USER MOD reduce.3.24.130724 H: found=0, std=0, add=666, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 666 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: T 69 SER OG : rot 99:sc= 1.08 USER MOD Set 1.2: T 71 THR OG1 : rot 180:sc= 1.08 USER MOD Single : T 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 1 MET N :NH3+ -161:sc= -0.167 (180deg=-0.961) USER MOD Single : T 5 TYR OH : rot 180:sc= 0 USER MOD Single : T 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 11 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : T 13 THR OG1 : rot 180:sc= 0.0166 USER MOD Single : T 16 GLN : amide:sc= -3.2! C(o=-3.2!,f=-3.5!) USER MOD Single : T 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 18 ASN : amide:sc= -2.89! K(o=-2.9!,f=-0.24) USER MOD Single : T 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 35 SER OG : rot 180:sc= 0 USER MOD Single : T 37 SER OG : rot -129:sc= 0.52 USER MOD Single : T 38 THR OG1 : rot -170:sc= 0 USER MOD Single : T 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 43 LYS NZ :NH3+ 170:sc= 0.103 (180deg=0.0883) USER MOD Single : T 45 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 47 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 50 GLN : amide:sc= -2.1! C(o=-2.1!,f=-3.1!) USER MOD Single : T 51 ASN : amide:sc= -0.568 K(o=-0.57,f=-1.3) USER MOD Single : T 53 THR OG1 : rot 180:sc= 0.177 USER MOD Single : T 58 GLN : amide:sc= -2.85! C(o=-2.8!,f=-6.7!) USER MOD Single : T 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 81 MET CE :methyl 168:sc= -0.813 (180deg=-1.45) USER MOD Single : T 84 SER OG : rot 180:sc= 0 USER MOD Single : T 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 89 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET T 1 76.934 -17.767 8.660 1.00 0.00 N ATOM 2 CA MET T 1 76.015 -18.252 7.593 1.00 0.00 C ATOM 3 C MET T 1 75.721 -17.112 6.622 1.00 0.00 C ATOM 4 O MET T 1 75.899 -17.254 5.412 1.00 0.00 O ATOM 5 CB MET T 1 74.712 -18.744 8.229 1.00 0.00 C ATOM 6 CG MET T 1 75.036 -19.643 9.423 1.00 0.00 C ATOM 7 SD MET T 1 73.500 -20.315 10.106 1.00 0.00 S ATOM 8 CE MET T 1 73.404 -21.781 9.051 1.00 0.00 C ATOM 0 H1 MET T 1 77.388 -18.580 9.123 1.00 0.00 H new ATOM 0 H2 MET T 1 77.663 -17.157 8.239 1.00 0.00 H new ATOM 0 H3 MET T 1 76.393 -17.225 9.364 1.00 0.00 H new ATOM 0 HA MET T 1 76.482 -19.074 7.051 1.00 0.00 H new ATOM 0 HB2 MET T 1 74.109 -17.895 8.552 1.00 0.00 H new ATOM 0 HB3 MET T 1 74.122 -19.294 7.496 1.00 0.00 H new ATOM 0 HG2 MET T 1 75.694 -20.454 9.113 1.00 0.00 H new ATOM 0 HG3 MET T 1 75.568 -19.075 10.186 1.00 0.00 H new ATOM 0 HE1 MET T 1 72.513 -22.355 9.306 1.00 0.00 H new ATOM 0 HE2 MET T 1 73.352 -21.475 8.006 1.00 0.00 H new ATOM 0 HE3 MET T 1 74.289 -22.398 9.205 1.00 0.00 H new ATOM 20 N ASP T 2 75.273 -15.983 7.160 1.00 0.00 N ATOM 21 CA ASP T 2 74.958 -14.826 6.331 1.00 0.00 C ATOM 22 C ASP T 2 74.037 -15.224 5.183 1.00 0.00 C ATOM 23 O ASP T 2 74.324 -14.947 4.018 1.00 0.00 O ATOM 24 CB ASP T 2 76.245 -14.221 5.769 1.00 0.00 C ATOM 25 CG ASP T 2 77.034 -13.544 6.885 1.00 0.00 C ATOM 26 OD1 ASP T 2 77.407 -14.231 7.820 1.00 0.00 O ATOM 27 OD2 ASP T 2 77.253 -12.348 6.786 1.00 0.00 O ATOM 0 H ASP T 2 75.121 -15.845 8.159 1.00 0.00 H new ATOM 0 HA ASP T 2 74.449 -14.087 6.950 1.00 0.00 H new ATOM 0 HB2 ASP T 2 76.850 -15.000 5.305 1.00 0.00 H new ATOM 0 HB3 ASP T 2 76.006 -13.497 4.990 1.00 0.00 H new ATOM 32 N ASP T 3 72.929 -15.878 5.519 1.00 0.00 N ATOM 33 CA ASP T 3 71.971 -16.312 4.508 1.00 0.00 C ATOM 34 C ASP T 3 71.077 -15.154 4.080 1.00 0.00 C ATOM 35 O ASP T 3 70.982 -14.836 2.894 1.00 0.00 O ATOM 36 CB ASP T 3 71.107 -17.447 5.062 1.00 0.00 C ATOM 37 CG ASP T 3 71.990 -18.615 5.489 1.00 0.00 C ATOM 38 OD1 ASP T 3 72.862 -18.983 4.721 1.00 0.00 O ATOM 39 OD2 ASP T 3 71.779 -19.123 6.578 1.00 0.00 O ATOM 0 H ASP T 3 72.674 -16.118 6.477 1.00 0.00 H new ATOM 0 HA ASP T 3 72.526 -16.666 3.639 1.00 0.00 H new ATOM 0 HB2 ASP T 3 70.525 -17.090 5.912 1.00 0.00 H new ATOM 0 HB3 ASP T 3 70.396 -17.776 4.305 1.00 0.00 H new ATOM 44 N ILE T 4 70.420 -14.528 5.052 1.00 0.00 N ATOM 45 CA ILE T 4 69.530 -13.407 4.763 1.00 0.00 C ATOM 46 C ILE T 4 70.164 -12.442 3.763 1.00 0.00 C ATOM 47 O ILE T 4 69.477 -11.605 3.177 1.00 0.00 O ATOM 48 CB ILE T 4 69.168 -12.661 6.056 1.00 0.00 C ATOM 49 CG1 ILE T 4 70.385 -11.891 6.606 1.00 0.00 C ATOM 50 CG2 ILE T 4 68.681 -13.665 7.105 1.00 0.00 C ATOM 51 CD1 ILE T 4 71.586 -12.828 6.798 1.00 0.00 C ATOM 0 H ILE T 4 70.486 -14.775 6.039 1.00 0.00 H new ATOM 0 HA ILE T 4 68.620 -13.810 4.319 1.00 0.00 H new ATOM 0 HB ILE T 4 68.378 -11.944 5.833 1.00 0.00 H new ATOM 0 HG12 ILE T 4 70.652 -11.087 5.920 1.00 0.00 H new ATOM 0 HG13 ILE T 4 70.126 -11.426 7.557 1.00 0.00 H new ATOM 0 HG21 ILE T 4 68.424 -13.136 8.023 1.00 0.00 H new ATOM 0 HG22 ILE T 4 67.801 -14.187 6.728 1.00 0.00 H new ATOM 0 HG23 ILE T 4 69.471 -14.387 7.311 1.00 0.00 H new ATOM 0 HD11 ILE T 4 72.432 -12.261 7.187 1.00 0.00 H new ATOM 0 HD12 ILE T 4 71.323 -13.617 7.503 1.00 0.00 H new ATOM 0 HD13 ILE T 4 71.857 -13.273 5.841 1.00 0.00 H new ATOM 63 N TYR T 5 71.476 -12.563 3.569 1.00 0.00 N ATOM 64 CA TYR T 5 72.191 -11.695 2.634 1.00 0.00 C ATOM 65 C TYR T 5 72.209 -12.313 1.240 1.00 0.00 C ATOM 66 O TYR T 5 71.935 -11.638 0.247 1.00 0.00 O ATOM 67 CB TYR T 5 73.629 -11.482 3.117 1.00 0.00 C ATOM 68 CG TYR T 5 73.630 -10.564 4.319 1.00 0.00 C ATOM 69 CD1 TYR T 5 73.286 -9.216 4.166 1.00 0.00 C ATOM 70 CD2 TYR T 5 73.973 -11.060 5.584 1.00 0.00 C ATOM 71 CE1 TYR T 5 73.286 -8.362 5.276 1.00 0.00 C ATOM 72 CE2 TYR T 5 73.971 -10.206 6.694 1.00 0.00 C ATOM 73 CZ TYR T 5 73.628 -8.858 6.541 1.00 0.00 C ATOM 74 OH TYR T 5 73.626 -8.017 7.635 1.00 0.00 O ATOM 0 H TYR T 5 72.063 -13.249 4.043 1.00 0.00 H new ATOM 0 HA TYR T 5 71.676 -10.736 2.589 1.00 0.00 H new ATOM 0 HB2 TYR T 5 74.081 -12.439 3.377 1.00 0.00 H new ATOM 0 HB3 TYR T 5 74.232 -11.051 2.317 1.00 0.00 H new ATOM 0 HD1 TYR T 5 73.020 -8.834 3.191 1.00 0.00 H new ATOM 0 HD2 TYR T 5 74.239 -12.100 5.703 1.00 0.00 H new ATOM 0 HE1 TYR T 5 73.022 -7.321 5.157 1.00 0.00 H new ATOM 0 HE2 TYR T 5 74.234 -10.588 7.669 1.00 0.00 H new ATOM 0 HH TYR T 5 73.885 -8.520 8.435 1.00 0.00 H new ATOM 84 N LYS T 6 72.531 -13.600 1.173 1.00 0.00 N ATOM 85 CA LYS T 6 72.581 -14.301 -0.105 1.00 0.00 C ATOM 86 C LYS T 6 71.236 -14.207 -0.820 1.00 0.00 C ATOM 87 O LYS T 6 71.181 -14.023 -2.036 1.00 0.00 O ATOM 88 CB LYS T 6 72.940 -15.775 0.119 1.00 0.00 C ATOM 89 CG LYS T 6 74.388 -15.898 0.639 1.00 0.00 C ATOM 90 CD LYS T 6 75.383 -15.952 -0.538 1.00 0.00 C ATOM 91 CE LYS T 6 75.526 -17.393 -1.044 1.00 0.00 C ATOM 92 NZ LYS T 6 76.080 -17.380 -2.428 1.00 0.00 N ATOM 0 H LYS T 6 72.760 -14.176 1.983 1.00 0.00 H new ATOM 0 HA LYS T 6 73.344 -13.832 -0.725 1.00 0.00 H new ATOM 0 HB2 LYS T 6 72.250 -16.220 0.835 1.00 0.00 H new ATOM 0 HB3 LYS T 6 72.833 -16.329 -0.814 1.00 0.00 H new ATOM 0 HG2 LYS T 6 74.623 -15.050 1.282 1.00 0.00 H new ATOM 0 HG3 LYS T 6 74.487 -16.797 1.248 1.00 0.00 H new ATOM 0 HD2 LYS T 6 75.037 -15.308 -1.346 1.00 0.00 H new ATOM 0 HD3 LYS T 6 76.354 -15.572 -0.221 1.00 0.00 H new ATOM 0 HE2 LYS T 6 76.183 -17.959 -0.383 1.00 0.00 H new ATOM 0 HE3 LYS T 6 74.557 -17.892 -1.033 1.00 0.00 H new ATOM 0 HZ1 LYS T 6 76.177 -18.357 -2.772 1.00 0.00 H new ATOM 0 HZ2 LYS T 6 75.437 -16.855 -3.054 1.00 0.00 H new ATOM 0 HZ3 LYS T 6 77.013 -16.920 -2.424 1.00 0.00 H new ATOM 106 N ALA T 7 70.157 -14.334 -0.056 1.00 0.00 N ATOM 107 CA ALA T 7 68.817 -14.262 -0.626 1.00 0.00 C ATOM 108 C ALA T 7 68.627 -12.955 -1.387 1.00 0.00 C ATOM 109 O ALA T 7 67.893 -12.900 -2.374 1.00 0.00 O ATOM 110 CB ALA T 7 67.770 -14.365 0.485 1.00 0.00 C ATOM 0 H ALA T 7 70.183 -14.486 0.952 1.00 0.00 H new ATOM 0 HA ALA T 7 68.693 -15.094 -1.320 1.00 0.00 H new ATOM 0 HB1 ALA T 7 66.772 -14.310 0.050 1.00 0.00 H new ATOM 0 HB2 ALA T 7 67.887 -15.314 1.008 1.00 0.00 H new ATOM 0 HB3 ALA T 7 67.905 -13.544 1.189 1.00 0.00 H new ATOM 116 N ALA T 8 69.294 -11.903 -0.922 1.00 0.00 N ATOM 117 CA ALA T 8 69.191 -10.599 -1.569 1.00 0.00 C ATOM 118 C ALA T 8 70.019 -10.568 -2.849 1.00 0.00 C ATOM 119 O ALA T 8 69.599 -10.000 -3.857 1.00 0.00 O ATOM 120 CB ALA T 8 69.678 -9.506 -0.616 1.00 0.00 C ATOM 0 H ALA T 8 69.907 -11.927 -0.107 1.00 0.00 H new ATOM 0 HA ALA T 8 68.146 -10.421 -1.823 1.00 0.00 H new ATOM 0 HB1 ALA T 8 69.599 -8.535 -1.105 1.00 0.00 H new ATOM 0 HB2 ALA T 8 69.065 -9.510 0.285 1.00 0.00 H new ATOM 0 HB3 ALA T 8 70.718 -9.693 -0.348 1.00 0.00 H new ATOM 126 N VAL T 9 71.197 -11.182 -2.802 1.00 0.00 N ATOM 127 CA VAL T 9 72.076 -11.217 -3.965 1.00 0.00 C ATOM 128 C VAL T 9 71.370 -11.867 -5.151 1.00 0.00 C ATOM 129 O VAL T 9 71.735 -11.637 -6.304 1.00 0.00 O ATOM 130 CB VAL T 9 73.348 -12.000 -3.634 1.00 0.00 C ATOM 131 CG1 VAL T 9 74.279 -11.995 -4.848 1.00 0.00 C ATOM 132 CG2 VAL T 9 74.056 -11.342 -2.448 1.00 0.00 C ATOM 0 H VAL T 9 71.563 -11.659 -1.978 1.00 0.00 H new ATOM 0 HA VAL T 9 72.338 -10.193 -4.230 1.00 0.00 H new ATOM 0 HB VAL T 9 73.087 -13.027 -3.379 1.00 0.00 H new ATOM 0 HG11 VAL T 9 75.186 -12.553 -4.613 1.00 0.00 H new ATOM 0 HG12 VAL T 9 73.775 -12.461 -5.695 1.00 0.00 H new ATOM 0 HG13 VAL T 9 74.540 -10.968 -5.102 1.00 0.00 H new ATOM 0 HG21 VAL T 9 74.963 -11.899 -2.211 1.00 0.00 H new ATOM 0 HG22 VAL T 9 74.317 -10.315 -2.704 1.00 0.00 H new ATOM 0 HG23 VAL T 9 73.393 -11.342 -1.583 1.00 0.00 H new ATOM 142 N GLU T 10 70.361 -12.680 -4.860 1.00 0.00 N ATOM 143 CA GLU T 10 69.611 -13.358 -5.911 1.00 0.00 C ATOM 144 C GLU T 10 68.615 -12.404 -6.563 1.00 0.00 C ATOM 145 O GLU T 10 68.227 -12.588 -7.716 