595 CA VAL A 47 -13.191 15.362 5.871 1.00 44.45 C ATOM 596 C VAL A 47 -14.616 14.828 5.953 1.00 12.55 C ATOM 597 O VAL A 47 -15.463 15.155 5.121 1.00 20.14 O ATOM 598 CB VAL A 47 -13.146 16.774 6.485 1.00 54.23 C ATOM 599 CG1 VAL A 47 -13.756 16.770 7.878 1.00 22.23 C ATOM 600 CG2 VAL A 47 -11.717 17.295 6.520 1.00 34.34 C ATOM 0 H VAL A 47 -12.591 16.297 4.092 1.00 72.41 H new ATOM 0 HA VAL A 47 -12.528 14.707 6.436 1.00 44.45 H new ATOM 0 HB VAL A 47 -13.736 17.443 5.858 1.00 54.23 H new ATOM 0 HG11 VAL A 47 -13.715 17.776 8.296 1.00 22.23 H new ATOM 0 HG12 VAL A 47 -14.794 16.443 7.820 1.00 22.23 H new ATOM 0 HG13 VAL A 47 -13.196 16.088 8.518 1.00 22.23 H new ATOM 0 HG21 VAL A 47 -11.704 18.294 6.957 1.00 34.34 H new ATOM 0 HG22 VAL A 47 -11.101 16.628 7.123 1.00 34.34 H new ATOM 0 HG23 VAL A 47 -11.320 17.338 5.506 1.00 34.34 H new ATOM 610 N LYS A 48 -14.876 14.005 6.964 1.00 41.34 N ATOM 611 CA LYS A 48 -16.200 13.426 7.158 1.00 3.02 C ATOM 612 C LYS A 48 -16.906 14.070 8.347 1.00 51.22 C ATOM 613 O LYS A 48 -18.078 14.440 8.261 1.00 64.12 O ATOM 614 CB LYS A 48 -16.091 11.915 7.374 1.00 70.23 C ATOM 615 CG LYS A 48 -17.191 11.122 6.690 1.00 55.23 C ATOM 616 CD LYS A 48 -17.126 9.648 7.054 1.00 12.51 C ATOM 617 CE LYS A 48 -17.757 8.780 5.977 1.00 34.51 C ATOM 618 NZ LYS A 48 -17.244 7.382 6.020 1.00 11.32 N ATOM 0 H LYS A 48 -14.187 13.724 7.662 1.00 41.34 H new ATOM 0 HA LYS A 48 -16.788 13.618 6.261 1.00 3.02 H new ATOM 0 HB2 LYS A 48 -15.124 11.572 7.005 1.00 70.23 H new ATOM 0 HB3 LYS A 48 -16.116 11.707 8.444 1.00 70.23 H new ATOM 0 HG2 LYS A 48 -18.163 11.525 6.975 1.00 55.23 H new ATOM 0 HG3 LYS A 48 -17.104 11.235 5.609 1.00 55.23 H new ATOM 0 HD2 LYS A 48 -16.087 9.353 7.198 1.00 12.51 H new ATOM 0 HD3 LYS A 48 -17.638 9.483 8.002 1.00 12.51 H new ATOM 0 HE2 LYS A 48 -18.840 8.774 6.104 1.00 34.51 H new ATOM 0 HE3 LYS A 48 -17.553 9.212 4.997 1.00 34.51 H new ATOM 0 HZ1 LYS A 48 -17.855 6.770 5.443 1.00 11.32 H new ATOM 0 HZ2 LYS A 48 -16.275 7.356 5.644 1.00 11.32 H new ATOM 0 HZ3 LYS A 48 -17.243 7.042 7.003 1.00 11.32 H new ATOM 632 N THR A 49 -16.186 14.203 9.456 1.00 0.35 N ATOM 633 CA THR A 49 -16.743 14.803 10.662 1.00 15.10 C ATOM 634 C THR A 49 -15.641 15.240 11.619 1.00 4.42 C ATOM 635 O THR A 49 -14.996 14.409 12.260 1.00 51.15 O ATOM 636 CB THR A 49 -17.684 13.826 11.392 1.00 22.15 C ATOM 637 OG1 THR A 49 -18.810 13.518 10.563 1.00 20.35 O ATOM 638 CG2 THR A 49 -18.164 14.419 12.709 1.00 63.43 C ATOM 0 H THR A 49 -15.215 13.903 9.544 1.00 0.35 H new ATOM 0 HA THR A 49 -17.312 15.677 10.346 1.00 15.10 H new ATOM 0 HB THR A 49 -17.129 12.912 11.604 1.00 22.15 H new ATOM 0 HG1 THR A 49 -18.794 14.087 9.765 1.00 20.35 H new ATOM 0 HG21 THR A 49 -18.827 13.711 13.207 1.00 63.43 H new ATOM 0 HG22 THR A 49 -17.306 14.625 13.349 1.00 63.43 H new ATOM 0 HG23 THR A 49 -18.703 15.346 12.515 1.00 63.43 H new ATOM 646 N ILE A 50 -15.429 16.549 11.712 1.00 20.24 N ATOM 647 CA ILE A 50 -14.405 17.096 12.594 1.00 64.45 C ATOM 648 C ILE A 50 -15.002 17.531 13.927 1.00 20.54 C ATOM 649 O ILE A 50 -16.151 17.966 13.993 1.00 44.34 O ATOM 650 CB ILE A 50 -13.690 18.297 11.948 1.00 44.21 C ATOM 651 CG1 ILE A 50 -12.498 18.730 12.804 1.00 23.43 C ATOM 652 CG2 ILE A 50 -14.661 19.453 11.760 1.00 42.10 C ATOM 653 CD1 ILE A 50 -11.547 19.663 12.089 1.00 45.13 C ATOM 0 H ILE A 50 -15.953 17.250 11.188 1.00 20.24 H new ATOM 0 HA ILE A 50 -13.680 16.301 12.767 1.00 64.45 H new ATOM 0 HB ILE A 50 -13.319 17.996 10.968 1.00 44.21 H new ATOM 0 HG12 ILE A 50 -12.867 19.221 13.704 1.00 23.43 H new ATOM 0 HG13 ILE A 50 -11.951 17.844 13.126 1.00 23.43 H new ATOM 0 HG21 ILE A 50 -14.141 20.294 11.302 1.00 42.10 H new ATOM 0 HG22 ILE A 50 -15.481 19.138 11.114 1.00 42.10 H new ATOM 0 HG23 ILE A 50 -15.058 19.756 12.729 1.00 42.10 H new ATOM 0 HD11 ILE A 50 -10.727 19.928 12.756 1.00 45.13 H new ATOM 0 HD12 ILE A 50 -11.149 19.168 11.203 1.00 45.13 H new ATOM 0 HD13 ILE A 50 -12.079 20.567 11.791 1.00 45.13 H new ATOM 665 N GLY A 51 -14.213 17.410 14.991 1.00 45.43 N ATOM 666 CA GLY A 51 -14.680 17.797 16.309 1.00 21.21 C ATOM 667 C GLY A 51 -14.104 19.123 16.763 1.00 44.32 C ATOM 668 O GLY A 51 -13.453 19.822 15.986 1.00 12.15 O ATOM 0 H GLY A 51 -13.259 17.051 14.963 1.00 45.43 H new ATOM 0 HA2 GLY A 51 -15.768 17.861 16.301 1.00 21.21 H new ATOM 0 HA3 GLY A 51 -14.412 17.023 17.028 1.00 21.21 H new ATOM 672 N GLU A 52 -14.344 19.471 18.023 1.00 13.50 N ATOM 673 CA GLU A 52 -13.846 20.725 18.577 1.00 20.21 C ATOM 674 C GLU A 52 -14.253 20.873 20.040 1.00 32.02 C ATOM 675 O GLU A 52 -14.838 21.882 20.434 1.00 54.25 O ATOM 676 CB GLU A 52 -14.373 21.911 17.767 1.00 4.41 C ATOM 677 CG GLU A 52 -15.858 21.828 17.461 1.00 75.43 C ATOM 678 CD GLU A 52 -16.391 23.087 16.804 1.00 23.34 C ATOM 679 OE1 GLU A 52 -16.658 24.067 17.530 1.00 43.31 O ATOM 680 OE2 GLU A 52 -16.540 23.091 15.564 1.00 2.04 O ATOM 0 H GLU A 52 -14.880 18.903 18.679 1.00 13.50 H new ATOM 0 HA GLU A 52 -12.758 20.711 18.520 1.00 20.21 H new ATOM 0 HB2 GLU A 52 -14.175 22.832 18.316 1.00 4.41 H new ATOM 0 HB3 GLU A 52 -13.821 21.974 16.829 1.00 4.41 H new ATOM 0 HG2 GLU A 52 -16.043 20.976 16.807 1.00 75.43 H new ATOM 0 HG3 GLU A 52 -16.406 21.646 18.386 1.00 75.43 H new ATOM 687 N ARG A 53 -13.940 19.860 20.841 1.00 23.30 N ATOM 688 CA ARG A 53 -14.274 19.876 22.260 1.00 72.40 C ATOM 689 C ARG A 53 -15.784 19.974 22.462 1.00 65.53 C ATOM 690 O ARG A 53 -16.253 20.358 23.532 1.00 74.42 O ATOM 691 CB ARG A 53 -13.579 21.047 22.957 1.00 63.44 C ATOM 692 CG ARG A 53 -12.118 21.206 22.568 1.00 21.20 C ATOM 693 CD ARG A 53 -11.359 22.042 23.586 1.00 24.13 C ATOM 694 NE ARG A 53 -11.199 21.343 24.859 1.00 71.04 N ATOM 695 CZ ARG A 53 -10.343 21.719 25.802 1.00 45.44 C ATOM 696 NH1 ARG A 53 -9.573 22.783 25.616 1.00 24.22 N ATOM 697 NH2 ARG A 53 -10.255 21.032 26.933 1.00 33.11 N ATOM 0 H ARG A 53 -13.455 19.018 20.531 1.00 23.30 H new ATOM 0 HA ARG A 53 -13.925 18.942 22.700 1.00 72.40 H new ATOM 0 HB2 ARG A 53 -14.112 21.968 22.720 1.00 63.44 H new ATOM 0 HB3 ARG A 53 -13.646 20.908 24.036 1.00 63.44 H new ATOM 0 HG2 ARG A 53 -11.654 20.223 22.484 1.00 21.20 H new ATOM 0 HG3 ARG A 53 -12.051 21.676 21.587 1.00 21.20 H new ATOM 0 HD2 ARG A 53 -10.377 22.296 23.186 1.00 24.13 H new ATOM 0 HD3 ARG A 53 -11.889 22.980 23.752 1.00 24.13 H new ATOM 0 HE ARG A 53 -11.777 20.521 25.033 1.00 71.04 H new ATOM 0 HH11 ARG A 53 -9.638 23.314 24.747 1.00 24.22 H new ATOM 0 HH12 ARG A 53 -8.916 23.070 26.342 1.00 24.22 H new ATOM 0 HH21 ARG A 53 -10.845 20.213 27.080 1.00 33.11 H new ATOM 0 HH22 ARG A 53 -9.597 21.322 27.656 1.00 33.11 H new ATOM 711 N GLY A 54 -16.538 19.624 21.424 1.00 32.44 N ATOM 712 CA GLY A 54 -17.986 19.680 21.508 1.00 61.22 C ATOM 713 C GLY A 54 -18.656 18.591 20.694 1.00 33.42 C ATOM 714 O GLY A 54 -19.861 18.642 20.449 1.00 40.43 O ATOM 0 H GLY A 54 -16.172 19.303 20.527 1.00 32.44 H new ATOM 0 HA2 GLY A 54 -18.290 19.589 22.551 1.00 61.22 H new ATOM 0 HA3 GLY A 54 -18.330 20.654 21.159 1.00 61.22 H new ATOM 718 N ALA A 55 -17.874 17.602 20.274 1.00 41.04 N ATOM 719 CA ALA A 55 -18.399 16.496 19.483 1.00 32.31 C ATOM 720 C ALA A 55 -18.772 15.314 20.372 1.00 13.32 C ATOM 721 O ALA A 55 -17.904 14.661 20.949 1.00 60.35 O ATOM 722 CB ALA A 55 -17.384 16.069 18.433 1.00 33.31 C ATOM 0 H ALA A 55 -16.874 17.544 20.468 1.00 41.04 H new ATOM 0 HA ALA A 55 -19.303 16.839 18.980 1.00 32.31 H new ATOM 0 HB1 ALA A 55 -17.790 15.242 17.850 1.00 33.31 H new ATOM 0 HB2 ALA A 55 -17.169 16.909 17.772 1.00 33.31 H new ATOM 0 HB3 ALA A 55 -16.465 15.750 18.924 1.00 33.31 H new ATOM 728 N ASN A 56 -20.070 15.047 20.479 1.00 22.33 N ATOM 729 CA ASN A 56 -20.558 13.944 21.300 1.00 44.22 C ATOM 730 C ASN A 56 -20.241 12.601 20.650 1.00 71.33 C ATOM 731 O ASN A 56 -19.950 12.530 19.456 1.00 71.05 O ATOM 732 CB ASN A 56 -22.066 14.074 21.521 1.00 71.25 C ATOM 733 CG ASN A 56 -22.405 14.613 22.897 1.00 42.02 C ATOM 734 OD1 ASN A 56 -21.912 15.666 23.302 1.00 63.21 O ATOM 735 ND2 ASN A 56 -23.250 13.891 23.623 1.00 15.32 N ATOM 0 H ASN A 56 -20.802 15.579 20.008 1.00 22.33 H new ATOM 0 HA ASN A 56 -20.052 13.989 22.264 1.00 44.22 H new ATOM 0 HB2 ASN A 56 -22.486 14.734 20.762 1.00 71.25 H new ATOM 0 HB3 ASN A 56 -22.535 13.099 21.390 1.00 71.25 H new ATOM 0 HD21 ASN A 56 -23.515 14.203 24.557 1.00 15.32 H new ATOM 0 HD22 ASN A 56 -23.634 13.024 23.247 1.00 15.32 H new ATOM 742 N PHE A 57 -20.301 11.537 21.444 1.00 64.22 N ATOM 743 CA PHE A 57 -20.020 10.195 20.946 1.00 31.03 C ATOM 744 C PHE A 57 -21.120 9.725 19.999 1.00 13.11 C ATOM 745 O PHE A 57 -20.852 9.046 19.008 1.00 55.13 O ATOM 746 CB PHE A 57 -19.882 9.214 22.113 1.00 54.24 C ATOM 747 CG PHE A 57 -21.145 9.050 22.910 1.00 63.32 C ATOM 748 CD1 PHE A 57 -21.410 9.875 23.990 1.00 3.55 C ATOM 749 CD2 PHE A 57 -22.067 8.070 22.578 1.00 25.13 C ATOM 750 CE1 PHE A 57 -22.570 9.726 24.726 1.00 31.31 C ATOM 751 CE2 PHE A 57 -23.229 7.916 23.310 1.00 70.30 C ATOM 752 CZ PHE A 57 -23.481 8.745 24.385 1.00 55.43 C ATOM 0 H PHE A 57 -20.542 11.578 22.434 1.00 64.22 H new ATOM 0 HA PHE A 57 -19.080 10.228 20.395 1.00 31.03 H new ATOM 0 HB2 PHE A 57 -19.577 8.242 21.726 1.00 54.24 H new ATOM 0 HB3 PHE A 57 -19.086 9.558 22.774 1.00 54.24 H new ATOM 0 HD1 PHE A 57 -20.702 10.644 24.260 1.00 3.55 H new ATOM 0 HD2 PHE A 57 -21.875 7.419 21.738 1.00 25.13 H new ATOM 0 HE1 PHE A 57 -22.764 10.376 25.567 1.00 31.31 H new ATOM 0 HE2 PHE A 57 -23.939 7.148 23.041 1.00 70.30 H new ATOM 0 HZ PHE A 57 -24.389 8.627 24.958 1.00 55.43 H new ATOM 762 N ASP A 58 -22.358 10.091 20.312 1.00 13.03 N ATOM 763 CA ASP A 58 -23.500 9.708 19.490 1.00 40.12 C ATOM 764 C ASP A 58 -23.333 10.212 18.060 1.00 42.13 C ATOM 765 O ASP A 58 -23.544 9.469 17.102 1.00 62.03 O ATOM 766 CB ASP A 58 -24.795 10.258 20.089 1.00 10.15 C ATOM 767 CG ASP A 58 -25.627 9.181 20.757 1.00 72.11 C ATOM 768 OD1 ASP A 58 -26.240 8.369 20.032 1.00 51.44 O ATOM 769 OD2 ASP A 58 -25.665 9.149 22.004 1.00 21.35 O ATOM 0 H ASP A 58 -22.596 10.653 21.129 1.00 13.03 H new ATOM 