USER MOD reduce.3.24.130724 H: found=0, std=0, add=777, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 775 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 87 SER OG : rot 179:sc= 0.249 USER MOD Set 1.2: A 89 GLN : amide:sc= -2.23 K(o=-2,f=0.12) USER MOD Set 2.1: A 80 GLN : amide:sc= -1.11 K(o=-0.64,f=-0.098) USER MOD Set 2.2: A 84 THR OG1 : rot 98:sc= 0.464 USER MOD Set 3.1: A 45 LYS NZ :NH3+ 156:sc= 0.375 (180deg=0) USER MOD Set 3.2: A 48 CYS SG : rot -3:sc= -0.382 USER MOD Set 4.1: A 44 SER OG : rot 9:sc= 0.91 USER MOD Set 4.2: A 51 SER OG : rot 107:sc= 0.417 USER MOD Set 4.3: A 52 THR OG1 : rot -15:sc= 0.721 USER MOD Set 5.1: A 38 ASN : amide:sc= -0.616 K(o=-6.9,f=-5.9) USER MOD Set 5.2: A 41 MET CE :methyl 156:sc= -6.27! (180deg=-7.67!) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 HIS : no HD1:sc= -0.86 X(o=-0.86,f=-0.82) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 7:sc= 0.674 USER MOD Single : A 65 TYR OH : rot -87:sc= 0.731 USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 GLN : amide:sc= -0.337 X(o=-0.34,f=-0.28) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 88 ASN : amide:sc= -0.159 K(o=-0.16,f=-2!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 THR OG1 : rot 160:sc= 0.0688 USER MOD Single : A 94 ASN : amide:sc= -6.17! C(o=-6.2!,f=-7!) USER MOD Single : A 98 ASN : amide:sc= -0.801 K(o=-0.8,f=-3.5!) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 HIS : no HD1:sc= -0.25 X(o=-0.25,f=-0.49) USER MOD Single : A 105 CYS SG : rot 56:sc= -0.14 USER MOD Single : A 108 THR OG1 : rot 122:sc= -0.752 USER MOD Single : A 110 GLN : amide:sc= -2.37 K(o=-2.4,f=-7.3!) USER MOD Single : A 112 HIS : no HD1:sc= -1.32 X(o=-1.3,f=-1.7) USER MOD Single : A 113 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 ASN : amide:sc=-0.000505 X(o=-0.00051,f=-0.063) USER MOD Single : A 118 GLN : amide:sc= -0.0644 X(o=-0.064,f=0) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 27 3.407 -2.558 -5.692 1.00 55.11 N ATOM 66 CA LEU A 27 4.471 -3.436 -6.165 1.00 5.30 C ATOM 67 C LEU A 27 3.946 -4.415 -7.209 1.00 65.12 C ATOM 68 O LEU A 27 4.425 -4.445 -8.343 1.00 45.11 O ATOM 69 CB LEU A 27 5.085 -4.203 -4.992 1.00 73.43 C ATOM 70 CG LEU A 27 5.935 -5.421 -5.359 1.00 14.25 C ATOM 71 CD1 LEU A 27 7.371 -5.228 -4.897 1.00 55.35 C ATOM 72 CD2 LEU A 27 5.343 -6.685 -4.753 1.00 3.14 C ATOM 0 HA LEU A 27 5.239 -2.818 -6.629 1.00 5.30 H new ATOM 0 HB2 LEU A 27 5.703 -3.514 -4.416 1.00 73.43 H new ATOM 0 HB3 LEU A 27 4.279 -4.532 -4.336 1.00 73.43 H new ATOM 0 HG LEU A 27 5.935 -5.527 -6.444 1.00 14.25 H new ATOM 0 HD11 LEU A 27 7.961 -6.104 -5.167 1.00 55.35 H new ATOM 0 HD12 LEU A 27 7.792 -4.345 -5.378 1.00 55.35 H new ATOM 0 HD13 LEU A 27 7.391 -5.096 -3.815 1.00 55.35 H new ATOM 0 HD21 LEU A 27 5.960 -7.542 -5.024 1.00 3.14 H new ATOM 0 HD22 LEU A 27 5.313 -6.588 -3.668 1.00 3.14 H new ATOM 0 HD23 LEU A 27 4.332 -6.831 -5.133 1.00 3.14 H new ATOM 84 N ARG A 28 2.957 -5.213 -6.820 1.00 62.54 N ATOM 85 CA ARG A 28 2.367 -6.194 -7.723 1.00 33.21 C ATOM 86 C ARG A 28 1.916 -5.534 -9.022 1.00 43.34 C ATOM 87 O ARG A 28 2.135 -6.067 -10.110 1.00 75.45 O ATOM 88 CB ARG A 28 1.178 -6.886 -7.052 1.00 2.12 C ATOM 89 CG ARG A 28 0.856 -8.249 -7.641 1.00 72.54 C ATOM 90 CD ARG A 28 0.230 -8.125 -9.022 1.00 61.13 C ATOM 91 NE ARG A 28 -0.974 -8.942 -9.153 1.00 11.40 N ATOM 92 CZ ARG A 28 -1.929 -8.704 -10.044 1.00 72.24 C ATOM 93 NH1 ARG A 28 -1.821 -7.681 -10.880 1.00 50.24 N ATOM 94 NH2 ARG A 28 -2.995 -9.492 -10.102 1.00 52.23 N ATOM 0 H ARG A 28 2.548 -5.199 -5.886 1.00 62.54 H new ATOM 0 HA ARG A 28 3.128 -6.938 -7.958 1.00 33.21 H new ATOM 0 HB2 ARG A 28 1.387 -6.999 -5.988 1.00 2.12 H new ATOM 0 HB3 ARG A 28 0.300 -6.246 -7.138 1.00 2.12 H new ATOM 0 HG2 ARG A 28 1.767 -8.843 -7.705 1.00 72.54 H new ATOM 0 HG3 ARG A 28 0.174 -8.782 -6.978 1.00 72.54 H new ATOM 0 HD2 ARG A 28 -0.017 -7.081 -9.215 1.00 61.13 H new ATOM 0 HD3 ARG A 28 0.956 -8.426 -9.777 1.00 61.13 H new ATOM 0 HE ARG A 28 -1.087 -9.738 -8.526 1.00 11.40 H new ATOM 0 HH11 ARG A 28 -1.002 -7.074 -10.840 1.00 50.24 H new ATOM 0 HH12 ARG A 28 -2.557 -7.501 -11.563 1.00 50.24 H new ATOM 0 HH21 ARG A 28 -3.081 -10.281 -9.462 1.00 52.23 H new ATOM 0 HH22 ARG A 28 -3.728 -9.308 -10.787 1.00 52.23 H new ATOM 108 N ARG A 29 1.286 -4.369 -8.902 1.00 23.34 N ATOM 109 CA ARG A 29 0.803 -3.637 -10.066 1.00 2.11 C ATOM 110 C ARG A 29 1.949 -3.325 -11.024 1.00 54.45 C ATOM 111 O ARG A 29 1.731 -3.099 -12.215 1.00 40.54 O ATOM 112 CB ARG A 29 0.119 -2.339 -9.632 1.00 32.14 C ATOM 113 CG ARG A 29 -1.241 -2.124 -10.273 1.00 51.41 C ATOM 114 CD ARG A 29 -2.358 -2.702 -9.419 1.00 33.15 C ATOM 115 NE ARG A 29 -3.627 -2.756 -10.141 1.00 21.34 N ATOM 116 CZ ARG A 29 -4.667 -3.483 -9.744 1.00 61.34 C ATOM 117 NH1 ARG A 29 -4.589 -4.212 -8.640 1.00 5.15 N ATOM 118 NH2 ARG A 29 -5.788 -3.481 -10.455 1.00 24.14 N ATOM 0 H ARG A 29 1.098 -3.912 -8.009 1.00 23.34 H new ATOM 0 HA ARG A 29 0.078 -4.265 -10.584 1.00 2.11 H new ATOM 0 HB2 ARG A 29 0.004 -2.344 -8.548 1.00 32.14 H new ATOM 0 HB3 ARG A 29 0.765 -1.497 -9.880 1.00 32.14 H new ATOM 0 HG2 ARG A 29 -1.410 -1.057 -10.421 1.00 51.41 H new ATOM 0 HG3 ARG A 29 -1.257 -2.589 -11.259 1.00 51.41 H new ATOM 0 HD2 ARG A 29 -2.083 -3.705 -9.093 1.00 33.15 H new ATOM 0 HD3 ARG A 29 -2.478 -2.097 -8.520 1.00 33.15 H new ATOM 0 HE ARG A 29 -3.720 -2.207 -10.995 1.00 21.34 H new ATOM 0 HH11 ARG A 29 -3.729 -4.217 -8.092 1.00 5.15 H new ATOM 0 HH12 ARG A 29 -5.389 -4.768 -8.339 1.00 5.15 H new ATOM 0 HH21 ARG A 29 -5.851 -2.922 -11.306 1.00 24.14 H new ATOM 0 HH22 ARG A 29 -6.586 -4.039 -10.151 1.00 24.14 H new ATOM 132 N ARG A 30 3.169 -3.312 -10.497 1.00 53.01 N ATOM 133 CA ARG A 30 4.347 -3.025 -11.305 1.00 43.33 C ATOM 134 C ARG A 30 4.868 -4.292 -11.978 1.00 31.25 C ATOM 135 O ARG A 30 5.278 -4.270 -13.139 1.00 4.53 O ATOM 136 CB ARG A 30 5.447 -2.406 -10.440 1.00 1.10 C ATOM 137 CG ARG A 30 6.081 -1.169 -11.055 1.00 1.22 C ATOM 138 CD ARG A 30 6.816 -0.343 -10.011 1.00 25.02 C ATOM 139 NE ARG A 30 6.834 1.078 -10.349 1.00 63.52 N ATOM 140 CZ ARG A 30 7.692 1.947 -9.826 1.00 53.11 C ATOM 141 NH1 ARG A 30 8.596 1.543 -8.945 1.00 31.04 N ATOM 142 NH2 ARG A 30 7.645 3.224 -10.184 1.00 40.11 N ATOM 0 H ARG A 30 3.367 -3.497 -9.514 1.00 53.01 H new ATOM 0 HA ARG A 30 4.060 -2.314 -12.080 1.00 43.33 H new ATOM 0 HB2 ARG A 30 5.029 -2.145 -9.468 1.00 1.10 H new ATOM 0 HB3 ARG A 30 6.222 -3.152 -10.264 1.00 1.10 H new ATOM 0 HG2 ARG A 30 6.776 -1.467 -11.840 1.00 1.22 H new ATOM 0 HG3 ARG A 30 5.310 -0.559 -11.526 1.00 1.22 H new ATOM 0 HD2 ARG A 30 6.339 -0.478 -9.040 1.00 25.02 H new ATOM 0 HD3 ARG A 30 7.839 -0.706 -9.917 1.00 25.02 H new ATOM 0 HE ARG A 30 6.150 1.422 -11.023 1.00 63.52 H new ATOM 0 HH11 ARG A 30 8.634 0.562 -8.667 1.00 31.04 H new ATOM 0 HH12 ARG A 30 9.253 2.213 -8.545 1.00 31.04 H new ATOM 0 HH21 ARG A 30 6.950 3.539 -10.861 1.00 40.11 H new ATOM 0 HH22 ARG A 30 8.304 3.891 -9.782 1.00 40.11 H new ATOM 156 N LEU A 31 4.848 -5.397 -11.240 1.00 72.01 N ATOM 157 CA LEU A 31 5.318 -6.675 -11.764 1.00 54.12 C ATOM 158 C LEU A 31 4.518 -7.085 -12.997 1.00 22.53 C ATOM 159 O LEU A 31 5.077 -7.592 -13.970 1.00 13.12 O ATOM 160 CB LEU A 31 5.212 -7.759 -10.690 1.00 25.54 C ATOM 161 CG LEU A 31 5.660 -7.357 -9.284 1.00 63.22 C ATOM 162 CD1 LEU A 31 5.607 -8.552 -8.344 1.00 53.35 C ATOM 163 CD2 LEU A 31 7.063 -6.767 -9.320 1.00 15.22 C ATOM 0 H LEU A 31 4.512 -5.434 -10.278 1.00 72.01 H new ATOM 0 HA LEU A 31 6.363 -6.559 -12.053 1.00 54.12 H new ATOM 0 HB2 LEU A 31 4.175 -8.091 -10.638 1.00 25.54 H new ATOM 0 HB3 LEU A 31 5.806 -8.616 -11.008 1.00 25.54 H new ATOM 0 HG LEU A 31 4.976 -6.596 -8.909 1.00 63.22 H new ATOM 0 HD11 LEU A 31 5.929 -8.246 -7.349 1.00 53.35 H new ATOM 0 HD12 LEU A 31 4.586 -8.931 -8.295 1.00 53.35 H new ATOM 0 HD13 LEU A 31 6.268 -9.336 -8.714 1.00 53.35 H new ATOM 0 HD21 LEU A 31 7.366 -6.486 -8.311 1.00 15.22 H new ATOM 0 HD22 LEU A 31 7.759 -7.507 -9.715 1.00 15.22 H new ATOM 0 HD23 LEU A 31 7.070 -5.884 -9.960 1.00 15.22 H new ATOM 175 N ARG A 32 3.210 -6.862 -12.948 1.00 13.12 N ATOM 176 CA ARG A 32 2.333 -7.208 -14.061 1.00 2.54 C ATOM 177 C ARG A 32 2.438 -6.172 -15.177 1.00 31.14 C ATOM 178 O ARG A 32 2.430 -6.516 -16.359 1.00 14.52 O ATOM 179 CB ARG A 32 0.884 -7.314 -13.583 1.00 52.31 C ATOM 180 CG ARG A 32 0.494 -8.710 -13.127 1.00 30.31 C ATOM 181 CD ARG A 32 0.577 -9.713 -14.268 1.00 12.42 C ATOM 182 NE ARG A 32 -0.117 -9.240 -15.463 1.00 44.53 N ATOM 183 CZ ARG A 32 -1.434 -9.294 -15.618 1.00 13.24 C ATOM 184 NH1 ARG A 32 -2.198 -9.796 -14.657 1.00 73.34 N ATOM 185 NH2 ARG A 32 -1.992 -8.843 -16.734 1.00 74.41 N ATOM 0 H ARG A 32 2.733 -6.443 -12.150 1.00 13.12 H new ATOM 0 HA ARG A 32 2.649 -8.174 -14.454 1.00 2.54 H new ATOM 0 HB2 ARG A 32 0.730 -6.616 -12.760 1.00 52.31 H new ATOM 0 HB3 ARG A 32 0.220 -7.006 -14.391 1.00 52.31 H new ATOM 0 HG2 ARG A 32 1.150 -9.025 -12.316 1.00 30.31 H new ATOM 0 HG3 ARG A 32 -0.520 -8.694 -12.729 1.00 30.31 H new ATOM 0 HD2 ARG A 32 1.623 -9.904 -14.508 1.00 12.42 H new ATOM 0 HD3 ARG A 32 0.145 -10.662 -13.949 1.00 12.42 H new ATOM 0 HE ARG A 32 0.441 -8.846 -16.220 1.00 44.53 H new ATOM 0 HH11 ARG A 32 -1.774 -10.142 -13.796 1.00 73.34 H new ATOM 0 HH12 ARG A 32 -3.210 -9.836 -14.779 1.00 73.34 H new ATOM 0 HH21 ARG A 32 -1.409 -8.454 -17.475 1.00 74.41 H new ATOM 0 HH22 ARG A 32 -3.004 -8.885 -16.851 1.00 74.41 H new ATOM 199 N ASP A 33 2.535 -4.903 -14.793 1.00 23.44 N ATOM 200 CA ASP A 33 2.642 -3.818 -15.760 1.00 53.43 C ATOM 201 C ASP A 33 3.952 -3.907 -16.535 1.00 4.33 C ATOM 202 O ASP A 33 4.018 -3.543 -17.710 1.00 1.11 O ATOM 203 CB