1.00 0.00 O ATOM 146 CB GLU T 10 68.862 -14.558 -5.327 1.00 0.00 C ATOM 147 CG GLU T 10 69.864 -15.654 -4.959 1.00 0.00 C ATOM 148 CD GLU T 10 70.381 -16.334 -6.222 1.00 0.00 C ATOM 149 OE1 GLU T 10 69.930 -15.968 -7.295 1.00 0.00 O ATOM 150 OE2 GLU T 10 71.220 -17.210 -6.098 1.00 0.00 O ATOM 0 H GLU T 10 70.045 -12.885 -3.912 1.00 0.00 H new ATOM 0 HA GLU T 10 70.316 -13.702 -6.668 1.00 0.00 H new ATOM 0 HB2 GLU T 10 68.298 -14.254 -4.445 1.00 0.00 H new ATOM 0 HB3 GLU T 10 68.141 -14.938 -6.051 1.00 0.00 H new ATOM 0 HG2 GLU T 10 70.696 -15.225 -4.401 1.00 0.00 H new ATOM 0 HG3 GLU T 10 69.389 -16.389 -4.309 1.00 0.00 H new ATOM 157 N GLN T 11 68.204 -11.384 -5.815 1.00 0.00 N ATOM 158 CA GLN T 11 67.252 -10.407 -6.331 1.00 0.00 C ATOM 159 C GLN T 11 67.938 -9.452 -7.303 1.00 0.00 C ATOM 160 O GLN T 11 67.282 -8.811 -8.124 1.00 0.00 O ATOM 161 CB GLN T 11 66.643 -9.611 -5.176 1.00 0.00 C ATOM 162 CG GLN T 11 65.904 -10.562 -4.234 1.00 0.00 C ATOM 163 CD GLN T 11 65.321 -9.784 -3.059 1.00 0.00 C ATOM 164 OE1 GLN T 11 65.329 -8.553 -3.063 1.00 0.00 O ATOM 165 NE2 GLN T 11 64.814 -10.432 -2.046 1.00 0.00 N ATOM 0 H GLN T 11 68.512 -11.214 -4.858 1.00 0.00 H new ATOM 0 HA GLN T 11 66.463 -10.941 -6.860 1.00 0.00 H new ATOM 0 HB2 GLN T 11 67.426 -9.080 -4.634 1.00 0.00 H new ATOM 0 HB3 GLN T 11 65.956 -8.858 -5.562 1.00 0.00 H new ATOM 0 HG2 GLN T 11 65.107 -11.074 -4.773 1.00 0.00 H new ATOM 0 HG3 GLN T 11 66.587 -11.330 -3.870 1.00 0.00 H new ATOM 0 HE21 GLN T 11 64.808 -11.452 -2.044 1.00 0.00 H new ATOM 0 HE22 GLN T 11 64.424 -9.918 -1.256 1.00 0.00 H new ATOM 174 N LEU T 12 69.260 -9.363 -7.205 1.00 0.00 N ATOM 175 CA LEU T 12 70.024 -8.483 -8.081 1.00 0.00 C ATOM 176 C LEU T 12 70.168 -9.101 -9.469 1.00 0.00 C ATOM 177 O LEU T 12 70.747 -10.177 -9.622 1.00 0.00 O ATOM 178 CB LEU T 12 71.410 -8.225 -7.485 1.00 0.00 C ATOM 179 CG LEU T 12 71.285 -7.983 -5.978 1.00 0.00 C ATOM 180 CD1 LEU T 12 72.663 -7.657 -5.399 1.00 0.00 C ATOM 181 CD2 LEU T 12 70.333 -6.808 -5.726 1.00 0.00 C ATOM 0 H LEU T 12 69.821 -9.886 -6.533 1.00 0.00 H new ATOM 0 HA LEU T 12 69.489 -7.538 -8.172 1.00 0.00 H new ATOM 0 HB2 LEU T 12 72.062 -9.078 -7.674 1.00 0.00 H new ATOM 0 HB3 LEU T 12 71.868 -7.361 -7.965 1.00 0.00 H new ATOM 0 HG LEU T 12 70.891 -8.878 -5.497 1.00 0.00 H new ATOM 0 HD11 LEU T 12 72.575 -7.484 -4.326 1.00 0.00 H new ATOM 0 HD12 LEU T 12 73.340 -8.492 -5.578 1.00 0.00 H new ATOM 0 HD13 LEU T 12 73.057 -6.761 -5.879 1.00 0.00 H new ATOM 0 HD21 LEU T 12 70.244 -6.636 -4.653 1.00 0.00 H new ATOM 0 HD22 LEU T 12 70.726 -5.912 -6.206 1.00 0.00 H new ATOM 0 HD23 LEU T 12 69.351 -7.040 -6.139 1.00 0.00 H new ATOM 193 N THR T 13 69.641 -8.412 -10.475 1.00 0.00 N ATOM 194 CA THR T 13 69.716 -8.901 -11.847 1.00 0.00 C ATOM 195 C THR T 13 71.174 -8.991 -12.300 1.00 0.00 C ATOM 196 O THR T 13 72.004 -9.601 -11.626 1.00 0.00 O ATOM 197 CB THR T 13 68.930 -7.966 -12.774 1.00 0.00 C ATOM 198 OG1 THR T 13 67.716 -7.589 -12.138 1.00 0.00 O ATOM 199 CG2 THR T 13 68.612 -8.678 -14.093 1.00 0.00 C ATOM 0 H THR T 13 69.160 -7.519 -10.368 1.00 0.00 H new ATOM 0 HA THR T 13 69.278 -9.898 -11.892 1.00 0.00 H new ATOM 0 HB THR T 13 69.531 -7.081 -12.983 1.00 0.00 H new ATOM 0 HG1 THR T 13 67.211 -6.990 -12.726 1.00 0.00 H new ATOM 0 HG21 THR T 13 68.054 -8.005 -14.744 1.00 0.00 H new ATOM 0 HG22 THR T 13 69.541 -8.969 -14.583 1.00 0.00 H new ATOM 0 HG23 THR T 13 68.014 -9.567 -13.892 1.00 0.00 H new ATOM 207 N GLU T 14 71.482 -8.380 -13.445 1.00 0.00 N ATOM 208 CA GLU T 14 72.844 -8.394 -13.982 1.00 0.00 C ATOM 209 C GLU T 14 73.200 -7.028 -14.558 1.00 0.00 C ATOM 210 O GLU T 14 74.357 -6.609 -14.517 1.00 0.00 O ATOM 211 CB GLU T 14 72.961 -9.457 -15.077 1.00 0.00 C ATOM 212 CG GLU T 14 72.963 -10.849 -14.441 1.00 0.00 C ATOM 213 CD GLU T 14 73.056 -11.917 -15.526 1.00 0.00 C ATOM 214 OE1 GLU T 14 72.295 -11.837 -16.475 1.00 0.00 O ATOM 215 OE2 GLU T 14 73.889 -12.798 -15.390 1.00 0.00 O ATOM 0 H GLU T 14 70.809 -7.870 -14.017 1.00 0.00 H new ATOM 0 HA GLU T 14 73.535 -8.629 -13.173 1.00 0.00 H new ATOM 0 HB2 GLU T 14 72.130 -9.367 -15.776 1.00 0.00 H new ATOM 0 HB3 GLU T 14 73.877 -9.306 -15.649 1.00 0.00 H new ATOM 0 HG2 GLU T 14 73.804 -10.943 -13.754 1.00 0.00 H new ATOM 0 HG3 GLU T 14 72.055 -10.992 -13.855 1.00 0.00 H new ATOM 222 N GLU T 15 72.198 -6.337 -15.091 1.00 0.00 N ATOM 223 CA GLU T 15 72.417 -5.016 -15.668 1.00 0.00 C ATOM 224 C GLU T 15 72.786 -4.015 -14.580 1.00 0.00 C ATOM 225 O GLU T 15 73.570 -3.093 -14.810 1.00 0.00 O ATOM 226 CB GLU T 15 71.154 -4.546 -16.392 1.00 0.00 C ATOM 227 CG GLU T 15 70.604 -5.686 -17.252 1.00 0.00 C ATOM 228 CD GLU T 15 69.378 -5.212 -18.024 1.00 0.00 C ATOM 229 OE1 GLU T 15 68.511 -4.612 -17.411 1.00 0.00 O ATOM 230 OE2 GLU T 15 69.324 -5.457 -19.218 1.00 0.00 O ATOM 0 H GLU T 15 71.234 -6.666 -15.135 1.00 0.00 H new ATOM 0 HA GLU T 15 73.239 -5.081 -16.381 1.00 0.00 H new ATOM 0 HB2 GLU T 15 70.404 -4.228 -15.668 1.00 0.00 H new ATOM 0 HB3 GLU T 15 71.380 -3.682 -17.017 1.00 0.00 H new ATOM 0 HG2 GLU T 15 71.370 -6.031 -17.946 1.00 0.00 H new ATOM 0 HG3 GLU T 15 70.341 -6.535 -16.621 1.00 0.00 H new ATOM 237 N GLN T 16 72.219 -4.204 -13.392 1.00 0.00 N ATOM 238 CA GLN T 16 72.497 -3.314 -12.271 1.00 0.00 C ATOM 239 C GLN T 16 73.835 -3.665 -11.630 1.00 0.00 C ATOM 240 O GLN T 16 74.347 -2.922 -10.793 1.00 0.00 O ATOM 241 CB GLN T 16 71.380 -3.418 -11.227 1.00 0.00 C ATOM 242 CG GLN T 16 71.251 -4.868 -10.740 1.00 0.00 C ATOM 243 CD GLN T 16 72.332 -5.178 -9.708 1.00 0.00 C ATOM 244 OE1 GLN T 16 72.989 -6.215 -9.789 1.00 0.00 O ATOM 245 NE2 GLN T 16 72.555 -4.335 -8.737 1.00 0.00 N ATOM 0 H GLN T 16 71.568 -4.961 -13.182 1.00 0.00 H new ATOM 0 HA GLN T 16 72.544 -2.292 -12.646 1.00 0.00 H new ATOM 0 HB2 GLN T 16 71.596 -2.761 -10.385 1.00 0.00 H new ATOM 0 HB3 GLN T 16 70.436 -3.085 -11.658 1.00 0.00 H new ATOM 0 HG2 GLN T 16 70.265 -5.026 -10.303 1.00 0.00 H new ATOM 0 HG3 GLN T 16 71.338 -5.552 -11.585 1.00 0.00 H new ATOM 0 HE21 GLN T 16 72.009 -3.476 -8.672 1.00 0.00 H new ATOM 0 HE22 GLN T 16 73.275 -4.535 -8.043 1.00 0.00 H new ATOM 254 N LYS T 17 74.397 -4.802 -12.030 1.00 0.00 N ATOM 255 CA LYS T 17 75.678 -5.247 -11.492 1.00 0.00 C ATOM 256 C LYS T 17 76.832 -4.573 -12.227 1.00 0.00 C ATOM 257 O LYS T 17 77.982 -4.637 -11.793 1.00 0.00 O ATOM 258 CB LYS T 17 75.797 -6.766 -11.632 1.00 0.00 C ATOM 259 CG LYS T 17 76.971 -7.274 -10.791 1.00 0.00 C ATOM 260 CD LYS T 17 76.967 -8.803 -10.785 1.00 0.00 C ATOM 261 CE LYS T 17 78.051 -9.314 -9.834 1.00 0.00 C ATOM 262 NZ LYS T 17 77.952 -10.796 -9.718 1.00 0.00 N ATOM 0 H LYS T 17 73.987 -5.430 -12.722 1.00 0.00 H new ATOM 0 HA LYS T 17 75.727 -4.972 -10.438 1.00 0.00 H new ATOM 0 HB2 LYS T 17 74.872 -7.244 -11.308 1.00 0.00 H new ATOM 0 HB3 LYS T 17 75.945 -7.033 -12.678 1.00 0.00 H new ATOM 0 HG2 LYS T 17 77.912 -6.903 -11.198 1.00 0.00 H new ATOM 0 HG3 LYS T 17 76.894 -6.895 -9.772 1.00 0.00 H new ATOM 0 HD2 LYS T 17 75.991 -9.173 -10.472 1.00 0.00 H new ATOM 0 HD3 LYS T 17 77.144 -9.181 -11.792 1.00 0.00 H new ATOM 0 HE2 LYS T 17 79.037 -9.033 -10.204 1.00 0.00 H new ATOM 0 HE3 LYS T 17 77.936 -8.853 -8.853 1.00 0.00 H new ATOM 0 HZ1 LYS T 17 78.689 -11.144 -9.072 1.00 0.00 H new ATOM 0 HZ2 LYS T 17 77.016 -11.053 -9.346 1.00 0.00 H new ATOM 0 HZ3 LYS T 17 78.082 -11.227 -10.655 1.00 0.00 H new ATOM 276 N ASN T 18 76.517 -3.928 -13.346 1.00 0.00 N ATOM 277 CA ASN T 18 77.536 -3.248 -14.138 1.00 0.00 C ATOM 278 C ASN T 18 78.096 -2.043 -13.387 1.00 0.00 C ATOM 279 O ASN T 18 79.279 -2.007 -13.046 1.00 0.00 O ATOM 280 CB ASN T 18 76.938 -2.787 -15.469 1.00 0.00 C ATOM 281 CG ASN T 18 76.672 -3.991 -16.367 1.00 0.00 C ATOM 282 OD1 ASN T 18 76.888 -3.923 -17.577 1.00 0.00 O ATOM 283 ND2 ASN T 18 76.211 -5.095 -15.845 1.00 0.00 N ATOM 0 H ASN T 18 75.571 -3.862 -13.723 1.00 0.00 H new ATOM 0 HA ASN T 18 78.348 -3.950 -14.324 1.00 0.00 H new ATOM 0 HB2 ASN T 18 76.010 -2.244 -15.291 1.00 0.00 H new ATOM 0 HB3 ASN T 18 77.621 -2.097 -15.965 1.00 0.00 H new ATOM 0 HD21 ASN T 18 76.029 -5.903 -16.440 1.00 0.00 H new ATOM 0 HD22 ASN T 18 76.033 -5.149 -14.842 1.00 0.00 H new ATOM 290 N GLU T 19 77.241 -1.054 -13.139 1.00 0.00 N ATOM 291 CA GLU T 19 77.660 0.157 -12.434 1.00 0.00 C ATOM 292 C GLU T 19 78.603 -0.179 -11.278 1.00 0.00 C ATOM 293 O GLU T 19 79.609 0.501 -11.072 1.00 0.00 O ATOM 294 CB GLU T 19 76.428 0.912 -11.905 1.00 0.00 C ATOM 295 CG GLU T 19 75.375 -0.084 -11.391 1.00 0.00 C ATOM 296 CD GLU T 19 74.521 -0.599 -12.548 1.00 0.00 C ATOM 297 OE1 GLU T 19 73.597 0.101 -12.932 1.00 0.00 O ATOM 298 OE2 GLU T 19 74.803 -1.682 -13.032 1.00 0.00 O ATOM 0 H GLU T 19 76.259 -1.066 -13.414 1.00 0.00 H new ATOM 0 HA GLU T 19 78.197 0.792 -13.139 1.00 0.00 H new ATOM 0 HB2 GLU T 19 76.723 1.587 -11.102 1.00 0.00 H new ATOM 0 HB3 GLU T 19 76.001 1.527 -12.697 1.00 0.00 H new ATOM 0 HG2 GLU T 19 75.868 -0.920 -10.894 1.00 0.00 H new ATOM 0 HG3 GLU T 19 74.740 0.399 -10.649 1.00 0.00 H new ATOM 305 N PHE T 20 78.277 -1.225 -10.524 1.00 0.00 N ATOM 306 CA PHE T 20 79.112 -1.624 -9.396 1.00 0.00 C ATOM 307 C PHE T 20 80.498 -2.041 -9.880 1.00 0.00 C ATOM 308 O PHE T 20 81.490 -1.367 -9.599 1.00 0.00 O ATOM 309 CB PHE T 20 78.453 -2.785 -8.637 1.00 0.00 C ATOM 310 CG PHE T 20 77.322 -2.256 -7.779 1.00 0.00 C ATOM 311 CD1 PHE T 20 77.606 -1.448 -6.672 1.00 0.00 C ATOM 312 CD2 PHE T 20 75.994 -2.575 -8.089 1.00 0.00 C ATOM 313 CE1 PHE T 20 76.563 -0.957 -5.877 1.00 0.00 C ATOM 314 CE2 PHE T 20 74.952 -2.085 -7.293 1.00 0.00 C ATOM 315 CZ PHE T 20 75.237 -1.276 -6.187 1.00 0.00 C ATOM 0 H PHE T 20 77.451 -1.805 -10.671 1.00 0.00 H new ATOM 0 HA PHE T 20 79.217 -0.772 -8.724 1.00 0.00 H new ATOM 0 HB2 PHE T 20 78.073 -3.524 -9.342 1.00 0.00 H new ATOM 0 HB3 PHE T 20 79.191 -3.290 -8.013 1.00 0.00 H new ATOM 0 HD1 PHE T 20 78.630 -1.203 -6.431 1.00 0.00 H new ATOM 0 HD2 PHE T 20 75.774 -3.199 -8.942 1.00 0.00 H new ATOM 0 HE1 PHE T 20 76.783 -0.332 -5.024 1.00 0.00 H new ATOM 0 HE2 PHE T 20 73.928 -2.331 -7.532 1.00 0.00 H new ATOM 0 HZ PHE T 20 74.433 -0.898 -5.573 1.00 0.00 H new ATOM 325 N LYS T 21 80.562 -3.151 -10.608 1.00 0.00 N ATOM 326 CA LYS T 21 81.837 -3.639 -11.124 1.00 0.00 C ATOM 327 C LYS T 21 82.624 -2.499 -11.762 1.00 0.00 C ATOM 328 O LYS T 21 83.849 -2.441 -11.654 1.00 0.00 O ATOM 329 CB LYS T 21 81.597 -4.739 -12.161 1.00 0.00 C ATOM 330 CG LYS T 21 80.996 -5.971 -11.479 1.00 0.00 C ATOM 331 CD LYS T 21 81.069 -7.171 -12.429 1.00 0.00 C ATOM 332 CE LYS T 21 80.416 -6.814 -13.767 1.00 0.00 C ATOM 333 NZ LYS T 21 80.094 -8.064 -14.510 1.00 0.00 N ATOM 0 H LYS T 21 79.755 -3.725 -10.852 1.00 0.00 H new ATOM 0 HA LYS T 21 82.413 -4.046 -10.293 1.00 0.00 H new ATOM 0 HB2 LYS T 21 80.924 -4.378 -12.939 1.00 0.00 H new ATOM 0 HB3 LYS T 21 82.535 -5.003 -12.649 1.00 0.00 H new ATOM 0 HG2 LYS T 21 81.537 -6.190 -10.558 1.00 0.00 H new ATOM 0 HG3 LYS T 21 79.960 -5.776 -11.201 1.00 0.00 H new ATOM 0 HD2 LYS T 21 82.108 -7.459 -12.587 1.00 0.00 H new ATOM 0 HD3 LYS T 21 80.564 -8.029 -11.985 1.00 0.00 H new ATOM 0 HE2 LYS T 21 79.508 -6.234 -13.598 1.00 0.00 H new ATOM 0 HE3 LYS T 21 81.087 -6.190 -14.357 1.00 0.00 H new ATOM 0 HZ1 LYS T 21 79.650 -7.823 -15.419 1.00 0.00 H new ATOM 0 HZ2 LYS T 21 80.968 -8.600 -14.683 1.00 0.00 H new ATOM 0 HZ3 LYS T 21 79.438 -8.643 -13.948 1.00 0.00 H new ATOM 347 N ALA T 22 81.912 -1.591 -12.421 1.00 0.00 N ATOM 348 CA ALA T 22 82.556 -0.454 -13.067 1.00 0.00 C ATOM 349 C ALA T 22 83.138 0.491 -12.022 1.00 0.00 C ATOM 350 O ALA T 22 84.133 1.172 -12.272 1.00 0.00 O ATOM 351 CB ALA T 22 81.544 0.299 -13.933 1.00 0.00 C ATOM 0 H ALA T 22 80.897 -1.619 -12.521 1.00 0.00 H new ATOM 0 HA ALA T 22 83.364 -0.826 -13.697 1.00 0.00 H new ATOM 0 HB1 ALA T 22 82.034 1.147 -14.412 1.00 0.00 H new ATOM 0 HB2 ALA T 22 81.149 -0.371 -14.697 1.00 0.00 H new ATOM 0 HB3 ALA T 22 80.726 0.658 -13.308 1.00 0.00 H new ATOM 357 N ALA T 23 82.514 0.524 -10.849 1.00 0.00 N ATOM 358 CA ALA T 23 82.982 1.386 -9.771 1.00 0.00 C ATOM 359 C ALA T 23 84.394 0.994 -9.352 1.00 0.00 C ATOM 360 O ALA T 23 85.299 1.829 -9.326 1.00 0.00 O ATOM 361 CB ALA T 23 82.042 1.278 -8.569 1.00 0.00 C ATOM 0 H ALA T 23 81.689 -0.032 -10.622 1.00 0.00 H new ATOM 0 HA ALA T 23 82.992 2.415 -10.130 1.00 0.00 H new ATOM 0 HB1 ALA T 23 82.399 1.925 -7.768 1.00 0.00 H new ATOM 0 HB2 ALA T 23 81.038 1.585 -8.863 1.00 0.00 H new ATOM 0 HB3 ALA T 23 82.017 0.246 -8.218 1.00 0.00 H new ATOM 367 N PHE T 24 84.577 -0.283 -9.028 1.00 0.00 N ATOM 368 CA PHE T 24 85.887 -0.780 -8.614 1.00 0.00 C ATOM 369 C PHE T 24 86.981 -0.230 -9.524 1.00 0.00 C ATOM 370 O PHE T 24 87.963 0.345 -9.053 1.00 0.00 O ATOM 371 CB PHE T 24 85.905 -2.311 -8.660 1.00 0.00 C ATOM 372 CG PHE T 24 85.098 -2.864 -7.509 1.00 0.00 C ATOM 373 CD1 PHE T 24 83.702 -2.913 -7.593 1.00 0.00 C ATOM 374 CD2 PHE T 24 85.748 -3.331 -6.359 1.00 0.00 C ATOM 375 CE1 PHE T 24 82.955 -3.427 -6.527 1.00 0.00 C ATOM 376 CE2 PHE T 24 85.000 -3.845 -5.293 1.00 0.00 C ATOM 377 CZ PHE T 24 83.604 -3.894 -5.377 1.00 0.00 C ATOM 0 H PHE T 24 83.841 -0.989 -9.044 1.00 0.00 H new ATOM 0 HA PHE T 24 86.075 -0.445 -7.594 1.00 0.00 H new ATOM 0 HB2 PHE T 24 85.493 -2.661 -9.607 1.00 0.00 H new ATOM 0 HB3 PHE T 24 86.931 -2.674 -8.605 1.00 0.00 H new ATOM 0 HD1 PHE T 24 83.201 -2.554 -8.480 1.00 0.00 H new ATOM 0 HD2 PHE T 24 86.825 -3.294 -6.295 1.00 0.00 H new ATOM 0 HE1 PHE T 24 81.878 -3.464 -6.591 1.00 0.00 H new ATOM 0 HE2 PHE T 24 85.500 -4.204 -4.406 1.00 0.00 H new ATOM 0 HZ PHE T 24 83.027 -4.292 -4.555 1.00 0.00 H new ATOM 387 N ASP T 25 86.805 -0.409 -10.830 1.00 0.00 N ATOM 388 CA ASP T 25 87.785 0.074 -11.798 1.00 0.00 C ATOM 389 C ASP T 25 88.246 1.483 -11.439 1.00 0.00 C ATOM 390 O ASP T 25 89.380 1.869 -11.724 1.00 0.00 O ATOM 391 CB ASP T 25 87.174 0.077 -13.200 1.00 0.00 C ATOM 392 CG ASP T 25 86.748 -1.336 -13.586 1.00 0.00 C ATOM 393 OD1 ASP T 25 86.976 -2.238 -12.797 1.00 0.00 O ATOM 394 OD2 ASP T 25 86.200 -1.494 -14.664 1.00 0.00 O ATOM 0 H ASP T 25 85.999 -0.881 -11.240 1.00 0.00 H new ATOM 0 HA ASP T 25 88.647 -0.593 -11.778 1.00 0.00 H new ATOM 0 HB2 ASP T 25 86.314 0.746 -13.229 1.00 0.00 H new ATOM 0 HB3 ASP T 25 87.898 0.457 -13.921 1.00 0.00 H new ATOM 399 N ILE T 26 87.358 2.248 -10.810 1.00 0.00 N ATOM 400 CA ILE T 26 87.681 3.616 -10.413 1.00 0.00 C ATOM 401 C ILE T 26 88.474 3.623 -9.108 1.00 0.00 C ATOM 402 O ILE T 26 89.287 4.516 -8.870 1.00 0.00 O ATOM 403 CB ILE T 26 86.393 4.426 -10.235 1.00 0.00 C ATOM 404 CG1 ILE T 26 85.427 4.122 -11.389 1.00 0.00 C ATOM 405 CG2 ILE T 26 86.720 5.921 -10.224 1.00 0.00 C ATOM 406 CD1 ILE T 26 86.147 4.282 -12.732 1.00 0.00 C ATOM 0 H ILE T 26 86.415 1.947 -10.565 1.00 0.00 H new ATOM 0 HA ILE T 26 88.289 4.068 -11.196 1.00 0.00 H new ATOM 0 HB ILE T 26 85.926 4.151 -9.289 1.00 0.00 H new ATOM 0 HG12 ILE T 26 85.041 3.107 -11.293 1.00 0.00 H new ATOM 0 HG13 ILE T 26 84.571 4.795 -11.344 1.00 0.00 H new ATOM 0 HG21 ILE T 26 85.801 6.493 -10.097 1.00 0.00 H new ATOM 0 HG22 ILE T 26 87.400 6.139 -9.400 1.00 0.00 H new ATOM 0 HG23 ILE T 26 87.192 6.197 -11.167 1.00 0.00 H new ATOM 0 HD11 ILE T 26 85.454 4.064 -13.545 1.00 0.00 H new ATOM 0 HD12 ILE T 26 86.511 5.305 -12.830 1.00 0.00 H new ATOM 0 HD13 ILE T 26 86.989 3.591 -12.778 1.00 0.00 H new ATOM 418 N PHE T 27 88.232 2.620 -8.267 1.00 0.00 N ATOM 419 CA PHE T 27 88.928 2.518 -6.987 1.00 0.00 C ATOM 420 C PHE T 27 90.271 1.815 -7.165 1.00 0.00 C ATOM 421 O PHE T 27 91.328 2.411 -6.952 1.00 0.00 O ATOM 422 CB PHE T 27 88.073 1.733 -5.988 1.00 0.00 C ATOM 423 CG PHE T 27 86.904 2.580 -5.544 1.00 0.00 C ATOM 424 CD1 PHE T 27 87.060 3.496 -4.497 1.00 0.00 C ATOM 425 CD2 PHE T 27 85.663 2.449 -6.178 1.00 0.00 C ATOM 426 CE1 PHE T 27 85.975 4.280 -4.085 1.00 0.00 C ATOM 427 CE2 PHE T 27 84.579 3.232 -5.767 1.00 0.00 C ATOM 428 CZ PHE T 27 84.736 4.149 -4.721 1.00 0.00 C ATOM 0 H PHE T 27 87.564 1.871 -8.447 1.00 0.00 H new ATOM 0 HA PHE T 27 89.101 3.525 -6.607 1.00 0.00 H new ATOM 0 HB2 PHE T 27 87.714 0.812 -6.447 1.00 0.00 H new ATOM 0 HB3 PHE T 27 88.675 1.446 -5.126 1.00 0.00 H new ATOM 0 HD1 PHE T 27 88.017 3.598 -4.007 1.00 0.00 H new ATOM 0 HD2 PHE T 27 85.542 1.742 -6.986 1.00 0.00 H new ATOM 0 HE1 PHE T 27 86.095 4.986 -3.276 1.00 0.00 H new ATOM 0 HE2 PHE T 27 83.622 3.129 -6.256 1.00 0.00 H new ATOM 0 HZ PHE T 27 83.900 4.756 -4.405 1.00 0.00 H new ATOM 438 N VAL T 28 90.221 0.544 -7.554 1.00 0.00 N ATOM 439 CA VAL T 28 91.439 -0.236 -7.754 1.00 0.00 C ATOM 440 C VAL T 28 92.074 0.091 -9.103 1.00 0.00 C ATOM 441 O VAL T 28 92.432 -0.808 -9.865 1.00 0.00 O ATOM 442 CB VAL T 28 91.118 -1.732 -7.683 1.00 0.00 C ATOM 443 CG1 VAL T 28 90.655 -2.087 -6.269 1.00 0.00 C ATOM 444 CG2 VAL T 28 90.001 -2.066 -8.676 1.00 0.00 C ATOM 0 H VAL T 28 89.356 0.035 -7.736 1.00 0.00 H new ATOM 0 HA VAL T 28 92.146 0.021 -6.965 1.00 0.00 H new ATOM 0 HB VAL T 28 92.012 -2.304 -7.933 1.00 0.00 H new ATOM 0 HG11 VAL T 28 90.426 -3.151 -6.218 1.00 0.00 H new ATOM 0 HG12 VAL T 28 91.446 -1.851 -5.557 1.00 0.00 H new ATOM 0 HG13 VAL T 28 89.762 -1.512 -6.023 1.00 0.00 H new ATOM 0 HG21 VAL T 28 89.774 -3.131 -8.624 1.00 0.00 H new ATOM 0 HG22 VAL T 28 89.109 -1.492 -8.426 1.00 0.00 H new ATOM 0 HG23 VAL T 28 90.324 -1.813 -9.686 1.00 0.00 H new ATOM 454 N LEU T 29 92.213 1.382 -9.392 1.00 0.00 N ATOM 455 CA LEU T 29 92.808 1.814 -10.654 1.00 0.00 C ATOM 456 C LEU T 29 94.333 1.718 -10.591 1.00 0.00 C ATOM 457 O LEU T 29 95.042 2.498 -11.226 1.00 0.00 O ATOM 458 CB LEU T 29 92.375 3.256 -10.980 1.00 0.00 C ATOM 459 CG LEU T 29 92.300 4.095 -9.698 1.00 0.00 C ATOM 460 CD1 LEU T 29 93.622 4.003 -8.931 1.00 0.00 C ATOM 461 CD2 LEU T 29 92.033 5.556 -10.069 1.00 0.00 C ATOM 0 H LEU T 29 91.925 2.142 -8.776 1.00 0.00 H new ATOM 0 HA LEU T 29 92.455 1.154 -11.447 1.00 0.00 H new ATOM 0 HB2 LEU T 29 93.083 3.706 -11.676 1.00 0.00 H new ATOM 0 HB3 LEU T 29 91.403 3.248 -11.474 1.00 0.00 H new ATOM 0 HG LEU T 29 91.495 3.716 -9.068 1.00 0.00 H new ATOM 0 HD11 LEU T 29 93.558 4.602 -8.023 1.00 0.00 H new ATOM 0 HD12 LEU T 29 93.818 2.964 -8.667 1.00 0.00 H new ATOM 0 HD13 LEU T 29 94.432 4.378 -9.556 1.00 0.00 H new ATOM 0 HD21 LEU T 29 91.979 6.158 -9.162 1.00 0.00 H new ATOM 0 HD22 LEU T 29 92.841 5.924 -10.701 1.00 0.00 H new ATOM 0 HD23 LEU T 29 91.089 5.628 -10.609 1.00 0.00 H new ATOM 473 N GLY T 30 94.830 0.755 -9.821 1.00 0.00 N ATOM 474 CA GLY T 30 96.271 0.569 -9.686 1.00 0.00 C ATOM 475 C GLY T 30 96.591 -0.492 -8.639 1.00 0.00 C ATOM 476 O GLY T 30 97.699 -1.029 -8.606 1.00 0.00 O ATOM 0 H GLY T 30 94.263 0.097 -9.286 1.00 0.00 H new ATOM 0 HA2 GLY T 30 96.695 0.276 -10.647 1.00 0.00 H new ATOM 0 HA3 GLY T 30 96.738 1.513 -9.406 1.00 0.00 H new ATOM 480 N ALA T 31 95.619 -0.790 -7.784 1.00 0.00 N ATOM 481 CA ALA T 31 95.814 -1.790 -6.740 1.00 0.00 C ATOM 482 C ALA T 31 96.172 -3.142 -7.350 1.00 0.00 C ATOM 483 O ALA T 31 95.588 -3.555 -8.352 1.00 0.00 O ATOM 484 CB ALA T 31 94.544 -1.925 -5.899 1.00 0.00 C ATOM 0 H ALA T 31 94.695 -0.358 -7.792 1.00 0.00 H new ATOM 0 HA ALA T 31 96.636 -1.464 -6.103 1.00 0.00 H new ATOM 0 HB1 ALA T 31 94.700 -2.674 -5.122 1.00 0.00 H new ATOM 0 HB2 ALA T 31 94.310 -0.966 -5.437 1.00 0.00 H new ATOM 0 HB3 ALA T 31 93.716 -2.231 -6.538 1.00 0.00 H new ATOM 490 N GLU T 32 97.134 -3.826 -6.740 1.00 0.00 N ATOM 491 CA GLU T 32 97.561 -5.131 -7.233 1.00 0.00 C ATOM 492 C GLU T 32 96.412 -6.131 -7.163 1.00 0.00 C ATOM 493 O GLU T 32 95.664 -6.300 -8.126 1.00 0.00 O ATOM 494 CB GLU T 32 98.737 -5.644 -6.400 1.00 0.00 C ATOM 495 CG GLU T 32 99.995 -4.843 -6.744 1.00 0.00 C ATOM 496 CD GLU T 32 101.144 -5.258 -5.830 1.00 0.00 C ATOM 497 OE1 GLU T 32 100.871 -5.867 -4.808 1.00 0.00 O ATOM 498 OE2 GLU T 32 102.278 -4.962 -6.165 1.00 0.00 O ATOM 0 H GLU T 32 97.630 -3.502 -5.910 1.00 0.00 H new ATOM 0 HA GLU T 32 97.872 -5.023 -8.272 1.00 0.00 H new ATOM 0 HB2 GLU T 32 98.512 -5.550 -5.338 1.00 0.00 H new ATOM 0 HB3 GLU T 32 98.902 -6.703 -6.598 1.00 0.00 H new ATOM 0 HG2 GLU T 32 100.269 -5.010 -7.786 1.00 0.00 H new ATOM 0 HG3 GLU T 32 99.799 -3.777 -6.634 1.00 0.00 H new ATOM 505 N ASP T 33 96.276 -6.791 -6.017 1.00 0.00 N ATOM 506 CA ASP T 33 95.212 -7.772 -5.835 1.00 0.00 C ATOM 507 C ASP T 33 93.867 -7.184 -6.249 1.00 0.00 C ATOM 508 O ASP T 33 93.316 -7.544 -7.289 1.00 0.00 O ATOM 509 CB ASP T 33 95.154 -8.214 -4.370 1.00 0.00 C ATOM 510 CG ASP T 33 95.244 -6.999 -3.453 1.00 0.00 C ATOM 511 OD1 ASP T 33 96.315 -6.420 -3.373 1.00 0.00 O ATOM 512 OD2 ASP T 33 94.241 -6.665 -2.845 1.00 0.00 O ATOM 0 H ASP T 33 96.883 -6.666 -5.207 1.00 0.00 H new ATOM 0 HA ASP T 33 95.426 -8.636 -6.464 1.00 0.00 H new ATOM 0 HB2 ASP T 33 94.226 -8.754 -4.181 1.00 0.00 H new ATOM 0 HB3 ASP T 33 95.972 -8.902 -4.157 1.00 0.00 H new ATOM 517 N GLY T 34 93.343 -6.277 -5.430 1.00 0.00 N ATOM 518 CA GLY T 34 92.062 -5.644 -5.723 1.00 0.00 C ATOM 519 C GLY T 34 91.428 -5.081 -4.455 1.00 0.00 C ATOM 520 O GLY T 34 90.205 -5.006 -4.342 1.00 0.00 O ATOM 0 H GLY T 34 93.782 -5.966 -4.564 1.00 0.00 H new ATOM 0 HA2 GLY T 34 92.205 -4.843 -6.449 1.00 0.00 H new ATOM 0 HA3 GLY T 34 91.389 -6.370 -6.179 1.00 0.00 H new ATOM 524 N SER T 35 92.270 -4.687 -3.502 1.00 0.00 N ATOM 525 CA SER T 35 91.785 -4.130 -2.241 1.00 0.00 C ATOM 526 C SER T 35 91.552 -2.629 -2.369 1.00 0.00 C ATOM 527 O SER T 35 92.097 -1.980 -3.262 1.00 0.00 O ATOM 528 CB SER T 35 92.801 -4.395 -1.130 1.00 0.00 C ATOM 529 OG SER T 35 94.024 -3.745 -1.448 1.00 0.00 O ATOM 0 H SER T 35 93.286 -4.742 -3.578 1.00 0.00 H new ATOM 0 HA SER T 35 90.839 -4.612 -1.994 1.00 0.00 H new ATOM 0 HB2 SER T 35 92.419 -4.030 -0.177 1.00 0.00 H new ATOM 0 HB3 SER T 35 92.964 -5.467 -1.018 1.00 0.00 H new ATOM 0 HG SER T 35 94.677 -3.911 -0.737 1.00 0.00 H new ATOM 535 N ILE T 36 90.734 -2.079 -1.469 1.00 0.00 N ATOM 536 CA ILE T 36 90.426 -0.647 -1.481 1.00 0.00 C ATOM 537 C ILE T 36 90.539 -0.065 -0.076 1.00 0.00 C ATOM 538 O ILE T 36 89.561 -0.023 0.670 1.00 0.00 O ATOM 539 CB ILE T 36 89.007 -0.423 -2.009 1.00 0.00 C ATOM 540 CG1 ILE T 36 88.884 -1.032 -3.408 1.00 0.00 C ATOM 541 CG2 ILE T 36 88.719 1.078 -2.079 1.00 0.00 C ATOM 542 CD1 ILE T 36 87.423 -0.987 -3.862 1.00 0.00 C ATOM 0 H ILE T 36 90.274 -2.602 -0.724 1.00 0.00 H new ATOM 0 HA ILE T 36 91.142 -0.146 -2.132 1.00 0.00 H new ATOM 0 HB ILE T 36 88.290 -0.899 -1.340 1.00 0.00 H new ATOM 0 HG12 ILE T 36 89.511 -0.483 -4.111 1.00 0.00 H new ATOM 0 HG13 ILE T 36 89.241 -2.062 -3.400 1.00 0.00 H new ATOM 0 HG21 ILE T 36 87.708 1.237 -2.455 1.00 0.00 H new ATOM 0 HG22 ILE T 36 88.808 1.512 -1.083 1.00 0.00 H new ATOM 0 HG23 ILE T 36 89.435 1.555 -2.749 1.00 0.00 H new ATOM 0 HD11 ILE T 36 87.338 -1.421 -4.858 1.00 0.00 H new ATOM 0 HD12 ILE T 36 86.808 -1.556 -3.165 1.00 0.00 H new ATOM 0 HD13 ILE T 36 87.081 0.048 -3.887 1.00 0.00 H new ATOM 554 N SER T 37 91.739 0.386 0.279 1.00 0.00 N ATOM 555 CA SER T 37 91.971 0.968 1.597 1.00 0.00 C ATOM 556 C SER T 37 91.549 2.434 1.615 1.00 0.00 C ATOM 557 O SER T 37 90.764 2.875 0.777 1.00 0.00 O ATOM 558 CB SER T 37 93.450 0.857 1.964 1.00 0.00 C ATOM 559 OG SER T 37 93.633 1.270 3.311 1.00 0.00 O ATOM 0 H SER T 37 92.561 0.360 -0.324 1.00 0.00 H new ATOM 0 HA SER T 37 91.375 0.420 2.326 1.00 0.00 H new ATOM 0 HB2 SER T 37 93.792 -0.170 1.837 1.00 0.00 H new ATOM 0 HB3 SER T 37 94.049 1.477 1.297 1.00 0.00 H new ATOM 0 HG SER T 37 94.352 1.934 3.355 1.00 0.00 H new ATOM 565 N THR T 38 92.079 3.184 2.577 1.00 0.00 N ATOM 566 CA THR T 38 91.752 4.601 2.696 1.00 0.00 C ATOM 567 C THR T 38 92.564 5.426 1.701 1.00 0.00 C ATOM 568 O THR T 38 92.411 6.644 1.619 1.00 0.00 O ATOM 569 CB THR T 38 92.042 5.085 4.117 1.00 0.00 C ATOM 570 OG1 THR T 38 93.447 5.181 4.306 1.00 0.00 O ATOM 571 CG2 THR T 38 91.458 4.094 5.125 1.00 0.00 C ATOM 0 H THR T 38 92.732 2.838 3.280 1.00 0.00 H new ATOM 0 HA THR T 38 90.692 4.729 2.476 1.00 0.00 H new ATOM 0 HB THR T 38 91.587 6.064 4.267 1.00 0.00 H new ATOM 0 HG1 THR T 38 93.640 5.337 5.254 1.00 0.00 H new ATOM 0 HG21 THR T 38 91.665 4.440 6.138 1.00 0.00 H new ATOM 0 HG22 THR T 38 90.380 4.020 4.980 1.00 0.00 H new ATOM 0 HG23 THR T 38 91.912 3.114 4.977 1.00 0.00 H new ATOM 579 N LYS T 39 93.430 4.752 0.948 1.00 0.00 N ATOM 580 CA LYS T 39 94.265 5.431 -0.039 1.00 0.00 C ATOM 581 C LYS T 39 93.507 5.624 -1.349 1.00 0.00 C ATOM 582 O LYS T 39 93.415 6.737 -1.865 1.00 0.00 O ATOM 583 CB LYS T 39 95.532 4.612 -0.299 1.00 0.00 C ATOM 584 CG LYS T 39 96.393 4.586 0.965 1.00 0.00 C ATOM 585 CD LYS T 39 97.645 3.742 0.712 1.00 0.00 C ATOM 586 CE LYS T 39 98.616 3.906 1.883 1.00 0.00 C ATOM 587 NZ LYS T 39 99.890 3.197 1.574 1.00 0.00 N ATOM 0 H LYS T 39 93.571 3.743 1.002 1.00 0.00 H new ATOM 0 HA LYS T 39 94.535 6.410 0.356 1.00 0.00 H new ATOM 0 HB2 LYS T 39 95.267 3.596 -0.592 1.00 0.00 H new ATOM 0 HB3 LYS T 39 96.095 5.046 -1.126 1.00 0.00 H new ATOM 0 HG2 LYS T 39 96.676 5.600 1.246 1.00 0.00 H new ATOM 0 HG3 LYS T 39 95.824 4.172 1.797 1.00 0.00 H new ATOM 0 HD2 LYS T 39 97.372 2.693 0.596 1.00 0.00 H new ATOM 0 HD3 LYS T 39 98.124 4.051 -0.217 1.00 0.00 H new ATOM 0 HE2 LYS T 39 98.810 4.963 2.063 1.00 0.00 H new ATOM 0 HE3 LYS T 39 98.175 3.503 2.795 1.00 0.00 H new ATOM 0 HZ1 LYS T 39 100.551 3.308 2.369 1.00 0.00 H new ATOM 0 HZ2 LYS T 39 99.697 2.186 1.423 1.00 0.00 H new ATOM 0 HZ3 LYS T 39 100.313 3.601 0.714 1.00 0.00 H new ATOM 601 N GLU T 40 92.970 4.532 -1.884 1.00 0.00 N ATOM 602 CA GLU T 40 92.226 4.592 -3.138 1.00 0.00 C ATOM 603 C GLU T 40 90.810 5.107 -2.903 1.00 0.00 C ATOM 604 O GLU T 40 90.011 5.200 -3.834 1.00 0.00 O ATOM 605 CB GLU T 40 92.162 3.202 -3.774 1.00 0.00 C ATOM 606 CG GLU T 40 93.581 2.687 -4.022 1.00 0.00 C ATOM 607 CD GLU T 40 94.274 3.550 -5.071 1.00 0.00 C ATOM 608 OE1 GLU T 40 93.584 4.066 -5.934 1.00 0.00 O ATOM 609 OE2 GLU T 40 95.484 3.682 -4.995 1.00 0.00 O ATOM 0 H GLU T 40 93.035 3.601 -1.473 1.00 0.00 H new ATOM 0 HA GLU T 40 92.743 5.279 -3.809 1.00 0.00 H new ATOM 0 HB2 GLU T 40 91.624 2.516 -3.120 1.00 0.00 H new ATOM 0 HB3 GLU T 40 91.610 3.245 -4.713 1.00 0.00 H new ATOM 0 HG2 GLU T 40 94.150 2.703 -3.092 1.00 0.00 H new ATOM 0 HG3 GLU T 40 93.547 1.650 -4.357 1.00 0.00 H new ATOM 616 N LEU T 41 90.504 5.440 -1.653 1.00 0.00 N ATOM 617 CA LEU T 41 89.178 5.943 -1.307 1.00 0.00 C ATOM 618 C LEU T 41 89.060 7.422 -1.674 1.00 0.00 C ATOM 619 O LEU T 41 88.286 7.794 -2.556 1.00 0.00 O ATOM 620 CB LEU T 41 88.931 5.748 0.201 1.00 0.00 C ATOM 621 CG LEU T 41 87.424 5.639 0.510 1.00 0.00 C ATOM 622 CD1 LEU T 41 86.670 6.814 -0.124 1.00 0.00 C ATOM 623 CD2 LEU T 41 86.851 4.307 -0.019 1.00 0.00 C ATOM 0 H LEU T 41 91.151 5.372 -0.867 1.00 0.00 H new ATOM 0 HA LEU T 41 88.427 5.387 -1.869 1.00 0.00 H new ATOM 0 HB2 LEU T 41 89.441 4.847 0.542 1.00 0.00 H new ATOM 0 HB3 LEU T 41 89.359 6.585 0.753 1.00 0.00 H new ATOM 0 HG LEU T 41 87.295 5.668 1.592 1.00 0.00 H new ATOM 0 HD11 LEU T 41 85.607 6.727 0.100 1.00 0.00 H new ATOM 0 HD12 LEU T 41 87.051 7.752 0.281 1.00 0.00 H new ATOM 0 HD13 LEU T 41 86.815 6.799 -1.204 1.00 0.00 H new ATOM 0 HD21 LEU T 41 85.787 4.252 0.210 1.00 0.00 H new ATOM 0 HD22 LEU T 41 86.993 4.253 -1.098 1.00 0.00 H new ATOM 0 HD23 LEU T 41 87.368 3.474 0.457 1.00 0.00 H new ATOM 635 N GLY T 42 89.830 8.259 -0.985 1.00 0.00 N ATOM 636 CA GLY T 42 89.804 9.696 -1.238 1.00 0.00 C ATOM 637 C GLY T 42 89.853 9.997 -2.732 1.00 0.00 C ATOM 638 O GLY T 42 89.111 10.845 -3.228 1.00 0.00 O ATOM 0 H GLY T 42 90.476 7.969 -0.251 1.00 0.00 H new ATOM 0 HA2 GLY T 42 88.900 10.127 -0.808 1.00 0.00 H new ATOM 0 HA3 GLY T 42 90.651 10.170 -0.741 1.00 0.00 H new ATOM 642 N LYS T 43 90.734 9.303 -3.445 1.00 0.00 N ATOM 643 CA LYS T 43 90.875 9.510 -4.883 1.00 0.00 C ATOM 644 C LYS T 43 89.507 9.599 -5.556 1.00 0.00 C ATOM 645 O LYS T 43 89.275 10.471 -6.395 1.00 0.00 O ATOM 646 CB LYS T 43 91.674 8.361 -5.502 1.00 0.00 C ATOM 647 CG LYS T 43 93.115 8.400 -4.986 1.00 0.00 C ATOM 648 CD LYS T 43 93.977 7.441 -5.809 1.00 0.00 C ATOM 649 CE LYS T 43 95.444 7.595 -5.402 1.00 0.00 C ATOM 650 NZ LYS T 43 96.275 6.620 -6.161 1.00 0.00 N ATOM 0 H LYS T 43 91.358 8.597 -3.054 1.00 0.00 H new ATOM 0 HA LYS T 43 91.405 10.450 -5.041 1.00 0.00 H new ATOM 0 HB2 LYS T 43 91.212 7.406 -5.249 1.00 0.00 H new ATOM 0 HB3 LYS T 43 91.664 8.442 -6.589 1.00 0.00 H new ATOM 0 HG2 LYS T 43 93.511 9.413 -5.056 1.00 0.00 H new ATOM 0 HG3 LYS T 43 93.143 8.119 -3.933 1.00 0.00 H new ATOM 0 HD2 LYS T 43 93.650 6.413 -5.649 1.00 0.00 H new ATOM 0 HD3 LYS T 43 93.860 7.651 -6.872 1.00 0.00 H new ATOM 0 HE2 LYS T 43 95.783 8.611 -5.602 1.00 0.00 H new ATOM 0 HE3 LYS T 43 95.555 7.427 -4.331 1.00 0.00 H new ATOM 0 HZ1 LYS T 43 97.282 6.834 -6.015 1.00 0.00 H new ATOM 0 HZ2 LYS T 43 96.074 5.657 -5.825 1.00 0.00 H new ATOM 0 HZ3 LYS T 43 96.050 6.687 -7.174 1.00 0.00 H new ATOM 664 N VAL T 44 88.608 8.695 -5.187 1.00 0.00 N ATOM 665 CA VAL T 44 