0 HA ASP A 58 -23.552 8.619 19.470 1.00 40.12 H new ATOM 0 HB2 ASP A 58 -24.555 11.032 20.818 1.00 10.15 H new ATOM 0 HB3 ASP A 58 -25.383 10.732 19.303 1.00 10.15 H new ATOM 774 N GLN A 59 -22.954 11.479 17.925 1.00 61.25 N ATOM 775 CA GLN A 59 -22.761 12.082 16.611 1.00 24.11 C ATOM 776 C GLN A 59 -21.551 11.476 15.907 1.00 52.13 C ATOM 777 O GLN A 59 -21.520 11.376 14.680 1.00 72.40 O ATOM 778 CB GLN A 59 -22.584 13.596 16.743 1.00 62.44 C ATOM 779 CG GLN A 59 -23.813 14.307 17.285 1.00 21.23 C ATOM 780 CD GLN A 59 -24.174 15.541 16.483 1.00 14.44 C ATOM 781 OE1 GLN A 59 -23.370 16.463 16.345 1.00 41.33 O ATOM 782 NE2 GLN A 59 -25.390 15.566 15.950 1.00 51.12 N ATOM 0 H GLN A 59 -22.775 12.107 18.708 1.00 61.25 H new ATOM 0 HA GLN A 59 -23.648 11.878 16.011 1.00 24.11 H new ATOM 0 HB2 GLN A 59 -21.738 13.799 17.400 1.00 62.44 H new ATOM 0 HB3 GLN A 59 -22.336 14.011 15.766 1.00 62.44 H new ATOM 0 HG2 GLN A 59 -24.657 13.617 17.283 1.00 21.23 H new ATOM 0 HG3 GLN A 59 -23.636 14.591 18.322 1.00 21.23 H new ATOM 0 HE21 GLN A 59 -26.024 14.780 16.090 1.00 51.12 H new ATOM 0 HE22 GLN A 59 -25.690 16.372 15.401 1.00 51.12 H new ATOM 791 N PHE A 60 -20.556 11.074 16.690 1.00 12.04 N ATOM 792 CA PHE A 60 -19.343 10.479 16.142 1.00 52.15 C ATOM 793 C PHE A 60 -19.647 9.140 15.476 1.00 52.21 C ATOM 794 O PHE A 60 -19.182 8.865 14.369 1.00 3.35 O ATOM 795 CB PHE A 60 -18.299 10.288 17.244 1.00 55.10 C ATOM 796 CG PHE A 60 -17.127 9.451 16.821 1.00 63.35 C ATOM 797 CD1 PHE A 60 -16.521 9.654 15.591 1.00 54.12 C ATOM 798 CD2 PHE A 60 -16.629 8.461 17.652 1.00 32.53 C ATOM 799 CE1 PHE A 60 -15.443 8.884 15.199 1.00 44.44 C ATOM 800 CE2 PHE A 60 -15.550 7.688 17.266 1.00 73.15 C ATOM 801 CZ PHE A 60 -14.956 7.901 16.037 1.00 23.14 C ATOM 0 H PHE A 60 -20.566 11.150 17.707 1.00 12.04 H new ATOM 0 HA PHE A 60 -18.944 11.158 15.388 1.00 52.15 H new ATOM 0 HB2 PHE A 60 -17.940 11.265 17.566 1.00 55.10 H new ATOM 0 HB3 PHE A 60 -18.775 9.823 18.107 1.00 55.10 H new ATOM 0 HD1 PHE A 60 -16.896 10.423 14.932 1.00 54.12 H new ATOM 0 HD2 PHE A 60 -17.090 8.291 18.614 1.00 32.53 H new ATOM 0 HE1 PHE A 60 -14.981 9.051 14.237 1.00 44.44 H new ATOM 0 HE2 PHE A 60 -15.172 6.919 17.924 1.00 73.15 H new ATOM 0 HZ PHE A 60 -14.112 7.300 15.732 1.00 23.14 H new ATOM 811 N ILE A 61 -20.430 8.311 16.158 1.00 13.51 N ATOM 812 CA ILE A 61 -20.797 7.002 15.633 1.00 21.14 C ATOM 813 C ILE A 61 -21.775 7.130 14.471 1.00 70.15 C ATOM 814 O ILE A 61 -21.632 6.457 13.450 1.00 11.12 O ATOM 815 CB ILE A 61 -21.426 6.115 16.724 1.00 73.34 C ATOM 816 CG1 ILE A 61 -20.458 5.946 17.897 1.00 53.34 C ATOM 817 CG2 ILE A 61 -21.810 4.760 16.148 1.00 61.23 C ATOM 818 CD1 ILE A 61 -19.154 5.283 17.513 1.00 32.32 C ATOM 0 H ILE A 61 -20.822 8.523 17.075 1.00 13.51 H new ATOM 0 HA ILE A 61 -19.878 6.534 15.280 1.00 21.14 H new ATOM 0 HB ILE A 61 -22.329 6.602 17.091 1.00 73.34 H new ATOM 0 HG12 ILE A 61 -20.246 6.925 18.327 1.00 53.34 H new ATOM 0 HG13 ILE A 61 -20.942 5.355 18.675 1.00 53.34 H new ATOM 0 HG21 ILE A 61 -22.253 4.144 16.931 1.00 61.23 H new ATOM 0 HG22 ILE A 61 -22.532 4.898 15.343 1.00 61.23 H new ATOM 0 HG23 ILE A 61 -20.921 4.265 15.757 1.00 61.23 H new ATOM 0 HD11 ILE A 61 -18.517 5.196 18.393 1.00 32.32 H new ATOM 0 HD12 ILE A 61 -19.355 4.290 17.111 1.00 32.32 H new ATOM 0 HD13 ILE A 61 -18.649 5.885 16.758 1.00 32.32 H new ATOM 830 N GLU A 62 -22.768 7.999 14.632 1.00 4.41 N ATOM 831 CA GLU A 62 -23.769 8.216 13.594 1.00 21.04 C ATOM 832 C GLU A 62 -23.117 8.695 12.300 1.00 23.35 C ATOM 833 O GLU A 62 -23.497 8.273 11.209 1.00 50.54 O ATOM 834 CB GLU A 62 -24.808 9.237 14.063 1.00 72.34 C ATOM 835 CG GLU A 62 -25.792 9.645 12.979 1.00 63.13 C ATOM 836 CD GLU A 62 -27.194 9.862 13.515 1.00 64.35 C ATOM 837 OE1 GLU A 62 -27.922 8.862 13.691 1.00 4.43 O ATOM 838 OE2 GLU A 62 -27.563 11.030 13.757 1.00 63.32 O ATOM 0 H GLU A 62 -22.901 8.564 15.471 1.00 4.41 H new ATOM 0 HA GLU A 62 -24.266 7.265 13.399 1.00 21.04 H new ATOM 0 HB2 GLU A 62 -25.360 8.820 14.905 1.00 72.34 H new ATOM 0 HB3 GLU A 62 -24.293 10.126 14.428 1.00 72.34 H new ATOM 0 HG2 GLU A 62 -25.443 10.562 12.503 1.00 63.13 H new ATOM 0 HG3 GLU A 62 -25.817 8.875 12.208 1.00 63.13 H new ATOM 845 N ALA A 63 -22.133 9.578 12.432 1.00 3.24 N ATOM 846 CA ALA A 63 -21.426 10.114 11.275 1.00 35.52 C ATOM 847 C ALA A 63 -20.523 9.058 10.647 1.00 72.13 C ATOM 848 O ALA A 63 -20.602 8.795 9.446 1.00 13.03 O ATOM 849 CB ALA A 63 -20.614 11.337 11.672 1.00 12.33 C ATOM 0 H ALA A 63 -21.807 9.938 13.329 1.00 3.24 H new ATOM 0 HA ALA A 63 -22.167 10.410 10.532 1.00 35.52 H new ATOM 0 HB1 ALA A 63 -20.092 11.726 10.798 1.00 12.33 H new ATOM 0 HB2 ALA A 63 -21.280 12.103 12.068 1.00 12.33 H new ATOM 0 HB3 ALA A 63 -19.887 11.059 12.435 1.00 12.33 H new ATOM 855 N ILE A 64 -19.665 8.457 11.464 1.00 35.04 N ATOM 856 CA ILE A 64 -18.748 7.430 10.988 1.00 62.15 C ATOM 857 C ILE A 64 -19.498 6.162 10.595 1.00 31.41 C ATOM 858 O ILE A 64 -20.522 5.824 11.190 1.00 2.50 O ATOM 859 CB ILE A 64 -17.692 7.079 12.053 1.00 52.52 C ATOM 860 CG1 ILE A 64 -16.574 6.237 11.436 1.00 4.21 C ATOM 861 CG2 ILE A 64 -18.338 6.342 13.216 1.00 32.21 C ATOM 862 CD1 ILE A 64 -15.492 5.854 12.422 1.00 41.42 C ATOM 0 H ILE A 64 -19.586 8.664 12.460 1.00 35.04 H new ATOM 0 HA ILE A 64 -18.246 7.839 10.111 1.00 62.15 H new ATOM 0 HB ILE A 64 -17.257 8.004 12.431 1.00 52.52 H new ATOM 0 HG12 ILE A 64 -17.005 5.330 11.011 1.00 4.21 H new ATOM 0 HG13 ILE A 64 -16.124 6.792 10.613 1.00 4.21 H new ATOM 0 HG21 ILE A 64 -17.579 6.101 13.960 1.00 32.21 H new ATOM 0 HG22 ILE A 64 -19.102 6.974 13.668 1.00 32.21 H new ATOM 0 HG23 ILE A 64 -18.797 5.422 12.854 1.00 32.21 H new ATOM 0 HD11 ILE A 64 -14.733 5.258 11.916 1.00 41.42 H new ATOM 0 HD12 ILE A 64 -15.034 6.756 12.828 1.00 41.42 H new ATOM 0 HD13 ILE A 64 -15.929 5.272 13.233 1.00 41.42 H new ATOM 874 N ASP A 65 -18.981 5.462 9.591 1.00 30.23 N ATOM 875 CA ASP A 65 -19.600 4.228 9.121 1.00 51.24 C ATOM 876 C ASP A 65 -18.865 3.008 9.667 1.00 43.34 C ATOM 877 O ASP A 65 -18.009 3.127 10.544 1.00 63.14 O ATOM 878 CB ASP A 65 -19.612 4.190 7.592 1.00 73.34 C ATOM 879 CG ASP A 65 -20.978 3.844 7.032 1.00 32.21 C ATOM 880 OD1 ASP A 65 -21.870 4.717 7.061 1.00 14.44 O ATOM 881 OD2 ASP A 65 -21.155 2.700 6.564 1.00 63.20 O ATOM 0 H ASP A 65 -18.135 5.728 9.087 1.00 30.23 H new ATOM 0 HA ASP A 65 -20.627 4.203 9.486 1.00 51.24 H new ATOM 0 HB2 ASP A 65 -19.299 5.160 7.205 1.00 73.34 H new ATOM 0 HB3 ASP A 65 -18.884 3.458 7.244 1.00 73.34 H new ATOM 886 N LYS A 66 -19.205 1.835 9.143 1.00 3.51 N ATOM 887 CA LYS A 66 -18.578 0.593 9.577 1.00 64.32 C ATOM 888 C LYS A 66 -18.217 -0.282 8.380 1.00 52.41 C ATOM 889 O LYS A 66 -18.802 -1.345 8.178 1.00 24.12 O ATOM 890 CB LYS A 66 -19.511 -0.172 10.518 1.00 61.20 C ATOM 891 CG LYS A 66 -18.783 -1.107 11.468 1.00 35.43 C ATOM 892 CD LYS A 66 -19.464 -2.464 11.546 1.00 40.23 C ATOM 893 CE LYS A 66 -18.797 -3.475 10.626 1.00 22.44 C ATOM 894 NZ LYS A 66 -18.213 -4.615 11.387 1.00 45.24 N ATOM 0 H LYS A 66 -19.912 1.719 8.417 1.00 3.51 H new ATOM 0 HA LYS A 66 -17.661 0.845 10.110 1.00 64.32 H new ATOM 0 HB2 LYS A 66 -20.093 0.543 11.100 1.00 61.20 H new ATOM 0 HB3 LYS A 66 -20.219 -0.750 9.924 1.00 61.20 H new ATOM 0 HG2 LYS A 66 -17.753 -1.235 11.136 1.00 35.43 H new ATOM 0 HG3 LYS A 66 -18.745 -0.660 12.462 1.00 35.43 H new ATOM 0 HD2 LYS A 66 -19.434 -2.829 12.573 1.00 40.23 H new ATOM 0 HD3 LYS A 66 -20.515 -2.361 11.275 1.00 40.23 H new ATOM 0 HE2 LYS A 66 -19.527 -3.852 9.910 1.00 22.44 H new ATOM 0 HE3 LYS A 66 -18.013 -2.982 10.052 1.00 22.44 H new ATOM 0 HZ1 LYS A 66 -17.768 -5.282 10.725 1.00 45.24 H new ATOM 0 HZ2 LYS A 66 -17.498 -4.258 12.052 1.00 45.24 H new ATOM 0 HZ3 LYS A 66 -18.965 -5.101 11.915 1.00 45.24 H new ATOM 908 N ASN A 67 -17.250 0.174 7.590 1.00 72.10 N ATOM 909 CA ASN A 67 -16.812 -0.568 6.413 1.00 5.14 C ATOM 910 C ASN A 67 -15.682 0.167 5.697 1.00 32.53 C ATOM 911 O ASN A 67 -14.591 -0.374 5.518 1.00 22.21 O ATOM 912 CB ASN A 67 -17.984 -0.783 5.454 1.00 22.21 C ATOM 913 CG ASN A 67 -18.029 -2.196 4.904 1.00 2.30 C ATOM 914 OD1 ASN A 67 -17.584 -2.452 3.785 1.00 21.52 O ATOM 915 ND2 ASN A 67 -18.568 -3.120 5.690 1.00 14.24 N ATOM 0 H ASN A 67 -16.755 1.053 7.743 1.00 72.10 H new ATOM 0 HA ASN A 67 -16.440 -1.538 6.743 1.00 5.14 H new ATOM 0 HB2 ASN A 67 -18.918 -0.568 5.972 1.00 22.21 H new ATOM 0 HB3 ASN A 67 -17.908 -0.076 4.627 1.00 22.21 H new ATOM 0 HD21 ASN A 67 -18.626 -4.088 5.374 1.00 14.24 H new ATOM 0 HD22 ASN A 67 -18.924 -2.862 6.610 1.00 14.24 H new ATOM 922 N VAL A 68 -15.952 1.403 5.290 1.00 32.20 N ATOM 923 CA VAL A 68 -14.959 2.213 4.595 1.00 61.20 C ATOM 924 C VAL A 68 -13.826 2.616 5.532 1.00 65.25 C ATOM 925 O VAL A 68 -13.998 2.721 6.746 1.00 52.40 O ATOM 926 CB VAL A 68 -15.591 3.483 3.995 1.00 23.01 C ATOM 927 CG1 VAL A 68 -16.764 3.123 3.096 1.00 21.35 C ATOM 928 CG2 VAL A 68 -16.027 4.433 5.100 1.00 42.41 C ATOM 0 H VAL A 68 -16.850 1.865 5.430 1.00 32.20 H new ATOM 0 HA VAL A 68 -14.558 1.600 3.788 1.00 61.20 H new ATOM 0 HB VAL A 68 -14.841 3.989 3.387 1.00 23.01 H new ATOM 0 HG11 VAL A 68 -17.197 4.033 2.681 1.00 21.35 H new ATOM 0 HG12 VAL A 68 -16.417 2.484 2.284 1.00 21.35 H new ATOM 0 HG13 VAL A 68 -17.519 2.594 3.677 1.00 21.35 H new ATOM 0 HG21 VAL A 68 -16.471 5.325 4.659 1.00 42.41 H new ATOM 0 HG22 VAL A 68 -16.761 3.939 5.736 1.00 42.41 H new ATOM 0 HG23 VAL A 68 -15.161 4.717 5.698 1.00 42.41 H new ATOM 938 N PRO A 69 -12.636 2.847 4.956 1.00 54.51 N ATOM 939 CA PRO A 69 -11.450 3.244 5.721 1.00 74.01 C ATOM 940 C PRO A 69 -11.566 4.659 6.278 1.00 33.42 C ATOM 941 O PRO A 69 -11.797 5.612 5.534 1.00 44.34 O ATOM 942 CB PRO A 69 -10.321 3.166 4.690 1.00 12.13 C ATOM 943 CG PRO A 69 -10.994 3.359 3.375 1.00 34.14 C ATOM 944 CD PRO A 69 -12.358 2.741 3.514 1.00 72.32 C ATOM 0 HA PRO A 69 -11.295 2.608 6.592 1.00 74.01 H new ATOM 0 HB2 PRO A 69 -9.570 3.936 4.867 1.00 12.13 H new ATOM 0 HB3 PRO A 69 -9.809 2.205 4.735 1.00 12.13 H new ATOM 0 HG2 PRO A 69 -11.069 4.418 3.126 