ASP A 33 2.545 -2.465 -15.053 1.00 54.30 C ATOM 204 CG ASP A 33 2.439 -1.309 -16.027 1.00 72.14 C ATOM 205 OD1 ASP A 33 3.410 -1.073 -16.775 1.00 5.51 O ATOM 206 OD2 ASP A 33 1.383 -0.640 -16.043 1.00 5.21 O ATOM 0 H ASP A 33 2.542 -4.602 -13.819 1.00 23.44 H new ATOM 0 HA ASP A 33 1.816 -3.911 -16.466 1.00 53.43 H new ATOM 0 HB2 ASP A 33 1.675 -2.463 -14.396 1.00 54.30 H new ATOM 0 HB3 ASP A 33 3.422 -2.325 -14.421 1.00 54.30 H new ATOM 211 N LEU A 34 4.996 -4.392 -15.870 1.00 74.03 N ATOM 212 CA LEU A 34 6.306 -4.528 -16.496 1.00 24.25 C ATOM 213 C LEU A 34 6.217 -5.362 -17.770 1.00 1.00 C ATOM 214 O LEU A 34 6.977 -5.150 -18.716 1.00 12.04 O ATOM 215 CB LEU A 34 7.295 -5.171 -15.521 1.00 74.12 C ATOM 216 CG LEU A 34 8.642 -4.464 -15.367 1.00 34.12 C ATOM 217 CD1 LEU A 34 9.587 -5.297 -14.515 1.00 54.25 C ATOM 218 CD2 LEU A 34 9.256 -4.185 -16.731 1.00 40.52 C ATOM 0 H LEU A 34 4.960 -4.697 -14.897 1.00 74.03 H new ATOM 0 HA LEU A 34 6.660 -3.531 -16.760 1.00 24.25 H new ATOM 0 HB2 LEU A 34 6.823 -5.227 -14.540 1.00 74.12 H new ATOM 0 HB3 LEU A 34 7.480 -6.195 -15.845 1.00 74.12 H new ATOM 0 HG LEU A 34 8.476 -3.512 -14.864 1.00 34.12 H new ATOM 0 HD11 LEU A 34 10.541 -4.778 -14.416 1.00 54.25 H new ATOM 0 HD12 LEU A 34 9.151 -5.446 -13.527 1.00 54.25 H new ATOM 0 HD13 LEU A 34 9.748 -6.265 -14.990 1.00 54.25 H new ATOM 0 HD21 LEU A 34 10.214 -3.681 -16.603 1.00 40.52 H new ATOM 0 HD22 LEU A 34 9.408 -5.125 -17.261 1.00 40.52 H new ATOM 0 HD23 LEU A 34 8.586 -3.548 -17.308 1.00 40.52 H new ATOM 230 N ILE A 35 5.284 -6.307 -17.789 1.00 74.32 N ATOM 231 CA ILE A 35 5.093 -7.169 -18.948 1.00 43.05 C ATOM 232 C ILE A 35 4.354 -6.436 -20.063 1.00 64.22 C ATOM 233 O ILE A 35 4.446 -6.810 -21.232 1.00 10.30 O ATOM 234 CB ILE A 35 4.309 -8.443 -18.580 1.00 63.35 C ATOM 235 CG1 ILE A 35 5.050 -9.227 -17.495 1.00 73.31 C ATOM 236 CG2 ILE A 35 4.095 -9.308 -19.814 1.00 51.41 C ATOM 237 CD1 ILE A 35 4.311 -9.280 -16.177 1.00 13.34 C ATOM 0 H ILE A 35 4.648 -6.495 -17.014 1.00 74.32 H new ATOM 0 HA ILE A 35 6.086 -7.451 -19.297 1.00 43.05 H new ATOM 0 HB ILE A 35 3.333 -8.153 -18.190 1.00 63.35 H new ATOM 0 HG12 ILE A 35 5.222 -10.244 -17.847 1.00 73.31 H new ATOM 0 HG13 ILE A 35 6.029 -8.775 -17.336 1.00 73.31 H new ATOM 0 HG21 ILE A 35 3.540 -10.204 -19.538 1.00 51.41 H new ATOM 0 HG22 ILE A 35 3.531 -8.746 -20.559 1.00 51.41 H new ATOM 0 HG23 ILE A 35 5.061 -9.593 -20.230 1.00 51.41 H new ATOM 0 HD11 ILE A 35 4.895 -9.851 -15.455 1.00 13.34 H new ATOM 0 HD12 ILE A 35 4.162 -8.267 -15.803 1.00 13.34 H new ATOM 0 HD13 ILE A 35 3.343 -9.760 -16.322 1.00 13.34 H new ATOM 249 N GLU A 36 3.624 -5.388 -19.693 1.00 24.42 N ATOM 250 CA GLU A 36 2.870 -4.602 -20.662 1.00 61.34 C ATOM 251 C GLU A 36 3.754 -3.535 -21.302 1.00 64.12 C ATOM 252 O GLU A 36 3.551 -3.153 -22.454 1.00 21.55 O ATOM 253 CB GLU A 36 1.663 -3.944 -19.991 1.00 33.31 C ATOM 254 CG GLU A 36 0.695 -3.306 -20.972 1.00 54.42 C ATOM 255 CD GLU A 36 -0.397 -2.512 -20.280 1.00 40.11 C ATOM 256 OE1 GLU A 36 -1.092 -3.087 -19.417 1.00 12.42 O ATOM 257 OE2 GLU A 36 -0.556 -1.316 -20.603 1.00 12.20 O ATOM 0 H GLU A 36 3.539 -5.064 -18.730 1.00 24.42 H new ATOM 0 HA GLU A 36 2.519 -5.276 -21.443 1.00 61.34 H new ATOM 0 HB2 GLU A 36 1.131 -4.693 -19.404 1.00 33.31 H new ATOM 0 HB3 GLU A 36 2.015 -3.183 -19.294 1.00 33.31 H new ATOM 0 HG2 GLU A 36 1.246 -2.649 -21.645 1.00 54.42 H new ATOM 0 HG3 GLU A 36 0.240 -4.083 -21.586 1.00 54.42 H new ATOM 264 N GLY A 37 4.737 -3.056 -20.544 1.00 74.40 N ATOM 265 CA GLY A 37 5.636 -2.037 -21.053 1.00 22.53 C ATOM 266 C GLY A 37 6.668 -2.600 -22.010 1.00 71.51 C ATOM 267 O GLY A 37 7.331 -1.853 -22.728 1.00 51.44 O ATOM 0 H GLY A 37 4.926 -3.356 -19.588 1.00 74.40 H new ATOM 0 HA2 GLY A 37 5.056 -1.266 -21.561 1.00 22.53 H new ATOM 0 HA3 GLY A 37 6.144 -1.555 -20.218 1.00 22.53 H new ATOM 271 N ASN A 38 6.805 -3.922 -22.021 1.00 14.23 N ATOM 272 CA ASN A 38 7.764 -4.584 -22.896 1.00 30.34 C ATOM 273 C ASN A 38 7.188 -5.884 -23.451 1.00 55.04 C ATOM 274 O ASN A 38 6.509 -6.627 -22.742 1.00 42.35 O ATOM 275 CB ASN A 38 9.062 -4.872 -22.139 1.00 4.52 C ATOM 276 CG ASN A 38 9.482 -3.717 -21.251 1.00 14.11 C ATOM 277 OD1 ASN A 38 10.304 -2.888 -21.640 1.00 3.45 O ATOM 278 ND2 ASN A 38 8.916 -3.657 -20.050 1.00 62.44 N ATOM 0 H ASN A 38 6.263 -4.556 -21.433 1.00 14.23 H new ATOM 0 HA ASN A 38 7.977 -3.916 -23.730 1.00 30.34 H new ATOM 0 HB2 ASN A 38 8.933 -5.767 -21.530 1.00 4.52 H new ATOM 0 HB3 ASN A 38 9.857 -5.085 -22.854 1.00 4.52 H new ATOM 0 HD21 ASN A 38 9.159 -2.901 -19.409 1.00 62.44 H new ATOM 0 HD22 ASN A 38 8.239 -4.366 -19.769 1.00 62.44 H new ATOM 285 N ARG A 39 7.463 -6.150 -24.724 1.00 24.55 N ATOM 286 CA ARG A 39 6.972 -7.359 -25.374 1.00 51.12 C ATOM 287 C ARG A 39 7.241 -8.588 -24.512 1.00 34.10 C ATOM 288 O ARG A 39 6.321 -9.331 -24.167 1.00 43.35 O ATOM 289 CB ARG A 39 7.632 -7.531 -26.744 1.00 54.45 C ATOM 290 CG ARG A 39 7.494 -8.932 -27.316 1.00 12.22 C ATOM 291 CD ARG A 39 7.017 -8.900 -28.759 1.00 41.04 C ATOM 292 NE ARG A 39 7.748 -7.917 -29.555 1.00 52.21 N ATOM 293 CZ ARG A 39 7.359 -7.509 -30.759 1.00 11.14 C ATOM 294 NH1 ARG A 39 6.251 -7.997 -31.300 1.00 41.32 N ATOM 295 NH2 ARG A 39 8.077 -6.612 -31.421 1.00 14.21 N ATOM 0 H ARG A 39 8.023 -5.545 -25.325 1.00 24.55 H new ATOM 0 HA ARG A 39 5.895 -7.258 -25.506 1.00 51.12 H new ATOM 0 HB2 ARG A 39 7.192 -6.818 -27.442 1.00 54.45 H new ATOM 0 HB3 ARG A 39 8.690 -7.284 -26.661 1.00 54.45 H new ATOM 0 HG2 ARG A 39 8.454 -9.445 -27.260 1.00 12.22 H new ATOM 0 HG3 ARG A 39 6.791 -9.505 -26.712 1.00 12.22 H new ATOM 0 HD2 ARG A 39 7.138 -9.888 -29.203 1.00 41.04 H new ATOM 0 HD3 ARG A 39 5.952 -8.667 -28.784 1.00 41.04 H new ATOM 0 HE ARG A 39 8.604 -7.522 -29.166 1.00 52.21 H new ATOM 0 HH11 ARG A 39 5.696 -8.686 -30.792 1.00 41.32 H new ATOM 0 HH12 ARG A 39 5.953 -7.683 -32.224 1.00 41.32 H new ATOM 0 HH21 ARG A 39 8.929 -6.234 -31.007 1.00 14.21 H new ATOM 0 HH22 ARG A 39 7.777 -6.300 -32.345 1.00 14.21 H new ATOM 309 N VAL A 40 8.506 -8.798 -24.166 1.00 64.04 N ATOM 310 CA VAL A 40 8.897 -9.937 -23.344 1.00 13.45 C ATOM 311 C VAL A 40 9.424 -9.480 -21.988 1.00 22.35 C ATOM 312 O VAL A 40 10.322 -8.642 -21.910 1.00 60.25 O ATOM 313 CB VAL A 40 9.972 -10.791 -24.040 1.00 41.10 C ATOM 314 CG1 VAL A 40 10.398 -11.947 -23.147 1.00 44.54 C ATOM 315 CG2 VAL A 40 9.463 -11.301 -25.379 1.00 54.42 C ATOM 0 H VAL A 40 9.279 -8.193 -24.443 1.00 64.04 H new ATOM 0 HA VAL A 40 8.003 -10.543 -23.198 1.00 13.45 H new ATOM 0 HB VAL A 40 10.845 -10.165 -24.224 1.00 41.10 H new ATOM 0 HG11 VAL A 40 11.158 -12.539 -23.656 1.00 44.54 H new ATOM 0 HG12 VAL A 40 10.807 -11.556 -22.215 1.00 44.54 H new ATOM 0 HG13 VAL A 40 9.535 -12.575 -22.929 1.00 44.54 H new ATOM 0 HG21 VAL A 40 10.236 -11.903 -25.857 1.00 54.42 H new ATOM 0 HG22 VAL A 40 8.574 -11.911 -25.222 1.00 54.42 H new ATOM 0 HG23 VAL A 40 9.214 -10.455 -26.020 1.00 54.42 H new ATOM 325 N MET A 41 8.861 -10.038 -20.921 1.00 43.34 N ATOM 326 CA MET A 41 9.277 -9.689 -19.568 1.00 3.21 C ATOM 327 C MET A 41 9.511 -10.943 -18.731 1.00 4.13 C ATOM 328 O MET A 41 8.672 -11.843 -18.696 1.00 43.53 O ATOM 329 CB MET A 41 8.222 -8.805 -18.898 1.00 60.05 C ATOM 330 CG MET A 41 8.670 -8.225 -17.567 1.00 30.42 C ATOM 331 SD MET A 41 10.208 -7.293 -17.698 1.00 1.15 S ATOM 332 CE MET A 41 9.938 -6.408 -19.231 1.00 15.30 C ATOM 0 H MET A 41 8.116 -10.733 -20.967 1.00 43.34 H new ATOM 0 HA MET A 41 10.214 -9.137 -19.634 1.00 3.21 H new ATOM 0 HB2 MET A 41 7.963 -7.988 -19.572 1.00 60.05 H new ATOM 0 HB3 MET A 41 7.315 -9.390 -18.743 1.00 60.05 H new ATOM 0 HG2 MET A 41 7.887 -7.574 -17.177 1.00 30.42 H new ATOM 0 HG3 MET A 41 8.800 -9.034 -16.848 1.00 30.42 H new ATOM 0 HE1 MET A 41 10.553 -5.508 -19.245 1.00 15.30 H new ATOM 0 HE2 MET A 41 10.210 -7.046 -20.072 1.00 15.30 H new ATOM 0 HE3 MET A 41 8.887 -6.131 -19.311 1.00 15.30 H new ATOM 342 N ILE A 42 10.657 -10.994 -18.058 1.00 50.24 N ATOM 343 CA ILE A 42 11.000 -12.137 -17.222 1.00 10.34 C ATOM 344 C ILE A 42 11.698 -11.691 -15.941 1.00 31.41 C ATOM 345 O ILE A 42 12.342 -10.642 -15.906 1.00 31.43 O ATOM 346 CB ILE A 42 11.910 -13.129 -17.970 1.00 54.12 C ATOM 347 CG1 ILE A 42 13.292 -12.514 -18.199 1.00 34.23 C ATOM 348 CG2 ILE A 42 11.277 -13.533 -19.293 1.00 62.12 C ATOM 349 CD1 ILE A 42 14.307 -13.495 -18.745 1.00 54.21 C ATOM 0 H ILE A 42 11.362 -10.257 -18.076 1.00 50.24 H new ATOM 0 HA ILE A 42 10.064 -12.635 -16.969 1.00 10.34 H new ATOM 0 HB ILE A 42 12.029 -14.023 -17.358 1.00 54.12 H new ATOM 0 HG12 ILE A 42 13.198 -11.677 -18.891 1.00 34.23 H new ATOM 0 HG13 ILE A 42 13.661 -12.108 -17.257 1.00 34.23 H new ATOM 0 HG21 ILE A 42 11.932 -14.234 -19.810 1.00 62.12 H new ATOM 0 HG22 ILE A 42 10.313 -14.007 -19.106 1.00 62.12 H new ATOM 0 HG23 ILE A 42 11.132 -12.648 -19.912 1.00 62.12 H new ATOM 0 HD11 ILE A 42 15.263 -12.990 -18.883 1.00 54.21 H new ATOM 0 HD12 ILE A 42 14.430 -14.320 -18.043 1.00 54.21 H new ATOM 0 HD13 ILE A 42 13.960 -13.882 -19.703 1.00 54.21 H new ATOM 361 N PHE A 43 11.566 -12.495 -14.892 1.00 22.22 N ATOM 362 CA PHE A 43 12.185 -12.185 -13.608 1.00 12.31 C ATOM 363 C PHE A 43 13.093 -13.323 -13.153 1.00 10.24 C ATOM 364 O PHE A 43 12.827 -14.492 -13.428 1.00 52.14 O ATOM 365 CB PHE A 43 11.110 -11.920 -12.551 1.00 51.21 C ATOM 366 CG PHE A 43 10.272 -10.707 -12.839 1.00 24.43 C ATOM 367 CD1 PHE A 43 9.401 -10.691 -13.916 1.00 51.01 C ATOM 368 CD2 PHE A 43 10.354 -9.585 -12.032 1.00 2.44 C ATOM 369 CE1 PHE A 43 8.630 -9.576 -14.184 1.00 13.55 C ATOM 370 CE2 PHE A 43 9.584 -8.466 -12.294 1.00 21.32 C ATOM 371 CZ PHE A 43 8.720 -8.463 -13.371 1.00 10.23 C ATOM 0 H PHE