87.269 8.684 -5.767 1.00 0.00 C ATOM 666 C VAL T 44 86.405 9.781 -5.152 1.00 0.00 C ATOM 667 O VAL T 44 85.894 10.650 -5.859 1.00 0.00 O ATOM 668 CB VAL T 44 86.611 7.322 -5.539 1.00 0.00 C ATOM 669 CG1 VAL T 44 85.183 7.346 -6.085 1.00 0.00 C ATOM 670 CG2 VAL T 44 87.416 6.239 -6.264 1.00 0.00 C ATOM 0 H VAL T 44 88.778 7.965 -4.495 1.00 0.00 H new ATOM 0 HA VAL T 44 87.358 8.869 -6.838 1.00 0.00 H new ATOM 0 HB VAL T 44 86.587 7.105 -4.471 1.00 0.00 H new ATOM 0 HG11 VAL T 44 84.715 6.375 -5.922 1.00 0.00 H new ATOM 0 HG12 VAL T 44 84.609 8.116 -5.570 1.00 0.00 H new ATOM 0 HG13 VAL T 44 85.205 7.563 -7.153 1.00 0.00 H new ATOM 0 HG21 VAL T 44 86.948 5.268 -6.102 1.00 0.00 H new ATOM 0 HG22 VAL T 44 87.440 6.457 -7.332 1.00 0.00 H new ATOM 0 HG23 VAL T 44 88.434 6.220 -5.875 1.00 0.00 H new ATOM 680 N MET T 45 86.243 9.735 -3.833 1.00 0.00 N ATOM 681 CA MET T 45 85.435 10.731 -3.139 1.00 0.00 C ATOM 682 C MET T 45 85.838 12.140 -3.567 1.00 0.00 C ATOM 683 O MET T 45 85.132 13.109 -3.289 1.00 0.00 O ATOM 684 CB MET T 45 85.610 10.587 -1.627 1.00 0.00 C ATOM 685 CG MET T 45 84.905 9.316 -1.148 1.00 0.00 C ATOM 686 SD MET T 45 83.113 9.544 -1.256 1.00 0.00 S ATOM 687 CE MET T 45 82.640 7.907 -0.647 1.00 0.00 C ATOM 0 H MET T 45 86.657 9.025 -3.228 1.00 0.00 H new ATOM 0 HA MET T 45 84.389 10.568 -3.400 1.00 0.00 H new ATOM 0 HB2 MET T 45 86.670 10.544 -1.376 1.00 0.00 H new ATOM 0 HB3 MET T 45 85.197 11.458 -1.118 1.00 0.00 H new ATOM 0 HG2 MET T 45 85.212 8.466 -1.757 1.00 0.00 H new ATOM 0 HG3 MET T 45 85.193 9.093 -0.121 1.00 0.00 H new ATOM 0 HE1 MET T 45 81.553 7.825 -0.630 1.00 0.00 H new ATOM 0 HE2 MET T 45 83.051 7.141 -1.305 1.00 0.00 H new ATOM 0 HE3 MET T 45 83.030 7.767 0.361 1.00 0.00 H new ATOM 697 N ARG T 46 86.977 12.245 -4.244 1.00 0.00 N ATOM 698 CA ARG T 46 87.463 13.540 -4.705 1.00 0.00 C ATOM 699 C ARG T 46 86.658 14.018 -5.910 1.00 0.00 C ATOM 700 O ARG T 46 86.443 15.216 -6.089 1.00 0.00 O ATOM 701 CB ARG T 46 88.942 13.438 -5.084 1.00 0.00 C ATOM 702 CG ARG T 46 89.472 14.826 -5.447 1.00 0.00 C ATOM 703 CD ARG T 46 90.975 14.746 -5.716 1.00 0.00 C ATOM 704 NE ARG T 46 91.525 16.084 -5.905 1.00 0.00 N ATOM 705 CZ ARG T 46 92.825 16.269 -6.110 1.00 0.00 C ATOM 706 NH1 ARG T 46 93.633 15.245 -6.145 1.00 0.00 N ATOM 707 NH2 ARG T 46 93.294 17.476 -6.276 1.00 0.00 N ATOM 0 H ARG T 46 87.576 11.455 -4.484 1.00 0.00 H new ATOM 0 HA ARG T 46 87.344 14.260 -3.895 1.00 0.00 H new ATOM 0 HB2 ARG T 46 89.514 13.025 -4.253 1.00 0.00 H new ATOM 0 HB3 ARG T 46 89.067 12.758 -5.926 1.00 0.00 H new ATOM 0 HG2 ARG T 46 88.954 15.205 -6.328 1.00 0.00 H new ATOM 0 HG3 ARG T 46 89.274 15.526 -4.635 1.00 0.00 H new ATOM 0 HD2 ARG T 46 91.475 14.254 -4.882 1.00 0.00 H new ATOM 0 HD3 ARG T 46 91.161 14.140 -6.602 1.00 0.00 H new ATOM 0 HE ARG T 46 90.901 16.891 -5.879 1.00 0.00 H new ATOM 0 HH11 ARG T 46 93.267 14.302 -6.015 1.00 0.00 H new ATOM 0 HH12 ARG T 46 94.631 15.388 -6.302 1.00 0.00 H new ATOM 0 HH21 ARG T 46 92.663 18.277 -6.248 1.00 0.00 H new ATOM 0 HH22 ARG T 46 94.292 17.618 -6.433 1.00 0.00 H new ATOM 721 N MET T 47 86.217 13.073 -6.733 1.00 0.00 N ATOM 722 CA MET T 47 85.437 13.410 -7.919 1.00 0.00 C ATOM 723 C MET T 47 84.114 14.058 -7.525 1.00 0.00 C ATOM 724 O MET T 47 83.660 15.005 -8.168 1.00 0.00 O ATOM 725 CB MET T 47 85.164 12.149 -8.740 1.00 0.00 C ATOM 726 CG MET T 47 86.490 11.468 -9.087 1.00 0.00 C ATOM 727 SD MET T 47 86.173 10.035 -10.146 1.00 0.00 S ATOM 728 CE MET T 47 87.779 10.010 -10.979 1.00 0.00 C ATOM 0 H MET T 47 86.384 12.075 -6.603 1.00 0.00 H new ATOM 0 HA MET T 47 86.011 14.117 -8.518 1.00 0.00 H new ATOM 0 HB2 MET T 47 84.529 11.466 -8.176 1.00 0.00 H new ATOM 0 HB3 MET T 47 84.625 12.406 -9.652 1.00 0.00 H new ATOM 0 HG2 MET T 47 87.150 12.171 -9.596 1.00 0.00 H new ATOM 0 HG3 MET T 47 87.000 11.155 -8.176 1.00 0.00 H new ATOM 0 HE1 MET T 47 87.806 9.187 -11.693 1.00 0.00 H new ATOM 0 HE2 MET T 47 87.930 10.952 -11.506 1.00 0.00 H new ATOM 0 HE3 MET T 47 88.570 9.876 -10.241 1.00 0.00 H new ATOM 738 N LEU T 48 83.501 13.544 -6.464 1.00 0.00 N ATOM 739 CA LEU T 48 82.229 14.083 -5.994 1.00 0.00 C ATOM 740 C LEU T 48 82.407 15.522 -5.514 1.00 0.00 C ATOM 741 O LEU T 48 82.054 16.468 -6.216 1.00 0.00 O ATOM 742 CB LEU T 48 81.683 13.219 -4.848 1.00 0.00 C ATOM 743 CG LEU T 48 81.068 11.933 -5.413 1.00 0.00 C ATOM 744 CD1 LEU T 48 82.103 11.193 -6.265 1.00 0.00 C ATOM 745 CD2 LEU T 48 80.622 11.037 -4.254 1.00 0.00 C ATOM 0 H LEU T 48 83.860 12.762 -5.917 1.00 0.00 H new ATOM 0 HA LEU T 48 81.520 14.072 -6.822 1.00 0.00 H new ATOM 0 HB2 LEU T 48 82.485 12.974 -4.152 1.00 0.00 H new ATOM 0 HB3 LEU T 48 80.932 13.776 -4.287 1.00 0.00 H new ATOM 0 HG LEU T 48 80.209 12.184 -6.035 1.00 0.00 H new ATOM 0 HD11 LEU T 48 81.660 10.280 -6.664 1.00 0.00 H new ATOM 0 HD12 LEU T 48 82.420 11.832 -7.089 1.00 0.00 H new ATOM 0 HD13 LEU T 48 82.966 10.939 -5.650 1.00 0.00 H new ATOM 0 HD21 LEU T 48 80.184 10.121 -4.650 1.00 0.00 H new ATOM 0 HD22 LEU T 48 81.483 10.789 -3.634 1.00 0.00 H new ATOM 0 HD23 LEU T 48 79.881 11.563 -3.652 1.00 0.00 H new ATOM 757 N GLY T 49 82.958 15.675 -4.314 1.00 0.00 N ATOM 758 CA GLY T 49 83.179 17.003 -3.751 1.00 0.00 C ATOM 759 C GLY T 49 83.568 16.912 -2.279 1.00 0.00 C ATOM 760 O GLY T 49 83.219 17.781 -1.480 1.00 0.00 O ATOM 0 H GLY T 49 83.257 14.904 -3.717 1.00 0.00 H new ATOM 0 HA2 GLY T 49 83.965 17.512 -4.308 1.00 0.00 H new ATOM 0 HA3 GLY T 49 82.274 17.602 -3.856 1.00 0.00 H new ATOM 764 N GLN T 50 84.296 15.851 -1.928 1.00 0.00 N ATOM 765 CA GLN T 50 84.735 15.644 -0.546 1.00 0.00 C ATOM 766 C GLN T 50 86.178 15.151 -0.517 1.00 0.00 C ATOM 767 O GLN T 50 86.634 14.478 -1.442 1.00 0.00 O ATOM 768 CB GLN T 50 83.834 14.614 0.141 1.00 0.00 C ATOM 769 CG GLN T 50 82.376 15.075 0.070 1.00 0.00 C ATOM 770 CD GLN T 50 82.207 16.391 0.822 1.00 0.00 C ATOM 771 OE1 GLN T 50 81.679 17.357 0.272 1.00 0.00 O ATOM 772 NE2 GLN T 50 82.625 16.486 2.054 1.00 0.00 N ATOM 0 H GLN T 50 84.594 15.124 -2.578 1.00 0.00 H new ATOM 0 HA GLN T 50 84.670 16.595 -0.017 1.00 0.00 H new ATOM 0 HB2 GLN T 50 83.942 13.643 -0.341 1.00 0.00 H new ATOM 0 HB3 GLN T 50 84.136 14.489 1.181 1.00 0.00 H new ATOM 0 HG2 GLN T 50 82.076 15.200 -0.970 1.00 0.00 H new ATOM 0 HG3 GLN T 50 81.724 14.315 0.500 1.00 0.00 H new ATOM 0 HE21 GLN T 50 83.062 15.684 2.507 1.00 0.00 H new ATOM 0 HE22 GLN T 50 82.515 17.362 2.564 1.00 0.00 H new ATOM 781 N ASN T 51 86.894 15.490 0.552 1.00 0.00 N ATOM 782 CA ASN T 51 88.285 15.075 0.690 1.00 0.00 C ATOM 783 C ASN T 51 88.735 15.182 2.145 1.00 0.00 C ATOM 784 O ASN T 51 89.676 15.911 2.460 1.00 0.00 O ATOM 785 CB ASN T 51 89.180 15.951 -0.189 1.00 0.00 C ATOM 786 CG ASN T 51 90.639 15.539 -0.020 1.00 0.00 C ATOM 787 OD1 ASN T 51 90.936 14.354 0.133 1.00 0.00 O ATOM 788 ND2 ASN T 51 91.571 16.452 -0.039 1.00 0.00 N ATOM 0 H ASN T 51 86.537 16.046 1.329 1.00 0.00 H new ATOM 0 HA ASN T 51 88.368 14.036 0.372 1.00 0.00 H new ATOM 0 HB2 ASN T 51 88.885 15.854 -1.234 1.00 0.00 H new ATOM 0 HB3 ASN T 51 89.056 17.000 0.082 1.00 0.00 H new ATOM 0 HD21 ASN T 51 92.549 16.185 0.073 1.00 0.00 H new ATOM 0 HD22 ASN T 51 91.322 17.433 -0.166 1.00 0.00 H new ATOM 795 N PRO T 52 88.083 14.473 3.028 1.00 0.00 N ATOM 796 CA PRO T 52 88.420 14.486 4.482 1.00 0.00 C ATOM 797 C PRO T 52 89.688 13.687 4.781 1.00 0.00 C ATOM 798 O PRO T 52 90.404 13.273 3.869 1.00 0.00 O ATOM 799 CB PRO T 52 87.187 13.847 5.133 1.00 0.00 C ATOM 800 CG PRO T 52 86.645 12.921 4.090 1.00 0.00 C ATOM 801 CD PRO T 52 86.947 13.579 2.739 1.00 0.00 C ATOM 0 HA PRO T 52 88.631 15.488 4.856 1.00 0.00 H new ATOM 0 HB2 PRO T 52 87.454 13.307 6.042 1.00 0.00 H new ATOM 0 HB3 PRO T 52 86.452 14.601 5.414 1.00 0.00 H new ATOM 0 HG2 PRO T 52 87.114 11.939 4.159 1.00 0.00 H new ATOM 0 HG3 PRO T 52 85.573 12.772 4.220 1.00 0.00 H new ATOM 0 HD2 PRO T 52 87.204 12.838 1.982 1.00 0.00 H new ATOM 0 HD3 PRO T 52 86.087 14.134 2.363 1.00 0.00 H new ATOM 809 N THR T 53 89.958 13.477 6.067 1.00 0.00 N ATOM 810 CA THR T 53 91.142 12.727 6.478 1.00 0.00 C ATOM 811 C THR T 53 90.907 11.225 6.296 1.00 0.00 C ATOM 812 O THR T 53 89.769 10.761 6.361 1.00 0.00 O ATOM 813 CB THR T 53 91.464 13.024 7.952 1.00 0.00 C ATOM 814 OG1 THR T 53 92.085 11.889 8.539 1.00 0.00 O ATOM 815 CG2 THR T 53 90.173 13.342 8.709 1.00 0.00 C ATOM 0 H THR T 53 89.379 13.812 6.837 1.00 0.00 H new ATOM 0 HA THR T 53 91.983 13.033 5.856 1.00 0.00 H new ATOM 0 HB THR T 53 92.137 13.880 8.007 1.00 0.00 H new ATOM 0 HG1 THR T 53 92.292 12.078 9.478 1.00 0.00 H new ATOM 0 HG21 THR T 53 90.406 13.552 9.753 1.00 0.00 H new ATOM 0 HG22 THR T 53 89.694 14.213 8.262 1.00 0.00 H new ATOM 0 HG23 THR T 53 89.498 12.488 8.652 1.00 0.00 H new ATOM 823 N PRO T 54 91.950 10.456 6.073 1.00 0.00 N ATOM 824 CA PRO T 54 91.825 8.979 5.886 1.00 0.00 C ATOM 825 C PRO T 54 91.457 8.270 7.190 1.00 0.00 C ATOM 826 O PRO T 54 91.200 7.067 7.203 1.00 0.00 O ATOM 827 CB PRO T 54 93.219 8.560 5.392 1.00 0.00 C ATOM 828 CG PRO T 54 94.145 9.590 5.952 1.00 0.00 C ATOM 829 CD PRO T 54 93.354 10.900 5.974 1.00 0.00 C ATOM 0 HA PRO T 54 91.030 8.711 5.190 1.00 0.00 H new ATOM 0 HB2 PRO T 54 93.479 7.561 5.742 1.00 0.00 H new ATOM 0 HB3 PRO T 54 93.263 8.538 4.303 1.00 0.00 H new ATOM 0 HG2 PRO T 54 94.474 9.316 6.954 1.00 0.00 H new ATOM 0 HG3 PRO T 54 95.040 9.685 5.338 1.00 0.00 H new ATOM 0 HD2 PRO T 54 93.637 11.525 6.821 1.00 0.00 H new ATOM 0 HD3 PRO T 54 93.526 11.487 5.072 1.00 0.00 H new ATOM 837 N GLU T 55 91.436 9.028 8.283 1.00 0.00 N ATOM 838 CA GLU T 55 91.099 8.467 9.587 1.00 0.00 C ATOM 839 C GLU T 55 89.586 8.356 9.749 1.00 