1.00 34.14 H new ATOM 0 HG3 PRO A 69 -10.429 2.882 2.574 1.00 34.14 H new ATOM 0 HD2 PRO A 69 -13.102 3.273 2.921 1.00 72.32 H new ATOM 0 HD3 PRO A 69 -12.365 1.704 3.179 1.00 72.32 H new ATOM 952 N CYS A 70 -11.405 4.787 7.590 1.00 1.43 N ATOM 953 CA CYS A 70 -11.492 6.087 8.247 1.00 21.35 C ATOM 954 C CYS A 70 -10.347 6.273 9.238 1.00 43.05 C ATOM 955 O CYS A 70 -9.877 5.312 9.847 1.00 33.14 O ATOM 956 CB CYS A 70 -12.833 6.228 8.968 1.00 13.22 C ATOM 957 SG CYS A 70 -14.251 6.410 7.861 1.00 61.35 S ATOM 0 H CYS A 70 -11.214 4.008 8.220 1.00 1.43 H new ATOM 0 HA CYS A 70 -11.416 6.859 7.482 1.00 21.35 H new ATOM 0 HB2 CYS A 70 -12.988 5.353 9.599 1.00 13.22 H new ATOM 0 HB3 CYS A 70 -12.789 7.093 9.629 1.00 13.22 H new ATOM 0 HG CYS A 70 -15.339 6.520 8.564 1.00 61.35 H new ATOM 963 N TYR A 71 -9.901 7.515 9.391 1.00 64.31 N ATOM 964 CA TYR A 71 -8.807 7.827 10.304 1.00 73.32 C ATOM 965 C TYR A 71 -9.188 8.971 11.239 1.00 63.15 C ATOM 966 O TYR A 71 -9.660 10.018 10.796 1.00 23.33 O ATOM 967 CB TYR A 71 -7.547 8.193 9.518 1.00 54.15 C ATOM 968 CG TYR A 71 -7.253 7.251 8.372 1.00 11.01 C ATOM 969 CD1 TYR A 71 -7.049 5.895 8.597 1.00 13.02 C ATOM 970 CD2 TYR A 71 -7.178 7.717 7.065 1.00 23.43 C ATOM 971 CE1 TYR A 71 -6.779 5.030 7.554 1.00 54.50 C ATOM 972 CE2 TYR A 71 -6.910 6.859 6.016 1.00 42.21 C ATOM 973 CZ TYR A 71 -6.711 5.517 6.265 1.00 12.23 C ATOM 974 OH TYR A 71 -6.443 4.660 5.223 1.00 43.13 O ATOM 0 H TYR A 71 -10.280 8.322 8.895 1.00 64.31 H new ATOM 0 HA TYR A 71 -8.606 6.941 10.906 1.00 73.32 H new ATOM 0 HB2 TYR A 71 -7.654 9.205 9.127 1.00 54.15 H new ATOM 0 HB3 TYR A 71 -6.695 8.202 10.198 1.00 54.15 H new ATOM 0 HD1 TYR A 71 -7.102 5.511 9.605 1.00 13.02 H new ATOM 0 HD2 TYR A 71 -7.332 8.767 6.866 1.00 23.43 H new ATOM 0 HE1 TYR A 71 -6.622 3.979 7.747 1.00 54.50 H new ATOM 0 HE2 TYR A 71 -6.857 7.237 5.006 1.00 42.21 H new ATOM 0 HH TYR A 71 -7.261 4.181 4.974 1.00 43.13 H new ATOM 984 N ALA A 72 -8.978 8.762 12.534 1.00 3.42 N ATOM 985 CA ALA A 72 -9.295 9.776 13.532 1.00 34.14 C ATOM 986 C ALA A 72 -8.038 10.249 14.254 1.00 40.02 C ATOM 987 O ALA A 72 -7.302 9.448 14.829 1.00 34.50 O ATOM 988 CB ALA A 72 -10.307 9.234 14.531 1.00 11.13 C ATOM 0 H ALA A 72 -8.590 7.900 12.917 1.00 3.42 H new ATOM 0 HA ALA A 72 -9.730 10.633 13.018 1.00 34.14 H new ATOM 0 HB1 ALA A 72 -10.535 10.001 15.271 1.00 11.13 H new ATOM 0 HB2 ALA A 72 -11.220 8.952 14.007 1.00 11.13 H new ATOM 0 HB3 ALA A 72 -9.892 8.359 15.032 1.00 11.13 H new ATOM 994 N ALA A 73 -7.797 11.556 14.218 1.00 32.54 N ATOM 995 CA ALA A 73 -6.629 12.135 14.870 1.00 32.01 C ATOM 996 C ALA A 73 -7.023 12.884 16.139 1.00 75.33 C ATOM 997 O ALA A 73 -7.704 13.908 16.081 1.00 45.41 O ATOM 998 CB ALA A 73 -5.897 13.064 13.913 1.00 72.22 C ATOM 0 H ALA A 73 -8.395 12.233 13.744 1.00 32.54 H new ATOM 0 HA ALA A 73 -5.961 11.321 15.152 1.00 32.01 H new ATOM 0 HB1 ALA A 73 -5.027 13.489 14.413 1.00 72.22 H new ATOM 0 HB2 ALA A 73 -5.573 12.502 13.037 1.00 72.22 H new ATOM 0 HB3 ALA A 73 -6.566 13.867 13.603 1.00 72.22 H new ATOM 1004 N PHE A 74 -6.593 12.365 17.284 1.00 1.31 N ATOM 1005 CA PHE A 74 -6.903 12.984 18.568 1.00 44.23 C ATOM 1006 C PHE A 74 -5.646 13.567 19.208 1.00 60.12 C ATOM 1007 O PHE A 74 -4.635 12.880 19.355 1.00 72.54 O ATOM 1008 CB PHE A 74 -7.541 11.962 19.510 1.00 75.11 C ATOM 1009 CG PHE A 74 -9.002 11.732 19.244 1.00 2.42 C ATOM 1010 CD1 PHE A 74 -9.432 11.285 18.006 1.00 72.43 C ATOM 1011 CD2 PHE A 74 -9.944 11.965 20.233 1.00 53.11 C ATOM 1012 CE1 PHE A 74 -10.775 11.072 17.758 1.00 54.11 C ATOM 1013 CE2 PHE A 74 -11.289 11.754 19.991 1.00 24.11 C ATOM 1014 CZ PHE A 74 -11.705 11.308 18.752 1.00 42.12 C ATOM 0 H PHE A 74 -6.029 11.518 17.349 1.00 1.31 H new ATOM 0 HA PHE A 74 -7.609 13.795 18.391 1.00 44.23 H new ATOM 0 HB2 PHE A 74 -7.010 11.015 19.419 1.00 75.11 H new ATOM 0 HB3 PHE A 74 -7.416 12.300 20.539 1.00 75.11 H new ATOM 0 HD1 PHE A 74 -8.709 11.101 17.225 1.00 72.43 H new ATOM 0 HD2 PHE A 74 -9.624 12.315 21.203 1.00 53.11 H new ATOM 0 HE1 PHE A 74 -11.097 10.722 16.788 1.00 54.11 H new ATOM 0 HE2 PHE A 74 -12.014 11.938 20.770 1.00 24.11 H new ATOM 0 HZ PHE A 74 -12.755 11.144 18.560 1.00 42.12 H new ATOM 1024 N ASP A 75 -5.717 14.838 19.586 1.00 14.31 N ATOM 1025 CA ASP A 75 -4.587 15.515 20.211 1.00 64.30 C ATOM 1026 C ASP A 75 -4.777 15.609 21.722 1.00 51.24 C ATOM 1027 O ASP A 75 -5.766 16.165 22.199 1.00 35.15 O ATOM 1028 CB ASP A 75 -4.411 16.914 19.618 1.00 24.41 C ATOM 1029 CG ASP A 75 -3.538 17.803 20.482 1.00 15.12 C ATOM 1030 OD1 ASP A 75 -2.336 17.496 20.627 1.00 54.14 O ATOM 1031 OD2 ASP A 75 -4.058 18.807 21.013 1.00 22.34 O ATOM 0 H ASP A 75 -6.546 15.421 19.470 1.00 14.31 H new ATOM 0 HA ASP A 75 -3.689 14.929 20.012 1.00 64.30 H new ATOM 0 HB2 ASP A 75 -3.970 16.832 18.625 1.00 24.41 H new ATOM 0 HB3 ASP A 75 -5.389 17.379 19.495 1.00 24.41 H new ATOM 1036 N PHE A 76 -3.824 15.062 22.468 1.00 21.05 N ATOM 1037 CA PHE A 76 -3.888 15.083 23.925 1.00 23.42 C ATOM 1038 C PHE A 76 -2.550 15.511 24.522 1.00 33.11 C ATOM 1039 O PHE A 76 -1.493 15.045 24.099 1.00 41.21 O ATOM 1040 CB PHE A 76 -4.279 13.703 24.459 1.00 0.23 C ATOM 1041 CG PHE A 76 -4.771 13.727 25.878 1.00 13.31 C ATOM 1042 CD1 PHE A 76 -3.878 13.807 26.934 1.00 1.51 C ATOM 1043 CD2 PHE A 76 -6.128 13.669 26.156 1.00 45.22 C ATOM 1044 CE1 PHE A 76 -4.328 13.830 28.241 1.00 44.20 C ATOM 1045 CE2 PHE A 76 -6.583 13.692 27.460 1.00 10.04 C ATOM 1046 CZ PHE A 76 -5.682 13.771 28.504 1.00 10.43 C ATOM 0 H PHE A 76 -2.998 14.599 22.088 1.00 21.05 H new ATOM 0 HA PHE A 76 -4.646 15.808 24.220 1.00 23.42 H new ATOM 0 HB2 PHE A 76 -5.056 13.282 23.821 1.00 0.23 H new ATOM 0 HB3 PHE A 76 -3.417 13.039 24.393 1.00 0.23 H new ATOM 0 HD1 PHE A 76 -2.818 13.852 26.734 1.00 1.51 H new ATOM 0 HD2 PHE A 76 -6.837 13.605 25.344 1.00 45.22 H new ATOM 0 HE1 PHE A 76 -3.621 13.894 29.055 1.00 44.20 H new ATOM 0 HE2 PHE A 76 -7.643 13.648 27.663 1.00 10.04 H new ATOM 0 HZ PHE A 76 -6.036 13.787 29.524 1.00 10.43 H new ATOM 1056 N GLU A 77 -2.607 16.402 25.507 1.00 22.33 N ATOM 1057 CA GLU A 77 -1.400 16.894 26.161 1.00 11.03 C ATOM 1058 C GLU A 77 -1.284 16.339 27.578 1.00 63.42 C ATOM 1059 O GLU A 77 -2.289 16.116 28.253 1.00 23.34 O ATOM 1060 CB GLU A 77 -1.402 18.424 26.200 1.00 31.40 C ATOM 1061 CG GLU A 77 -2.736 19.020 26.618 1.00 5.12 C ATOM 1062 CD GLU A 77 -2.641 20.502 26.927 1.00 63.30 C ATOM 1063 OE1 GLU A 77 -2.366 21.286 25.995 1.00 14.21 O ATOM 1064 OE2 GLU A 77 -2.841 20.876 28.101 1.00 13.24 O ATOM 0 H GLU A 77 -3.475 16.797 25.869 1.00 22.33 H new ATOM 0 HA GLU A 77 -0.540 16.553 25.584 1.00 11.03 H new ATOM 0 HB2 GLU A 77 -0.630 18.763 26.891 1.00 31.40 H new ATOM 0 HB3 GLU A 77 -1.136 18.805 25.214 1.00 31.40 H new ATOM 0 HG2 GLU A 77 -3.465 18.864 25.822 1.00 5.12 H new ATOM 0 HG3 GLU A 77 -3.106 18.492 27.497 1.00 5.12 H new ATOM 1167 N ARG A 85 3.486 18.400 27.548 1.00 20.22 N ATOM 1168 CA ARG A 85 3.742 18.221 26.124 1.00 32.21 C ATOM 1169 C ARG A 85 2.455 17.875 25.380 1.00 42.52 C ATOM 1170 O ARG A 85 1.398 17.715 25.989 1.00 13.13 O ATOM 1171 CB ARG A 85 4.781 17.120 25.905 1.00 3.03 C ATOM 1172 CG ARG A 85 5.873 17.501 24.919 1.00 24.11 C ATOM 1173 CD ARG A 85 6.668 18.703 25.405 1.00 41.02 C ATOM 1174 NE ARG A 85 6.233 19.942 24.765 1.00 31.40 N ATOM 1175 CZ ARG A 85 6.436 20.216 23.481 1.00 1.54 C ATOM 1176 NH1 ARG A 85 7.064 19.345 22.705 1.00 60.54 N ATOM 1177 NH2 ARG A 85 6.010 21.365 22.972 1.00 2.41 N ATOM 0 HA ARG A 85 4.129 19.160 25.729 1.00 32.21 H new ATOM 0 HB2 ARG A 85 5.239 16.868 26.862 1.00 3.03 H new ATOM 0 HB3 ARG A 85 4.277 16.222 25.547 1.00 3.03 H new ATOM 0 HG2 ARG A 85 6.544 16.655 24.773 1.00 24.11 H new ATOM 0 HG3 ARG A 85 5.427 17.726 23.950 1.00 24.11 H new ATOM 0 HD2 ARG A 85 6.560 18.796 26.486 1.00 41.02 H new ATOM 0 HD3 ARG A 85 7.727 18.543 25.203 1.00 41.02 H new ATOM 0 HE ARG A 85 5.747 20.634 25.335 1.00 31.40 H new ATOM 0 HH11 ARG A 85 7.393 18.461 23.093 1.00 60.54 H new ATOM 0 HH12 ARG A 85 7.218 19.558 21.720 1.00 60.54 H new ATOM 0 HH21 ARG A 85 5.527 22.038 23.567 1.00 2.41 H new ATOM 0 HH22 ARG A 85 6.166 21.575 21.986 1.00 2.41 H new ATOM 1191 N ASP A 86 2.554 17.763 24.060 1.00 54.22 N ATOM 1192 CA ASP A 86 1.398 17.436 23.232 1.00 3.51 C ATOM 1193 C ASP A 86 1.711 16.271 22.299 1.00 52.14 C ATOM 1194 O ASP A 86 2.766 16.234 21.666 1.00 42.04 O ATOM 1195 CB ASP A 86 0.966 18.657 22.418 1.00 61.24 C ATOM 1196 CG ASP A 86 2.128 19.314 21.699 1.00 72.03 C ATOM 1197 OD1 ASP A 86 2.666 18.698 20.755 1.00 1.13 O ATOM 1198 OD2 ASP A 86 2.499 20.444 22.080 1.00 63.01 O ATOM 0 H ASP A 86 3.422 17.894 23.540 1.00 54.22 H new ATOM 0 HA ASP A 86 0.581 17.141 23.890 1.00 3.51 H new ATOM 0 HB2 ASP A 86 0.214 18.356 21.688 1.00 61.24 H new ATOM 0 HB3 ASP A 86 0.495 19.383 23.080 1.00 61.24 H new ATOM 1203 N LYS A 87 0.787 15.320 22.218 1.00 33.23 N ATOM 1204 CA LYS A 87 0.962 14.152 21.363 1.00 50.44 C ATOM 1205 C LYS A 87 -0.318 13.847 20.591 1.00 64.44 C ATOM 1206 O LYS A 87 -1.412 13.854 21.155 1.00 32.43 O ATOM 1207 CB LYS A 87 1.368 12.937 22.200 1.00 51.24 C ATOM 1208 CG LYS A 87 2.567 12.189 21.643 1.00 32.44 C ATOM 1209 CD LYS A 87 3.780 12.327 22.548 1.00 15.04 C ATOM 1210 CE LYS A 87 5.062 11.947 21.824 1.00 32.21 C ATOM 1211 NZ LYS A 87 6.127 12.971 22.008 1.00 24.43 N ATOM 0 H LYS A 87 -0.092 15.335 22.735 1.00 33.23 H new ATOM 0 HA LYS A 87 1.754 14.372 20.647 1.00 50.44 H new ATOM 0 HB2 LYS A 87 1.594 13.264 23.215 1.00 51.24 H new ATOM 0 HB3 LYS A 87 0.522 12.253 22.266 1.00 51.24 H new ATOM 0 HG2 LYS A 87 2.317 11.134 21.526 1.00 32.44 H new ATOM 0 HG3 LYS A 87 2.807 12.571 20.651 1.00 32.44 H new ATOM 0 HD2 LYS A 87 3.854 13.354 22.905 1.00 15.04 H new ATOM 0 HD3 LYS A 87 3.655 11.692 23.425 1.00 15.04 H new ATOM 0 HE2 LYS A 87 5.416 10.984 22.193 1.00 32.21 H new ATOM 0 HE3 LYS A 87 4.856 11.824 20.761 1.00 32.21 H new ATOM 0 HZ1 LYS A 87 6.985 12.675 21.499 1.00 24.43 H new ATOM 0 HZ2 LYS A 87 5.799 13.884 21.633 1.00 24.43 H new ATOM 0 HZ3 LYS A 87 6.342 13.070 23.021 1.00 