A 43 11.036 -13.366 -14.905 1.00 22.22 H new ATOM 0 HA PHE A 43 12.792 -11.288 -13.732 1.00 12.31 H new ATOM 0 HB2 PHE A 43 10.460 -12.792 -12.479 1.00 51.21 H new ATOM 0 HB3 PHE A 43 11.589 -11.798 -11.580 1.00 51.21 H new ATOM 0 HD1 PHE A 43 9.324 -11.560 -14.553 1.00 51.01 H new ATOM 0 HD2 PHE A 43 11.027 -9.583 -11.188 1.00 2.44 H new ATOM 0 HE1 PHE A 43 7.957 -9.575 -15.029 1.00 13.55 H new ATOM 0 HE2 PHE A 43 9.659 -7.597 -11.658 1.00 21.32 H new ATOM 0 HZ PHE A 43 8.116 -7.592 -13.577 1.00 10.23 H new ATOM 381 N SER A 44 14.167 -12.971 -12.453 1.00 35.13 N ATOM 382 CA SER A 44 15.118 -13.962 -11.962 1.00 53.44 C ATOM 383 C SER A 44 15.736 -13.513 -10.641 1.00 34.12 C ATOM 384 O SER A 44 15.227 -12.607 -9.979 1.00 62.22 O ATOM 385 CB SER A 44 16.218 -14.199 -12.998 1.00 21.21 C ATOM 386 OG SER A 44 16.371 -15.582 -13.271 1.00 55.40 O ATOM 0 H SER A 44 14.400 -12.007 -12.213 1.00 35.13 H new ATOM 0 HA SER A 44 14.580 -14.895 -11.793 1.00 53.44 H new ATOM 0 HB2 SER A 44 15.976 -13.668 -13.918 1.00 21.21 H new ATOM 0 HB3 SER A 44 17.160 -13.791 -12.633 1.00 21.21 H new ATOM 0 HG SER A 44 15.646 -16.082 -12.841 1.00 55.40 H new ATOM 392 N LYS A 45 16.835 -14.155 -10.262 1.00 3.05 N ATOM 393 CA LYS A 45 17.525 -13.824 -9.020 1.00 42.42 C ATOM 394 C LYS A 45 19.038 -13.875 -9.208 1.00 64.52 C ATOM 395 O LYS A 45 19.530 -13.983 -10.332 1.00 3.13 O ATOM 396 CB LYS A 45 17.107 -14.787 -7.907 1.00 54.50 C ATOM 397 CG LYS A 45 15.650 -14.646 -7.498 1.00 71.24 C ATOM 398 CD LYS A 45 15.498 -14.585 -5.988 1.00 44.44 C ATOM 399 CE LYS A 45 14.735 -15.786 -5.454 1.00 31.43 C ATOM 400 NZ LYS A 45 15.327 -16.302 -4.189 1.00 21.51 N ATOM 0 H LYS A 45 17.268 -14.908 -10.797 1.00 3.05 H new ATOM 0 HA LYS A 45 17.245 -12.809 -8.738 1.00 42.42 H new ATOM 0 HB2 LYS A 45 17.286 -15.810 -8.237 1.00 54.50 H new ATOM 0 HB3 LYS A 45 17.739 -14.618 -7.035 1.00 54.50 H new ATOM 0 HG2 LYS A 45 15.232 -13.743 -7.943 1.00 71.24 H new ATOM 0 HG3 LYS A 45 15.079 -15.488 -7.888 1.00 71.24 H new ATOM 0 HD2 LYS A 45 16.483 -14.543 -5.524 1.00 44.44 H new ATOM 0 HD3 LYS A 45 14.976 -13.669 -5.711 1.00 44.44 H new ATOM 0 HE2 LYS A 45 13.695 -15.508 -5.281 1.00 31.43 H new ATOM 0 HE3 LYS A 45 14.733 -16.578 -6.203 1.00 31.43 H new ATOM 0 HZ1 LYS A 45 14.601 -16.817 -3.651 1.00 21.51 H new ATOM 0 HZ2 LYS A 45 16.114 -16.944 -4.411 1.00 21.51 H new ATOM 0 HZ3 LYS A 45 15.679 -15.506 -3.621 1.00 21.51 H new ATOM 414 N SER A 46 19.771 -13.800 -8.102 1.00 72.44 N ATOM 415 CA SER A 46 21.228 -13.835 -8.146 1.00 33.42 C ATOM 416 C SER A 46 21.734 -15.273 -8.215 1.00 74.13 C ATOM 417 O SER A 46 22.537 -15.620 -9.082 1.00 2.13 O ATOM 418 CB SER A 46 21.814 -13.135 -6.918 1.00 31.44 C ATOM 419 OG SER A 46 23.142 -12.707 -7.161 1.00 0.04 O ATOM 0 H SER A 46 19.380 -13.715 -7.164 1.00 72.44 H new ATOM 0 HA SER A 46 21.553 -13.309 -9.044 1.00 33.42 H new ATOM 0 HB2 SER A 46 21.195 -12.278 -6.654 1.00 31.44 H new ATOM 0 HB3 SER A 46 21.798 -13.814 -6.066 1.00 31.44 H new ATOM 0 HG SER A 46 23.493 -12.261 -6.362 1.00 0.04 H new ATOM 425 N TYR A 47 21.258 -16.106 -7.296 1.00 40.13 N ATOM 426 CA TYR A 47 21.663 -17.507 -7.250 1.00 44.43 C ATOM 427 C TYR A 47 20.446 -18.425 -7.220 1.00 51.10 C ATOM 428 O TYR A 47 20.167 -19.072 -6.210 1.00 73.40 O ATOM 429 CB TYR A 47 22.541 -17.765 -6.024 1.00 42.12 C ATOM 430 CG TYR A 47 22.255 -16.834 -4.867 1.00 73.51 C ATOM 431 CD1 TYR A 47 21.097 -16.970 -4.112 1.00 52.33 C ATOM 432 CD2 TYR A 47 23.143 -15.822 -4.528 1.00 45.52 C ATOM 433 CE1 TYR A 47 20.830 -16.121 -3.055 1.00 22.30 C ATOM 434 CE2 TYR A 47 22.887 -14.970 -3.472 1.00 31.45 C ATOM 435 CZ TYR A 47 21.728 -15.123 -2.738 1.00 63.54 C ATOM 436 OH TYR A 47 21.468 -14.278 -1.684 1.00 21.21 O ATOM 0 H TYR A 47 20.591 -15.836 -6.573 1.00 40.13 H new ATOM 0 HA TYR A 47 22.236 -17.723 -8.152 1.00 44.43 H new ATOM 0 HB2 TYR A 47 22.398 -18.794 -5.695 1.00 42.12 H new ATOM 0 HB3 TYR A 47 23.588 -17.665 -6.310 1.00 42.12 H new ATOM 0 HD1 TYR A 47 20.393 -17.752 -4.355 1.00 52.33 H new ATOM 0 HD2 TYR A 47 24.050 -15.699 -5.101 1.00 45.52 H new ATOM 0 HE1 TYR A 47 19.923 -16.238 -2.480 1.00 22.30 H new ATOM 0 HE2 TYR A 47 23.589 -14.189 -3.222 1.00 31.45 H new ATOM 0 HH TYR A 47 22.200 -13.633 -1.594 1.00 21.21 H new ATOM 446 N CYS A 48 19.725 -18.477 -8.334 1.00 72.34 N ATOM 447 CA CYS A 48 18.536 -19.316 -8.437 1.00 62.05 C ATOM 448 C CYS A 48 18.418 -19.921 -9.832 1.00 34.41 C ATOM 449 O CYS A 48 18.013 -19.262 -10.789 1.00 51.15 O ATOM 450 CB CYS A 48 17.282 -18.503 -8.113 1.00 0.12 C ATOM 451 SG CYS A 48 17.228 -17.873 -6.419 1.00 3.03 S ATOM 0 H CYS A 48 19.943 -17.948 -9.179 1.00 72.34 H new ATOM 0 HA CYS A 48 18.630 -20.127 -7.715 1.00 62.05 H new ATOM 0 HB2 CYS A 48 17.218 -17.662 -8.804 1.00 0.12 H new ATOM 0 HB3 CYS A 48 16.404 -19.125 -8.286 1.00 0.12 H new ATOM 0 HG CYS A 48 18.272 -18.291 -5.767 1.00 3.03 H new ATOM 457 N PRO A 49 18.780 -21.208 -9.952 1.00 0.03 N ATOM 458 CA PRO A 49 18.723 -21.931 -11.226 1.00 2.43 C ATOM 459 C PRO A 49 17.292 -22.190 -11.683 1.00 40.42 C ATOM 460 O PRO A 49 16.342 -21.987 -10.926 1.00 41.43 O ATOM 461 CB PRO A 49 19.433 -23.251 -10.916 1.00 11.52 C ATOM 462 CG PRO A 49 19.265 -23.436 -9.448 1.00 33.42 C ATOM 463 CD PRO A 49 19.272 -22.055 -8.853 1.00 32.52 C ATOM 0 HA PRO A 49 19.181 -21.365 -12.037 1.00 2.43 H new ATOM 0 HB2 PRO A 49 18.992 -24.078 -11.472 1.00 11.52 H new ATOM 0 HB3 PRO A 49 20.487 -23.208 -11.192 1.00 11.52 H new ATOM 0 HG2 PRO A 49 18.332 -23.953 -9.224 1.00 33.42 H new ATOM 0 HG3 PRO A 49 20.072 -24.042 -9.036 1.00 33.42 H new ATOM 0 HD2 PRO A 49 18.627 -21.992 -7.977 1.00 32.52 H new ATOM 0 HD3 PRO A 49 20.272 -21.760 -8.535 1.00 32.52 H new ATOM 471 N HIS A 50 17.144 -22.639 -12.925 1.00 24.21 N ATOM 472 CA HIS A 50 15.828 -22.927 -13.483 1.00 34.40 C ATOM 473 C HIS A 50 15.122 -21.642 -13.901 1.00 42.43 C ATOM 474 O HIS A 50 14.646 -21.522 -15.030 1.00 35.11 O ATOM 475 CB HIS A 50 14.974 -23.684 -12.465 1.00 32.13 C ATOM 476 CG HIS A 50 15.724 -24.753 -11.731 1.00 71.02 C ATOM 477 ND1 HIS A 50 15.574 -24.986 -10.380 1.00 20.30 N ATOM 478 CD2 HIS A 50 16.632 -25.656 -12.169 1.00 21.32 C ATOM 479 CE1 HIS A 50 16.359 -25.985 -10.018 1.00 12.13 C ATOM 480 NE2 HIS A 50 17.012 -26.409 -11.085 1.00 73.42 N ATOM 0 H HIS A 50 17.920 -22.811 -13.564 1.00 24.21 H new ATOM 0 HA HIS A 50 15.964 -23.550 -14.367 1.00 34.40 H new ATOM 0 HB2 HIS A 50 14.570 -22.974 -11.743 1.00 32.13 H new ATOM 0 HB3 HIS A 50 14.125 -24.135 -12.979 1.00 32.13 H new ATOM 0 HD2 HIS A 50 16.991 -25.764 -13.182 1.00 21.32 H new ATOM 0 HE1 HIS A 50 16.451 -26.387 -9.020 1.00 12.13 H new ATOM 0 HE2 HIS A 50 17.689 -27.172 -11.101 1.00 73.42 H new ATOM 488 N SER A 51 15.057 -20.682 -12.983 1.00 60.33 N ATOM 489 CA SER A 51 14.405 -19.406 -13.255 1.00 31.34 C ATOM 490 C SER A 51 15.266 -18.541 -14.170 1.00 53.45 C ATOM 491 O SER A 51 14.755 -17.695 -14.906 1.00 1.24 O ATOM 492 CB SER A 51 14.125 -18.664 -11.947 1.00 40.21 C ATOM 493 OG SER A 51 14.330 -17.269 -12.099 1.00 72.12 O ATOM 0 H SER A 51 15.448 -20.764 -12.044 1.00 60.33 H new ATOM 0 HA SER A 51 13.460 -19.608 -13.759 1.00 31.34 H new ATOM 0 HB2 SER A 51 13.099 -18.852 -11.631 1.00 40.21 H new ATOM 0 HB3 SER A 51 14.776 -19.047 -11.161 1.00 40.21 H new ATOM 0 HG SER A 51 13.464 -16.811 -12.117 1.00 72.12 H new ATOM 499 N THR A 52 16.576 -18.758 -14.121 1.00 10.22 N ATOM 500 CA THR A 52 17.509 -17.998 -14.943 1.00 62.30 C ATOM 501 C THR A 52 17.639 -18.610 -16.334 1.00 20.14 C ATOM 502 O THR A 52 17.650 -17.897 -17.337 1.00 60.01 O ATOM 503 CB THR A 52 18.903 -17.928 -14.293 1.00 5.10 C ATOM 504 OG1 THR A 52 18.862 -17.086 -13.136 1.00 31.54 O ATOM 505 CG2 THR A 52 19.933 -17.396 -15.277 1.00 43.41 C ATOM 0 H THR A 52 17.016 -19.455 -13.520 1.00 10.22 H new ATOM 0 HA THR A 52 17.106 -16.989 -15.028 1.00 62.30 H new ATOM 0 HB THR A 52 19.193 -18.936 -13.998 1.00 5.10 H new ATOM 0 HG1 THR A 52 18.036 -16.559 -13.144 1.00 31.54 H new ATOM 0 HG21 THR A 52 20.910 -17.356 -14.795 1.00 43.41 H new ATOM 0 HG22 THR A 52 19.983 -18.055 -16.144 1.00 43.41 H new ATOM 0 HG23 THR A 52 19.646 -16.395 -15.599 1.00 43.41 H new ATOM 513 N ARG A 53 17.737 -19.935 -16.386 1.00 2.42 N ATOM 514 CA ARG A 53 17.868 -20.642 -17.654 1.00 71.23 C ATOM 515 C ARG A 53 16.794 -20.193 -18.640 1.00 11.35 C ATOM 516 O ARG A 53 17.076 -19.942 -19.812 1.00 65.50 O ATOM 517 CB ARG A 53 17.772 -22.153 -17.432 1.00 45.51 C ATOM 518 CG ARG A 53 16.908 -22.866 -18.459 1.00 40.40 C ATOM 519 CD ARG A 53 16.908 -24.370 -18.239 1.00 31.23 C ATOM 520 NE ARG A 53 17.795 -25.060 -19.170 1.00 45.04 N ATOM 521 CZ ARG A 53 18.218 -26.307 -18.996 1.00 60.44 C ATOM 522 NH1 ARG A 53 17.833 -26.998 -17.932 1.00 60.40 N ATOM 523 NH2 ARG A 53 19.025 -26.866 -19.889 1.00 20.33 N ATOM 0 H ARG A 53 17.728 -20.540 -15.565 1.00 2.42 H new ATOM 0 HA ARG A 53 18.845 -20.405 -18.075 1.00 71.23 H new ATOM 0 HB2 ARG A 53 18.775 -22.579 -17.455 1.00 45.51 H new ATOM 0 HB3 ARG A 53 17.368 -22.341 -16.437 1.00 45.51 H new ATOM 0 HG2 ARG A 53 15.887 -22.489 -18.402 1.00 40.40 H new ATOM 0 HG3 ARG A 53 17.274 -22.644 -19.461 1.00 40.40 H new ATOM 0 HD2 ARG A 53 17.217 -24.587 -17.216 1.00 31.23 H new ATOM 0 HD3 ARG A 53 15.894 -24.753 -18.354 1.00 31.23 H new ATOM 0 HE ARG A 53 18.107 -24.557 -20.000 1.00 45.04 H new ATOM 0 HH11 ARG A 53 17.211 -26.572 -17.245 1.00 60.40 H new ATOM 0 HH12 ARG A 53 18.159 -27.955 -17.800 1.00 60.40 H new ATOM 0 HH21 ARG A 53 19.321 -26.338 -20.710 1.00 20.33 H new ATOM 0 HH22 ARG A 53 19.349 -27.824 -19.754 1.00 20.33 H new ATOM 537 N VAL A 54 15.559 -20.093 -18.157 1.00 31.05 N ATOM 538 CA VAL A 54 14.442 -19.673 -18.995 1.00 34.33 