0.00 C ATOM 840 O GLU T 55 89.082 7.390 10.319 1.00 0.00 O ATOM 841 CB GLU T 55 91.669 9.352 10.697 1.00 0.00 C ATOM 842 CG GLU T 55 91.494 8.656 12.049 1.00 0.00 C ATOM 843 CD GLU T 55 92.017 9.551 13.167 1.00 0.00 C ATOM 844 OE1 GLU T 55 91.550 10.674 13.268 1.00 0.00 O ATOM 845 OE2 GLU T 55 92.877 9.101 13.906 1.00 0.00 O ATOM 0 H GLU T 55 91.647 10.026 8.292 1.00 0.00 H new ATOM 0 HA GLU T 55 91.534 7.470 9.656 1.00 0.00 H new ATOM 0 HB2 GLU T 55 92.725 9.550 10.512 1.00 0.00 H new ATOM 0 HB3 GLU T 55 91.161 10.316 10.704 1.00 0.00 H new ATOM 0 HG2 GLU T 55 90.441 8.428 12.217 1.00 0.00 H new ATOM 0 HG3 GLU T 55 92.030 7.707 12.051 1.00 0.00 H new ATOM 852 N GLU T 56 88.867 9.354 9.244 1.00 0.00 N ATOM 853 CA GLU T 56 87.412 9.362 9.342 1.00 0.00 C ATOM 854 C GLU T 56 86.797 8.439 8.294 1.00 0.00 C ATOM 855 O GLU T 56 85.720 7.879 8.502 1.00 0.00 O ATOM 856 CB GLU T 56 86.883 10.784 9.145 1.00 0.00 C ATOM 857 CG GLU T 56 87.299 11.651 10.334 1.00 0.00 C ATOM 858 CD GLU T 56 86.886 13.099 10.093 1.00 0.00 C ATOM 859 OE1 GLU T 56 85.848 13.304 9.485 1.00 0.00 O ATOM 860 OE2 GLU T 56 87.613 13.981 10.519 1.00 0.00 O ATOM 0 H GLU T 56 89.265 10.162 8.766 1.00 0.00 H new ATOM 0 HA GLU T 56 87.133 9.004 10.333 1.00 0.00 H new ATOM 0 HB2 GLU T 56 87.276 11.205 8.219 1.00 0.00 H new ATOM 0 HB3 GLU T 56 85.797 10.770 9.053 1.00 0.00 H new ATOM 0 HG2 GLU T 56 86.834 11.279 11.247 1.00 0.00 H new ATOM 0 HG3 GLU T 56 88.378 11.591 10.479 1.00 0.00 H new ATOM 867 N LEU T 57 87.486 8.285 7.168 1.00 0.00 N ATOM 868 CA LEU T 57 86.995 7.427 6.095 1.00 0.00 C ATOM 869 C LEU T 57 87.058 5.960 6.513 1.00 0.00 C ATOM 870 O LEU T 57 86.240 5.147 6.083 1.00 0.00 O ATOM 871 CB LEU T 57 87.834 7.643 4.827 1.00 0.00 C ATOM 872 CG LEU T 57 87.439 8.973 4.147 1.00 0.00 C ATOM 873 CD1 LEU T 57 88.612 9.494 3.309 1.00 0.00 C ATOM 874 CD2 LEU T 57 86.229 8.761 3.225 1.00 0.00 C ATOM 0 H LEU T 57 88.379 8.739 6.975 1.00 0.00 H new ATOM 0 HA LEU T 57 85.957 7.688 5.889 1.00 0.00 H new ATOM 0 HB2 LEU T 57 88.894 7.657 5.081 1.00 0.00 H new ATOM 0 HB3 LEU T 57 87.683 6.814 4.136 1.00 0.00 H new ATOM 0 HG LEU T 57 87.183 9.696 4.922 1.00 0.00 H new ATOM 0 HD11 LEU T 57 88.329 10.432 2.831 1.00 0.00 H new ATOM 0 HD12 LEU T 57 89.474 9.661 3.954 1.00 0.00 H new ATOM 0 HD13 LEU T 57 88.867 8.760 2.545 1.00 0.00 H new ATOM 0 HD21 LEU T 57 85.962 9.706 2.753 1.00 0.00 H new ATOM 0 HD22 LEU T 57 86.481 8.030 2.457 1.00 0.00 H new ATOM 0 HD23 LEU T 57 85.385 8.396 3.810 1.00 0.00 H new ATOM 886 N GLN T 58 88.035 5.627 7.352 1.00 0.00 N ATOM 887 CA GLN T 58 88.192 4.254 7.819 1.00 0.00 C ATOM 888 C GLN T 58 86.951 3.806 8.587 1.00 0.00 C ATOM 889 O GLN T 58 86.644 2.615 8.647 1.00 0.00 O ATOM 890 CB GLN T 58 89.434 4.151 8.718 1.00 0.00 C ATOM 891 CG GLN T 58 89.483 2.783 9.415 1.00 0.00 C ATOM 892 CD GLN T 58 89.255 1.660 8.408 1.00 0.00 C ATOM 893 OE1 GLN T 58 88.287 0.908 8.523 1.00 0.00 O ATOM 894 NE2 GLN T 58 90.094 1.499 7.420 1.00 0.00 N ATOM 0 H GLN T 58 88.724 6.283 7.720 1.00 0.00 H new ATOM 0 HA GLN T 58 88.318 3.601 6.955 1.00 0.00 H new ATOM 0 HB2 GLN T 58 90.335 4.294 8.121 1.00 0.00 H new ATOM 0 HB3 GLN T 58 89.417 4.945 9.464 1.00 0.00 H new ATOM 0 HG2 GLN T 58 90.449 2.651 9.902 1.00 0.00 H new ATOM 0 HG3 GLN T 58 88.723 2.739 10.196 1.00 0.00 H new ATOM 0 HE21 GLN T 58 90.896 2.122 7.325 1.00 0.00 H new ATOM 0 HE22 GLN T 58 89.947 0.750 6.743 1.00 0.00 H new ATOM 903 N GLU T 59 86.241 4.765 9.170 1.00 0.00 N ATOM 904 CA GLU T 59 85.036 4.453 9.930 1.00 0.00 C ATOM 905 C GLU T 59 83.998 3.781 9.035 1.00 0.00 C ATOM 906 O GLU T 59 83.111 3.077 9.519 1.00 0.00 O ATOM 907 CB GLU T 59 84.446 5.734 10.526 1.00 0.00 C ATOM 908 CG GLU T 59 85.408 6.300 11.571 1.00 0.00 C ATOM 909 CD GLU T 59 84.905 7.654 12.062 1.00 0.00 C ATOM 910 OE1 GLU T 59 83.951 8.154 11.488 1.00 0.00 O ATOM 911 OE2 GLU T 59 85.481 8.172 13.005 1.00 0.00 O ATOM 0 H GLU T 59 86.476 5.757 9.132 1.00 0.00 H new ATOM 0 HA GLU T 59 85.304 3.769 10.735 1.00 0.00 H new ATOM 0 HB2 GLU T 59 84.274 6.468 9.739 1.00 0.00 H new ATOM 0 HB3 GLU T 59 83.479 5.524 10.983 1.00 0.00 H new ATOM 0 HG2 GLU T 59 85.495 5.609 12.409 1.00 0.00 H new ATOM 0 HG3 GLU T 59 86.404 6.407 11.141 1.00 0.00 H new ATOM 918 N MET T 60 84.115 4.004 7.730 1.00 0.00 N ATOM 919 CA MET T 60 83.182 3.416 6.774 1.00 0.00 C ATOM 920 C MET T 60 83.576 1.977 6.451 1.00 0.00 C ATOM 921 O MET T 60 82.727 1.151 6.118 1.00 0.00 O ATOM 922 CB MET T 60 83.163 4.244 5.486 1.00 0.00 C ATOM 923 CG MET T 60 82.425 5.562 5.733 1.00 0.00 C ATOM 924 SD MET T 60 80.642 5.254 5.786 1.00 0.00 S ATOM 925 CE MET T 60 80.323 5.459 4.016 1.00 0.00 C ATOM 0 H MET T 60 84.842 4.584 7.311 1.00 0.00 H new ATOM 0 HA MET T 60 82.188 3.415 7.221 1.00 0.00 H new ATOM 0 HB2 MET T 60 84.182 4.443 5.155 1.00 0.00 H new ATOM 0 HB3 MET T 60 82.672 3.685 4.689 1.00 0.00 H new ATOM 0 HG2 MET T 60 82.756 6.006 6.672 1.00 0.00 H new ATOM 0 HG3 MET T 60 82.658 6.276 4.943 1.00 0.00 H new ATOM 0 HE1 MET T 60 79.262 5.309 3.818 1.00 0.00 H new ATOM 0 HE2 MET T 60 80.611 6.464 3.708 1.00 0.00 H new ATOM 0 HE3 MET T 60 80.904 4.727 3.454 1.00 0.00 H new ATOM 935 N ILE T 61 84.872 1.684 6.551 1.00 0.00 N ATOM 936 CA ILE T 61 85.374 0.339 6.267 1.00 0.00 C ATOM 937 C ILE T 61 85.384 -0.506 7.541 1.00 0.00 C ATOM 938 O ILE T 61 85.277 -1.731 7.485 1.00 0.00 O ATOM 939 CB ILE T 61 86.795 0.426 5.693 1.00 0.00 C ATOM 940 CG1 ILE T 61 86.747 1.050 4.291 1.00 0.00 C ATOM 941 CG2 ILE T 61 87.404 -0.976 5.592 1.00 0.00 C ATOM 942 CD1 ILE T 61 86.252 2.500 4.366 1.00 0.00 C ATOM 0 H ILE T 61 85.590 2.355 6.825 1.00 0.00 H new ATOM 0 HA ILE T 61 84.716 -0.133 5.537 1.00 0.00 H new ATOM 0 HB ILE T 61 87.405 1.043 6.353 1.00 0.00 H new ATOM 0 HG12 ILE T 61 87.739 1.021 3.839 1.00 0.00 H new ATOM 0 HG13 ILE T 61 86.087 0.467 3.649 1.00 0.00 H new ATOM 0 HG21 ILE T 61 88.412 -0.906 5.184 1.00 0.00 H new ATOM 0 HG22 ILE T 61 87.444 -1.427 6.583 1.00 0.00 H new ATOM 0 HG23 ILE T 61 86.789 -1.593 4.937 1.00 0.00 H new ATOM 0 HD11 ILE T 61 86.224 2.927 3.364 1.00 0.00 H new ATOM 0 HD12 ILE T 61 85.251 2.521 4.797 1.00 0.00 H new ATOM 0 HD13 ILE T 61 86.929 3.084 4.990 1.00 0.00 H new ATOM 954 N ASP T 62 85.524 0.156 8.684 1.00 0.00 N ATOM 955 CA ASP T 62 85.559 -0.545 9.965 1.00 0.00 C ATOM 956 C ASP T 62 84.203 -1.164 10.296 1.00 0.00 C ATOM 957 O ASP T 62 84.118 -2.092 11.100 1.00 0.00 O ATOM 958 CB ASP T 62 85.959 0.428 11.077 1.00 0.00 C ATOM 959 CG ASP T 62 85.928 -0.280 12.426 1.00 0.00 C ATOM 960 OD1 ASP T 62 86.659 -1.245 12.583 1.00 0.00 O ATOM 961 OD2 ASP T 62 85.174 0.151 13.283 1.00 0.00 O ATOM 0 H ASP T 62 85.615 1.170 8.752 1.00 0.00 H new ATOM 0 HA ASP T 62 86.294 -1.347 9.890 1.00 0.00 H new ATOM 0 HB2 ASP T 62 86.958 0.820 10.886 1.00 0.00 H new ATOM 0 HB3 ASP T 62 85.279 1.280 11.088 1.00 0.00 H new ATOM 966 N GLU T 63 83.145 -0.645 9.680 1.00 0.00 N ATOM 967 CA GLU T 63 81.801 -1.161 9.933 1.00 0.00 C ATOM 968 C GLU T 63 81.557 -2.452 9.153 1.00 0.00 C ATOM 969 O GLU T 63 80.933 -3.383 9.662 1.00 0.00 O ATOM 970 CB GLU T 63 80.755 -0.110 9.544 1.00 0.00 C ATOM 971 CG GLU T 63 81.146 0.543 8.217 1.00 0.00 C ATOM 972 CD GLU T 63 79.980 1.362 7.675 1.00 0.00 C ATOM 973 OE1 GLU T 63 79.815 2.486 8.119 1.00 0.00 O ATOM 974 OE2 GLU T 63 79.268 0.853 6.825 1.00 0.00 O ATOM 0 H GLU T 63 83.189 0.123 9.010 1.00 0.00 H new ATOM 0 HA GLU T 63 81.713 -1.381 10.997 1.00 0.00 H new ATOM 0 HB2 GLU T 63 79.773 -0.576 9.455 1.00 0.00 H new ATOM 0 HB3 GLU T 63 80.679 0.647 10.324 1.00 0.00 H new ATOM 0 HG2 GLU T 63 82.016 1.184 8.360 1.00 0.00 H new ATOM 0 HG3 GLU T 63 81.430 -0.223 7.495 1.00 0.00 H new ATOM 981 N VAL T 64 82.046 -2.502 7.917 1.00 0.00 N ATOM 982 CA VAL T 64 81.868 -3.686 7.076 1.00 0.00 C ATOM 983 C VAL T 64 82.990 -4.693 7.315 1.00 0.00 C ATOM 984 O VAL T 64 82.885 -5.854 6.918 1.00 0.00 O ATOM 985 CB VAL T 64 81.851 -3.278 5.599 1.00 0.00 C ATOM 986 CG1 VAL T 64 80.514 -2.614 5.264 1.00 0.00 C ATOM 987 CG2 VAL T 64 82.989 -2.290 5.332 1.00 0.00 C ATOM 0 H VAL T 64 82.565 -1.743 7.476 1.00 0.00 H new ATOM 0 HA VAL T 64 80.918 -4.153 7.337 1.00 0.00 H new ATOM 0 HB VAL T 64 81.981 -4.164 4.978 1.00 0.00 H new ATOM 0 HG11 VAL T 64 80.505 -2.325 4.213 1.00 0.00 H new ATOM 0 HG12 VAL T 64 79.702 -3.315 5.455 1.00 0.00 H new ATOM 0 HG13 VAL T 64 80.382 -1.728 5.885 1.00 0.00 H new ATOM 0 HG21 VAL T 64 82.979 -1.998 4.282 1.00 0.00 H new ATOM 0 HG22 VAL T 64 82.857 -1.406 5.955 1.00 0.00 H new ATOM 0 HG23 VAL T 64 83.943 -2.761 5.568 1.00 0.00 H new ATOM 997 N ASP T 65 84.061 -4.246 7.963 1.00 0.00 N ATOM 998 CA ASP T 65 85.190 -5.127 8.244 1.00 0.00 C ATOM 999 C ASP T 65 84.755 -6.275 9.152 1.00 0.00 C ATOM 1000 O ASP T 65 85.107 -6.313 10.332 1.00 0.00 O ATOM 1001 CB ASP T 65 86.323 -4.334 8.911 1.00 0.00 C ATOM 1002 CG ASP T 65 87.116 -3.560 7.862 1.00 0.00 C ATOM 1003 OD1 ASP T 65 86.715 -3.580 6.710 1.00 0.00 O ATOM 1004 OD2 ASP T 65 88.115 -2.961 8.227 1.00 0.00 O ATOM 0 H ASP T 65 84.171 -3.290 8.300 1.00 0.00 H new ATOM 0 HA ASP T 65 85.551 -5.542 7.303 1.00 0.00 H new ATOM 0 HB2 ASP T 65 85.909 -3.644 9.646 1.00 0.00 H new ATOM 0 HB3 ASP T 65 86.984 -5.014 9.448 1.00 0.00 H new ATOM 1009 N GLU T 66 83.994 -7.209 8.593 1.00 0.00 N ATOM 1010 CA GLU T 66 83.523 -8.354 9.360 1.00 0.00 C ATOM 1011 C GLU T 66 84.645 -9.374 9.527 1.00 0.00 C ATOM 1012 O GLU T 66 84.394 -10.557 9.759 1.00 0.00 O ATOM 1013 CB GLU T 66 82.336 -9.009 8.651 1.00 0.00 C ATOM 1014 CG GLU T 66 81.112 -8.097 8.757 1.00 0.00 C ATOM 1015 CD GLU T 66 80.594 -8.085 10.191 1.00 0.00 C ATOM 1016 OE1 GLU T 66 80.211 -9.139 10.670 1.00 0.00 O ATOM 1017 