24.43 H new ATOM 1225 N LEU A 88 -0.173 13.577 19.298 1.00 41.11 N ATOM 1226 CA LEU A 88 -1.318 13.267 18.448 1.00 25.23 C ATOM 1227 C LEU A 88 -1.326 11.791 18.064 1.00 60.24 C ATOM 1228 O LEU A 88 -0.318 11.253 17.604 1.00 41.50 O ATOM 1229 CB LEU A 88 -1.292 14.134 17.188 1.00 33.23 C ATOM 1230 CG LEU A 88 -2.635 14.718 16.748 1.00 33.14 C ATOM 1231 CD1 LEU A 88 -2.432 15.767 15.666 1.00 33.03 C ATOM 1232 CD2 LEU A 88 -3.561 13.615 16.257 1.00 34.24 C ATOM 0 H LEU A 88 0.726 13.566 18.815 1.00 41.11 H new ATOM 0 HA LEU A 88 -2.227 13.482 19.010 1.00 25.23 H new ATOM 0 HB2 LEU A 88 -0.597 14.957 17.352 1.00 33.23 H new ATOM 0 HB3 LEU A 88 -0.892 13.537 16.368 1.00 33.23 H new ATOM 0 HG LEU A 88 -3.100 15.199 17.609 1.00 33.14 H new ATOM 0 HD11 LEU A 88 -3.399 16.171 15.365 1.00 33.03 H new ATOM 0 HD12 LEU A 88 -1.806 16.572 16.052 1.00 33.03 H new ATOM 0 HD13 LEU A 88 -1.945 15.311 14.804 1.00 33.03 H new ATOM 0 HD21 LEU A 88 -4.512 14.049 15.948 1.00 34.24 H new ATOM 0 HD22 LEU A 88 -3.102 13.105 15.410 1.00 34.24 H new ATOM 0 HD23 LEU A 88 -3.733 12.899 17.061 1.00 34.24 H new ATOM 1244 N ILE A 89 -2.470 11.142 18.253 1.00 40.03 N ATOM 1245 CA ILE A 89 -2.610 9.729 17.922 1.00 10.34 C ATOM 1246 C ILE A 89 -3.610 9.526 16.789 1.00 11.23 C ATOM 1247 O ILE A 89 -4.553 10.303 16.632 1.00 35.44 O ATOM 1248 CB ILE A 89 -3.062 8.908 19.144 1.00 23.51 C ATOM 1249 CG1 ILE A 89 -2.195 9.242 20.360 1.00 63.43 C ATOM 1250 CG2 ILE A 89 -2.998 7.419 18.834 1.00 12.43 C ATOM 1251 CD1 ILE A 89 -2.795 10.301 21.257 1.00 2.21 C ATOM 0 H ILE A 89 -3.313 11.572 18.633 1.00 40.03 H new ATOM 0 HA ILE A 89 -1.628 9.380 17.603 1.00 10.34 H new ATOM 0 HB ILE A 89 -4.095 9.168 19.376 1.00 23.51 H new ATOM 0 HG12 ILE A 89 -2.033 8.334 20.941 1.00 63.43 H new ATOM 0 HG13 ILE A 89 -1.217 9.579 20.017 1.00 63.43 H new ATOM 0 HG21 ILE A 89 -3.320 6.851 19.707 1.00 12.43 H new ATOM 0 HG22 ILE A 89 -3.653 7.194 17.993 1.00 12.43 H new ATOM 0 HG23 ILE A 89 -1.974 7.144 18.580 1.00 12.43 H new ATOM 0 HD11 ILE A 89 -2.127 10.487 22.098 1.00 2.21 H new ATOM 0 HD12 ILE A 89 -2.931 11.223 20.691 1.00 2.21 H new ATOM 0 HD13 ILE A 89 -3.760 9.958 21.630 1.00 2.21 H new ATOM 1263 N LEU A 90 -3.399 8.477 16.002 1.00 30.04 N ATOM 1264 CA LEU A 90 -4.283 8.169 14.884 1.00 53.44 C ATOM 1265 C LEU A 90 -4.887 6.777 15.034 1.00 72.22 C ATOM 1266 O LEU A 90 -4.166 5.781 15.106 1.00 40.42 O ATOM 1267 CB LEU A 90 -3.519 8.267 13.562 1.00 21.52 C ATOM 1268 CG LEU A 90 -4.309 7.912 12.302 1.00 13.40 C ATOM 1269 CD1 LEU A 90 -3.934 8.842 11.158 1.00 32.40 C ATOM 1270 CD2 LEU A 90 -4.070 6.461 11.913 1.00 73.22 C ATOM 0 H LEU A 90 -2.623 7.825 16.118 1.00 30.04 H new ATOM 0 HA LEU A 90 -5.094 8.898 14.883 1.00 53.44 H new ATOM 0 HB2 LEU A 90 -3.144 9.285 13.457 1.00 21.52 H new ATOM 0 HB3 LEU A 90 -2.650 7.612 13.618 1.00 21.52 H new ATOM 0 HG LEU A 90 -5.371 8.039 12.514 1.00 13.40 H new ATOM 0 HD11 LEU A 90 -4.506 8.575 10.269 1.00 32.40 H new ATOM 0 HD12 LEU A 90 -4.158 9.871 11.438 1.00 32.40 H new ATOM 0 HD13 LEU A 90 -2.869 8.747 10.946 1.00 32.40 H new ATOM 0 HD21 LEU A 90 -4.640 6.227 11.014 1.00 73.22 H new ATOM 0 HD22 LEU A 90 -3.008 6.306 11.720 1.00 73.22 H new ATOM 0 HD23 LEU A 90 -4.390 5.809 12.726 1.00 73.22 H new ATOM 1282 N ILE A 91 -6.214 6.715 15.078 1.00 23.51 N ATOM 1283 CA ILE A 91 -6.914 5.444 15.216 1.00 31.30 C ATOM 1284 C ILE A 91 -7.782 5.159 13.995 1.00 62.12 C ATOM 1285 O ILE A 91 -8.563 6.007 13.564 1.00 31.02 O ATOM 1286 CB ILE A 91 -7.799 5.422 16.477 1.00 42.35 C ATOM 1287 CG1 ILE A 91 -6.950 5.664 17.726 1.00 24.53 C ATOM 1288 CG2 ILE A 91 -8.540 4.098 16.581 1.00 53.02 C ATOM 1289 CD1 ILE A 91 -7.003 7.090 18.227 1.00 21.10 C ATOM 0 H ILE A 91 -6.825 7.530 15.020 1.00 23.51 H new ATOM 0 HA ILE A 91 -6.150 4.672 15.305 1.00 31.30 H new ATOM 0 HB ILE A 91 -8.535 6.222 16.401 1.00 42.35 H new ATOM 0 HG12 ILE A 91 -7.287 4.996 18.519 1.00 24.53 H new ATOM 0 HG13 ILE A 91 -5.915 5.403 17.508 1.00 24.53 H new ATOM 0 HG21 ILE A 91 -9.161 4.098 17.477 1.00 53.02 H new ATOM 0 HG22 ILE A 91 -9.171 3.964 15.702 1.00 53.02 H new ATOM 0 HG23 ILE A 91 -7.820 3.282 16.638 1.00 53.02 H new ATOM 0 HD11 ILE A 91 -6.378 7.187 19.114 1.00 21.10 H new ATOM 0 HD12 ILE A 91 -6.638 7.762 17.450 1.00 21.10 H new ATOM 0 HD13 ILE A 91 -8.032 7.350 18.478 1.00 21.10 H new ATOM 1301 N SER A 92 -7.640 3.958 13.442 1.00 50.40 N ATOM 1302 CA SER A 92 -8.409 3.562 12.269 1.00 75.54 C ATOM 1303 C SER A 92 -9.580 2.666 12.664 1.00 64.32 C ATOM 1304 O SER A 92 -9.397 1.644 13.326 1.00 71.03 O ATOM 1305 CB SER A 92 -7.512 2.834 11.266 1.00 44.21 C ATOM 1306 OG SER A 92 -6.209 2.646 11.791 1.00 41.03 O ATOM 0 H SER A 92 -7.000 3.243 13.788 1.00 50.40 H new ATOM 0 HA SER A 92 -8.805 4.465 11.803 1.00 75.54 H new ATOM 0 HB2 SER A 92 -7.950 1.868 11.016 1.00 44.21 H new ATOM 0 HB3 SER A 92 -7.456 3.407 10.341 1.00 44.21 H new ATOM 0 HG SER A 92 -5.607 3.327 11.425 1.00 41.03 H new ATOM 1312 N TRP A 93 -10.780 3.057 12.253 1.00 34.21 N ATOM 1313 CA TRP A 93 -11.981 2.290 12.564 1.00 75.21 C ATOM 1314 C TRP A 93 -12.567 1.662 11.304 1.00 33.32 C ATOM 1315 O TRP A 93 -13.031 2.365 10.407 1.00 21.43 O ATOM 1316 CB TRP A 93 -13.024 3.186 13.234 1.00 33.33 C ATOM 1317 CG TRP A 93 -14.357 2.522 13.404 1.00 71.50 C ATOM 1318 CD1 TRP A 93 -15.337 2.399 12.461 1.00 34.42 C ATOM 1319 CD2 TRP A 93 -14.856 1.891 14.589 1.00 42.21 C ATOM 1320 NE1 TRP A 93 -16.416 1.730 12.989 1.00 63.23 N ATOM 1321 CE2 TRP A 93 -16.145 1.407 14.292 1.00 21.00 C ATOM 1322 CE3 TRP A 93 -14.338 1.687 15.871 1.00 73.13 C ATOM 1323 CZ2 TRP A 93 -16.921 0.733 15.231 1.00 12.53 C ATOM 1324 CZ3 TRP A 93 -15.110 1.019 16.802 1.00 72.41 C ATOM 1325 CH2 TRP A 93 -16.390 0.548 16.479 1.00 63.45 C ATOM 0 H TRP A 93 -10.948 3.900 11.704 1.00 34.21 H new ATOM 0 HA TRP A 93 -11.704 1.491 13.251 1.00 75.21 H new ATOM 0 HB2 TRP A 93 -12.653 3.495 14.211 1.00 33.33 H new ATOM 0 HB3 TRP A 93 -13.150 4.091 12.640 1.00 33.33 H new ATOM 0 HD1 TRP A 93 -15.274 2.772 11.450 1.00 34.42 H new ATOM 0 HE1 TRP A 93 -17.279 1.510 12.491 1.00 63.23 H new ATOM 0 HE3 TRP A 93 -13.352 2.045 16.129 1.00 73.13 H new ATOM 0 HZ2 TRP A 93 -17.907 0.369 14.983 1.00 12.53 H new ATOM 0 HZ3 TRP A 93 -14.720 0.857 17.796 1.00 72.41 H new ATOM 0 HH2 TRP A 93 -16.968 0.029 17.229 1.00 63.45 H new ATOM 1336 N ASN A 94 -12.543 0.334 11.244 1.00 52.22 N ATOM 1337 CA ASN A 94 -13.072 -0.388 10.093 1.00 73.34 C ATOM 1338 C ASN A 94 -12.859 -1.891 10.248 1.00 3.13 C ATOM 1339 O ASN A 94 -12.015 -2.346 11.021 1.00 35.42 O ATOM 1340 CB ASN A 94 -12.406 0.102 8.806 1.00 45.41 C ATOM 1341 CG ASN A 94 -10.959 0.503 9.021 1.00 41.31 C ATOM 1342 OD1 ASN A 94 -10.631 1.689 9.060 1.00 11.35 O ATOM 1343 ND2 ASN A 94 -10.085 -0.487 9.161 1.00 52.02 N ATOM 0 H ASN A 94 -12.163 -0.263 11.979 1.00 52.22 H new ATOM 0 HA ASN A 94 -14.143 -0.194 10.036 1.00 73.34 H new ATOM 0 HB2 ASN A 94 -12.454 -0.684 8.053 1.00 45.41 H new ATOM 0 HB3 ASN A 94 -12.962 0.954 8.414 1.00 45.41 H new ATOM 0 HD21 ASN A 94 -9.097 -0.278 9.308 1.00 52.02 H new ATOM 0 HD22 ASN A 94 -10.401 -1.456 9.122 1.00 52.02 H new ATOM 1350 N PRO A 95 -13.640 -2.681 9.496 1.00 2.54 N ATOM 1351 CA PRO A 95 -13.554 -4.144 9.532 1.00 13.50 C ATOM 1352 C PRO A 95 -12.263 -4.664 8.911 1.00 63.01 C ATOM 1353 O PRO A 95 -11.894 -4.273 7.803 1.00 30.41 O ATOM 1354 CB PRO A 95 -14.763 -4.590 8.705 1.00 1.34 C ATOM 1355 CG PRO A 95 -15.038 -3.447 7.790 1.00 34.00 C ATOM 1356 CD PRO A 95 -14.666 -2.206 8.553 1.00 33.02 C ATOM 0 HA PRO A 95 -13.553 -4.528 10.552 1.00 13.50 H new ATOM 0 HB2 PRO A 95 -14.547 -5.501 8.147 1.00 1.34 H new ATOM 0 HB3 PRO A 95 -15.622 -4.803 9.342 1.00 1.34 H new ATOM 0 HG2 PRO A 95 -14.454 -3.531 6.874 1.00 34.00 H new ATOM 0 HG3 PRO A 95 -16.088 -3.425 7.498 1.00 34.00 H new ATOM 0 HD2 PRO A 95 -14.277 -1.430 7.894 1.00 33.02 H new ATOM 0 HD3 PRO A 95 -15.525 -1.782 9.073 1.00 33.02 H new ATOM 1364 N ASP A 96 -11.580 -5.547 9.631 1.00 63.34 N ATOM 1365 CA ASP A 96 -10.329 -6.123 9.149 1.00 53.20 C ATOM 1366 C ASP A 96 -10.570 -6.995 7.920 1.00 1.45 C ATOM 1367 O ASP A 96 -9.795 -6.965 6.965 1.00 62.13 O ATOM 1368 CB ASP A 96 -9.664 -6.947 10.252 1.00 31.13 C ATOM 1369 CG ASP A 96 -10.591 -8.001 10.826 1.00 2.45 C ATOM 1370 OD1 ASP A 96 -11.355 -7.674 11.758 1.00 2.24 O ATOM 1371 OD2 ASP A 96 -10.551 -9.152 10.344 1.00 35.35 O ATOM 0 H ASP A 96 -11.871 -5.880 10.550 1.00 63.34 H new ATOM 0 HA ASP A 96 -9.666 -5.305 8.867 1.00 53.20 H new ATOM 0 HB2 ASP A 96 -8.772 -7.430 9.853 1.00 31.13 H new ATOM 0 HB3 ASP A 96 -9.336 -6.282 11.051 1.00 31.13 H new ATOM 1376 N SER A 97 -11.649 -7.770 7.954 1.00 64.42 N ATOM 1377 CA SER A 97 -11.989 -8.655 6.845 1.00 1.42 C ATOM 1378 C SER A 97 -13.207 -8.133 6.089 1.00 62.24 C ATOM 1379 O SER A 97 -13.807 -8.849 5.288 1.00 15.31 O ATOM 1380 CB SER A 97 -12.261 -10.070 7.359 1.00 43.22 C ATOM 1381 OG SER A 97 -11.134 -10.908 7.165 1.00 14.32 O ATOM 0 H SER A 97 -12.303 -7.803 8.736 1.00 64.42 H new ATOM 0 HA SER A 97 -11.141 -8.682 6.160 1.00 1.42 H new ATOM 0 HB2 SER A 97 -12.513 -10.033 8.419 1.00 43.22 H new ATOM 0 HB3 SER A 97 -13.123 -10.489 6.841 1.00 43.22 H new ATOM 0 HG SER A 97 -11.332 -11.806 7.503 1.00 14.32 H new ATOM 1387 N GLY A 98 -13.566 -6.880 6.349 1.00 2.32 N ATOM 1388 CA GLY A 98 -14.710 -6.283 5.686 1.00 51.42 C ATOM 1389 C GLY A 98 -14.599 -6.340 4.175 1.00 14.21 C ATOM 1390 O GLY A 98 -14.988 -7.329 3.555 1.00 64.13 O ATOM 0 H GLY A 98 -13.085 -6.267 7.007 1.00 2.32 H new ATOM 0 HA2 GLY A 98 -15.618 -6.798 6.000 1.00 51.42 H new ATOM 0 HA3 GLY A 98 -14.807 -5.244 6.001 1.00 51.42 H new ATOM 1394 N ALA A 99 -14.070 -5.275 3.581 1.00 23.34 N ATOM 1395 CA ALA A 99 -13.909 -5.209 2.134 1.00 10.32 C ATOM 1396 C ALA A 99 -12.435 -5.145 1.748 1.00 52.11 C ATOM 1397 O ALA A 99 -11.580 -4.734 2.533 1.00 71.53 O ATOM 1398 CB ALA A 99 -14.656 -4.007 1.575 1.00 3.41 C ATOM 0 H ALA A 99 -13.746 -4.446 4.080 1.00 23.34 H new ATOM 0 HA ALA A 99 -14.331 -6.117 1.704 1.00 10.32 H new ATOM 0 HB1 ALA A 99 -14.527 -3.970 0.493 1.00 3.41 