C ATOM 539 C VAL A 54 14.773 -18.390 -19.749 1.00 32.10 C ATOM 540 O VAL A 54 14.249 -18.143 -20.836 1.00 42.03 O ATOM 541 CB VAL A 54 13.167 -19.451 -18.161 1.00 31.42 C ATOM 542 CG1 VAL A 54 13.283 -18.178 -17.335 1.00 25.33 C ATOM 543 CG2 VAL A 54 11.942 -19.401 -19.062 1.00 45.22 C ATOM 0 H VAL A 54 15.307 -20.297 -17.190 1.00 31.05 H new ATOM 0 HA VAL A 54 14.264 -20.476 -19.710 1.00 34.33 H new ATOM 0 HB VAL A 54 13.052 -20.291 -17.476 1.00 31.42 H new ATOM 0 HG11 VAL A 54 12.372 -18.038 -16.752 1.00 25.33 H new ATOM 0 HG12 VAL A 54 14.136 -18.258 -16.661 1.00 25.33 H new ATOM 0 HG13 VAL A 54 13.424 -17.325 -17.999 1.00 25.33 H new ATOM 0 HG21 VAL A 54 11.050 -19.244 -18.455 1.00 45.22 H new ATOM 0 HG22 VAL A 54 12.047 -18.581 -19.773 1.00 45.22 H new ATOM 0 HG23 VAL A 54 11.850 -20.342 -19.604 1.00 45.22 H new ATOM 553 N LYS A 55 15.645 -17.575 -19.166 1.00 73.20 N ATOM 554 CA LYS A 55 16.048 -16.318 -19.783 1.00 1.01 C ATOM 555 C LYS A 55 16.802 -16.567 -21.085 1.00 73.14 C ATOM 556 O LYS A 55 16.640 -15.829 -22.058 1.00 31.44 O ATOM 557 CB LYS A 55 16.924 -15.512 -18.821 1.00 64.21 C ATOM 558 CG LYS A 55 18.414 -15.709 -19.045 1.00 33.10 C ATOM 559 CD LYS A 55 19.237 -14.983 -17.994 1.00 53.41 C ATOM 560 CE LYS A 55 20.662 -15.512 -17.938 1.00 13.41 C ATOM 561 NZ LYS A 55 21.506 -14.948 -19.028 1.00 1.53 N ATOM 0 H LYS A 55 16.086 -17.763 -18.266 1.00 73.20 H new ATOM 0 HA LYS A 55 15.147 -15.748 -20.009 1.00 1.01 H new ATOM 0 HB2 LYS A 55 16.686 -14.454 -18.926 1.00 64.21 H new ATOM 0 HB3 LYS A 55 16.679 -15.793 -17.797 1.00 64.21 H new ATOM 0 HG2 LYS A 55 18.649 -16.773 -19.021 1.00 33.10 H new ATOM 0 HG3 LYS A 55 18.685 -15.345 -20.036 1.00 33.10 H new ATOM 0 HD2 LYS A 55 19.252 -13.916 -18.216 1.00 53.41 H new ATOM 0 HD3 LYS A 55 18.766 -15.099 -17.018 1.00 53.41 H new ATOM 0 HE2 LYS A 55 21.103 -15.265 -16.972 1.00 13.41 H new ATOM 0 HE3 LYS A 55 20.649 -16.599 -18.014 1.00 13.41 H new ATOM 0 HZ1 LYS A 55 22.469 -15.333 -18.955 1.00 1.53 H new ATOM 0 HZ2 LYS A 55 21.099 -15.205 -19.950 1.00 1.53 H new ATOM 0 HZ3 LYS A 55 21.539 -13.912 -18.941 1.00 1.53 H new ATOM 575 N GLU A 56 17.624 -17.611 -21.098 1.00 34.54 N ATOM 576 CA GLU A 56 18.401 -17.958 -22.282 1.00 10.10 C ATOM 577 C GLU A 56 17.487 -18.382 -23.428 1.00 70.44 C ATOM 578 O GLU A 56 17.887 -18.373 -24.592 1.00 42.44 O ATOM 579 CB GLU A 56 19.390 -19.080 -21.961 1.00 73.12 C ATOM 580 CG GLU A 56 20.294 -18.776 -20.779 1.00 4.12 C ATOM 581 CD GLU A 56 21.636 -19.477 -20.875 1.00 52.22 C ATOM 582 OE1 GLU A 56 22.222 -19.485 -21.977 1.00 45.13 O ATOM 583 OE2 GLU A 56 22.098 -20.017 -19.849 1.00 10.41 O ATOM 0 H GLU A 56 17.769 -18.232 -20.302 1.00 34.54 H new ATOM 0 HA GLU A 56 18.956 -17.073 -22.592 1.00 10.10 H new ATOM 0 HB2 GLU A 56 18.834 -19.995 -21.756 1.00 73.12 H new ATOM 0 HB3 GLU A 56 20.007 -19.271 -22.839 1.00 73.12 H new ATOM 0 HG2 GLU A 56 20.454 -17.700 -20.716 1.00 4.12 H new ATOM 0 HG3 GLU A 56 19.796 -19.078 -19.858 1.00 4.12 H new ATOM 590 N LEU A 57 16.258 -18.754 -23.089 1.00 71.44 N ATOM 591 CA LEU A 57 15.285 -19.183 -24.088 1.00 60.23 C ATOM 592 C LEU A 57 14.984 -18.058 -25.073 1.00 65.20 C ATOM 593 O LEU A 57 15.271 -18.168 -26.265 1.00 21.31 O ATOM 594 CB LEU A 57 13.994 -19.641 -23.408 1.00 23.20 C ATOM 595 CG LEU A 57 13.152 -20.658 -24.182 1.00 5.44 C ATOM 596 CD1 LEU A 57 12.954 -21.921 -23.359 1.00 72.32 C ATOM 597 CD2 LEU A 57 11.810 -20.055 -24.567 1.00 41.53 C ATOM 0 H LEU A 57 15.911 -18.767 -22.130 1.00 71.44 H new ATOM 0 HA LEU A 57 15.713 -20.019 -24.640 1.00 60.23 H new ATOM 0 HB2 LEU A 57 14.250 -20.072 -22.440 1.00 23.20 H new ATOM 0 HB3 LEU A 57 13.378 -18.763 -23.213 1.00 23.20 H new ATOM 0 HG LEU A 57 13.684 -20.923 -25.096 1.00 5.44 H new ATOM 0 HD11 LEU A 57 12.353 -22.633 -23.924 1.00 72.32 H new ATOM 0 HD12 LEU A 57 13.924 -22.364 -23.133 1.00 72.32 H new ATOM 0 HD13 LEU A 57 12.443 -21.673 -22.429 1.00 72.32 H new ATOM 0 HD21 LEU A 57 11.224 -20.792 -25.117 1.00 41.53 H new ATOM 0 HD22 LEU A 57 11.271 -19.762 -23.666 1.00 41.53 H new ATOM 0 HD23 LEU A 57 11.972 -19.179 -25.195 1.00 41.53 H new ATOM 609 N PHE A 58 14.406 -16.974 -24.565 1.00 73.35 N ATOM 610 CA PHE A 58 14.067 -15.828 -25.400 1.00 12.31 C ATOM 611 C PHE A 58 15.273 -15.372 -26.216 1.00 22.42 C ATOM 612 O PHE A 58 15.168 -15.134 -27.419 1.00 33.15 O ATOM 613 CB PHE A 58 13.557 -14.673 -24.535 1.00 62.21 C ATOM 614 CG PHE A 58 12.147 -14.862 -24.052 1.00 63.31 C ATOM 615 CD1 PHE A 58 11.113 -15.055 -24.954 1.00 30.03 C ATOM 616 CD2 PHE A 58 11.857 -14.848 -22.698 1.00 2.13 C ATOM 617 CE1 PHE A 58 9.815 -15.229 -24.512 1.00 14.40 C ATOM 618 CE2 PHE A 58 10.561 -15.020 -22.250 1.00 73.50 C ATOM 619 CZ PHE A 58 9.539 -15.213 -23.159 1.00 73.11 C ATOM 0 H PHE A 58 14.163 -16.866 -23.580 1.00 73.35 H new ATOM 0 HA PHE A 58 13.279 -16.133 -26.089 1.00 12.31 H new ATOM 0 HB2 PHE A 58 14.215 -14.557 -23.674 1.00 62.21 H new ATOM 0 HB3 PHE A 58 13.615 -13.748 -25.108 1.00 62.21 H new ATOM 0 HD1 PHE A 58 11.323 -15.070 -26.013 1.00 30.03 H new ATOM 0 HD2 PHE A 58 12.653 -14.701 -21.983 1.00 2.13 H new ATOM 0 HE1 PHE A 58 9.017 -15.377 -25.224 1.00 14.40 H new ATOM 0 HE2 PHE A 58 10.348 -15.004 -21.191 1.00 73.50 H new ATOM 0 HZ PHE A 58 8.526 -15.351 -22.812 1.00 73.11 H new ATOM 629 N SER A 59 16.419 -15.255 -25.552 1.00 15.13 N ATOM 630 CA SER A 59 17.645 -14.824 -26.213 1.00 60.13 C ATOM 631 C SER A 59 17.931 -15.685 -27.440 1.00 24.32 C ATOM 632 O SER A 59 18.207 -15.169 -28.524 1.00 32.15 O ATOM 633 CB SER A 59 18.824 -14.893 -25.242 1.00 20.14 C ATOM 634 OG SER A 59 19.844 -13.982 -25.612 1.00 71.12 O ATOM 0 H SER A 59 16.524 -15.453 -24.557 1.00 15.13 H new ATOM 0 HA SER A 59 17.511 -13.792 -26.537 1.00 60.13 H new ATOM 0 HB2 SER A 59 18.481 -14.669 -24.232 1.00 20.14 H new ATOM 0 HB3 SER A 59 19.226 -15.906 -25.225 1.00 20.14 H new ATOM 0 HG SER A 59 20.586 -14.045 -24.974 1.00 71.12 H new ATOM 640 N SER A 60 17.863 -17.001 -27.262 1.00 2.52 N ATOM 641 CA SER A 60 18.119 -17.934 -28.352 1.00 0.11 C ATOM 642 C SER A 60 16.945 -17.965 -29.327 1.00 65.00 C ATOM 643 O SER A 60 17.015 -18.600 -30.381 1.00 11.43 O ATOM 644 CB SER A 60 18.374 -19.338 -27.800 1.00 23.23 C ATOM 645 OG SER A 60 18.294 -20.312 -28.826 1.00 2.13 O ATOM 0 H SER A 60 17.633 -17.444 -26.373 1.00 2.52 H new ATOM 0 HA SER A 60 19.006 -17.595 -28.887 1.00 0.11 H new ATOM 0 HB2 SER A 60 19.359 -19.376 -27.335 1.00 23.23 H new ATOM 0 HB3 SER A 60 17.645 -19.564 -27.022 1.00 23.23 H new ATOM 0 HG SER A 60 18.194 -19.866 -29.693 1.00 2.13 H new ATOM 651 N LEU A 61 15.869 -17.275 -28.969 1.00 33.04 N ATOM 652 CA LEU A 61 14.679 -17.222 -29.811 1.00 33.42 C ATOM 653 C LEU A 61 14.723 -16.013 -30.740 1.00 41.05 C ATOM 654 O LEU A 61 13.727 -15.669 -31.374 1.00 42.12 O ATOM 655 CB LEU A 61 13.419 -17.168 -28.945 1.00 2.43 C ATOM 656 CG LEU A 61 12.252 -18.043 -29.403 1.00 32.14 C ATOM 657 CD1 LEU A 61 12.067 -17.942 -30.908 1.00 41.44 C ATOM 658 CD2 LEU A 61 12.474 -19.489 -28.986 1.00 63.31 C ATOM 0 H LEU A 61 15.795 -16.744 -28.101 1.00 33.04 H new ATOM 0 HA LEU A 61 14.655 -18.125 -30.421 1.00 33.42 H new ATOM 0 HB2 LEU A 61 13.688 -17.458 -27.929 1.00 2.43 H new ATOM 0 HB3 LEU A 61 13.076 -16.134 -28.901 1.00 2.43 H new ATOM 0 HG LEU A 61 11.343 -17.683 -28.922 1.00 32.14 H new ATOM 0 HD11 LEU A 61 11.232 -18.572 -31.215 1.00 41.44 H new ATOM 0 HD12 LEU A 61 11.860 -16.907 -31.181 1.00 41.44 H new ATOM 0 HD13 LEU A 61 12.976 -18.275 -31.409 1.00 41.44 H new ATOM 0 HD21 LEU A 61 11.634 -20.097 -29.320 1.00 63.31 H new ATOM 0 HD22 LEU A 61 13.394 -19.861 -29.438 1.00 63.31 H new ATOM 0 HD23 LEU A 61 12.554 -19.546 -27.900 1.00 63.31 H new ATOM 670 N GLY A 62 15.887 -15.375 -30.818 1.00 11.45 N ATOM 671 CA GLY A 62 16.039 -14.213 -31.673 1.00 64.21 C ATOM 672 C GLY A 62 15.180 -13.047 -31.227 1.00 61.43 C ATOM 673 O GLY A 62 15.032 -12.062 -31.952 1.00 20.40 O ATOM 0 H GLY A 62 16.727 -15.642 -30.304 1.00 11.45 H new ATOM 0 HA2 GLY A 62 17.085 -13.907 -31.682 1.00 64.21 H new ATOM 0 HA3 GLY A 62 15.777 -14.482 -32.696 1.00 64.21 H new ATOM 677 N VAL A 63 14.608 -13.158 -30.033 1.00 4.13 N ATOM 678 CA VAL A 63 13.757 -12.105 -29.491 1.00 43.14 C ATOM 679 C VAL A 63 14.400 -11.451 -28.272 1.00 72.31 C ATOM 680 O VAL A 63 15.073 -12.113 -27.483 1.00 63.53 O ATOM 681 CB VAL A 63 12.371 -12.649 -29.099 1.00 2.34 C ATOM 682 CG1 VAL A 63 12.403 -13.221 -27.690 1.00 14.24 C ATOM 683 CG2 VAL A 63 11.317 -11.559 -29.216 1.00 44.32 C ATOM 0 H VAL A 63 14.718 -13.967 -29.422 1.00 4.13 H new ATOM 0 HA VAL A 63 13.636 -11.360 -30.277 1.00 43.14 H new ATOM 0 HB VAL A 63 12.107 -13.452 -29.787 1.00 2.34 H new ATOM 0 HG11 VAL A 63 11.415 -13.601 -27.429 1.00 14.24 H new ATOM 0 HG12 VAL A 63 13.128 -14.033 -27.643 1.00 14.24 H new ATOM 0 HG13 VAL A 63 12.688 -12.439 -26.986 1.00 14.24 H new ATOM 0 HG21 VAL A 63 10.344 -11.962 -28.935 1.00 44.32 H new ATOM 0 HG22 VAL A 63 11.573 -10.733 -28.553 1.00 44.32 H new ATOM 0 HG23 VAL A 63 11.278 -11.200 -30.244 1.00 44.32 H new ATOM 693 N VAL A 64 14.186 -10.148 -28.125 1.00 32.32 N ATOM 694 CA VAL A 64 14.741 -9.404 -27.001 1.00 45.01 C ATOM 695 C VAL A 64 13.811 -9.455 -25.794 1.00 41.20 C ATOM 696 O VAL A 64 12.592 -9.543 -25.940 1.00 42.22 O ATOM 697 CB VAL A 64 15.000 -7.933 -27.374 1.00 43.22 C ATOM 698 CG1 VAL A 64 15.713 -7.211 -26.240 1.00 53.05 C ATOM 699 CG2 VAL A 64 15.804 -7.844 -28.663 1.00 11.42 C ATOM 0 H VAL A 64 13.632 -9.585 -28.771 1.00 32.32 H new ATOM 0 HA VAL A 64 15.689 -9.878 -26.746 1.00 45.01 H new ATOM 0 HB VAL A 64 14.040 -7.443 -27.537 1.00 43.22 H new ATOM 0 HG11 VAL A 64 15.887 -6.173 -26.522 1.00 53.05 H new ATOM 0 HG12 VAL