OE2 GLU T 66 80.591 -7.022 10.790 1.00 0.00 O ATOM 0 H GLU T 66 83.692 -7.196 7.619 1.00 0.00 H new ATOM 0 HA GLU T 66 83.207 -8.007 10.344 1.00 0.00 H new ATOM 0 HB2 GLU T 66 82.579 -9.190 7.604 1.00 0.00 H new ATOM 0 HB3 GLU T 66 82.120 -9.979 9.100 1.00 0.00 H new ATOM 0 HG2 GLU T 66 81.374 -7.085 8.448 1.00 0.00 H new ATOM 0 HG3 GLU T 66 80.330 -8.444 8.082 1.00 0.00 H new ATOM 1024 N ASP T 67 85.883 -8.904 9.405 1.00 0.00 N ATOM 1025 CA ASP T 67 87.043 -9.778 9.542 1.00 0.00 C ATOM 1026 C ASP T 67 88.274 -8.971 9.941 1.00 0.00 C ATOM 1027 O ASP T 67 89.392 -9.487 9.945 1.00 0.00 O ATOM 1028 CB ASP T 67 87.311 -10.499 8.219 1.00 0.00 C ATOM 1029 CG ASP T 67 87.278 -9.502 7.065 1.00 0.00 C ATOM 1030 OD1 ASP T 67 87.468 -8.324 7.319 1.00 0.00 O ATOM 1031 OD2 ASP T 67 87.065 -9.932 5.943 1.00 0.00 O ATOM 0 H ASP T 67 86.108 -7.928 9.213 1.00 0.00 H new ATOM 0 HA ASP T 67 86.834 -10.512 10.320 1.00 0.00 H new ATOM 0 HB2 ASP T 67 88.282 -10.994 8.255 1.00 0.00 H new ATOM 0 HB3 ASP T 67 86.563 -11.276 8.061 1.00 0.00 H new ATOM 1036 N GLY T 68 88.061 -7.703 10.278 1.00 0.00 N ATOM 1037 CA GLY T 68 89.162 -6.833 10.677 1.00 0.00 C ATOM 1038 C GLY T 68 90.357 -7.002 9.745 1.00 0.00 C ATOM 1039 O GLY T 68 91.279 -7.763 10.034 1.00 0.00 O ATOM 0 H GLY T 68 87.143 -7.257 10.283 1.00 0.00 H new ATOM 0 HA2 GLY T 68 88.832 -5.794 10.666 1.00 0.00 H new ATOM 0 HA3 GLY T 68 89.459 -7.062 11.700 1.00 0.00 H new ATOM 1043 N SER T 69 90.331 -6.286 8.622 1.00 0.00 N ATOM 1044 CA SER T 69 91.418 -6.363 7.646 1.00 0.00 C ATOM 1045 C SER T 69 91.568 -5.040 6.902 1.00 0.00 C ATOM 1046 O SER T 69 92.497 -4.865 6.113 1.00 0.00 O ATOM 1047 CB SER T 69 91.138 -7.482 6.644 1.00 0.00 C ATOM 1048 OG SER T 69 90.018 -7.126 5.845 1.00 0.00 O ATOM 0 H SER T 69 89.575 -5.650 8.366 1.00 0.00 H new ATOM 0 HA SER T 69 92.345 -6.573 8.179 1.00 0.00 H new ATOM 0 HB2 SER T 69 92.011 -7.648 6.013 1.00 0.00 H new ATOM 0 HB3 SER T 69 90.942 -8.416 7.170 1.00 0.00 H new ATOM 0 HG SER T 69 90.329 -6.772 4.985 1.00 0.00 H new ATOM 1054 N GLY T 70 90.652 -4.110 7.157 1.00 0.00 N ATOM 1055 CA GLY T 70 90.700 -2.808 6.501 1.00 0.00 C ATOM 1056 C GLY T 70 90.775 -2.964 4.986 1.00 0.00 C ATOM 1057 O GLY T 70 91.641 -2.380 4.335 1.00 0.00 O ATOM 0 H GLY T 70 89.875 -4.232 7.807 1.00 0.00 H new ATOM 0 HA2 GLY T 70 89.816 -2.229 6.768 1.00 0.00 H new ATOM 0 HA3 GLY T 70 91.566 -2.249 6.856 1.00 0.00 H new ATOM 1061 N THR T 71 89.862 -3.756 4.430 1.00 0.00 N ATOM 1062 CA THR T 71 89.828 -3.986 2.987 1.00 0.00 C ATOM 1063 C THR T 71 88.406 -4.293 2.528 1.00 0.00 C ATOM 1064 O THR T 71 87.783 -5.244 3.002 1.00 0.00 O ATOM 1065 CB THR T 71 90.745 -5.158 2.620 1.00 0.00 C ATOM 1066 OG1 THR T 71 90.496 -6.244 3.501 1.00 0.00 O ATOM 1067 CG2 THR T 71 92.211 -4.730 2.739 1.00 0.00 C ATOM 0 H THR T 71 89.138 -4.248 4.954 1.00 0.00 H new ATOM 0 HA THR T 71 90.175 -3.082 2.487 1.00 0.00 H new ATOM 0 HB THR T 71 90.544 -5.464 1.593 1.00 0.00 H new ATOM 0 HG1 THR T 71 91.080 -6.995 3.268 1.00 0.00 H new ATOM 0 HG21 THR T 71 92.857 -5.568 2.477 1.00 0.00 H new ATOM 0 HG22 THR T 71 92.403 -3.898 2.062 1.00 0.00 H new ATOM 0 HG23 THR T 71 92.417 -4.419 3.763 1.00 0.00 H new ATOM 1075 N VAL T 72 87.900 -3.482 1.603 1.00 0.00 N ATOM 1076 CA VAL T 72 86.547 -3.672 1.082 1.00 0.00 C ATOM 1077 C VAL T 72 86.562 -4.639 -0.098 1.00 0.00 C ATOM 1078 O VAL T 72 86.415 -4.230 -1.250 1.00 0.00 O ATOM 1079 CB VAL T 72 85.969 -2.328 0.632 1.00 0.00 C ATOM 1080 CG1 VAL T 72 84.508 -2.509 0.211 1.00 0.00 C ATOM 1081 CG2 VAL T 72 86.043 -1.333 1.792 1.00 0.00 C ATOM 0 H VAL T 72 88.402 -2.691 1.200 1.00 0.00 H new ATOM 0 HA VAL T 72 85.926 -4.089 1.875 1.00 0.00 H new ATOM 0 HB VAL T 72 86.544 -1.951 -0.214 1.00 0.00 H new ATOM 0 HG11 VAL T 72 84.100 -1.550 -0.109 1.00 0.00 H new ATOM 0 HG12 VAL T 72 84.452 -3.220 -0.613 1.00 0.00 H new ATOM 0 HG13 VAL T 72 83.930 -2.886 1.055 1.00 0.00 H new ATOM 0 HG21 VAL T 72 85.632 -0.374 1.476 1.00 0.00 H new ATOM 0 HG22 VAL T 72 85.467 -1.714 2.635 1.00 0.00 H new ATOM 0 HG23 VAL T 72 87.082 -1.201 2.092 1.00 0.00 H new ATOM 1091 N ASP T 73 86.741 -5.922 0.196 1.00 0.00 N ATOM 1092 CA ASP T 73 86.774 -6.935 -0.852 1.00 0.00 C ATOM 1093 C ASP T 73 85.405 -7.061 -1.513 1.00 0.00 C ATOM 1094 O ASP T 73 84.396 -6.619 -0.965 1.00 0.00 O ATOM 1095 CB ASP T 73 87.188 -8.285 -0.263 1.00 0.00 C ATOM 1096 CG ASP T 73 86.402 -8.559 1.014 1.00 0.00 C ATOM 1097 OD1 ASP T 73 85.199 -8.364 0.997 1.00 0.00 O ATOM 1098 OD2 ASP T 73 87.016 -8.959 1.990 1.00 0.00 O ATOM 0 H ASP T 73 86.864 -6.283 1.142 1.00 0.00 H new ATOM 0 HA ASP T 73 87.502 -6.632 -1.604 1.00 0.00 H new ATOM 0 HB2 ASP T 73 87.008 -9.078 -0.988 1.00 0.00 H new ATOM 0 HB3 ASP T 73 88.257 -8.286 -0.049 1.00 0.00 H new ATOM 1103 N PHE T 74 85.380 -7.664 -2.698 1.00 0.00 N ATOM 1104 CA PHE T 74 84.132 -7.839 -3.431 1.00 0.00 C ATOM 1105 C PHE T 74 83.166 -8.733 -2.657 1.00 0.00 C ATOM 1106 O PHE T 74 82.070 -9.030 -3.129 1.00 0.00 O ATOM 1107 CB PHE T 74 84.417 -8.461 -4.799 1.00 0.00 C ATOM 1108 CG PHE T 74 83.165 -8.424 -5.641 1.00 0.00 C ATOM 1109 CD1 PHE T 74 82.803 -7.246 -6.305 1.00 0.00 C ATOM 1110 CD2 PHE T 74 82.366 -9.568 -5.760 1.00 0.00 C ATOM 1111 CE1 PHE T 74 81.643 -7.211 -7.087 1.00 0.00 C ATOM 1112 CE2 PHE T 74 81.205 -9.533 -6.542 1.00 0.00 C ATOM 1113 CZ PHE T 74 80.844 -8.354 -7.206 1.00 0.00 C ATOM 0 H PHE T 74 86.205 -8.037 -3.168 1.00 0.00 H new ATOM 0 HA PHE T 74 83.672 -6.859 -3.561 1.00 0.00 H new ATOM 0 HB2 PHE T 74 85.219 -7.917 -5.297 1.00 0.00 H new ATOM 0 HB3 PHE T 74 84.757 -9.490 -4.679 1.00 0.00 H new ATOM 0 HD1 PHE T 74 83.419 -6.364 -6.214 1.00 0.00 H new ATOM 0 HD2 PHE T 74 82.645 -10.477 -5.249 1.00 0.00 H new ATOM 0 HE1 PHE T 74 81.364 -6.302 -7.599 1.00 0.00 H new ATOM 0 HE2 PHE T 74 80.588 -10.415 -6.633 1.00 0.00 H new ATOM 0 HZ PHE T 74 79.949 -8.327 -7.810 1.00 0.00 H new ATOM 1123 N ASP T 75 83.581 -9.163 -1.466 1.00 0.00 N ATOM 1124 CA ASP T 75 82.743 -10.028 -0.637 1.00 0.00 C ATOM 1125 C ASP T 75 81.847 -9.198 0.281 1.00 0.00 C ATOM 1126 O ASP T 75 80.640 -9.101 0.061 1.00 0.00 O ATOM 1127 CB ASP T 75 83.624 -10.955 0.206 1.00 0.00 C ATOM 1128 CG ASP T 75 84.766 -11.501 -0.644 1.00 0.00 C ATOM 1129 OD1 ASP T 75 84.503 -11.903 -1.765 1.00 0.00 O ATOM 1130 OD2 ASP T 75 85.885 -11.510 -0.160 1.00 0.00 O ATOM 0 H ASP T 75 84.485 -8.929 -1.056 1.00 0.00 H new ATOM 0 HA ASP T 75 82.110 -10.624 -1.295 1.00 0.00 H new ATOM 0 HB2 ASP T 75 84.024 -10.411 1.062 1.00 0.00 H new ATOM 0 HB3 ASP T 75 83.028 -11.778 0.601 1.00 0.00 H new ATOM 1135 N GLU T 76 82.445 -8.609 1.313 1.00 0.00 N ATOM 1136 CA GLU T 76 81.687 -7.798 2.260 1.00 0.00 C ATOM 1137 C GLU T 76 81.141 -6.542 1.587 1.00 0.00 C ATOM 1138 O GLU T 76 80.346 -5.809 2.174 1.00 0.00 O ATOM 1139 CB GLU T 76 82.576 -7.411 3.449 1.00 0.00 C ATOM 1140 CG GLU T 76 83.608 -6.364 3.014 1.00 0.00 C ATOM 1141 CD GLU T 76 84.747 -6.297 4.027 1.00 0.00 C ATOM 1142 OE1 GLU T 76 85.321 -7.335 4.314 1.00 0.00 O ATOM 1143 OE2 GLU T 76 85.028 -5.209 4.502 1.00 0.00 O ATOM 0 H GLU T 76 83.443 -8.677 1.514 1.00 0.00 H new ATOM 0 HA GLU T 76 80.844 -8.389 2.618 1.00 0.00 H new ATOM 0 HB2 GLU T 76 81.963 -7.015 4.258 1.00 0.00 H new ATOM 0 HB3 GLU T 76 83.083 -8.294 3.837 1.00 0.00 H new ATOM 0 HG2 GLU T 76 84.001 -6.617 2.029 1.00 0.00 H new ATOM 0 HG3 GLU T 76 83.132 -5.388 2.926 1.00 0.00 H new ATOM 1150 N PHE T 77 81.570 -6.299 0.352 1.00 0.00 N ATOM 1151 CA PHE T 77 81.112 -5.128 -0.385 1.00 0.00 C ATOM 1152 C PHE T 77 79.622 -5.241 -0.697 1.00 0.00 C ATOM 1153 O PHE T 77 78.825 -4.402 -0.275 1.00 0.00 O ATOM 1154 CB PHE T 77 81.899 -4.985 -1.690 1.00 0.00 C ATOM 1155 CG PHE T 77 81.371 -3.800 -2.467 1.00 0.00 C ATOM 1156 CD1 PHE T 77 81.647 -2.500 -2.029 1.00 0.00 C ATOM 1157 CD2 PHE T 77 80.605 -4.001 -3.623 1.00 0.00 C ATOM 1158 CE1 PHE T 77 81.159 -1.401 -2.745 1.00 0.00 C ATOM 1159 CE2 PHE T 77 80.117 -2.901 -4.339 1.00 0.00 C ATOM 1160 CZ PHE T 77 80.394 -1.601 -3.900 1.00 0.00 C ATOM 0 H PHE T 77 82.228 -6.891 -0.155 1.00 0.00 H new ATOM 0 HA PHE T 77 81.278 -4.247 0.235 1.00 0.00 H new ATOM 0 HB2 PHE T 77 82.959 -4.850 -1.475 1.00 0.00 H new ATOM 0 HB3 PHE T 77 81.807 -5.894 -2.285 1.00 0.00 H new ATOM 0 HD1 PHE T 77 82.237 -2.345 -1.138 1.00 0.00 H new ATOM 0 HD2 PHE T 77 80.391 -5.004 -3.962 1.00 0.00 H new ATOM 0 HE1 PHE T 77 81.373 -0.398 -2.406 1.00 0.00 H new ATOM 0 HE2 PHE T 77 79.527 -3.056 -5.230 1.00 0.00 H new ATOM 0 HZ PHE T 77 80.018 -0.753 -4.452 1.00 0.00 H new ATOM 1170 N LEU T 78 79.254 -6.282 -1.436 1.00 0.00 N ATOM 1171 CA LEU T 78 77.857 -6.494 -1.797 1.00 0.00 C ATOM 1172 C LEU T 78 76.959 -6.325 -0.575 1.00 0.00 C ATOM 1173 O LEU T 78 75.797 -5.938 -0.696 1.00 0.00 O ATOM 1174 CB LEU T 78 77.669 -7.900 -2.377 1.00 0.00 C ATOM 1175 CG LEU T 78 78.626 -8.116 -3.557 1.00 0.00 C ATOM 1176 CD1 LEU T 78 78.614 -9.594 -3.951 1.00 0.00 C ATOM 1177 CD2 LEU T 78 78.190 -7.261 -4.758 1.00 0.00 C ATOM 0 H LEU T 78 79.898 -6.987 -1.794 1.00 0.00 H new ATOM 0 HA LEU T 78 77.581 -5.753 -2.547 1.00 0.00 H new ATOM 0 HB2 LEU T 78 77.855 -8.648 -1.606 1.00 0.00 H new ATOM 0 HB3 LEU T 78 76.638 -8.031 -2.706 1.00 0.00 H new ATOM 0 HG LEU T 78 79.632 -7.820 -3.260 1.00 0.00 H new ATOM 0 HD11 LEU T 78 79.293 -9.753 -4.789 1.00 0.00 H new ATOM 0 HD12 LEU T 78 78.936 -10.199 -3.104 1.00 0.00 H new ATOM 0 HD13 LEU T 78 77.604 -9.885 -4.241 1.00 0.00 H new ATOM 0 HD21 LEU T 78 78.877 -7.423 -5.589 1.00 0.00 H new ATOM 0 HD22 LEU T 78 77.182 -7.545 -5.060 1.00 0.00 H new ATOM 0 HD23 LEU T 78 78.202 -6.208 -4.478 1.00 0.00 H new ATOM 1189 N VAL T 79 77.507 -6.613 0.600 1.00 0.00 N ATOM 1190 