H new ATOM 0 HB2 ALA A 99 -15.716 -4.095 1.812 1.00 3.41 H new ATOM 0 HB3 ALA A 99 -14.260 -3.094 2.019 1.00 3.41 H new ATOM 1404 N PRO A 100 -12.129 -5.561 0.510 1.00 4.11 N ATOM 1405 CA PRO A 100 -10.757 -5.561 -0.008 1.00 54.31 C ATOM 1406 C PRO A 100 -10.227 -4.151 -0.245 1.00 14.41 C ATOM 1407 O PRO A 100 -9.046 -3.877 -0.031 1.00 71.45 O ATOM 1408 CB PRO A 100 -10.879 -6.316 -1.334 1.00 51.20 C ATOM 1409 CG PRO A 100 -12.297 -6.124 -1.750 1.00 44.15 C ATOM 1410 CD PRO A 100 -13.097 -6.063 -0.479 1.00 51.10 C ATOM 0 HA PRO A 100 -10.056 -6.014 0.694 1.00 54.31 H new ATOM 0 HB2 PRO A 100 -10.190 -5.920 -2.080 1.00 51.20 H new ATOM 0 HB3 PRO A 100 -10.642 -7.373 -1.211 1.00 51.20 H new ATOM 0 HG2 PRO A 100 -12.413 -5.208 -2.329 1.00 44.15 H new ATOM 0 HG3 PRO A 100 -12.633 -6.945 -2.383 1.00 44.15 H new ATOM 0 HD2 PRO A 100 -13.955 -5.397 -0.576 1.00 51.10 H new ATOM 0 HD3 PRO A 100 -13.484 -7.043 -0.201 1.00 51.10 H new ATOM 1418 N ARG A 101 -11.108 -3.259 -0.687 1.00 12.23 N ATOM 1419 CA ARG A 101 -10.728 -1.877 -0.953 1.00 10.30 C ATOM 1420 C ARG A 101 -10.381 -1.149 0.342 1.00 25.25 C ATOM 1421 O ARG A 101 -9.375 -0.443 0.421 1.00 44.02 O ATOM 1422 CB ARG A 101 -11.861 -1.144 -1.674 1.00 43.21 C ATOM 1423 CG ARG A 101 -11.562 -0.848 -3.135 1.00 0.23 C ATOM 1424 CD ARG A 101 -12.110 -1.934 -4.047 1.00 21.44 C ATOM 1425 NE ARG A 101 -13.104 -1.414 -4.981 1.00 74.42 N ATOM 1426 CZ ARG A 101 -13.565 -2.100 -6.022 1.00 24.44 C ATOM 1427 NH1 ARG A 101 -13.122 -3.328 -6.259 1.00 14.34 N ATOM 1428 NH2 ARG A 101 -14.469 -1.559 -6.827 1.00 55.00 N ATOM 0 H ARG A 101 -12.090 -3.469 -0.868 1.00 12.23 H new ATOM 0 HA ARG A 101 -9.845 -1.886 -1.592 1.00 10.30 H new ATOM 0 HB2 ARG A 101 -12.768 -1.745 -1.612 1.00 43.21 H new ATOM 0 HB3 ARG A 101 -12.063 -0.207 -1.156 1.00 43.21 H new ATOM 0 HG2 ARG A 101 -11.998 0.113 -3.409 1.00 0.23 H new ATOM 0 HG3 ARG A 101 -10.485 -0.762 -3.277 1.00 0.23 H new ATOM 0 HD2 ARG A 101 -11.290 -2.387 -4.605 1.00 21.44 H new ATOM 0 HD3 ARG A 101 -12.558 -2.723 -3.443 1.00 21.44 H new ATOM 0 HE ARG A 101 -13.465 -0.473 -4.826 1.00 74.42 H new ATOM 0 HH11 ARG A 101 -12.426 -3.747 -5.642 1.00 14.34 H new ATOM 0 HH12 ARG A 101 -13.477 -3.853 -7.058 1.00 14.34 H new ATOM 0 HH21 ARG A 101 -14.812 -0.615 -6.648 1.00 55.00 H new ATOM 0 HH22 ARG A 101 -14.822 -2.087 -7.625 1.00 55.00 H new ATOM 1442 N THR A 102 -11.220 -1.326 1.358 1.00 12.20 N ATOM 1443 CA THR A 102 -11.003 -0.685 2.649 1.00 34.42 C ATOM 1444 C THR A 102 -9.776 -1.259 3.348 1.00 1.40 C ATOM 1445 O THR A 102 -9.028 -0.535 4.006 1.00 14.30 O ATOM 1446 CB THR A 102 -12.227 -0.849 3.570 1.00 55.01 C ATOM 1447 OG1 THR A 102 -11.969 -0.241 4.841 1.00 73.54 O ATOM 1448 CG2 THR A 102 -12.566 -2.319 3.764 1.00 23.34 C ATOM 0 H THR A 102 -12.056 -1.908 1.312 1.00 12.20 H new ATOM 0 HA THR A 102 -10.844 0.375 2.453 1.00 34.42 H new ATOM 0 HB THR A 102 -13.077 -0.356 3.098 1.00 55.01 H new ATOM 0 HG1 THR A 102 -12.808 -0.156 5.340 1.00 73.54 H new ATOM 0 HG21 THR A 102 -13.433 -2.409 4.418 1.00 23.34 H new ATOM 0 HG22 THR A 102 -12.791 -2.771 2.798 1.00 23.34 H new ATOM 0 HG23 THR A 102 -11.717 -2.832 4.215 1.00 23.34 H new ATOM 1456 N LYS A 103 -9.573 -2.563 3.201 1.00 64.41 N ATOM 1457 CA LYS A 103 -8.434 -3.235 3.816 1.00 0.12 C ATOM 1458 C LYS A 103 -7.121 -2.739 3.218 1.00 14.43 C ATOM 1459 O LYS A 103 -6.186 -2.402 3.944 1.00 31.40 O ATOM 1460 CB LYS A 103 -8.549 -4.750 3.633 1.00 13.04 C ATOM 1461 CG LYS A 103 -7.325 -5.515 4.107 1.00 53.35 C ATOM 1462 CD LYS A 103 -7.130 -5.381 5.608 1.00 72.35 C ATOM 1463 CE LYS A 103 -6.172 -6.435 6.141 1.00 72.40 C ATOM 1464 NZ LYS A 103 -6.171 -6.482 7.629 1.00 12.44 N ATOM 0 H LYS A 103 -10.183 -3.177 2.661 1.00 64.41 H new ATOM 0 HA LYS A 103 -8.439 -3.002 4.881 1.00 0.12 H new ATOM 0 HB2 LYS A 103 -9.424 -5.108 4.176 1.00 13.04 H new ATOM 0 HB3 LYS A 103 -8.718 -4.968 2.578 1.00 13.04 H new ATOM 0 HG2 LYS A 103 -7.429 -6.568 3.845 1.00 53.35 H new ATOM 0 HG3 LYS A 103 -6.440 -5.144 3.590 1.00 53.35 H new ATOM 0 HD2 LYS A 103 -6.745 -4.388 5.839 1.00 72.35 H new ATOM 0 HD3 LYS A 103 -8.092 -5.475 6.111 1.00 72.35 H new ATOM 0 HE2 LYS A 103 -6.451 -7.412 5.747 1.00 72.40 H new ATOM 0 HE3 LYS A 103 -5.164 -6.224 5.784 1.00 72.40 H new ATOM 0 HZ1 LYS A 103 -5.506 -7.213 7.953 1.00 12.44 H new ATOM 0 HZ2 LYS A 103 -5.880 -5.557 8.005 1.00 12.44 H new ATOM 0 HZ3 LYS A 103 -7.127 -6.709 7.970 1.00 12.44 H new ATOM 1478 N MET A 104 -7.060 -2.694 1.891 1.00 31.35 N ATOM 1479 CA MET A 104 -5.862 -2.236 1.197 1.00 14.01 C ATOM 1480 C MET A 104 -5.687 -0.729 1.353 1.00 40.33 C ATOM 1481 O MET A 104 -4.571 -0.239 1.534 1.00 15.24 O ATOM 1482 CB MET A 104 -5.936 -2.602 -0.287 1.00 24.14 C ATOM 1483 CG MET A 104 -4.639 -2.351 -1.039 1.00 51.22 C ATOM 1484 SD MET A 104 -4.103 -3.782 -1.996 1.00 24.13 S ATOM 1485 CE MET A 104 -4.479 -3.237 -3.660 1.00 24.30 C ATOM 0 H MET A 104 -7.825 -2.969 1.275 1.00 31.35 H new ATOM 0 HA MET A 104 -5.000 -2.732 1.644 1.00 14.01 H new ATOM 0 HB2 MET A 104 -6.203 -3.655 -0.381 1.00 24.14 H new ATOM 0 HB3 MET A 104 -6.735 -2.028 -0.755 1.00 24.14 H new ATOM 0 HG2 MET A 104 -4.770 -1.500 -1.708 1.00 51.22 H new ATOM 0 HG3 MET A 104 -3.858 -2.081 -0.328 1.00 51.22 H new ATOM 0 HE1 MET A 104 -4.203 -4.017 -4.369 1.00 24.30 H new ATOM 0 HE2 MET A 104 -5.546 -3.032 -3.743 1.00 24.30 H new ATOM 0 HE3 MET A 104 -3.917 -2.330 -3.881 1.00 24.30 H new ATOM 1495 N LEU A 105 -6.794 0.002 1.280 1.00 31.22 N ATOM 1496 CA LEU A 105 -6.762 1.454 1.413 1.00 55.20 C ATOM 1497 C LEU A 105 -6.084 1.867 2.715 1.00 10.41 C ATOM 1498 O LEU A 105 -5.474 2.934 2.798 1.00 61.40 O ATOM 1499 CB LEU A 105 -8.182 2.022 1.362 1.00 71.21 C ATOM 1500 CG LEU A 105 -8.726 2.344 -0.030 1.00 73.03 C ATOM 1501 CD1 LEU A 105 -10.228 2.577 0.025 1.00 52.15 C ATOM 1502 CD2 LEU A 105 -8.017 3.558 -0.612 1.00 52.03 C ATOM 0 H LEU A 105 -7.725 -0.387 1.129 1.00 31.22 H new ATOM 0 HA LEU A 105 -6.185 1.858 0.581 1.00 55.20 H new ATOM 0 HB2 LEU A 105 -8.855 1.308 1.837 1.00 71.21 H new ATOM 0 HB3 LEU A 105 -8.209 2.933 1.961 1.00 71.21 H new ATOM 0 HG LEU A 105 -8.535 1.490 -0.680 1.00 73.03 H new ATOM 0 HD11 LEU A 105 -10.598 2.805 -0.975 1.00 52.15 H new ATOM 0 HD12 LEU A 105 -10.722 1.680 0.399 1.00 52.15 H new ATOM 0 HD13 LEU A 105 -10.442 3.413 0.690 1.00 52.15 H new ATOM 0 HD21 LEU A 105 -8.417 3.773 -1.603 1.00 52.03 H new ATOM 0 HD22 LEU A 105 -8.176 4.419 0.038 1.00 52.03 H new ATOM 0 HD23 LEU A 105 -6.949 3.354 -0.688 1.00 52.03 H new ATOM 1514 N TYR A 106 -6.193 1.016 3.729 1.00 61.12 N ATOM 1515 CA TYR A 106 -5.590 1.292 5.027 1.00 12.33 C ATOM 1516 C TYR A 106 -4.082 1.480 4.899 1.00 44.32 C ATOM 1517 O TYR A 106 -3.519 2.446 5.414 1.00 40.42 O ATOM 1518 CB TYR A 106 -5.892 0.156 6.006 1.00 73.04 C ATOM 1519 CG TYR A 106 -5.094 0.232 7.288 1.00 51.35 C ATOM 1520 CD1 TYR A 106 -5.220 1.320 8.143 1.00 4.01 C ATOM 1521 CD2 TYR A 106 -4.214 -0.782 7.643 1.00 70.32 C ATOM 1522 CE1 TYR A 106 -4.492 1.395 9.315 1.00 30.41 C ATOM 1523 CE2 TYR A 106 -3.484 -0.717 8.813 1.00 4.14 C ATOM 1524 CZ TYR A 106 -3.626 0.374 9.646 1.00 22.51 C ATOM 1525 OH TYR A 106 -2.899 0.443 10.812 1.00 2.14 O ATOM 0 H TYR A 106 -6.694 0.129 3.677 1.00 61.12 H new ATOM 0 HA TYR A 106 -6.022 2.217 5.409 1.00 12.33 H new ATOM 0 HB2 TYR A 106 -6.955 0.170 6.248 1.00 73.04 H new ATOM 0 HB3 TYR A 106 -5.689 -0.797 5.517 1.00 73.04 H new ATOM 0 HD1 TYR A 106 -5.898 2.120 7.887 1.00 4.01 H new ATOM 0 HD2 TYR A 106 -4.099 -1.636 6.992 1.00 70.32 H new ATOM 0 HE1 TYR A 106 -4.601 2.248 9.968 1.00 30.41 H new ATOM 0 HE2 TYR A 106 -2.806 -1.516 9.075 1.00 4.14 H new ATOM 0 HH TYR A 106 -2.338 -0.356 10.896 1.00 2.14 H new ATOM 1535 N SER A 107 -3.433 0.549 4.207 1.00 3.10 N ATOM 1536 CA SER A 107 -1.989 0.609 4.012 1.00 22.23 C ATOM 1537 C SER A 107 -1.629 1.609 2.918 1.00 52.12 C ATOM 1538 O SER A 107 -0.578 2.248 2.967 1.00 53.24 O ATOM 1539 CB SER A 107 -1.444 -0.775 3.653 1.00 4.14 C ATOM 1540 OG SER A 107 -2.156 -1.337 2.565 1.00 62.10 O ATOM 0 H SER A 107 -3.884 -0.256 3.772 1.00 3.10 H new ATOM 0 HA SER A 107 -1.535 0.940 4.946 1.00 22.23 H new ATOM 0 HB2 SER A 107 -0.387 -0.698 3.399 1.00 4.14 H new ATOM 0 HB3 SER A 107 -1.517 -1.434 4.518 1.00 4.14 H new ATOM 0 HG SER A 107 -2.870 -0.725 2.290 1.00 62.10 H new ATOM 1546 N SER A 108 -2.510 1.739 1.931 1.00 70.22 N ATOM 1547 CA SER A 108 -2.285 2.658 0.821 1.00 20.04 C ATOM 1548 C SER A 108 -2.328 4.106 1.299 1.00 52.44 C ATOM 1549 O SER A 108 -1.784 5.001 0.652 1.00 52.34 O ATOM 1550 CB SER A 108 -3.333 2.438 -0.272 1.00 24.34 C ATOM 1551 OG SER A 108 -2.952 3.076 -1.478 1.00 74.24 O ATOM 0 H SER A 108 -3.386 1.220 1.877 1.00 70.22 H new ATOM 0 HA SER A 108 -1.295 2.458 0.410 1.00 20.04 H new ATOM 0 HB2 SER A 108 -3.462 1.370 -0.447 1.00 24.34 H new ATOM 0 HB3 SER A 108 -4.296 2.826 0.060 1.00 24.34 H new ATOM 0 HG SER A 108 -3.637 2.920 -2.161 1.00 74.24 H new ATOM 1557 N SER A 109 -2.980 4.329 2.436 1.00 45.03 N ATOM 1558 CA SER A 109 -3.098 5.669 2.999 1.00 31.21 C ATOM 1559 C SER A 109 -2.156 5.844 4.186 1.00 44.30 C ATOM 1560 O SER A 109 -1.744 6.959 4.506 1.00 44.52 O ATOM 1561 CB SER A 109 -4.540 5.936 3.434 1.00 11.15 C ATOM 1562 OG SER A 109 -4.958 7.234 3.047 1.00 24.31 O ATOM 0 H SER A 109 -3.434 3.599 2.985 1.00 45.03 H new ATOM 0 HA SER A 109 -2.819 6.387 2.228 1.00 31.21 H new ATOM 0 HB2 SER A 109 -5.201 5.191 2.991 1.00 11.15 H new ATOM 0 HB3 SER A 109 -4.622 5.832 4.516 1.00 11.15 H new ATOM 0 HG SER A 109 -5.923 7.323 3.190 1.00 24.31 H new ATOM 1568 N ARG A 110 -1.819 4.735 4.835 1.00 22.41 N ATOM 1569 CA ARG A 110 -0.926 4.765 5.988 1.00 73.35 C ATOM 1570 C ARG A 110 0.462 5.256 5.587 1.00 31.33 C ATOM 1571 O ARG A 110 1.091 6.028 6.311 1.00 32.33 O ATOM 1572 CB ARG A 110 -0.825 3.374 6.618 1.00 52.35 C ATOM 1573 CG ARG A 110 -1.484 3.275 7.984 1.00 42.42 C ATOM 1574 CD ARG A 110 -0.685 2.387 8.924 1.00 22.04 C ATOM 1575 NE ARG A 110 -0.011 3.158 9.965 1.00 4.42 N ATOM 1576 CZ ARG A 110 0.883 2.641 10.801 1.00 44.35 C ATOM 1577 NH1 ARG A 110 1.209 1.359 10.717 1.00 