A 64 15.095 -7.244 -25.342 1.00 53.05 H new ATOM 0 HG13 VAL A 64 16.668 -7.698 -26.042 1.00 53.05 H new ATOM 0 HG21 VAL A 64 15.978 -6.797 -28.912 1.00 11.42 H new ATOM 0 HG22 VAL A 64 16.761 -8.349 -28.531 1.00 11.42 H new ATOM 0 HG23 VAL A 64 15.250 -8.322 -29.471 1.00 11.42 H new ATOM 709 N TYR A 65 14.394 -9.399 -24.601 1.00 44.04 N ATOM 710 CA TYR A 65 13.618 -9.441 -23.368 1.00 50.20 C ATOM 711 C TYR A 65 14.311 -8.653 -22.261 1.00 64.14 C ATOM 712 O TYR A 65 15.475 -8.274 -22.390 1.00 20.34 O ATOM 713 CB TYR A 65 13.405 -10.888 -22.924 1.00 20.33 C ATOM 714 CG TYR A 65 14.693 -11.643 -22.683 1.00 74.11 C ATOM 715 CD1 TYR A 65 15.491 -12.050 -23.745 1.00 31.30 C ATOM 716 CD2 TYR A 65 15.110 -11.952 -21.394 1.00 54.13 C ATOM 717 CE1 TYR A 65 16.668 -12.741 -23.530 1.00 11.41 C ATOM 718 CE2 TYR A 65 16.286 -12.640 -21.170 1.00 32.33 C ATOM 719 CZ TYR A 65 17.062 -13.033 -22.241 1.00 12.34 C ATOM 720 OH TYR A 65 18.233 -13.721 -22.021 1.00 44.01 O ATOM 0 H TYR A 65 15.402 -9.324 -24.462 1.00 44.04 H new ATOM 0 HA TYR A 65 12.649 -8.982 -23.563 1.00 50.20 H new ATOM 0 HB2 TYR A 65 12.813 -10.895 -22.009 1.00 20.33 H new ATOM 0 HB3 TYR A 65 12.824 -11.411 -23.684 1.00 20.33 H new ATOM 0 HD1 TYR A 65 15.186 -11.822 -24.756 1.00 31.30 H new ATOM 0 HD2 TYR A 65 14.504 -11.649 -20.553 1.00 54.13 H new ATOM 0 HE1 TYR A 65 17.276 -13.051 -24.367 1.00 11.41 H new ATOM 0 HE2 TYR A 65 16.597 -12.869 -20.161 1.00 32.33 H new ATOM 0 HH TYR A 65 18.058 -14.685 -22.059 1.00 44.01 H new ATOM 730 N ASN A 66 13.588 -8.413 -21.173 1.00 51.42 N ATOM 731 CA ASN A 66 14.133 -7.671 -20.041 1.00 41.12 C ATOM 732 C ASN A 66 14.433 -8.604 -18.872 1.00 15.01 C ATOM 733 O ASN A 66 13.562 -9.351 -18.423 1.00 2.52 O ATOM 734 CB ASN A 66 13.153 -6.581 -19.601 1.00 5.12 C ATOM 735 CG ASN A 66 13.788 -5.203 -19.590 1.00 50.11 C ATOM 736 OD1 ASN A 66 13.647 -4.436 -20.541 1.00 54.44 O ATOM 737 ND2 ASN A 66 14.493 -4.885 -18.510 1.00 51.12 N ATOM 0 H ASN A 66 12.623 -8.721 -21.050 1.00 51.42 H new ATOM 0 HA ASN A 66 15.066 -7.205 -20.358 1.00 41.12 H new ATOM 0 HB2 ASN A 66 12.294 -6.577 -20.271 1.00 5.12 H new ATOM 0 HB3 ASN A 66 12.779 -6.814 -18.604 1.00 5.12 H new ATOM 0 HD21 ASN A 66 14.944 -3.972 -18.446 1.00 51.12 H new ATOM 0 HD22 ASN A 66 14.583 -5.553 -17.745 1.00 51.12 H new ATOM 744 N ILE A 67 15.667 -8.555 -18.385 1.00 21.21 N ATOM 745 CA ILE A 67 16.081 -9.395 -17.267 1.00 55.35 C ATOM 746 C ILE A 67 16.227 -8.576 -15.990 1.00 24.11 C ATOM 747 O ILE A 67 17.069 -7.681 -15.907 1.00 4.45 O ATOM 748 CB ILE A 67 17.413 -10.109 -17.563 1.00 33.42 C ATOM 749 CG1 ILE A 67 17.424 -10.643 -18.997 1.00 22.13 C ATOM 750 CG2 ILE A 67 17.639 -11.239 -16.569 1.00 45.21 C ATOM 751 CD1 ILE A 67 18.137 -9.734 -19.974 1.00 1.02 C ATOM 0 H ILE A 67 16.398 -7.943 -18.746 1.00 21.21 H new ATOM 0 HA ILE A 67 15.301 -10.144 -17.128 1.00 55.35 H new ATOM 0 HB ILE A 67 18.225 -9.390 -17.458 1.00 33.42 H new ATOM 0 HG12 ILE A 67 17.903 -11.622 -19.008 1.00 22.13 H new ATOM 0 HG13 ILE A 67 16.396 -10.787 -19.331 1.00 22.13 H new ATOM 0 HG21 ILE A 67 18.584 -11.735 -16.790 1.00 45.21 H new ATOM 0 HG22 ILE A 67 17.670 -10.833 -15.558 1.00 45.21 H new ATOM 0 HG23 ILE A 67 16.825 -11.960 -16.646 1.00 45.21 H new ATOM 0 HD11 ILE A 67 18.106 -10.175 -20.970 1.00 1.02 H new ATOM 0 HD12 ILE A 67 17.645 -8.762 -19.992 1.00 1.02 H new ATOM 0 HD13 ILE A 67 19.175 -9.610 -19.664 1.00 1.02 H new ATOM 763 N LEU A 68 15.404 -8.890 -14.995 1.00 44.32 N ATOM 764 CA LEU A 68 15.443 -8.184 -13.719 1.00 20.30 C ATOM 765 C LEU A 68 15.513 -9.168 -12.555 1.00 54.03 C ATOM 766 O LEU A 68 14.714 -10.100 -12.471 1.00 14.10 O ATOM 767 CB LEU A 68 14.213 -7.287 -13.572 1.00 11.13 C ATOM 768 CG LEU A 68 13.563 -6.820 -14.875 1.00 4.51 C ATOM 769 CD1 LEU A 68 12.514 -7.818 -15.336 1.00 44.03 C ATOM 770 CD2 LEU A 68 12.948 -5.439 -14.698 1.00 1.13 C ATOM 0 H LEU A 68 14.702 -9.628 -15.047 1.00 44.32 H new ATOM 0 HA LEU A 68 16.340 -7.565 -13.701 1.00 20.30 H new ATOM 0 HB2 LEU A 68 13.465 -7.823 -12.988 1.00 11.13 H new ATOM 0 HB3 LEU A 68 14.497 -6.407 -12.995 1.00 11.13 H new ATOM 0 HG LEU A 68 14.335 -6.757 -15.642 1.00 4.51 H new ATOM 0 HD11 LEU A 68 12.063 -7.469 -16.265 1.00 44.03 H new ATOM 0 HD12 LEU A 68 12.983 -8.788 -15.503 1.00 44.03 H new ATOM 0 HD13 LEU A 68 11.743 -7.915 -14.572 1.00 44.03 H new ATOM 0 HD21 LEU A 68 12.490 -5.122 -15.635 1.00 1.13 H new ATOM 0 HD22 LEU A 68 12.189 -5.476 -13.917 1.00 1.13 H new ATOM 0 HD23 LEU A 68 13.725 -4.728 -14.415 1.00 1.13 H new ATOM 782 N GLU A 69 16.470 -8.951 -11.659 1.00 2.12 N ATOM 783 CA GLU A 69 16.641 -9.817 -10.499 1.00 63.45 C ATOM 784 C GLU A 69 16.052 -9.174 -9.247 1.00 12.31 C ATOM 785 O GLU A 69 16.508 -8.119 -8.804 1.00 43.41 O ATOM 786 CB GLU A 69 18.124 -10.125 -10.279 1.00 11.14 C ATOM 787 CG GLU A 69 18.859 -10.522 -11.548 1.00 53.50 C ATOM 788 CD GLU A 69 19.655 -9.376 -12.143 1.00 10.14 C ATOM 789 OE1 GLU A 69 19.035 -8.464 -12.729 1.00 71.05 O ATOM 790 OE2 GLU A 69 20.898 -9.391 -12.022 1.00 51.40 O ATOM 0 H GLU A 69 17.139 -8.183 -11.714 1.00 2.12 H new ATOM 0 HA GLU A 69 16.108 -10.748 -10.692 1.00 63.45 H new ATOM 0 HB2 GLU A 69 18.608 -9.249 -9.848 1.00 11.14 H new ATOM 0 HB3 GLU A 69 18.215 -10.930 -9.550 1.00 11.14 H new ATOM 0 HG2 GLU A 69 19.531 -11.352 -11.330 1.00 53.50 H new ATOM 0 HG3 GLU A 69 18.139 -10.880 -12.284 1.00 53.50 H new ATOM 797 N LEU A 70 15.036 -9.817 -8.682 1.00 12.42 N ATOM 798 CA LEU A 70 14.383 -9.307 -7.480 1.00 32.50 C ATOM 799 C LEU A 70 15.155 -9.710 -6.228 1.00 12.51 C ATOM 800 O LEU A 70 14.757 -9.385 -5.109 1.00 51.12 O ATOM 801 CB LEU A 70 12.947 -9.829 -7.397 1.00 2.30 C ATOM 802 CG LEU A 70 12.556 -10.887 -8.429 1.00 44.14 C ATOM 803 CD1 LEU A 70 13.159 -12.236 -8.067 1.00 15.44 C ATOM 804 CD2 LEU A 70 11.042 -10.989 -8.541 1.00 73.21 C ATOM 0 H LEU A 70 14.647 -10.691 -9.036 1.00 12.42 H new ATOM 0 HA LEU A 70 14.366 -8.219 -7.539 1.00 32.50 H new ATOM 0 HB2 LEU A 70 12.790 -10.246 -6.402 1.00 2.30 H new ATOM 0 HB3 LEU A 70 12.268 -8.983 -7.499 1.00 2.30 H new ATOM 0 HG LEU A 70 12.952 -10.585 -9.398 1.00 44.14 H new ATOM 0 HD11 LEU A 70 12.869 -12.976 -8.813 1.00 15.44 H new ATOM 0 HD12 LEU A 70 14.246 -12.153 -8.040 1.00 15.44 H new ATOM 0 HD13 LEU A 70 12.795 -12.546 -7.088 1.00 15.44 H new ATOM 0 HD21 LEU A 70 10.782 -11.747 -9.280 1.00 73.21 H new ATOM 0 HD22 LEU A 70 10.624 -11.267 -7.574 1.00 73.21 H new ATOM 0 HD23 LEU A 70 10.634 -10.026 -8.850 1.00 73.21 H new ATOM 816 N ASP A 71 16.263 -10.417 -6.425 1.00 43.41 N ATOM 817 CA ASP A 71 17.094 -10.860 -5.311 1.00 63.43 C ATOM 818 C ASP A 71 18.086 -9.775 -4.908 1.00 4.10 C ATOM 819 O ASP A 71 18.745 -9.877 -3.873 1.00 35.34 O ATOM 820 CB ASP A 71 17.843 -12.141 -5.686 1.00 53.01 C ATOM 821 CG ASP A 71 18.135 -13.014 -4.481 1.00 54.42 C ATOM 822 OD1 ASP A 71 17.308 -13.029 -3.545 1.00 61.50 O ATOM 823 OD2 ASP A 71 19.189 -13.682 -4.474 1.00 71.15 O ATOM 0 H ASP A 71 16.606 -10.695 -7.344 1.00 43.41 H new ATOM 0 HA ASP A 71 16.443 -11.064 -4.461 1.00 63.43 H new ATOM 0 HB2 ASP A 71 17.252 -12.707 -6.406 1.00 53.01 H new ATOM 0 HB3 ASP A 71 18.780 -11.880 -6.178 1.00 53.01 H new ATOM 828 N GLN A 72 18.189 -8.738 -5.733 1.00 44.00 N ATOM 829 CA GLN A 72 19.104 -7.635 -5.461 1.00 54.23 C ATOM 830 C GLN A 72 18.338 -6.336 -5.236 1.00 35.04 C ATOM 831 O GLN A 72 18.860 -5.388 -4.649 1.00 12.14 O ATOM 832 CB GLN A 72 20.089 -7.465 -6.619 1.00 63.15 C ATOM 833 CG GLN A 72 21.093 -8.600 -6.734 1.00 65.01 C ATOM 834 CD GLN A 72 21.859 -8.835 -5.446 1.00 72.03 C ATOM 835 OE1 GLN A 72 22.767 -8.078 -5.103 1.00 52.03 O ATOM 836 NE2 GLN A 72 21.494 -9.889 -4.725 1.00 53.12 N ATOM 0 H GLN A 72 17.651 -8.638 -6.594 1.00 44.00 H new ATOM 0 HA GLN A 72 19.658 -7.871 -4.553 1.00 54.23 H new ATOM 0 HB2 GLN A 72 19.531 -7.389 -7.552 1.00 63.15 H new ATOM 0 HB3 GLN A 72 20.628 -6.526 -6.492 1.00 63.15 H new ATOM 0 HG2 GLN A 72 20.571 -9.515 -7.014 1.00 65.01 H new ATOM 0 HG3 GLN A 72 21.797 -8.377 -7.536 1.00 65.01 H new ATOM 0 HE21 GLN A 72 20.735 -10.490 -5.048 1.00 53.12 H new ATOM 0 HE22 GLN A 72 21.972 -10.098 -3.849 1.00 53.12 H new ATOM 845 N VAL A 73 17.095 -6.298 -5.706 1.00 51.54 N ATOM 846 CA VAL A 73 16.256 -5.115 -5.556 1.00 53.02 C ATOM 847 C VAL A 73 16.053 -4.768 -4.085 1.00 20.42 C ATOM 848 O VAL A 73 16.652 -5.386 -3.204 1.00 2.31 O ATOM 849 CB VAL A 73 14.880 -5.315 -6.219 1.00 13.44 C ATOM 850 CG1 VAL A 73 15.040 -5.620 -7.701 1.00 5.24 C ATOM 851 CG2 VAL A 73 14.108 -6.423 -5.518 1.00 55.45 C ATOM 0 H VAL A 73 16.647 -7.073 -6.194 1.00 51.54 H new ATOM 0 HA VAL A 73 16.774 -4.294 -6.052 1.00 53.02 H new ATOM 0 HB VAL A 73 14.311 -4.390 -6.123 1.00 13.44 H new ATOM 0 HG11 VAL A 73 14.057 -5.758 -8.152 1.00 5.24 H new ATOM 0 HG12 VAL A 73 15.551 -4.790 -8.190 1.00 5.24 H new ATOM 0 HG13 VAL A 73 15.627 -6.530 -7.824 1.00 5.24 H new ATOM 0 HG21 VAL A 73 13.138 -6.551 -5.999 1.00 55.45 H new ATOM 0 HG22 VAL A 73 14.670 -7.355 -5.581 1.00 55.45 H new ATOM 0 HG23 VAL A 73 13.961 -6.158 -4.471 1.00 55.45 H new ATOM 861 N ASP A 74 15.207 -3.778 -3.827 1.00 34.42 N ATOM 862 CA ASP A 74 14.923 -3.351 -2.462 1.00 52.21 C ATOM 863 C ASP A 74 13.704 -4.080 -1.905 1.00 41.24 C ATOM 864 O ASP A 74 13.658 -4.420 -0.723 1.00 24.32 O ATOM 865 CB ASP A 74 14.693 -1.839 -2.417 1.00 1.14 C ATOM 866 CG ASP A 74 15.668 -1.078 -3.294 1.00 33.11 C ATOM 867 OD1 ASP A 74 16.837 -1.507 -3.393 1.00 14.00 O ATOM 868 OD2 ASP A 74 15.260 -0.055 -3.882 1.00 45.03 O ATOM 0 H ASP A 74 14.705 -3.256 -4.545 1.00 34.42 H new ATOM 0 HA ASP A 74 15.785 -3.600 -1.843 1.00 52.21 H new ATOM 0 HB2 ASP A 74 13.674 -1.620 -2.737 1.00 1.14 H new ATOM 0 HB3 ASP A 74 14.786 -1.491 -1.388 1.00 1.14 H new ATOM 873 N ASP A 75 12.720 -4.318 -2.765 1.00 54.43 N ATOM 874 CA ASP A 75 11.501 -5.006 -2.360 1.00 33.33 C ATOM 875 C ASP A 75 11.587 -6.496 -2.677 1.00 75.11 C ATOM 876 O ASP A 75 10.574 -7.149 -2.923 1.00 42.53 O ATOM 877 CB ASP A 75 10.286 -4.394 -3.059 1.00 11.43 C ATOM 878 CG ASP A 75 10.416 -2.893 -3.237 1.00 11.15 C ATOM 879 OD1 ASP A 75 10.910 -2.226 -2.303 1.00 44.51 O ATOM 880 OD2 ASP A 75 10.024 -2.387 -4.308 1.00 44.34 O ATOM 0 H ASP A 75 12.743 -4.044 -3.747 1.00 54.43 H new ATOM 0 HA ASP A 75 11.388 -4.887 -1.282 1.00 33.33 H new ATOM 0 HB2 ASP A 75 10.157 -4.863 -4.035 1.00 11.43 H new ATOM 0 HB3 ASP A 75 9.389 -4.612 -2.480 1.00 11.43 H new ATOM 885 N GLY A 76 12.806 -7.027 -2.669 1.00 22.43 N ATOM 886 CA GLY A 76 13.002 -8.436 -2.959 1.00 21.22 C ATOM 887 C GLY A 76 12.098 -9.330 -2.133 1.00 55.34 C ATOM 888 O GLY A 76 11.839 -10.474 -2.504 1.00 44.33 O ATOM 0 H GLY A 76 13.660 -6.508 -2.467 1.00 22.43 H new ATOM 0 HA2 GLY A 76 12.815 -8.615 -4.018 1.00 21.22 H new ATOM 0 HA3 GLY A 76 14.042 -8.701 -2.769 1.00 21.22 H new ATOM 892 N ALA A 77 11.616 -8.807 -1.010 1.00 43.42 N ATOM 893 CA ALA A 77 10.736 -9.565 -0.131 1.00 52.33 C ATOM 894 C ALA A 77 9.313 -9.604 -0.679 1.00 62.05 C ATOM 895 O ALA A 77 8.756 -10.677 -0.911 1.00 23.02 O ATOM 896 CB ALA A 77 10.747 -8.968 1.268 1.00 20.54 C ATOM 0 H ALA A 77 11.821 -7.861 -0.688 1.00 43.42 H new ATOM 0 HA ALA A 77 11.107 -10.589 -0.081 1.00 52.33 H new ATOM 0 HB1 ALA A 77 10.085 -9.544 1.915 1.00 20.54 H new ATOM 0 HB2 ALA A 77 11.761 -8.997 1.668 1.00 20.54 H new ATOM 0 HB3 ALA A 77 10.403 -7.935 1.225 1.00 20.54 H new ATOM 902 N SER A 78 8.731 -8.427 -0.886 1.00 54.01 N ATOM 903 CA SER A 78 7.371 -8.327 -1.403 1.00 72.52 C ATOM 904 C SER A 78 7.330 -8.667 -2.890 1.00 33.31 C ATOM 905 O SER A 78 6.491 -9.451 -3.337 1.00 52.01 O ATOM 906 CB SER A 78 6.818 -6.919 -1.175 1.00 70.52 C ATOM 907 OG SER A 78 6.639 -6.660 0.207 1.00 75.42 O ATOM 0 H SER A 78 9.180 -7.529 -0.704 1.00 54.01 H new ATOM 0 HA SER A 78 6.750 -9.044 -0.866 1.00 72.52 H new ATOM 0 HB2 SER A 78 7.500 -6.183 -1.601 1.00 70.52 H new ATOM 0 HB3 SER A 78 5.866 -6.810 -1.695 1.00 70.52 H new ATOM 0 HG SER A 78 6.286 -5.754 0.327 1.00 75.42 H new ATOM 913 N VAL A 79 8.241 -8.072 -3.653 1.00 15.53 N ATOM 914 CA VAL A 79 8.311 -8.311 -5.089 1.00 51.14 C ATOM 915 C VAL A 79 8.289 -9.803 -5.400 1.00 32.34 C ATOM 916 O VAL A 79 7.650 -10.238 -6.358 1.00 15.23 O ATOM 917 CB VAL A 79 9.580 -7.689 -5.701 1.00 41.04 C ATOM 918 CG1 VAL A 79 10.790 -8.572 -5.432 1.00 55.35 C ATOM 919 CG2 VAL A 79 9.396 -7.464 -7.194 1.00 13.10 C ATOM 0 H VAL A 79 8.942 -7.420 -3.300 1.00 15.53 H new ATOM 0 HA VAL A 79 7.434 -7.838 -5.531 1.00 51.14 H new ATOM 0 HB VAL A 79 9.753 -6.722 -5.230 1.00 41.04 H new ATOM 0 HG11 VAL A 79 11.678 -8.117 -5.872 1.00 55.35 H new ATOM 0 HG12 VAL A 79 10.931 -8.678 -4.356 1.00 55.35 H new ATOM 0 HG13 VAL A 79 10.629 -9.555 -5.875 1.00 55.35 H new ATOM 0 HG21 VAL A 79 10.302 -7.024 -7.610 1.00 13.10 H new ATOM 0 HG22 VAL A 79 9.198 -8.417 -7.684 1.00 13.10 H new ATOM 0 HG23 VAL A 79 8.556 -6.789 -7.359 1.00 13.10 H new ATOM 929 N GLN A 80 8.990 -10.583 -4.583 1.00 11.14 N ATOM 930 CA GLN A 80 9.051 -12.027 -4.771 1.00 2.34 C ATOM 931 C GLN A 80 7.892 -12.718 -4.059 1.00 51.10 C ATOM 932 O GLN A 80 7.544 -13.854 -4.380 1.00 52.42 O ATOM 933 CB GLN A 80 10.383 -12.575 -4.253 1.00 54.22 C ATOM 934 CG GLN A 80 10.892 -13.773 -5.035 1.00 22.32 C ATOM 935 CD GLN A 80 11.410 -14.879 -4.136 1.00 73.13 C ATOM 936 OE1 GLN A 80 11.111 -16.056 -4.345 1.00 40.30 O ATOM 937 NE2 GLN A 80 12.191 -14.507 -3.129 1.00 61.40 N ATOM 0 H GLN A 80 9.523 -10.239 -3.785 1.00 11.14 H new ATOM 0 HA GLN A 80 8.972 -12.233 -5.839 1.00 2.34 H new ATOM 0 HB2 GLN A 80 11.131 -11.783 -4.290 1.00 54.22 H new ATOM 0 HB3 GLN A 80 10.268 -12.857 -3.206 1.00 54.22 H new ATOM 0 HG2 GLN A 80 10.088 -14.163 -5.659 1.00 22.32 H new ATOM 0 HG3 GLN A 80 11.689 -13.452 -5.706 1.00 22.32 H new ATOM 0 HE21 GLN A 80 12.413 -13.521 -2.993 1.00 61.40 H new ATOM 0 HE22 GLN A 80 12.569 -15.207 -2.491 1.00 61.40 H new ATOM 946 N GLU A 81 7.300 -12.024 -3.092 1.00 24.44 N ATOM 947 CA GLU A 81 6.182 -12.574 -2.333 1.00 45.52 C ATOM 948 C GLU A 81 4.948 -12.724 -3.219 1.00 31.41 C ATOM 949 O GLU A 81 4.260 -13.745 -3.174 1.00 61.13 O ATOM 950 CB GLU A 81 5.859 -11.675 -1.137 1.00 73.23 C ATOM 951 CG GLU A 81 4.599 -12.085 -0.392 1.00 42.22 C ATOM 952 CD GLU A 81 4.744 -11.961 1.112 1.00 72.33 C ATOM 953 OE1 GLU A 81 5.340 -10.964 1.570 1.00 1.11 O ATOM 954 OE2 GLU A 81 4.262 -12.862 1.830 1.00 11.21 O ATOM 0 H GLU A 81 7.575 -11.081 -2.816 1.00 24.44 H new ATOM 0 HA GLU A 81 6.470 -13.560 -1.969 1.00 45.52 H new ATOM 0 HB2 GLU A 81 6.701 -11.688 -0.445 1.00 73.23 H new ATOM 0 HB3 GLU A 81 5.748 -10.648 -1.484 1.00 73.23 H new ATOM 0 HG2 GLU A 81 3.767 -11.465 -0.725 1.00 42.22 H new ATOM 0 HG3 GLU A 81 4.351 -13.116 -0.646 1.00 42.22 H new ATOM 961 N VAL A 82 4.673 -11.702 -4.021 1.00 3.51 N ATOM 962 CA VAL A 82 3.523 -11.719 -4.917 1.00 32.42 C ATOM 963 C VAL A 82 3.871 -12.384 -6.244 1.00 33.01 C ATOM 964 O VAL A 82 2.990 -12.857 -6.964 1.00 61.32 O ATOM 965 CB VAL A 82 3.001 -10.296 -5.190 1.00 62.11 C ATOM 966 CG1 VAL A 82 1.493 -10.309 -5.384 1.00 22.32 C ATOM 967 CG2 VAL A 82 3.393 -9.359 -4.057 1.00 61.14 C ATOM 0 H VAL A 82 5.232 -10.850 -4.069 1.00 3.51 H new ATOM 0 HA VAL A 82 2.743 -12.294 -4.418 1.00 32.42 H new ATOM 0 HB VAL A 82 3.458 -9.930 -6.109 1.00 62.11 H new ATOM 0 HG11 VAL A 82 1.142 -9.295 -5.576 1.00 22.32 H new ATOM 0 HG12 VAL A 82 1.241 -10.947 -6.231 1.00 22.32 H new ATOM 0 HG13 VAL A 82 1.014 -10.695 -4.484 1.00 22.32 H new ATOM 0 HG21 VAL A 82 3.016 -8.358 -4.266 1.00 61.14 H new ATOM 0 HG22 VAL A 82 2.965 -9.720 -3.122 1.00 61.14 H new ATOM 0 HG23 VAL A 82 4.479 -9.327 -3.970 1.00 61.14 H new ATOM 977 N LEU A 83 5.160 -12.418 -6.563 1.00 10.11 N ATOM 978 CA LEU A 83 5.626 -13.026 -7.805 1.00 2.13 C ATOM 979 C LEU A 83 5.743 -14.539 -7.659 1.00 50.04 C ATOM 980 O LEU A 83 5.269 -15.296 -8.508 1.00 52.52 O ATOM 981 CB LEU A 83 6.977 -12.434 -8.209 1.00 72.51 C ATOM 982 CG LEU A 83 7.419 -12.693 -9.650 1.00 55.34 C ATOM 983 CD1 LEU A 83 7.673 -14.175 -9.874 1.00 11.24 C ATOM 984 CD2 LEU A 83 6.373 -12.177 -10.629 1.00 12.52 C ATOM 0 H LEU A 83 5.902 -12.032 -5.979 1.00 10.11 H new ATOM 0 HA LEU A 83 4.895 -12.811 -8.584 1.00 2.13 H new ATOM 0 HB2 LEU A 83 6.941 -11.356 -8.049 1.00 72.51 H new ATOM 0 HB3 LEU A 83 7.740 -12.831 -7.539 1.00 72.51 H new ATOM 0 HG LEU A 83 8.351 -12.155 -9.825 1.00 55.34 H new ATOM 0 HD11 LEU A 83 7.986 -14.339 -10.905 1.00 11.24 H new ATOM 0 HD12 LEU A 83 8.457 -14.516 -9.198 1.00 11.24 H new ATOM 0 HD13 LEU A 83 6.758 -14.734 -9.680 1.00 11.24 H new ATOM 0 HD21 LEU A 83 6.704 -12.369 -11.650 1.00 12.52 H new ATOM 0 HD22 LEU A 83 5.426 -12.687 -10.452 1.00 12.52 H new ATOM 0 HD23 LEU A 83 6.239 -11.105 -10.487 1.00 12.52 H new ATOM 996 N THR A 84 6.378 -14.977 -6.575 1.00 73.15 N ATOM 997 CA THR A 84 6.556 -16.401 -6.317 1.00 4.31 C ATOM 998 C THR A 84 5.221 -17.135 -6.335 1.00 21.11 C ATOM 999 O THR A 84 5.170 -18.343 -6.565 1.00 53.44 O ATOM 1000 CB THR A 84 7.245 -16.643 -4.961 1.00 41.14 C ATOM 1001 OG1 THR A 84 8.608 -16.210 -5.019 1.00 45.35 O ATOM 1002 CG2 THR A 84 7.191 -18.115 -4.583 1.00 30.21 C ATOM 0 H THR A 84 6.777 -14.366 -5.862 1.00 73.15 H new ATOM 0 HA THR A 84 7.190 -16.790 -7.113 1.00 4.31 H new ATOM 0 HB THR A 84 6.715 -16.069 -4.201 1.00 41.14 H new ATOM 0 HG1 THR A 84 8.683 -15.312 -4.633 1.00 45.35 H new ATOM 0 HG21 THR A 84 7.684 -18.262 -3.622 1.00 30.21 H new ATOM 0 HG22 THR A 84 6.151 -18.434 -4.510 1.00 30.21 H new ATOM 0 HG23 THR A 84 7.699 -18.705 -5.345 1.00 30.21 H new ATOM 1010 N GLU A 85 4.142 -16.397 -6.091 1.00 35.44 N ATOM 1011 CA GLU A 85 2.806 -16.981 -6.078 1.00 51.31 C ATOM 1012 C GLU A 85 2.264 -17.129 -7.497 1.00 22.05 C ATOM 1013 O GLU A 85 1.464 -18.023 -7.777 1.00 54.33 O ATOM 1014 CB GLU A 85 1.856 -16.117 -5.245 1.00 70.11 C ATOM 1015 CG GLU A 85 1.417 -16.773 -3.948 1.00 31.33 C ATOM 1016 CD GLU A 85 -0.089 -16.758 -3.766 1.00 30.24 C ATOM 1017 OE1 GLU A 85 -0.776 -17.550 -4.443 1.00 30.33 O ATOM 1018 OE2 GLU A 85 -0.579 -15.953 -2.947 1.00 34.33 O ATOM 0 H GLU A 85 4.167 -15.395 -5.900 1.00 35.44 H new ATOM 0 HA GLU A 85 2.874 -17.971 -5.628 1.00 51.31 H new ATOM 0 HB2 GLU A 85 2.346 -15.170 -5.016 1.00 70.11 H new ATOM 0 HB3 GLU A 85 0.974 -15.883 -5.841 1.00 70.11 H new ATOM 0 HG2 GLU A 85 1.771 -17.804 -3.929 1.00 31.33 H new ATOM 0 HG3 GLU A 85 1.886 -16.259 -3.109 1.00 31.33 H new ATOM 1025 N ILE A 86 2.705 -16.247 -8.387 1.00 60.23 N ATOM 1026 CA ILE A 86 2.266 -16.280 -9.776 1.00 73.25 C ATOM 1027 C ILE A 86 2.537 -17.641 -10.408 1.00 35.55 C ATOM 1028 O ILE A 86 1.727 -18.151 -11.183 1.00 10.24 O ATOM 1029 CB ILE A 86 2.962 -15.191 -10.614 1.00 41.03 C ATOM 1030 CG1 ILE A 86 2.723 -13.812 -9.998 1.00 15.35 C ATOM 1031 CG2 ILE A 86 2.466 -15.230 -12.052 1.00 15.24 C ATOM 1032 CD1 ILE A 86 3.243 -12.672 -10.846 1.00 22.51 C ATOM 0 H ILE A 86 3.366 -15.501 -8.171 1.00 60.23 H new ATOM 0 HA ILE A 86 1.192 -16.092 -9.770 1.00 73.25 H new ATOM 0 HB ILE A 86 4.035 -15.385 -10.616 1.00 41.03 H new ATOM 0 HG12 ILE A 86 1.654 -13.676 -9.837 1.00 15.35 H new ATOM 0 HG13 ILE A 86 3.200 -13.773 -9.019 1.00 15.35 H new ATOM 0 HG21 ILE A 86 2.967 -14.454 -12.631 1.00 15.24 H new ATOM 0 HG22 ILE A 86 2.685 -16.206 -12.486 1.00 15.24 H new ATOM 0 HG23 ILE A 86 1.390 -15.058 -12.070 1.00 15.24 H new ATOM 0 HD11 ILE A 86 3.039 -11.725 -10.347 1.00 22.51 H new ATOM 0 HD12 ILE A 86 4.318 -12.784 -10.986 1.00 22.51 H new