CA VAL T 79 76.747 -6.486 1.838 1.00 0.00 C ATOM 1191 C VAL T 79 76.594 -5.018 2.221 1.00 0.00 C ATOM 1192 O VAL T 79 75.605 -4.627 2.841 1.00 0.00 O ATOM 1193 CB VAL T 79 77.453 -7.241 2.965 1.00 0.00 C ATOM 1194 CG1 VAL T 79 76.640 -7.117 4.253 1.00 0.00 C ATOM 1195 CG2 VAL T 79 77.583 -8.718 2.584 1.00 0.00 C ATOM 0 H VAL T 79 78.468 -6.934 0.722 1.00 0.00 H new ATOM 0 HA VAL T 79 75.757 -6.914 1.682 1.00 0.00 H new ATOM 0 HB VAL T 79 78.444 -6.816 3.121 1.00 0.00 H new ATOM 0 HG11 VAL T 79 77.145 -7.656 5.055 1.00 0.00 H new ATOM 0 HG12 VAL T 79 76.547 -6.066 4.525 1.00 0.00 H new ATOM 0 HG13 VAL T 79 75.648 -7.541 4.099 1.00 0.00 H new ATOM 0 HG21 VAL T 79 78.086 -9.258 3.386 1.00 0.00 H new ATOM 0 HG22 VAL T 79 76.591 -9.142 2.428 1.00 0.00 H new ATOM 0 HG23 VAL T 79 78.164 -8.807 1.666 1.00 0.00 H new ATOM 1205 N MET T 80 77.581 -4.210 1.847 1.00 0.00 N ATOM 1206 CA MET T 80 77.548 -2.785 2.156 1.00 0.00 C ATOM 1207 C MET T 80 76.259 -2.154 1.638 1.00 0.00 C ATOM 1208 O MET T 80 75.705 -1.249 2.263 1.00 0.00 O ATOM 1209 CB MET T 80 78.755 -2.089 1.520 1.00 0.00 C ATOM 1210 CG MET T 80 78.886 -0.670 2.077 1.00 0.00 C ATOM 1211 SD MET T 80 79.998 0.291 1.020 1.00 0.00 S ATOM 1212 CE MET T 80 81.550 -0.217 1.800 1.00 0.00 C ATOM 0 H MET T 80 78.408 -4.515 1.333 1.00 0.00 H new ATOM 0 HA MET T 80 77.586 -2.663 3.238 1.00 0.00 H new ATOM 0 HB2 MET T 80 79.663 -2.656 1.725 1.00 0.00 H new ATOM 0 HB3 MET T 80 78.638 -2.055 0.437 1.00 0.00 H new ATOM 0 HG2 MET T 80 77.907 -0.193 2.122 1.00 0.00 H new ATOM 0 HG3 MET T 80 79.272 -0.702 3.096 1.00 0.00 H new ATOM 0 HE1 MET T 80 82.386 0.267 1.296 1.00 0.00 H new ATOM 0 HE2 MET T 80 81.542 0.074 2.850 1.00 0.00 H new ATOM 0 HE3 MET T 80 81.658 -1.299 1.724 1.00 0.00 H new ATOM 1222 N MET T 81 75.784 -2.639 0.494 1.00 0.00 N ATOM 1223 CA MET T 81 74.558 -2.113 -0.098 1.00 0.00 C ATOM 1224 C MET T 81 73.332 -2.705 0.590 1.00 0.00 C ATOM 1225 O MET T 81 72.501 -1.976 1.131 1.00 0.00 O ATOM 1226 CB MET T 81 74.514 -2.444 -1.592 1.00 0.00 C ATOM 1227 CG MET T 81 75.533 -1.583 -2.341 1.00 0.00 C ATOM 1228 SD MET T 81 77.207 -2.055 -1.838 1.00 0.00 S ATOM 1229 CE MET T 81 77.960 -0.414 -1.960 1.00 0.00 C ATOM 0 H MET T 81 76.225 -3.389 -0.038 1.00 0.00 H new ATOM 0 HA MET T 81 74.550 -1.031 0.036 1.00 0.00 H new ATOM 0 HB2 MET T 81 74.733 -3.501 -1.747 1.00 0.00 H new ATOM 0 HB3 MET T 81 73.513 -2.265 -1.985 1.00 0.00 H new ATOM 0 HG2 MET T 81 75.415 -1.713 -3.417 1.00 0.00 H new ATOM 0 HG3 MET T 81 75.361 -0.528 -2.127 1.00 0.00 H new ATOM 0 HE1 MET T 81 78.943 -0.429 -1.490 1.00 0.00 H new ATOM 0 HE2 MET T 81 78.063 -0.138 -3.009 1.00 0.00 H new ATOM 0 HE3 MET T 81 77.327 0.315 -1.454 1.00 0.00 H new ATOM 1239 N VAL T 82 73.226 -4.029 0.565 1.00 0.00 N ATOM 1240 CA VAL T 82 72.094 -4.711 1.187 1.00 0.00 C ATOM 1241 C VAL T 82 71.791 -4.117 2.560 1.00 0.00 C ATOM 1242 O VAL T 82 70.644 -4.115 3.005 1.00 0.00 O ATOM 1243 CB VAL T 82 72.398 -6.203 1.332 1.00 0.00 C ATOM 1244 CG1 VAL T 82 71.188 -6.914 1.939 1.00 0.00 C ATOM 1245 CG2 VAL T 82 72.699 -6.797 -0.047 1.00 0.00 C ATOM 0 H VAL T 82 73.905 -4.649 0.124 1.00 0.00 H new ATOM 0 HA VAL T 82 71.222 -4.577 0.547 1.00 0.00 H new ATOM 0 HB VAL T 82 73.262 -6.336 1.983 1.00 0.00 H new ATOM 0 HG11 VAL T 82 71.405 -7.977 2.042 1.00 0.00 H new ATOM 0 HG12 VAL T 82 70.972 -6.491 2.920 1.00 0.00 H new ATOM 0 HG13 VAL T 82 70.324 -6.781 1.288 1.00 0.00 H new ATOM 0 HG21 VAL T 82 72.916 -7.860 0.054 1.00 0.00 H new ATOM 0 HG22 VAL T 82 71.834 -6.663 -0.697 1.00 0.00 H new ATOM 0 HG23 VAL T 82 73.561 -6.291 -0.481 1.00 0.00 H new ATOM 1255 N ARG T 83 72.826 -3.613 3.224 1.00 0.00 N ATOM 1256 CA ARG T 83 72.654 -3.018 4.544 1.00 0.00 C ATOM 1257 C ARG T 83 72.029 -1.631 4.430 1.00 0.00 C ATOM 1258 O ARG T 83 70.839 -1.452 4.692 1.00 0.00 O ATOM 1259 CB ARG T 83 74.009 -2.913 5.250 1.00 0.00 C ATOM 1260 CG ARG T 83 74.457 -4.303 5.712 1.00 0.00 C ATOM 1261 CD ARG T 83 75.865 -4.214 6.302 1.00 0.00 C ATOM 1262 NE ARG T 83 75.910 -3.206 7.355 1.00 0.00 N ATOM 1263 CZ ARG T 83 76.905 -3.174 8.233 1.00 0.00 C ATOM 1264 NH1 ARG T 83 77.866 -4.055 8.165 1.00 0.00 N ATOM 1265 NH2 ARG T 83 76.923 -2.260 9.165 1.00 0.00 N ATOM 0 H ARG T 83 73.784 -3.604 2.874 1.00 0.00 H new ATOM 0 HA ARG T 83 71.989 -3.657 5.126 1.00 0.00 H new ATOM 0 HB2 ARG T 83 74.750 -2.487 4.574 1.00 0.00 H new ATOM 0 HB3 ARG T 83 73.934 -2.241 6.105 1.00 0.00 H new ATOM 0 HG2 ARG T 83 73.763 -4.692 6.457 1.00 0.00 H new ATOM 0 HG3 ARG T 83 74.446 -4.998 4.873 1.00 0.00 H new ATOM 0 HD2 ARG T 83 76.160 -5.183 6.704 1.00 0.00 H new ATOM 0 HD3 ARG T 83 76.580 -3.963 5.518 1.00 0.00 H new ATOM 0 HE ARG T 83 75.164 -2.513 7.418 1.00 0.00 H new ATOM 0 HH11 ARG T 83 77.853 -4.769 7.437 1.00 0.00 H new ATOM 0 HH12 ARG T 83 78.630 -4.029 8.840 1.00 0.00 H new ATOM 0 HH21 ARG T 83 76.173 -1.571 9.218 1.00 0.00 H new ATOM 0 HH22 ARG T 83 77.687 -2.235 9.840 1.00 0.00 H new ATOM 1279 N SER T 84 72.838 -0.653 4.038 1.00 0.00 N ATOM 1280 CA SER T 84 72.354 0.715 3.893 1.00 0.00 C ATOM 1281 C SER T 84 71.030 0.739 3.134 1.00 0.00 C ATOM 1282 O SER T 84 70.232 1.663 3.289 1.00 0.00 O ATOM 1283 CB SER T 84 73.387 1.557 3.145 1.00 0.00 C ATOM 1284 OG SER T 84 74.517 1.767 3.982 1.00 0.00 O ATOM 0 H SER T 84 73.825 -0.780 3.816 1.00 0.00 H new ATOM 0 HA SER T 84 72.197 1.131 4.888 1.00 0.00 H new ATOM 0 HB2 SER T 84 73.689 1.052 2.227 1.00 0.00 H new ATOM 0 HB3 SER T 84 72.952 2.513 2.855 1.00 0.00 H new ATOM 0 HG SER T 84 75.182 2.305 3.504 1.00 0.00 H new ATOM 1290 N MET T 85 70.805 -0.282 2.313 1.00 0.00 N ATOM 1291 CA MET T 85 69.574 -0.368 1.535 1.00 0.00 C ATOM 1292 C MET T 85 68.420 -0.855 2.407 1.00 0.00 C ATOM 1293 O MET T 85 67.552 -0.074 2.798 1.00 0.00 O ATOM 1294 CB MET T 85 69.766 -1.326 0.359 1.00 0.00 C ATOM 1295 CG MET T 85 70.700 -0.690 -0.673 1.00 0.00 C ATOM 1296 SD MET T 85 69.808 0.593 -1.585 1.00 0.00 S ATOM 1297 CE MET T 85 70.860 0.597 -3.058 1.00 0.00 C ATOM 0 H MET T 85 71.454 -1.056 2.170 1.00 0.00 H new ATOM 0 HA MET T 85 69.335 0.627 1.159 1.00 0.00 H new ATOM 0 HB2 MET T 85 70.184 -2.270 0.710 1.00 0.00 H new ATOM 0 HB3 MET T 85 68.803 -1.554 -0.098 1.00 0.00 H new ATOM 0 HG2 MET T 85 71.569 -0.260 -0.176 1.00 0.00 H new ATOM 0 HG3 MET T 85 71.070 -1.450 -1.361 1.00 0.00 H new ATOM 0 HE1 MET T 85 70.486 1.332 -3.771 1.00 0.00 H new ATOM 0 HE2 MET T 85 71.881 0.853 -2.775 1.00 0.00 H new ATOM 0 HE3 MET T 85 70.848 -0.392 -3.516 1.00 0.00 H new ATOM 1307 N LYS T 86 68.418 -2.150 2.707 1.00 0.00 N ATOM 1308 CA LYS T 86 67.365 -2.731 3.531 1.00 0.00 C ATOM 1309 C LYS T 86 67.292 -2.027 4.883 1.00 0.00 C ATOM 1310 O LYS T 86 66.329 -2.197 5.631 1.00 0.00 O ATOM 1311 CB LYS T 86 67.633 -4.223 3.744 1.00 0.00 C ATOM 1312 CG LYS T 86 66.369 -4.904 4.276 1.00 0.00 C ATOM 1313 CD LYS T 86 66.600 -6.413 4.367 1.00 0.00 C ATOM 1314 CE LYS T 86 65.279 -7.114 4.690 1.00 0.00 C ATOM 1315 NZ LYS T 86 65.491 -8.589 4.714 1.00 0.00 N ATOM 0 H LYS T 86 69.128 -2.812 2.394 1.00 0.00 H new ATOM 0 HA LYS T 86 66.413 -2.602 3.016 1.00 0.00 H new ATOM 0 HB2 LYS T 86 67.939 -4.685 2.805 1.00 0.00 H new ATOM 0 HB3 LYS T 86 68.454 -4.358 4.448 1.00 0.00 H new ATOM 0 HG2 LYS T 86 66.114 -4.505 5.258 1.00 0.00 H new ATOM 0 HG3 LYS T 86 65.526 -4.694 3.618 1.00 0.00 H new ATOM 0 HD2 LYS T 86 67.002 -6.787 3.425 1.00 0.00 H new ATOM 0 HD3 LYS T 86 67.338 -6.633 5.138 1.00 0.00 H new ATOM 0 HE2 LYS T 86 64.901 -6.775 5.655 1.00 0.00 H new ATOM 0 HE3 LYS T 86 64.527 -6.856 3.945 1.00 0.00 H new ATOM 0 HZ1 LYS T 86 64.593 -9.065 4.934 1.00 0.00 H new ATOM 0 HZ2 LYS T 86 65.833 -8.906 3.784 1.00 0.00 H new ATOM 0 HZ3 LYS T 86 66.196 -8.827 5.441 1.00 0.00 H new ATOM 1329 N ASP T 87 68.315 -1.234 5.190 1.00 0.00 N ATOM 1330 CA ASP T 87 68.355 -0.508 6.455 1.00 0.00 C ATOM 1331 C ASP T 87 69.296 0.689 6.357 1.00 0.00 C ATOM 1332 O ASP T 87 70.502 0.561 6.566 1.00 0.00 O ATOM 1333 CB ASP T 87 68.824 -1.438 7.576 1.00 0.00 C ATOM 1334 CG ASP T 87 67.835 -2.586 7.750 1.00 0.00 C ATOM 1335 OD1 ASP T 87 67.936 -3.547 7.003 1.00 0.00 O ATOM 1336 OD2 ASP T 87 66.992 -2.488 8.625 1.00 0.00 O ATOM 0 H ASP T 87 69.121 -1.079 4.585 1.00 0.00 H new ATOM 0 HA ASP T 87 67.350 -0.148 6.678 1.00 0.00 H new ATOM 0 HB2 ASP T 87 69.813 -1.832 7.343 1.00 0.00 H new ATOM 0 HB3 ASP T 87 68.914 -0.880 8.508 1.00 0.00 H new ATOM 1341 N ASP T 88 68.735 1.851 6.040 1.00 0.00 N ATOM 1342 CA ASP T 88 69.532 3.066 5.917 1.00 0.00 C ATOM 1343 C ASP T 88 69.845 3.642 7.294 1.00 0.00 C ATOM 1344 O ASP T 88 68.973 4.208 7.954 1.00 0.00 O ATOM 1345 CB ASP T 88 68.776 4.105 5.088 1.00 0.00 C ATOM 1346 CG ASP T 88 67.370 4.295 5.646 1.00 0.00 C ATOM 1347 OD1 ASP T 88 66.649 3.315 5.732 1.00 0.00 O ATOM 1348 OD2 ASP T 88 67.034 5.420 5.982 1.00 0.00 O ATOM 0 H ASP T 88 67.738 1.977 5.865 1.00 0.00 H new ATOM 0 HA ASP T 88 70.468 2.815 5.418 1.00 0.00 H new ATOM 0 HB2 ASP T 88 69.313 5.054 5.102 1.00 0.00 H new ATOM 0 HB3 ASP T 88 68.723 3.784 4.048 1.00 0.00 H new ATOM 1353 N SER T 89 71.095 3.495 7.722 1.00 0.00 N ATOM 1354 CA SER T 89 71.511 4.006 9.024 1.00 0.00 C ATOM 1355 C SER T 89 73.029 3.948 9.161 1.00 0.00 C ATOM 1356 O SER T 89 73.681 3.615 8.184 1.00 0.00 O ATOM 1357 CB SER T 89 70.865 3.184 10.138 1.00 0.00 C ATOM 1358 OG SER T 89 71.593 1.974 10.313 1.00 0.00 O ATOM 1359 OXT SER T 89 73.518 4.237 10.240 1.00 0.00 O ATOM 0 H SER T 89 71.832 3.030 7.192 1.00 0.00 H new ATOM 0 HA SER T 89 71.189 5.044 9.106 1.00 0.00 H new ATOM 0 HB2 SER T 89 70.856 3.754 11.067 1.00 0.00 H new ATOM 0 HB3 SER T 89 69.827 2.964 9.888 1.00 0.00 H new ATOM 0 HG SER T 89 71.182 1.445 11.028 1.00 0.00 H new