24.12 N ATOM 1578 NH2 ARG A 110 1.454 3.408 11.721 1.00 31.33 N ATOM 0 H ARG A 110 -2.151 3.804 4.583 1.00 22.41 H new ATOM 0 HA ARG A 110 -1.341 5.458 6.720 1.00 73.35 H new ATOM 0 HB2 ARG A 110 -1.285 2.647 5.949 1.00 52.35 H new ATOM 0 HB3 ARG A 110 0.226 3.102 6.711 1.00 52.35 H new ATOM 0 HG2 ARG A 110 -1.580 4.271 8.416 1.00 42.42 H new ATOM 0 HG3 ARG A 110 -2.493 2.877 7.875 1.00 42.42 H new ATOM 0 HD2 ARG A 110 -1.350 1.658 9.386 1.00 22.04 H new ATOM 0 HD3 ARG A 110 0.054 1.826 8.352 1.00 22.04 H new ATOM 0 HE ARG A 110 -0.239 4.148 10.055 1.00 4.42 H new ATOM 0 HH11 ARG A 110 0.773 0.767 10.010 1.00 24.12 H new ATOM 0 HH12 ARG A 110 1.896 0.964 11.360 1.00 24.12 H new ATOM 0 HH21 ARG A 110 1.207 4.395 11.787 1.00 31.33 H new ATOM 0 HH22 ARG A 110 2.140 3.010 12.362 1.00 31.33 H new ATOM 1592 N ASP A 111 0.933 4.802 4.431 1.00 4.31 N ATOM 1593 CA ASP A 111 2.247 5.196 3.934 1.00 32.40 C ATOM 1594 C ASP A 111 2.313 6.703 3.708 1.00 24.22 C ATOM 1595 O ASP A 111 3.307 7.347 4.043 1.00 40.12 O ATOM 1596 CB ASP A 111 2.565 4.458 2.633 1.00 60.24 C ATOM 1597 CG ASP A 111 4.007 3.993 2.568 1.00 34.12 C ATOM 1598 OD1 ASP A 111 4.475 3.374 3.547 1.00 41.12 O ATOM 1599 OD2 ASP A 111 4.666 4.247 1.539 1.00 41.11 O ATOM 0 H ASP A 111 0.426 4.161 3.821 1.00 4.31 H new ATOM 0 HA ASP A 111 2.989 4.927 4.686 1.00 32.40 H new ATOM 0 HB2 ASP A 111 1.904 3.597 2.536 1.00 60.24 H new ATOM 0 HB3 ASP A 111 2.359 5.114 1.787 1.00 60.24 H new ATOM 1604 N ALA A 112 1.249 7.258 3.138 1.00 44.15 N ATOM 1605 CA ALA A 112 1.187 8.689 2.868 1.00 52.22 C ATOM 1606 C ALA A 112 0.843 9.471 4.131 1.00 54.32 C ATOM 1607 O ALA A 112 1.140 10.662 4.236 1.00 13.13 O ATOM 1608 CB ALA A 112 0.169 8.976 1.773 1.00 24.14 C ATOM 0 H ALA A 112 0.418 6.739 2.854 1.00 44.15 H new ATOM 0 HA ALA A 112 2.171 9.013 2.528 1.00 52.22 H new ATOM 0 HB1 ALA A 112 0.133 10.048 1.582 1.00 24.14 H new ATOM 0 HB2 ALA A 112 0.459 8.454 0.861 1.00 24.14 H new ATOM 0 HB3 ALA A 112 -0.815 8.631 2.091 1.00 24.14 H new ATOM 1614 N LEU A 113 0.214 8.796 5.086 1.00 23.35 N ATOM 1615 CA LEU A 113 -0.171 9.428 6.343 1.00 34.03 C ATOM 1616 C LEU A 113 1.000 9.457 7.320 1.00 32.01 C ATOM 1617 O LEU A 113 1.072 10.322 8.194 1.00 62.45 O ATOM 1618 CB LEU A 113 -1.354 8.686 6.969 1.00 64.42 C ATOM 1619 CG LEU A 113 -2.743 9.214 6.611 1.00 12.44 C ATOM 1620 CD1 LEU A 113 -3.699 8.063 6.340 1.00 20.02 C ATOM 1621 CD2 LEU A 113 -3.278 10.103 7.725 1.00 52.12 C ATOM 0 H LEU A 113 -0.040 7.811 5.014 1.00 23.35 H new ATOM 0 HA LEU A 113 -0.466 10.455 6.128 1.00 34.03 H new ATOM 0 HB2 LEU A 113 -1.298 7.639 6.673 1.00 64.42 H new ATOM 0 HB3 LEU A 113 -1.244 8.717 8.053 1.00 64.42 H new ATOM 0 HG LEU A 113 -2.661 9.811 5.703 1.00 12.44 H new ATOM 0 HD11 LEU A 113 -4.683 8.459 6.087 1.00 20.02 H new ATOM 0 HD12 LEU A 113 -3.323 7.466 5.509 1.00 20.02 H new ATOM 0 HD13 LEU A 113 -3.777 7.438 7.230 1.00 20.02 H new ATOM 0 HD21 LEU A 113 -4.268 10.470 7.454 1.00 52.12 H new ATOM 0 HD22 LEU A 113 -3.345 9.528 8.649 1.00 52.12 H new ATOM 0 HD23 LEU A 113 -2.605 10.948 7.871 1.00 52.12 H new ATOM 1633 N VAL A 114 1.917 8.507 7.165 1.00 13.11 N ATOM 1634 CA VAL A 114 3.087 8.426 8.031 1.00 31.51 C ATOM 1635 C VAL A 114 3.814 9.764 8.100 1.00 32.21 C ATOM 1636 O VAL A 114 4.037 10.322 9.174 1.00 2.53 O ATOM 1637 CB VAL A 114 4.070 7.344 7.545 1.00 2.14 C ATOM 1638 CG1 VAL A 114 5.498 7.715 7.917 1.00 71.33 C ATOM 1639 CG2 VAL A 114 3.696 5.987 8.121 1.00 30.25 C ATOM 0 H VAL A 114 1.872 7.783 6.448 1.00 13.11 H new ATOM 0 HA VAL A 114 2.728 8.160 9.025 1.00 31.51 H new ATOM 0 HB VAL A 114 4.007 7.282 6.459 1.00 2.14 H new ATOM 0 HG11 VAL A 114 6.179 6.939 7.566 1.00 71.33 H new ATOM 0 HG12 VAL A 114 5.760 8.665 7.452 1.00 71.33 H new ATOM 0 HG13 VAL A 114 5.580 7.806 9.000 1.00 71.33 H new ATOM 0 HG21 VAL A 114 4.401 5.235 7.767 1.00 30.25 H new ATOM 0 HG22 VAL A 114 3.729 6.032 9.210 1.00 30.25 H new ATOM 0 HG23 VAL A 114 2.689 5.720 7.800 1.00 30.25 H new ATOM 1649 N PRO A 115 4.193 10.293 6.927 1.00 35.41 N ATOM 1650 CA PRO A 115 4.899 11.573 6.827 1.00 24.03 C ATOM 1651 C PRO A 115 4.007 12.757 7.185 1.00 64.03 C ATOM 1652 O PRO A 115 4.480 13.769 7.703 1.00 42.40 O ATOM 1653 CB PRO A 115 5.309 11.638 5.354 1.00 64.11 C ATOM 1654 CG PRO A 115 4.317 10.781 4.646 1.00 11.24 C ATOM 1655 CD PRO A 115 3.959 9.682 5.608 1.00 63.43 C ATOM 0 HA PRO A 115 5.738 11.631 7.520 1.00 24.03 H new ATOM 0 HB2 PRO A 115 5.285 12.662 4.981 1.00 64.11 H new ATOM 0 HB3 PRO A 115 6.325 11.270 5.209 1.00 64.11 H new ATOM 0 HG2 PRO A 115 3.435 11.356 4.364 1.00 11.24 H new ATOM 0 HG3 PRO A 115 4.739 10.374 3.727 1.00 11.24 H new ATOM 0 HD2 PRO A 115 2.922 9.366 5.490 1.00 63.43 H new ATOM 0 HD3 PRO A 115 4.580 8.799 5.458 1.00 63.43 H new ATOM 1663 N LEU A 116 2.716 12.624 6.905 1.00 35.14 N ATOM 1664 CA LEU A 116 1.756 13.683 7.198 1.00 3.32 C ATOM 1665 C LEU A 116 1.615 13.890 8.703 1.00 64.31 C ATOM 1666 O LEU A 116 1.235 14.968 9.160 1.00 35.23 O ATOM 1667 CB LEU A 116 0.394 13.348 6.588 1.00 22.02 C ATOM 1668 CG LEU A 116 -0.176 14.378 5.612 1.00 31.14 C ATOM 1669 CD1 LEU A 116 -0.381 15.715 6.307 1.00 45.20 C ATOM 1670 CD2 LEU A 116 0.740 14.535 4.407 1.00 13.23 C ATOM 0 H LEU A 116 2.309 11.793 6.475 1.00 35.14 H new ATOM 0 HA LEU A 116 2.127 14.608 6.756 1.00 3.32 H new ATOM 0 HB2 LEU A 116 0.475 12.392 6.070 1.00 22.02 H new ATOM 0 HB3 LEU A 116 -0.321 13.211 7.399 1.00 22.02 H new ATOM 0 HG LEU A 116 -1.145 14.022 5.262 1.00 31.14 H new ATOM 0 HD11 LEU A 116 -0.787 16.436 5.597 1.00 45.20 H new ATOM 0 HD12 LEU A 116 -1.077 15.591 7.137 1.00 45.20 H new ATOM 0 HD13 LEU A 116 0.574 16.078 6.686 1.00 45.20 H new ATOM 0 HD21 LEU A 116 0.319 15.272 3.723 1.00 13.23 H new ATOM 0 HD22 LEU A 116 1.723 14.868 4.739 1.00 13.23 H new ATOM 0 HD23 LEU A 116 0.835 13.577 3.895 1.00 13.23 H new ATOM 1682 N THR A 117 1.927 12.849 9.470 1.00 43.34 N ATOM 1683 CA THR A 117 1.837 12.916 10.923 1.00 53.33 C ATOM 1684 C THR A 117 3.115 12.405 11.577 1.00 0.44 C ATOM 1685 O THR A 117 3.092 11.426 12.323 1.00 43.44 O ATOM 1686 CB THR A 117 0.642 12.099 11.449 1.00 12.23 C ATOM 1687 OG1 THR A 117 0.667 10.780 10.893 1.00 52.25 O ATOM 1688 CG2 THR A 117 -0.674 12.778 11.100 1.00 60.14 C ATOM 0 H THR A 117 2.244 11.950 9.108 1.00 43.34 H new ATOM 0 HA THR A 117 1.694 13.965 11.183 1.00 53.33 H new ATOM 0 HB THR A 117 0.723 12.036 12.534 1.00 12.23 H new ATOM 0 HG1 THR A 117 0.598 10.120 11.614 1.00 52.25 H new ATOM 0 HG21 THR A 117 -1.503 12.182 11.482 1.00 60.14 H new ATOM 0 HG22 THR A 117 -0.702 13.770 11.550 1.00 60.14 H new ATOM 0 HG23 THR A 117 -0.761 12.869 10.017 1.00 60.14 H new ATOM 1696 N GLN A 118 4.228 13.075 11.295 1.00 53.15 N ATOM 1697 CA GLN A 118 5.516 12.688 11.857 1.00 71.50 C ATOM 1698 C GLN A 118 5.434 12.572 13.376 1.00 43.44 C ATOM 1699 O GLN A 118 5.077 13.529 14.062 1.00 22.43 O ATOM 1700 CB GLN A 118 6.592 13.702 11.468 1.00 43.33 C ATOM 1701 CG GLN A 118 7.533 13.205 10.382 1.00 22.23 C ATOM 1702 CD GLN A 118 8.426 12.075 10.857 1.00 41.34 C ATOM 1703 OE1 GLN A 118 9.273 12.263 11.731 1.00 52.03 O ATOM 1704 NE2 GLN A 118 8.241 10.893 10.281 1.00 23.35 N ATOM 0 H GLN A 118 4.263 13.888 10.681 1.00 53.15 H new ATOM 0 HA GLN A 118 5.783 11.713 11.450 1.00 71.50 H new ATOM 0 HB2 GLN A 118 6.110 14.618 11.128 1.00 43.33 H new ATOM 0 HB3 GLN A 118 7.175 13.958 12.353 1.00 43.33 H new ATOM 0 HG2 GLN A 118 6.948 12.866 9.527 1.00 22.23 H new ATOM 0 HG3 GLN A 118 8.153 14.032 10.037 1.00 22.23 H new ATOM 0 HE21 GLN A 118 7.527 10.783 9.561 1.00 23.35 H new ATOM 0 HE22 GLN A 118 8.813 10.095 10.559 1.00 23.35 H new ATOM 1713 N GLY A 119 5.768 11.394 13.894 1.00 51.22 N ATOM 1714 CA GLY A 119 5.725 11.176 15.328 1.00 62.42 C ATOM 1715 C GLY A 119 4.322 10.903 15.831 1.00 34.31 C ATOM 1716 O GLY A 119 3.887 11.485 16.825 1.00 34.41 O ATOM 0 H GLY A 119 6.067 10.587 13.346 1.00 51.22 H new ATOM 0 HA2 GLY A 119 6.369 10.335 15.584 1.00 62.42 H new ATOM 0 HA3 GLY A 119 6.126 12.052 15.838 1.00 62.42 H new ATOM 1720 N PHE A 120 3.610 10.016 15.143 1.00 51.31 N ATOM 1721 CA PHE A 120 2.246 9.669 15.524 1.00 12.33 C ATOM 1722 C PHE A 120 2.080 8.156 15.634 1.00 0.45 C ATOM 1723 O PHE A 120 2.852 7.394 15.054 1.00 71.21 O ATOM 1724 CB PHE A 120 1.251 10.230 14.506 1.00 32.11 C ATOM 1725 CG PHE A 120 0.956 9.287 13.375 1.00 52.45 C ATOM 1726 CD1 PHE A 120 1.982 8.777 12.596 1.00 73.53 C ATOM 1727 CD2 PHE A 120 -0.347 8.912 13.090 1.00 71.21 C ATOM 1728 CE1 PHE A 120 1.713 7.910 11.553 1.00 32.34 C ATOM 1729 CE2 PHE A 120 -0.622 8.045 12.049 1.00 31.20 C ATOM 1730 CZ PHE A 120 0.410 7.542 11.280 1.00 15.45 C ATOM 0 H PHE A 120 3.955 9.525 14.319 1.00 51.31 H new ATOM 0 HA PHE A 120 2.045 10.111 16.500 1.00 12.33 H new ATOM 0 HB2 PHE A 120 0.320 10.475 15.017 1.00 32.11 H new ATOM 0 HB3 PHE A 120 1.646 11.161 14.099 1.00 32.11 H new ATOM 0 HD1 PHE A 120 3.003 9.060 12.806 1.00 73.53 H new ATOM 0 HD2 PHE A 120 -1.157 9.302 13.688 1.00 71.21 H new ATOM 0 HE1 PHE A 120 2.521 7.521 10.952 1.00 32.34 H new ATOM 0 HE2 PHE A 120 -1.642 7.761 11.837 1.00 31.20 H new ATOM 0 HZ PHE A 120 0.198 6.863 10.467 1.00 15.45 H new ATOM 1740 N GLN A 121 1.068 7.731 16.384 1.00 42.10 N ATOM 1741 CA GLN A 121 0.802 6.310 16.572 1.00 73.14 C ATOM 1742 C GLN A 121 -0.436 5.880 15.790 1.00 3.34 C ATOM 1743 O GLN A 121 -1.564 6.160 16.193 1.00 72.41 O ATOM 1744 CB GLN A 121 0.616 5.996 18.057 1.00 21.01 C ATOM 1745 CG GLN A 121 1.831 5.345 18.698 1.00 43.11 C ATOM 1746 CD GLN A 121 2.853 6.359 19.175 1.00 72.33 C ATOM 1747 OE1 GLN A 121 2.942 6.653 20.367 1.00 43.31 O ATOM 1748 NE2 GLN A 121 3.631 6.899 18.244 1.00 74.43 N ATOM 0 H GLN A 121 0.420 8.350 16.871 1.00 42.10 H new ATOM 0 HA GLN A 121 1.660 5.753 16.195 1.00 73.14 H new ATOM 0 HB2 GLN A 121 0.386 6.919 18.589 1.00 21.01 H new ATOM 0 HB3 GLN A 121 -0.244 5.337 18.176 1.00 21.01 H new ATOM 0 HG2 GLN A 121 1.509 4.735 19.542 1.00 43.11 H new ATOM 0 HG3 GLN A 121 2.300 4.673 17.979 1.00 43.11 H new ATOM 0 HE21 GLN A 121 3.522 6.626 17.267 1.00 74.43 H new ATOM 0 HE22 GLN A 121 4.337 