ATOM 0 HD13 ILE A 86 2.747 -12.685 -11.817 1.00 22.51 H new ATOM 1044 N SER A 87 3.680 -18.228 -10.068 1.00 11.21 N ATOM 1045 CA SER A 87 4.060 -19.530 -10.602 1.00 64.30 C ATOM 1046 C SER A 87 4.068 -20.587 -9.502 1.00 23.13 C ATOM 1047 O SER A 87 4.082 -21.786 -9.778 1.00 11.13 O ATOM 1048 CB SER A 87 5.438 -19.453 -11.260 1.00 44.25 C ATOM 1049 OG SER A 87 5.389 -19.903 -12.603 1.00 55.21 O ATOM 0 H SER A 87 4.359 -17.822 -9.425 1.00 11.21 H new ATOM 0 HA SER A 87 3.323 -19.816 -11.352 1.00 64.30 H new ATOM 0 HB2 SER A 87 5.801 -18.426 -11.231 1.00 44.25 H new ATOM 0 HB3 SER A 87 6.148 -20.058 -10.696 1.00 44.25 H new ATOM 0 HG SER A 87 6.279 -19.827 -13.006 1.00 55.21 H new ATOM 1055 N ASN A 88 4.060 -20.132 -8.253 1.00 21.11 N ATOM 1056 CA ASN A 88 4.067 -21.037 -7.110 1.00 23.54 C ATOM 1057 C ASN A 88 5.209 -22.044 -7.219 1.00 51.42 C ATOM 1058 O ASN A 88 5.026 -23.234 -6.967 1.00 50.12 O ATOM 1059 CB ASN A 88 2.731 -21.776 -7.008 1.00 55.41 C ATOM 1060 CG ASN A 88 2.299 -21.995 -5.571 1.00 33.20 C ATOM 1061 OD1 ASN A 88 2.697 -21.255 -4.671 1.00 50.05 O ATOM 1062 ND2 ASN A 88 1.480 -23.017 -5.349 1.00 1.10 N ATOM 0 H ASN A 88 4.049 -19.142 -8.007 1.00 21.11 H new ATOM 0 HA ASN A 88 4.215 -20.441 -6.209 1.00 23.54 H new ATOM 0 HB2 ASN A 88 1.963 -21.207 -7.532 1.00 55.41 H new ATOM 0 HB3 ASN A 88 2.813 -22.740 -7.511 1.00 55.41 H new ATOM 0 HD21 ASN A 88 1.156 -23.214 -4.402 1.00 1.10 H new ATOM 0 HD22 ASN A 88 1.175 -23.604 -6.125 1.00 1.10 H new ATOM 1069 N GLN A 89 6.386 -21.555 -7.596 1.00 2.42 N ATOM 1070 CA GLN A 89 7.558 -22.411 -7.739 1.00 35.53 C ATOM 1071 C GLN A 89 8.695 -21.931 -6.843 1.00 64.03 C ATOM 1072 O GLN A 89 8.823 -20.738 -6.569 1.00 42.23 O ATOM 1073 CB GLN A 89 8.019 -22.442 -9.197 1.00 54.31 C ATOM 1074 CG GLN A 89 7.413 -23.579 -10.003 1.00 0.23 C ATOM 1075 CD GLN A 89 6.433 -23.093 -11.053 1.00 51.52 C ATOM 1076 OE1 GLN A 89 5.317 -23.600 -11.159 1.00 54.43 O ATOM 1077 NE2 GLN A 89 6.847 -22.103 -11.837 1.00 20.43 N ATOM 0 H GLN A 89 6.553 -20.571 -7.808 1.00 2.42 H new ATOM 0 HA GLN A 89 7.280 -23.419 -7.433 1.00 35.53 H new ATOM 0 HB2 GLN A 89 7.762 -21.495 -9.671 1.00 54.31 H new ATOM 0 HB3 GLN A 89 9.105 -22.527 -9.224 1.00 54.31 H new ATOM 0 HG2 GLN A 89 8.211 -24.141 -10.489 1.00 0.23 H new ATOM 0 HG3 GLN A 89 6.904 -24.267 -9.328 1.00 0.23 H new ATOM 0 HE21 GLN A 89 7.781 -21.712 -11.714 1.00 20.43 H new ATOM 0 HE22 GLN A 89 6.231 -21.734 -12.561 1.00 20.43 H new ATOM 1086 N LYS A 90 9.521 -22.868 -6.390 1.00 35.43 N ATOM 1087 CA LYS A 90 10.649 -22.543 -5.526 1.00 13.15 C ATOM 1088 C LYS A 90 11.404 -21.327 -6.052 1.00 44.44 C ATOM 1089 O LYS A 90 11.740 -20.415 -5.296 1.00 31.55 O ATOM 1090 CB LYS A 90 11.597 -23.739 -5.419 1.00 2.14 C ATOM 1091 CG LYS A 90 11.848 -24.190 -3.990 1.00 1.12 C ATOM 1092 CD LYS A 90 12.722 -25.433 -3.943 1.00 13.22 C ATOM 1093 CE LYS A 90 13.195 -25.728 -2.527 1.00 44.40 C ATOM 1094 NZ LYS A 90 12.087 -26.219 -1.662 1.00 43.43 N ATOM 0 H LYS A 90 9.430 -23.860 -6.608 1.00 35.43 H new ATOM 0 HA LYS A 90 10.260 -22.306 -4.536 1.00 13.15 H new ATOM 0 HB2 LYS A 90 11.183 -24.572 -5.987 1.00 2.14 H new ATOM 0 HB3 LYS A 90 12.549 -23.480 -5.882 1.00 2.14 H new ATOM 0 HG2 LYS A 90 12.328 -23.386 -3.432 1.00 1.12 H new ATOM 0 HG3 LYS A 90 10.896 -24.394 -3.499 1.00 1.12 H new ATOM 0 HD2 LYS A 90 12.163 -26.287 -4.327 1.00 13.22 H new ATOM 0 HD3 LYS A 90 13.585 -25.298 -4.595 1.00 13.22 H new ATOM 0 HE2 LYS A 90 13.989 -26.474 -2.558 1.00 44.40 H new ATOM 0 HE3 LYS A 90 13.622 -24.825 -2.092 1.00 44.40 H new ATOM 0 HZ1 LYS A 90 12.451 -26.408 -0.706 1.00 43.43 H new ATOM 0 HZ2 LYS A 90 11.340 -25.497 -1.612 1.00 43.43 H new ATOM 0 HZ3 LYS A 90 11.695 -27.095 -2.063 1.00 43.43 H new ATOM 1108 N THR A 91 11.668 -21.319 -7.355 1.00 40.10 N ATOM 1109 CA THR A 91 12.383 -20.215 -7.984 1.00 11.42 C ATOM 1110 C THR A 91 11.431 -19.084 -8.357 1.00 23.22 C ATOM 1111 O THR A 91 10.249 -19.116 -8.013 1.00 43.23 O ATOM 1112 CB THR A 91 13.134 -20.678 -9.247 1.00 74.01 C ATOM 1113 OG1 THR A 91 12.592 -21.921 -9.710 1.00 2.54 O ATOM 1114 CG2 THR A 91 14.619 -20.839 -8.966 1.00 22.35 C ATOM 0 H THR A 91 11.397 -22.065 -7.996 1.00 40.10 H new ATOM 0 HA THR A 91 13.106 -19.851 -7.254 1.00 11.42 H new ATOM 0 HB THR A 91 13.008 -19.917 -10.017 1.00 74.01 H new ATOM 0 HG1 THR A 91 12.830 -22.051 -10.652 1.00 2.54 H new ATOM 0 HG21 THR A 91 15.127 -21.167 -9.873 1.00 22.35 H new ATOM 0 HG22 THR A 91 15.034 -19.884 -8.642 1.00 22.35 H new ATOM 0 HG23 THR A 91 14.762 -21.582 -8.181 1.00 22.35 H new ATOM 1122 N VAL A 92 11.953 -18.086 -9.064 1.00 23.35 N ATOM 1123 CA VAL A 92 11.148 -16.946 -9.485 1.00 70.45 C ATOM 1124 C VAL A 92 11.040 -16.882 -11.005 1.00 30.25 C ATOM 1125 O VAL A 92 11.337 -15.865 -11.630 1.00 70.34 O ATOM 1126 CB VAL A 92 11.738 -15.621 -8.967 1.00 73.30 C ATOM 1127 CG1 VAL A 92 10.663 -14.546 -8.905 1.00 64.42 C ATOM 1128 CG2 VAL A 92 12.382 -15.821 -7.604 1.00 70.33 C ATOM 0 H VAL A 92 12.929 -18.044 -9.357 1.00 23.35 H new ATOM 0 HA VAL A 92 10.155 -17.084 -9.058 1.00 70.45 H new ATOM 0 HB VAL A 92 12.509 -15.291 -9.663 1.00 73.30 H new ATOM 0 HG11 VAL A 92 11.098 -13.617 -8.537 1.00 64.42 H new ATOM 0 HG12 VAL A 92 10.252 -14.384 -9.902 1.00 64.42 H new ATOM 0 HG13 VAL A 92 9.867 -14.866 -8.232 1.00 64.42 H new ATOM 0 HG21 VAL A 92 12.794 -14.874 -7.254 1.00 70.33 H new ATOM 0 HG22 VAL A 92 11.633 -16.175 -6.896 1.00 70.33 H new ATOM 0 HG23 VAL A 92 13.182 -16.557 -7.684 1.00 70.33 H new ATOM 1138 N PRO A 93 10.603 -17.994 -11.614 1.00 23.52 N ATOM 1139 CA PRO A 93 10.444 -18.091 -13.068 1.00 44.35 C ATOM 1140 C PRO A 93 9.289 -17.237 -13.582 1.00 21.43 C ATOM 1141 O PRO A 93 8.148 -17.398 -13.153 1.00 3.13 O ATOM 1142 CB PRO A 93 10.155 -19.576 -13.296 1.00 43.31 C ATOM 1143 CG PRO A 93 9.565 -20.048 -12.013 1.00 33.12 C ATOM 1144 CD PRO A 93 10.231 -19.244 -10.930 1.00 73.51 C ATOM 0 HA PRO A 93 11.324 -17.729 -13.600 1.00 44.35 H new ATOM 0 HB2 PRO A 93 9.465 -19.722 -14.127 1.00 43.31 H new ATOM 0 HB3 PRO A 93 11.066 -20.124 -13.538 1.00 43.31 H new ATOM 0 HG2 PRO A 93 8.485 -19.899 -12.002 1.00 33.12 H new ATOM 0 HG3 PRO A 93 9.741 -21.114 -11.872 1.00 33.12 H new ATOM 0 HD2 PRO A 93 9.556 -19.059 -10.094 1.00 73.51 H new ATOM 0 HD3 PRO A 93 11.104 -19.757 -10.528 1.00 73.51 H new ATOM 1152 N ASN A 94 9.595 -16.330 -14.505 1.00 11.24 N ATOM 1153 CA ASN A 94 8.581 -15.451 -15.077 1.00 32.13 C ATOM 1154 C ASN A 94 8.721 -15.376 -16.594 1.00 45.53 C ATOM 1155 O ASN A 94 9.722 -14.878 -17.110 1.00 62.35 O ATOM 1156 CB ASN A 94 8.691 -14.050 -14.473 1.00 10.03 C ATOM 1157 CG ASN A 94 7.508 -13.708 -13.588 1.00 32.20 C ATOM 1158 OD1 ASN A 94 6.987 -12.594 -13.633 1.00 54.22 O ATOM 1159 ND2 ASN A 94 7.079 -14.668 -12.777 1.00 33.04 N ATOM 0 H ASN A 94 10.535 -16.185 -14.872 1.00 11.24 H new ATOM 0 HA ASN A 94 7.601 -15.865 -14.840 1.00 32.13 H new ATOM 0 HB2 ASN A 94 9.610 -13.979 -13.890 1.00 10.03 H new ATOM 0 HB3 ASN A 94 8.765 -13.316 -15.275 1.00 10.03 H new ATOM 0 HD21 ASN A 94 6.287 -14.496 -12.158 1.00 33.04 H new ATOM 0 HD22 ASN A 94 7.542 -15.577 -12.773 1.00 33.04 H new ATOM 1166 N ILE A 95 7.712 -15.871 -17.302 1.00 61.13 N ATOM 1167 CA ILE A 95 7.723 -15.858 -18.760 1.00 14.22 C ATOM 1168 C ILE A 95 6.390 -15.364 -19.314 1.00 24.00 C ATOM 1169 O ILE A 95 5.403 -16.099 -19.334 1.00 25.32 O ATOM 1170 CB ILE A 95 8.017 -17.257 -19.333 1.00 44.23 C ATOM 1171 CG1 ILE A 95 7.518 -18.341 -18.376 1.00 10.44 C ATOM 1172 CG2 ILE A 95 9.508 -17.419 -19.594 1.00 15.33 C ATOM 1173 CD1 ILE A 95 8.566 -18.807 -17.390 1.00 3.22 C ATOM 0 H ILE A 95 6.876 -16.286 -16.890 1.00 61.13 H new ATOM 0 HA ILE A 95 8.517 -15.176 -19.064 1.00 14.22 H new ATOM 0 HB ILE A 95 7.487 -17.364 -20.280 1.00 44.23 H new ATOM 0 HG12 ILE A 95 6.657 -17.960 -17.826 1.00 10.44 H new ATOM 0 HG13 ILE A 95 7.172 -19.196 -18.957 1.00 10.44 H new ATOM 0 HG21 ILE A 95 9.701 -18.413 -19.999 1.00 15.33 H new ATOM 0 HG22 ILE A 95 9.836 -16.666 -20.310 1.00 15.33 H new ATOM 0 HG23 ILE A 95 10.056 -17.295 -18.660 1.00 15.33 H new ATOM 0 HD11 ILE A 95 8.142 -19.575 -16.744 1.00 3.22 H new ATOM 0 HD12 ILE A 95 9.418 -19.218 -17.932 1.00 3.22 H new ATOM 0 HD13 ILE A 95 8.895 -17.964 -16.783 1.00 3.22 H new ATOM 1185 N PHE A 96 6.371 -14.114 -19.765 1.00 30.11 N ATOM 1186 CA PHE A 96 5.160 -13.522 -20.321 1.00 42.31 C ATOM 1187 C PHE A 96 5.491 -12.624 -21.510 1.00 72.42 C ATOM 1188 O PHE A 96 6.143 -11.591 -21.361 1.00 75.41 O ATOM 1189 CB PHE A 96 4.422 -12.715 -19.250 1.00 20.52 C ATOM 1190 CG PHE A 96 4.173 -13.487 -17.986 1.00 32.50 C ATOM 1191 CD1 PHE A 96 5.180 -13.652 -17.048 1.00 73.11 C ATOM 1192 CD2 PHE A 96 2.930 -14.049 -17.735 1.00 64.21 C ATOM 1193 CE1 PHE A 96 4.952 -14.361 -15.884 1.00 5.31 C ATOM 1194 CE2 PHE A 96 2.698 -14.758 -16.572 1.00 22.43 C ATOM 1195 CZ PHE A 96 3.711 -14.916 -15.646 1.00 52.10 C ATOM 0 H PHE A 96 7.179 -13.492 -19.756 1.00 30.11 H new ATOM 0 HA PHE A 96 4.516 -14.331 -20.665 1.00 42.31 H new ATOM 0 HB2 PHE A 96 5.002 -11.823 -19.014 1.00 20.52 H new ATOM 0 HB3 PHE A 96 3.468 -12.377 -19.654 1.00 20.52 H new ATOM 0 HD1 PHE A 96 6.154 -13.222 -17.229 1.00 73.11 H new ATOM 0 HD2 PHE A 96 2.135 -13.931 -18.456 1.00 64.21 H new ATOM 0 HE1 PHE A 96 5.745 -14.481 -15.161 1.00 5.31 H new ATOM 0 HE2 PHE A 96 1.725 -15.189 -16.387 1.00 22.43 H new ATOM 0 HZ PHE A 96 3.532 -15.473 -14.738 1.00 52.10 H new ATOM 1205 N VAL A 97 5.036 -13.028 -22.692 1.00 44.33 N ATOM 1206 CA VAL A 97 5.282 -12.262 -23.909 1.00 2.14 C ATOM 1207 C VAL A 97 3.979 -11.741 -24.504 1.00 23.13 C ATOM 1208 O VAL A 97 2.954 -12.422 -24.469 1.00 42.23 O ATOM 1209 CB VAL A 97 6.016 -13.107 -24.966 1.00 