7.587 18.506 1.00 74.43 H new ATOM 1757 N GLY A 122 -0.215 5.199 14.670 1.00 54.11 N ATOM 1758 CA GLY A 122 -1.322 4.742 13.850 1.00 51.43 C ATOM 1759 C GLY A 122 -1.706 3.305 14.142 1.00 43.34 C ATOM 1760 O GLY A 122 -0.933 2.384 13.876 1.00 32.33 O ATOM 0 H GLY A 122 0.710 4.956 14.316 1.00 54.11 H new ATOM 0 HA2 GLY A 122 -2.185 5.387 14.018 1.00 51.43 H new ATOM 0 HA3 GLY A 122 -1.054 4.836 12.798 1.00 51.43 H new ATOM 1764 N ILE A 123 -2.900 3.113 14.691 1.00 54.35 N ATOM 1765 CA ILE A 123 -3.384 1.778 15.019 1.00 1.11 C ATOM 1766 C ILE A 123 -4.801 1.563 14.499 1.00 50.12 C ATOM 1767 O ILE A 123 -5.659 2.435 14.630 1.00 51.55 O ATOM 1768 CB ILE A 123 -3.364 1.530 16.539 1.00 10.30 C ATOM 1769 CG1 ILE A 123 -2.009 1.933 17.126 1.00 73.53 C ATOM 1770 CG2 ILE A 123 -3.666 0.070 16.842 1.00 41.23 C ATOM 1771 CD1 ILE A 123 -2.034 3.262 17.846 1.00 3.32 C ATOM 0 H ILE A 123 -3.550 3.865 14.918 1.00 54.35 H new ATOM 0 HA ILE A 123 -2.711 1.071 14.534 1.00 1.11 H new ATOM 0 HB ILE A 123 -4.136 2.144 17.002 1.00 10.30 H new ATOM 0 HG12 ILE A 123 -1.678 1.160 17.819 1.00 73.53 H new ATOM 0 HG13 ILE A 123 -1.273 1.978 16.323 1.00 73.53 H new ATOM 0 HG21 ILE A 123 -3.648 -0.089 17.920 1.00 41.23 H new ATOM 0 HG22 ILE A 123 -4.652 -0.186 16.454 1.00 41.23 H new ATOM 0 HG23 ILE A 123 -2.915 -0.563 16.369 1.00 41.23 H new ATOM 0 HD11 ILE A 123 -1.040 3.483 18.236 1.00 3.32 H new ATOM 0 HD12 ILE A 123 -2.334 4.047 17.151 1.00 3.32 H new ATOM 0 HD13 ILE A 123 -2.745 3.216 18.671 1.00 3.32 H new ATOM 1783 N GLN A 124 -5.039 0.395 13.910 1.00 3.33 N ATOM 1784 CA GLN A 124 -6.353 0.065 13.371 1.00 3.43 C ATOM 1785 C GLN A 124 -7.030 -1.013 14.210 1.00 20.41 C ATOM 1786 O GLN A 124 -6.478 -2.095 14.411 1.00 1.55 O ATOM 1787 CB GLN A 124 -6.229 -0.403 11.920 1.00 13.43 C ATOM 1788 CG GLN A 124 -5.403 -1.668 11.757 1.00 30.14 C ATOM 1789 CD GLN A 124 -6.254 -2.923 11.744 1.00 4.14 C ATOM 1790 OE1 GLN A 124 -7.392 -2.910 11.275 1.00 61.30 O ATOM 1791 NE2 GLN A 124 -5.705 -4.016 12.261 1.00 25.00 N ATOM 0 H GLN A 124 -4.339 -0.338 13.794 1.00 3.33 H new ATOM 0 HA GLN A 124 -6.968 0.964 13.404 1.00 3.43 H new ATOM 0 HB2 GLN A 124 -7.227 -0.576 11.516 1.00 13.43 H new ATOM 0 HB3 GLN A 124 -5.779 0.394 11.327 1.00 13.43 H new ATOM 0 HG2 GLN A 124 -4.835 -1.609 10.829 1.00 30.14 H new ATOM 0 HG3 GLN A 124 -4.680 -1.732 12.570 1.00 30.14 H new ATOM 0 HE21 GLN A 124 -4.758 -3.981 12.639 1.00 25.00 H new ATOM 0 HE22 GLN A 124 -6.230 -4.890 12.280 1.00 25.00 H new ATOM 1800 N ALA A 125 -8.229 -0.711 14.697 1.00 31.42 N ATOM 1801 CA ALA A 125 -8.982 -1.656 15.513 1.00 53.12 C ATOM 1802 C ALA A 125 -10.483 -1.493 15.296 1.00 20.44 C ATOM 1803 O ALA A 125 -11.010 -0.383 15.350 1.00 75.33 O ATOM 1804 CB ALA A 125 -8.637 -1.476 16.984 1.00 44.14 C ATOM 0 H ALA A 125 -8.700 0.180 14.541 1.00 31.42 H new ATOM 0 HA ALA A 125 -8.704 -2.665 15.207 1.00 53.12 H new ATOM 0 HB1 ALA A 125 -9.207 -2.188 17.581 1.00 44.14 H new ATOM 0 HB2 ALA A 125 -7.571 -1.649 17.132 1.00 44.14 H new ATOM 0 HB3 ALA A 125 -8.886 -0.461 17.295 1.00 44.14 H new ATOM 1810 N ASN A 126 -11.165 -2.608 15.051 1.00 1.52 N ATOM 1811 CA ASN A 126 -12.606 -2.588 14.825 1.00 4.23 C ATOM 1812 C ASN A 126 -13.361 -2.942 16.102 1.00 34.42 C ATOM 1813 O ASN A 126 -12.822 -3.598 16.993 1.00 23.25 O ATOM 1814 CB ASN A 126 -12.981 -3.564 13.709 1.00 32.40 C ATOM 1815 CG ASN A 126 -13.150 -4.984 14.215 1.00 3.03 C ATOM 1816 OD1 ASN A 126 -14.256 -5.408 14.551 1.00 63.03 O ATOM 1817 ND2 ASN A 126 -12.050 -5.726 14.273 1.00 42.11 N ATOM 0 H ASN A 126 -10.743 -3.536 15.004 1.00 1.52 H new ATOM 0 HA ASN A 126 -12.889 -1.579 14.525 1.00 4.23 H new ATOM 0 HB2 ASN A 126 -13.908 -3.236 13.239 1.00 32.40 H new ATOM 0 HB3 ASN A 126 -12.210 -3.545 12.939 1.00 32.40 H new ATOM 0 HD21 ASN A 126 -12.101 -6.689 14.606 1.00 42.11 H new ATOM 0 HD22 ASN A 126 -11.154 -5.333 13.984 1.00 42.11 H new ATOM 1824 N ASP A 127 -14.613 -2.505 16.183 1.00 52.01 N ATOM 1825 CA ASP A 127 -15.445 -2.777 17.350 1.00 64.34 C ATOM 1826 C ASP A 127 -14.868 -2.111 18.595 1.00 20.41 C ATOM 1827 O ASP A 127 -14.025 -1.220 18.500 1.00 11.25 O ATOM 1828 CB ASP A 127 -15.568 -4.285 17.573 1.00 35.24 C ATOM 1829 CG ASP A 127 -16.984 -4.705 17.920 1.00 45.22 C ATOM 1830 OD1 ASP A 127 -17.889 -4.480 17.090 1.00 74.33 O ATOM 1831 OD2 ASP A 127 -17.185 -5.258 19.021 1.00 60.43 O ATOM 0 H ASP A 127 -15.074 -1.961 15.454 1.00 52.01 H new ATOM 0 HA ASP A 127 -16.436 -2.363 17.165 1.00 64.34 H new ATOM 0 HB2 ASP A 127 -15.246 -4.810 16.673 1.00 35.24 H new ATOM 0 HB3 ASP A 127 -14.895 -4.587 18.376 1.00 35.24 H new ATOM 1836 N ALA A 128 -15.329 -2.550 19.762 1.00 72.22 N ATOM 1837 CA ALA A 128 -14.859 -1.998 21.026 1.00 42.52 C ATOM 1838 C ALA A 128 -13.336 -2.028 21.106 1.00 73.42 C ATOM 1839 O ALA A 128 -12.726 -1.222 21.808 1.00 64.53 O ATOM 1840 CB ALA A 128 -15.466 -2.760 22.194 1.00 72.21 C ATOM 0 H ALA A 128 -16.028 -3.287 19.858 1.00 72.22 H new ATOM 0 HA ALA A 128 -15.179 -0.958 21.080 1.00 42.52 H new ATOM 0 HB1 ALA A 128 -15.106 -2.336 23.131 1.00 72.21 H new ATOM 0 HB2 ALA A 128 -16.552 -2.682 22.154 1.00 72.21 H new ATOM 0 HB3 ALA A 128 -15.175 -3.809 22.135 1.00 72.21 H new ATOM 1846 N SER A 129 -12.729 -2.964 20.383 1.00 72.12 N ATOM 1847 CA SER A 129 -11.278 -3.103 20.376 1.00 44.22 C ATOM 1848 C SER A 129 -10.612 -1.823 19.880 1.00 10.51 C ATOM 1849 O SER A 129 -9.449 -1.558 20.181 1.00 0.51 O ATOM 1850 CB SER A 129 -10.861 -4.282 19.494 1.00 10.24 C ATOM 1851 OG SER A 129 -9.583 -4.769 19.865 1.00 41.12 O ATOM 0 H SER A 129 -13.220 -3.637 19.795 1.00 72.12 H new ATOM 0 HA SER A 129 -10.951 -3.290 21.399 1.00 44.22 H new ATOM 0 HB2 SER A 129 -11.597 -5.082 19.578 1.00 10.24 H new ATOM 0 HB3 SER A 129 -10.846 -3.971 18.449 1.00 10.24 H new ATOM 0 HG SER A 129 -9.340 -5.523 19.288 1.00 41.12 H new ATOM 1857 N GLY A 130 -11.360 -1.031 19.117 1.00 31.02 N ATOM 1858 CA GLY A 130 -10.827 0.212 18.591 1.00 21.02 C ATOM 1859 C GLY A 130 -11.364 1.428 19.320 1.00 22.33 C ATOM 1860 O GLY A 130 -11.487 2.506 18.738 1.00 73.02 O ATOM 0 H GLY A 130 -12.326 -1.228 18.854 1.00 31.02 H new ATOM 0 HA2 GLY A 130 -9.740 0.198 18.666 1.00 21.02 H new ATOM 0 HA3 GLY A 130 -11.072 0.290 17.532 1.00 21.02 H new ATOM 1864 N LEU A 131 -11.686 1.255 20.598 1.00 44.15 N ATOM 1865 CA LEU A 131 -12.214 2.347 21.408 1.00 53.14 C ATOM 1866 C LEU A 131 -11.666 2.285 22.830 1.00 71.03 C ATOM 1867 O LEU A 131 -12.245 2.855 23.754 1.00 14.33 O ATOM 1868 CB LEU A 131 -13.743 2.294 21.435 1.00 2.02 C ATOM 1869 CG LEU A 131 -14.430 2.033 20.094 1.00 3.42 C ATOM 1870 CD1 LEU A 131 -15.879 1.624 20.307 1.00 23.24 C ATOM 1871 CD2 LEU A 131 -14.347 3.265 19.204 1.00 12.25 C ATOM 0 H LEU A 131 -11.591 0.369 21.095 1.00 44.15 H new ATOM 0 HA LEU A 131 -11.897 3.288 20.958 1.00 53.14 H new ATOM 0 HB2 LEU A 131 -14.047 1.515 22.134 1.00 2.02 H new ATOM 0 HB3 LEU A 131 -14.112 3.240 21.832 1.00 2.02 H new ATOM 0 HG LEU A 131 -13.912 1.213 19.596 1.00 3.42 H new ATOM 0 HD11 LEU A 131 -16.352 1.443 19.342 1.00 23.24 H new ATOM 0 HD12 LEU A 131 -15.916 0.714 20.906 1.00 23.24 H new ATOM 0 HD13 LEU A 131 -16.410 2.422 20.826 1.00 23.24 H new ATOM 0 HD21 LEU A 131 -14.841 3.061 18.254 1.00 12.25 H new ATOM 0 HD22 LEU A 131 -14.839 4.104 19.697 1.00 12.25 H new ATOM 0 HD23 LEU A 131 -13.301 3.514 19.023 1.00 12.25 H new ATOM 1883 N ASP A 132 -10.546 1.591 22.996 1.00 2.04 N ATOM 1884 CA ASP A 132 -9.917 1.457 24.305 1.00 1.13 C ATOM 1885 C ASP A 132 -9.099 2.699 24.645 1.00 13.40 C ATOM 1886 O ASP A 132 -7.946 2.828 24.234 1.00 22.33 O ATOM 1887 CB ASP A 132 -9.022 0.217 24.341 1.00 51.25 C ATOM 1888 CG ASP A 132 -9.819 -1.069 24.439 1.00 43.03 C ATOM 1889 OD1 ASP A 132 -11.017 -0.999 24.782 1.00 30.44 O ATOM 1890 OD2 ASP A 132 -9.243 -2.145 24.173 1.00 75.33 O ATOM 0 H ASP A 132 -10.055 1.112 22.241 1.00 2.04 H new ATOM 0 HA ASP A 132 -10.706 1.348 25.049 1.00 1.13 H new ATOM 0 HB2 ASP A 132 -8.405 0.191 23.443 1.00 51.25 H new ATOM 0 HB3 ASP A 132 -8.344 0.286 25.191 1.00 51.25 H new ATOM 1895 N PHE A 133 -9.705 3.613 25.397 1.00 60.14 N ATOM 1896 CA PHE A 133 -9.034 4.846 25.790 1.00 50.41 C ATOM 1897 C PHE A 133 -7.721 4.547 26.507 1.00 32.54 C ATOM 1898 O PHE A 133 -6.707 5.200 26.265 1.00 21.23 O ATOM 1899 CB PHE A 133 -9.944 5.681 26.694 1.00 24.33 C ATOM 1900 CG PHE A 133 -11.083 6.330 25.963 1.00 53.30 C ATOM 1901 CD1 PHE A 133 -10.937 7.589 25.402 1.00 25.14 C ATOM 1902 CD2 PHE A 133 -12.301 5.682 25.836 1.00 53.24 C ATOM 1903 CE1 PHE A 133 -11.984 8.189 24.730 1.00 50.23 C ATOM 1904 CE2 PHE A 133 -13.352 6.277 25.164 1.00 54.45 C ATOM 1905 CZ PHE A 133 -13.193 7.532 24.609 1.00 0.20 C ATOM 0 H PHE A 133 -10.659 3.522 25.746 1.00 60.14 H new ATOM 0 HA PHE A 133 -8.812 5.413 24.886 1.00 50.41 H new ATOM 0 HB2 PHE A 133 -10.345 5.043 27.481 1.00 24.33 H new ATOM 0 HB3 PHE A 133 -9.349 6.453 27.182 1.00 24.33 H new ATOM 0 HD1 PHE A 133 -9.994 8.107 25.491 1.00 25.14 H new ATOM 0 HD2 PHE A 133 -12.431 4.700 26.267 1.00 53.24 H new ATOM 0 HE1 PHE A 133 -11.857 9.171 24.299 1.00 50.23 H new ATOM 0 HE2 PHE A 133 -14.297 5.761 25.073 1.00 54.45 H new ATOM 0 HZ PHE A 133 -14.012 7.998 24.082 1.00 0.20 H new ATOM 1915 N GLU A 134 -7.750 3.554 27.391 1.00 11.14 N ATOM 1916 CA GLU A 134 -6.563 3.169 28.145 1.00 22.42 C ATOM 1917 C GLU A 134 -5.424 2.783 27.206 1.00 23.41 C ATOM 1918 O GLU A 134 -4.252 2.987 27.520 1.00 65.12 O ATOM 1919 CB GLU A 134 -6.883 2.002 29.083 1.00 50.44 C ATOM 1920 CG GLU A 134 -6.349 2.190 30.493 1.00 42.54 C ATOM 1921 CD GLU A 134 -7.206 1.504 31.538 1.00 72.53 C ATOM 1922 OE1 GLU A 134 -7.749 0.419 31.241 1.00 30.11 O ATOM 1923 OE2 GLU A 134 -7.334 2.051 32.653 1.00 42.31 O ATOM 0 H GLU A 134 -8.582 3.002 27.602 1.00 11.14 H new ATOM 0 HA GLU A 134 -6.247 4.027 28.739 1.00 22.42 H new ATOM 0 HB2 GLU A 134 -7.964 1.869 29.128 1.00 50.44 H new ATOM 0 HB3 GLU A 134 -6.466 1.086 28.665 1.00 50.44 H new ATOM 0 HG2 GLU A 134 -5.333 1.799 30.548 1.00 42.54 H new ATOM 0 HG3 GLU A 134 -6.293 3.255 30.717 1.00 42.54 H new ATOM 1930 N GLU A 135 -5.778 2.223 26.054 1.00 54.25 N ATOM 1931 CA GLU A 135 -4.786 1.807 25.070 1.00 42.34 C ATOM 1932 C GLU A 135 -4.088 3.018 24.456 1.00 63.40 C ATOM 1933 O GLU A 135 -2.871 3.014 24.263 1.00 35.04 O ATOM 1934 CB GLU A 135 -5.445 0.973 23.969 1.00 25.43 C ATOM 1935 CG GLU A 135 -4.463 0.124 23.179 1.00 21.43 C ATOM 1936 CD GLU A 135 -5.119 -0.600 22.019 1.00 10.32 C ATOM 1937 OE1 GLU A 135 -5.776 -1.634 22.259 1.00 21.14 O ATOM 1938 OE2 GLU A 135 -4.975 -0.130 20.871 1.00 74.42 O ATOM 0 H GLU A 135 -6.744 2.047 25.779 1.00 54.25 H new ATOM 0 HA GLU A 135 -4.040 1.198 25.580 1.00 42.34 H new ATOM 0 HB2 GLU A 135 -6.196 0.323 24.418 1.00 25.43 H new ATOM 0 HB3 GLU A 135 -5.969 1.640 23.284 1.00 25.43 H new ATOM 0 HG2 GLU A 135 -3.662 0.759 22.800 1.00 21.43 H new ATOM 0 HG3 GLU A 135 -4.003 -0.606 23.844 1.00 21.43 H new ATOM 1945 N ILE A 136 -4.866 4.050 24.151 1.00 0.40 N ATOM 1946 CA ILE A 136 -4.323 5.267 23.560 1.00 10.20 C ATOM 1947 C ILE A 136 -3.431 6.008 24.550 1.00 43.32 C ATOM 1948 O ILE A 136 -2.323 6.424 24.212 1.00 42.55 O ATOM 1949 CB ILE A 136 -5.444 6.213 23.089 1.00 64.34 C ATOM 1950 CG1 ILE A 136 -6.320 5.519 22.044 1.00 34.11 C ATOM 1951 CG2 ILE A 136 -4.852 7.495 22.524 1.00 43.32 C ATOM 1952 CD1 ILE A 136 -7.627 6.235 21.780 1.00 65.31 C ATOM 0 H ILE A 136 -5.874 4.068 24.303 1.00 0.40 H new ATOM 0 HA ILE A 136 -3.730 4.962 22.698 1.00 10.20 H new ATOM 0 HB ILE A 136 -6.067 6.470 23.946 1.00 64.34 H new ATOM 0 HG12 ILE A 136 -5.764 5.439 21.110 1.00 34.11 H new ATOM 0 HG13 ILE A 136 -6.532 4.503 22.376 1.00 34.11 H new ATOM 0 HG21 ILE A 136 -5.656 8.153 22.195 1.00 43.32 H new ATOM 0 HG22 ILE A 136 -4.265 7.995 23.295 1.00 43.32 H new ATOM 0 HG23 ILE A 136 -4.209 7.256 21.677 1.00 43.32 H new ATOM 0 HD11 ILE A 136 -8.197 5.687 21.029 1.00 65.31 H new ATOM 0 HD12 ILE A 136 -8.204 6.292 22.703 1.00 65.31 H new ATOM 0 HD13 ILE A 136 -7.423 7.242 21.417 1.00 65.31 H new ATOM 1964 N SER A 137 -3.921 6.168 25.775 1.00 3.21 N ATOM 1965 CA SER A 137 -3.169 6.861 26.815 1.00 64.03 C ATOM 1966 C SER A 137 -1.871 6.123 27.129 1.00 5.50 C ATOM 1967 O SER A 137 -0.828 6.743 27.344 1.00 73.35 O ATOM 1968 CB SER A 137 -4.014 6.993 28.083 1.00 23.32 C ATOM 1969 OG SER A 137 -5.043 7.952 27.913 1.00 4.12 O ATOM 0 H SER A 137 -4.835 5.827 26.072 1.00 3.21 H new ATOM 0 HA SER A 137 -2.921 7.857 26.448 1.00 64.03 H new ATOM 0 HB2 SER A 137 -4.451 6.027 28.335 1.00 23.32 H new ATOM 0 HB3 SER A 137 -3.378 7.282 28.919 1.00 23.32 H new ATOM 0 HG SER A 137 -5.570 8.016 28.737 1.00 4.12 H new ATOM 1975 N ARG A 138 -1.942 4.797 27.154 1.00 35.35 N ATOM 1976 CA ARG A 138 -0.774 3.974 27.444 1.00 74.43 C ATOM 1977 C ARG A 138 0.235 4.042 26.302 1.00 44.42 C ATOM 1978 O ARG A 138 1.446 4.047 26.528 1.00 54.01 O ATOM 1979 CB ARG A 138 -1.193 2.522 27.681 1.00 33.44 C ATOM 1980 CG ARG A 138 -0.032 1.600 28.017 1.00 72.24 C ATOM 1981 CD ARG A 138 0.394 0.779 26.809 1.00 0.33 C ATOM 1982 NE ARG A 138 -0.119 -0.587 26.867 1.00 13.21 N ATOM 1983 CZ ARG A 138 0.292 -1.490 27.750 1.00 11.33 C ATOM 1984 NH1 ARG A 138 1.217 -1.173 28.645 1.00 2.35 N ATOM 1985 NH2 ARG A 138 -0.223 -2.713 27.740 1.00 51.53 N ATOM 0 H ARG A 138 -2.796 4.269 26.977 1.00 35.35 H new ATOM 0 HA ARG A 138 -0.303 4.362 28.347 1.00 74.43 H new ATOM 0 HB2 ARG A 138 -1.918 2.490 28.494 1.00 33.44 H new ATOM 0 HB3 ARG A 138 -1.697 2.148 26.790 1.00 33.44 H new ATOM 0 HG2 ARG A 138 0.812 2.191 28.373 1.00 72.24 H new ATOM 0 HG3 ARG A 138 -0.319 0.932 28.829 1.00 72.24 H new ATOM 0 HD2 ARG A 138 0.038 1.262 25.899 1.00 0.33 H new ATOM 0 HD3 ARG A 138 1.482 0.755 26.752 1.00 0.33 H new ATOM 0 HE ARG A 138 -0.832 -0.863 26.192 1.00 13.21 H new ATOM 0 HH11 ARG A 138 1.615 -0.234 28.657 1.00 2.35 H new ATOM 0 HH12 ARG A 138 1.531 -1.868 29.322 1.00 2.35 H new ATOM 0 HH21 ARG A 138 -0.936 -2.961 27.053 1.00 51.53 H new ATOM 0 HH22 ARG A 138 0.094 -3.405 28.419 1.00 51.53 H new ATOM 1999 N LYS A 139 -0.270 4.095 25.074 1.00 13.32 N ATOM 2000 CA LYS A 139 0.586 4.165 23.896 1.00 72.51 C ATOM 2001 C LYS A 139 1.373 5.471 23.871 1.00 15.10 C ATOM 2002 O LYS A 139 2.586 5.473 23.664 1.00 61.11 O ATOM 2003 CB LYS A 139 -0.253 4.038 22.622 1.00 33.24 C ATOM 2004 CG LYS A 139 0.011 2.760 21.844 1.00 2.43 C ATOM 2005 CD LYS A 139 -1.254 1.935 21.682 1.00 62.54 C ATOM 2006 CE LYS A 139 -1.019 0.725 20.789 1.00 10.34 C ATOM 2007 NZ LYS A 139 -0.465 -0.427 21.552 1.00 62.51 N ATOM 0 H LYS A 139 -1.269 4.091 24.869 1.00 13.32 H new ATOM 0 HA LYS A 139 1.293 3.337 23.942 1.00 72.51 H new ATOM 0 HB2 LYS A 139 -1.309 4.080 22.887 1.00 33.24 H new ATOM 0 HB3 LYS A 139 -0.052 4.894 21.978 1.00 33.24 H new ATOM 0 HG2 LYS A 139 0.413 3.007 20.862 1.00 2.43 H new ATOM 0 HG3 LYS A 139 0.768 2.169 22.359 1.00 2.43 H new ATOM 0 HD2 LYS A 139 -1.602 1.604 22.661 1.00 62.54 H new ATOM 0 HD3 LYS A 139 -2.042 2.555 21.256 1.00 62.54 H new ATOM 0 HE2 LYS A 139 -1.958 0.432 20.320 1.00 10.34 H new ATOM 0 HE3 LYS A 139 -0.332 0.994 19.987 1.00 10.34 H new ATOM 0 HZ1 LYS A 139 -0.319 -1.231 20.909 1.00 62.51 H new ATOM 0 HZ2 LYS A 139 0.444 -0.156 21.979 1.00 62.51 H new ATOM 0 HZ3 LYS A 139 -1.132 -0.700 22.302 1.00 62.51 H new ATOM 2021 N VAL A 140 0.674 6.582 24.085 1.00 72.41 N ATOM 2022 CA VAL A 140 1.308 7.895 24.090 1.00 74.44 C ATOM 2023 C VAL A 140 2.240 8.050 25.286 1.00 41.54 C ATOM 2024 O VAL A 140 3.310 8.651 25.179 1.00 32.32 O ATOM 2025 CB VAL A 140 0.260 9.023 24.119 1.00 41.42 C ATOM 2026 CG1 VAL A 140 -0.627 8.898 25.348 1.00 25.43 C ATOM 2027 CG2 VAL A 140 0.941 10.383 24.079 1.00 23.04 C ATOM 0 H VAL A 140 -0.331 6.598 24.257 1.00 72.41 H new ATOM 0 HA VAL A 140 1.887 7.971 23.170 1.00 74.44 H new ATOM 0 HB VAL A 140 -0.371 8.931 23.235 1.00 41.42 H new ATOM 0 HG11 VAL A 140 -1.361 9.704 25.351 1.00 25.43 H new ATOM 0 HG12 VAL A 140 -1.143 7.938 25.329 1.00 25.43 H new ATOM 0 HG13 VAL A 140 -0.014 8.963 26.247 1.00 25.43 H new ATOM 0 HG21 VAL A 140 0.186 11.169 24.100 1.00 23.04 H new ATOM 0 HG22 VAL A 140 1.597 10.487 24.943 1.00 23.04 H new ATOM 0 HG23 VAL A 140 1.529 10.469 23.165 1.00 23.04 H new ATOM 2037 N LYS A 141 1.828 7.505 26.425 1.00 10.40 N ATOM 2038 CA LYS A 141 2.626 7.581 27.643 1.00 42.32 C ATOM 2039 C LYS A 141 3.865 6.698 27.537 1.00 20.53 C ATOM 2040 O LYS A 141 4.890 6.972 28.161 1.00 31.04 O ATOM 2041 CB LYS A 141 1.789 7.162 28.853 1.00 31.51 C ATOM 2042 CG LYS A 141 2.591 7.048 30.138 1.00 61.22 C ATOM 2043 CD LYS A 141 2.888 5.598 30.484 1.00 55.23 C ATOM 2044 CE LYS A 141 1.625 4.852 30.887 1.00 51.10 C ATOM 2045 NZ LYS A 141 1.862 3.945 32.044 1.00 64.34 N ATOM 0 H LYS A 141 0.945 7.005 26.530 1.00 10.40 H new ATOM 0 HA LYS A 141 2.948 8.614 27.773 1.00 42.32 H new ATOM 0 HB2 LYS A 141 0.987 7.886 28.998 1.00 31.51 H new ATOM 0 HB3 LYS A 141 1.317 6.202 28.643 1.00 31.51 H new ATOM 0 HG2 LYS A 141 3.527 7.597 30.034 1.00 61.22 H new ATOM 0 HG3 LYS A 141 2.039 7.512 30.955 1.00 61.22 H new ATOM 0 HD2 LYS A 141 3.346 5.104 29.627 1.00 55.23 H new ATOM 0 HD3 LYS A 141 3.611 5.558 31.298 1.00 55.23 H new ATOM 0 HE2 LYS A 141 0.845 5.570 31.142 1.00 51.10 H new ATOM 0 HE3 LYS A 141 1.260 4.272 30.040 1.00 51.10 H new ATOM 0 HZ1 LYS A 141 0.978 3.455 32.288 1.00 64.34 H new ATOM 0 HZ2 LYS A 141 2.588 3.244 31.793 1.00 64.34 H new ATOM 0 HZ3 LYS A 141 2.186 4.501 32.861 1.00 64.34 H new ATOM 2059 N SER A 142 3.764 5.637 26.743 1.00 72.14 N ATOM 2060 CA SER A 142 4.876 4.712 26.557 1.00 34.32 C ATOM 2061 C SER A 142 5.847 5.234 25.503 1.00 0.01 C ATOM 2062 O SER A 142 7.038 4.926 25.534 1.00 74.13 O ATOM 2063 CB SER A 142 4.356 3.332 26.149 1.00 31.11 C ATOM 2064 OG SER A 142 5.425 2.458 25.829 1.00 10.43 O ATOM 0 H SER A 142 2.923 5.396 26.218 1.00 72.14 H new ATOM 0 HA SER A 142 5.408 4.627 27.505 1.00 34.32 H new ATOM 0 HB2 SER A 142 3.766 2.908 26.961 1.00 31.11 H new ATOM 0 HB3 SER A 142 3.692 3.429 25.290 1.00 31.11 H new ATOM 0 HG SER A 142 5.681 2.584 24.892 1.00 10.43 H new ATOM 2070 N ASN A 143 5.329 6.027 24.571 1.00 74.11 N ATOM 2071 CA ASN A 143 6.149 6.592 23.506 1.00 50.50 C ATOM 2072 C ASN A 143 6.832 5.490 22.702 1.00 41.40 C ATOM 2073 O ASN A 143 8.051 5.499 22.529 1.00 70.11 O ATOM 2074 CB ASN A 143 7.200 7.539 24.091 1.00 74.51 C ATOM 2075 CG ASN A 143 7.758 8.495 23.054 1.00 32.54 C ATOM 2076 OD1 ASN A 143 8.423 8.079 22.105 1.00 14.31 O ATOM 2077 ND2 ASN A 143 7.489 9.783 23.233 1.00 64.22 N ATOM 0 H ASN A 143 4.345 6.293 24.532 1.00 74.11 H new ATOM 0 HA ASN A 143 5.496 7.153 22.837 1.00 50.50 H new ATOM 0 HB2 ASN A 143 6.757 8.110 24.907 1.00 74.51 H new ATOM 0 HB3 ASN A 143 8.015 6.954 24.518 1.00 74.51 H new ATOM 0 HD21 ASN A 143 7.838 10.474 22.569 1.00 64.22 H new ATOM 0 HD22 ASN A 143 6.933 10.081 24.035 1.00 64.22 H new ATOM 2084 N ARG A 144 6.038 4.544 22.213 1.00 61.52 N ATOM 2085 CA ARG A 144 6.566 3.434 21.428 1.00 51.34 C ATOM 2086 C ARG A 144 7.522 2.585 22.260 1.00 1.33 C ATOM 2087 O ARG A 144 7.126 1.987 23.260 1.00 34.42 O ATOM 2088 CB ARG A 144 7.285 3.959 20.183 1.00 34.12 C ATOM 2089 CG ARG A 144 7.356 2.949 19.050 1.00 72.33 C ATOM 2090 CD ARG A 144 6.663 3.466 17.798 1.00 25.24 C ATOM 2091 NE ARG A 144 6.294 2.383 16.890 1.00 12.34 N ATOM 2092 CZ ARG A 144 7.173 1.692 16.174 1.00 5.22 C ATOM 2093 NH1 ARG A 144 8.467 1.969 16.260 1.00 2.23 N ATOM 2094 NH2 ARG A 144 6.760 0.721 15.370 1.00 54.30 N ATOM 0 H ARG A 144 5.027 4.523 22.346 1.00 61.52 H new ATOM 0 HA ARG A 144 5.728 2.809 21.120 1.00 51.34 H new ATOM 0 HB2 ARG A 144 6.774 4.854 19.829 1.00 34.12 H new ATOM 0 HB3 ARG A 144 8.297 4.257 20.457 1.00 34.12 H new ATOM 0 HG2 ARG A 144 8.399 2.727 18.824 1.00 72.33 H new ATOM 0 HG3 ARG A 144 6.892 2.014 19.365 1.00 72.33 H new ATOM 0 HD2 ARG A 144 5.769 4.022 18.082 1.00 25.24 H new ATOM 0 HD3 ARG A 144 7.322 4.164 17.281 1.00 25.24 H new ATOM 0 HE ARG A 144 5.306 2.144 16.801 1.00 12.34 H new ATOM 0 HH11 ARG A 144 8.789 2.714 16.877 1.00 2.23 H new ATOM 0 HH12 ARG A 144 9.140 1.437 15.709 1.00 2.23 H new ATOM 0 HH21 ARG A 144 5.766 0.504 15.301 1.00 54.30 H new ATOM 0 HH22 ARG A 144 7.437 0.191 14.821 1.00 54.30 H new