60.43 C ATOM 1210 CG1 VAL A 97 5.108 -14.210 -25.491 1.00 23.13 C ATOM 1211 CG2 VAL A 97 6.510 -12.226 -26.104 1.00 24.23 C ATOM 0 H VAL A 97 4.495 -13.881 -22.833 1.00 44.33 H new ATOM 0 HA VAL A 97 5.912 -11.418 -23.629 1.00 2.14 H new ATOM 0 HB VAL A 97 6.882 -13.573 -24.496 1.00 60.43 H new ATOM 0 HG11 VAL A 97 5.643 -14.797 -26.237 1.00 23.13 H new ATOM 0 HG12 VAL A 97 4.808 -14.857 -24.667 1.00 23.13 H new ATOM 0 HG13 VAL A 97 4.222 -13.766 -25.945 1.00 23.13 H new ATOM 0 HG21 VAL A 97 7.026 -12.840 -26.842 1.00 24.23 H new ATOM 0 HG22 VAL A 97 5.661 -11.730 -26.575 1.00 24.23 H new ATOM 0 HG23 VAL A 97 7.197 -11.476 -25.712 1.00 24.23 H new ATOM 1221 N ASN A 98 4.025 -10.531 -25.051 1.00 5.23 N ATOM 1222 CA ASN A 98 2.848 -9.919 -25.654 1.00 62.15 C ATOM 1223 C ASN A 98 1.664 -9.952 -24.693 1.00 12.14 C ATOM 1224 O ASN A 98 0.545 -10.289 -25.079 1.00 53.14 O ATOM 1225 CB ASN A 98 2.484 -10.639 -26.955 1.00 11.32 C ATOM 1226 CG ASN A 98 1.391 -9.922 -27.726 1.00 23.05 C ATOM 1227 OD1 ASN A 98 0.844 -8.921 -27.262 1.00 42.02 O ATOM 1228 ND2 ASN A 98 1.069 -10.433 -28.908 1.00 70.42 N ATOM 0 H ASN A 98 4.866 -9.955 -25.089 1.00 5.23 H new ATOM 0 HA ASN A 98 3.084 -8.878 -25.875 1.00 62.15 H new ATOM 0 HB2 ASN A 98 3.372 -10.723 -27.582 1.00 11.32 H new ATOM 0 HB3 ASN A 98 2.158 -11.654 -26.727 1.00 11.32 H new ATOM 0 HD21 ASN A 98 0.341 -9.994 -29.472 1.00 70.42 H new ATOM 0 HD22 ASN A 98 1.549 -11.264 -29.252 1.00 70.42 H new ATOM 1235 N LYS A 99 1.919 -9.601 -23.437 1.00 13.34 N ATOM 1236 CA LYS A 99 0.876 -9.588 -22.419 1.00 10.44 C ATOM 1237 C LYS A 99 0.217 -10.958 -22.297 1.00 53.44 C ATOM 1238 O LYS A 99 -0.945 -11.067 -21.903 1.00 63.23 O ATOM 1239 CB LYS A 99 -0.180 -8.531 -22.754 1.00 3.54 C ATOM 1240 CG LYS A 99 0.391 -7.132 -22.915 1.00 31.22 C ATOM 1241 CD LYS A 99 0.722 -6.829 -24.366 1.00 63.23 C ATOM 1242 CE LYS A 99 1.029 -5.354 -24.573 1.00 23.53 C ATOM 1243 NZ LYS A 99 -0.208 -4.555 -24.790 1.00 50.44 N ATOM 0 H LYS A 99 2.840 -9.322 -23.100 1.00 13.34 H new ATOM 0 HA LYS A 99 1.339 -9.341 -21.464 1.00 10.44 H new ATOM 0 HB2 LYS A 99 -0.688 -8.816 -23.676 1.00 3.54 H new ATOM 0 HB3 LYS A 99 -0.933 -8.519 -21.966 1.00 3.54 H new ATOM 0 HG2 LYS A 99 -0.327 -6.400 -22.544 1.00 31.22 H new ATOM 0 HG3 LYS A 99 1.290 -7.033 -22.307 1.00 31.22 H new ATOM 0 HD2 LYS A 99 1.579 -7.427 -24.677 1.00 63.23 H new ATOM 0 HD3 LYS A 99 -0.116 -7.119 -24.999 1.00 63.23 H new ATOM 0 HE2 LYS A 99 1.562 -4.969 -23.704 1.00 23.53 H new ATOM 0 HE3 LYS A 99 1.691 -5.238 -25.431 1.00 23.53 H new ATOM 0 HZ1 LYS A 99 0.044 -3.555 -24.927 1.00 50.44 H new ATOM 0 HZ2 LYS A 99 -0.704 -4.906 -25.634 1.00 50.44 H new ATOM 0 HZ3 LYS A 99 -0.829 -4.645 -23.961 1.00 50.44 H new ATOM 1257 N VAL A 100 0.966 -12.002 -22.637 1.00 70.20 N ATOM 1258 CA VAL A 100 0.456 -13.366 -22.563 1.00 52.11 C ATOM 1259 C VAL A 100 1.236 -14.190 -21.545 1.00 72.25 C ATOM 1260 O VAL A 100 2.378 -13.869 -21.214 1.00 61.31 O ATOM 1261 CB VAL A 100 0.523 -14.065 -23.934 1.00 71.20 C ATOM 1262 CG1 VAL A 100 1.732 -14.985 -24.006 1.00 12.12 C ATOM 1263 CG2 VAL A 100 -0.761 -14.837 -24.201 1.00 51.54 C ATOM 0 H VAL A 100 1.929 -11.929 -22.967 1.00 70.20 H new ATOM 0 HA VAL A 100 -0.586 -13.298 -22.249 1.00 52.11 H new ATOM 0 HB VAL A 100 0.630 -13.303 -24.706 1.00 71.20 H new ATOM 0 HG11 VAL A 100 1.763 -15.470 -24.982 1.00 12.12 H new ATOM 0 HG12 VAL A 100 2.642 -14.402 -23.862 1.00 12.12 H new ATOM 0 HG13 VAL A 100 1.659 -15.743 -23.226 1.00 12.12 H new ATOM 0 HG21 VAL A 100 -0.697 -15.325 -25.174 1.00 51.54 H new ATOM 0 HG22 VAL A 100 -0.900 -15.590 -23.426 1.00 51.54 H new ATOM 0 HG23 VAL A 100 -1.607 -14.150 -24.195 1.00 51.54 H new ATOM 1273 N HIS A 101 0.612 -15.256 -21.053 1.00 24.40 N ATOM 1274 CA HIS A 101 1.250 -16.129 -20.072 1.00 54.55 C ATOM 1275 C HIS A 101 1.849 -17.358 -20.749 1.00 23.02 C ATOM 1276 O HIS A 101 1.170 -18.060 -21.497 1.00 21.51 O ATOM 1277 CB HIS A 101 0.239 -16.559 -19.010 1.00 13.04 C ATOM 1278 CG HIS A 101 -1.050 -17.069 -19.579 1.00 1.12 C ATOM 1279 ND1 HIS A 101 -2.143 -16.260 -19.809 1.00 61.22 N ATOM 1280 CD2 HIS A 101 -1.415 -18.313 -19.967 1.00 31.33 C ATOM 1281 CE1 HIS A 101 -3.126 -16.986 -20.312 1.00 24.42 C ATOM 1282 NE2 HIS A 101 -2.710 -18.235 -20.418 1.00 64.40 N ATOM 0 H HIS A 101 -0.333 -15.536 -21.317 1.00 24.40 H new ATOM 0 HA HIS A 101 2.055 -15.572 -19.593 1.00 54.55 H new ATOM 0 HB2 HIS A 101 0.685 -17.336 -18.390 1.00 13.04 H new ATOM 0 HB3 HIS A 101 0.028 -15.712 -18.357 1.00 13.04 H new ATOM 0 HD2 HIS A 101 -0.802 -19.202 -19.929 1.00 31.33 H new ATOM 0 HE1 HIS A 101 -4.104 -16.620 -20.589 1.00 24.42 H new ATOM 0 HE2 HIS A 101 -3.261 -19.015 -20.777 1.00 64.40 H new ATOM 1290 N VAL A 102 3.126 -17.611 -20.479 1.00 45.12 N ATOM 1291 CA VAL A 102 3.818 -18.756 -21.062 1.00 0.44 C ATOM 1292 C VAL A 102 3.788 -19.953 -20.118 1.00 63.05 C ATOM 1293 O VAL A 102 3.573 -21.087 -20.544 1.00 44.51 O ATOM 1294 CB VAL A 102 5.282 -18.416 -21.396 1.00 4.30 C ATOM 1295 CG1 VAL A 102 5.924 -19.543 -22.189 1.00 41.32 C ATOM 1296 CG2 VAL A 102 5.363 -17.102 -22.160 1.00 12.55 C ATOM 0 H VAL A 102 3.702 -17.040 -19.861 1.00 45.12 H new ATOM 0 HA VAL A 102 3.293 -19.009 -21.983 1.00 0.44 H new ATOM 0 HB VAL A 102 5.832 -18.302 -20.462 1.00 4.30 H new ATOM 0 HG11 VAL A 102 6.958 -19.285 -22.416 1.00 41.32 H new ATOM 0 HG12 VAL A 102 5.900 -20.461 -21.602 1.00 41.32 H new ATOM 0 HG13 VAL A 102 5.375 -19.692 -23.119 1.00 41.32 H new ATOM 0 HG21 VAL A 102 6.405 -16.877 -22.388 1.00 12.55 H new ATOM 0 HG22 VAL A 102 4.798 -17.186 -23.089 1.00 12.55 H new ATOM 0 HG23 VAL A 102 4.944 -16.301 -21.551 1.00 12.55 H new ATOM 1306 N GLY A 103 4.005 -19.692 -18.832 1.00 52.13 N ATOM 1307 CA GLY A 103 3.999 -20.758 -17.848 1.00 33.30 C ATOM 1308 C GLY A 103 5.282 -20.813 -17.044 1.00 21.04 C ATOM 1309 O GLY A 103 5.423 -20.115 -16.039 1.00 64.50 O ATOM 0 H GLY A 103 4.185 -18.762 -18.455 1.00 52.13 H new ATOM 0 HA2 GLY A 103 3.156 -20.619 -17.171 1.00 33.30 H new ATOM 0 HA3 GLY A 103 3.849 -21.713 -18.352 1.00 33.30 H new ATOM 1313 N GLY A 104 6.221 -21.645 -17.484 1.00 30.11 N ATOM 1314 CA GLY A 104 7.486 -21.773 -16.785 1.00 73.20 C ATOM 1315 C GLY A 104 7.804 -23.210 -16.422 1.00 44.41 C ATOM 1316 O GLY A 104 8.936 -23.665 -16.598 1.00 32.42 O ATOM 0 H GLY A 104 6.128 -22.233 -18.312 1.00 30.11 H new ATOM 0 HA2 GLY A 104 8.285 -21.374 -17.410 1.00 73.20 H new ATOM 0 HA3 GLY A 104 7.459 -21.170 -15.878 1.00 73.20 H new ATOM 1320 N CYS A 105 6.808 -23.925 -15.914 1.00 1.42 N ATOM 1321 CA CYS A 105 6.989 -25.319 -15.522 1.00 54.40 C ATOM 1322 C CYS A 105 7.127 -26.214 -16.749 1.00 60.42 C ATOM 1323 O CYS A 105 6.215 -26.971 -17.084 1.00 12.13 O ATOM 1324 CB CYS A 105 5.811 -25.785 -14.665 1.00 33.33 C ATOM 1325 SG CYS A 105 4.191 -25.478 -15.406 1.00 71.11 S ATOM 0 H CYS A 105 5.866 -23.564 -15.763 1.00 1.42 H new ATOM 0 HA CYS A 105 7.906 -25.392 -14.937 1.00 54.40 H new ATOM 0 HB2 CYS A 105 5.915 -26.853 -14.474 1.00 33.33 H new ATOM 0 HB3 CYS A 105 5.858 -25.283 -13.699 1.00 33.33 H new ATOM 0 HG CYS A 105 4.140 -26.030 -16.582 1.00 71.11 H new ATOM 1331 N ASP A 106 8.272 -26.122 -17.416 1.00 54.51 N ATOM 1332 CA ASP A 106 8.530 -26.923 -18.607 1.00 31.55 C ATOM 1333 C ASP A 106 7.659 -26.463 -19.772 1.00 0.52 C ATOM 1334 O ASP A 106 7.572 -27.135 -20.799 1.00 34.43 O ATOM 1335 CB ASP A 106 8.273 -28.403 -18.317 1.00 44.30 C ATOM 1336 CG ASP A 106 8.672 -28.794 -16.907 1.00 41.34 C ATOM 1337 OD1 ASP A 106 9.888 -28.864 -16.632 1.00 54.25 O ATOM 1338 OD2 ASP A 106 7.767 -29.031 -16.079 1.00 62.42 O ATOM 0 H ASP A 106 9.037 -25.501 -17.152 1.00 54.51 H new ATOM 0 HA ASP A 106 9.576 -26.790 -18.884 1.00 31.55 H new ATOM 0 HB2 ASP A 106 7.216 -28.621 -18.466 1.00 44.30 H new ATOM 0 HB3 ASP A 106 8.828 -29.012 -19.031 1.00 44.30 H new ATOM 1343 N ARG A 107 7.016 -25.311 -19.603 1.00 72.31 N ATOM 1344 CA ARG A 107 6.149 -24.762 -20.640 1.00 4.21 C ATOM 1345 C ARG A 107 6.961 -23.979 -21.667 1.00 62.34 C ATOM 1346 O ARG A 107 6.928 -24.281 -22.862 1.00 4.11 O ATOM 1347 CB ARG A 107 5.086 -23.855 -20.017 1.00 23.02 C ATOM 1348 CG ARG A 107 3.694 -24.071 -20.586 1.00 54.12 C ATOM 1349 CD ARG A 107 3.660 -23.825 -22.086 1.00 41.24 C ATOM 1350 NE ARG A 107 2.310 -23.943 -22.630 1.00 64.22 N ATOM 1351 CZ ARG A 107 1.688 -25.103 -22.805 1.00 54.05 C ATOM 1352 NH1 ARG A 107 2.289 -26.239 -22.480 1.00 5.44 N ATOM 1353 NH2 ARG A 107 0.459 -25.129 -23.306 1.00 73.41 N ATOM 0 H ARG A 107 7.079 -24.741 -18.760 1.00 72.31 H new ATOM 0 HA ARG A 107 5.658 -25.593 -21.146 1.00 4.21 H new ATOM 0 HB2 ARG A 107 5.060 -24.026 -18.941 1.00 23.02 H new ATOM 0 HB3 ARG A 107 5.374 -22.815 -20.168 1.00 23.02 H new ATOM 0 HG2 ARG A 107 3.368 -25.090 -20.376 1.00 54.12 H new ATOM 0 HG3 ARG A 107 2.990 -23.403 -20.091 1.00 54.12 H new ATOM 0 HD2 ARG A 107 4.051 -22.830 -22.299 1.00 41.24 H new ATOM 0 HD3 ARG A 107 4.316 -24.539 -22.585 1.00 41.24 H new ATOM 0 HE ARG A 107 1.818 -23.088 -22.890 1.00 64.22 H new ATOM 0 HH11 ARG A 107 3.233 -26.224 -22.094 1.00 5.44 H new ATOM 0 HH12 ARG A 107 1.807 -27.128 -22.616 1.00 5.44 H new ATOM 0 HH21 ARG A 107 -0.008 -24.258 -23.557 1.00 73.41 H new ATOM 0 HH22 ARG A 107 -0.018 -26.020 -23.440 1.00 73.41 H new ATOM 1367 N THR A 108 7.690 -22.971 -21.198 1.00 22.54 N ATOM 1368 CA THR A 108 8.509 -22.146 -22.074 1.00 44.44 C ATOM 1369 C THR A 108 9.632 -22.959 -22.707 1.00 64.11 C ATOM 1370 O THR A 108 10.200 -22.566 -23.726 1.00 61.20 O ATOM 1371 CB THR A 108 9.119 -20.952 -21.315 1.00 64.21 C ATOM 1372 OG1 THR A 108 8.396 -20.723 -20.101 1.00 42.23 O ATOM 1373 CG2 THR A 108 9.096 -19.695 -22.172 1.00 33.24 C ATOM 0 H THR A 108 7.729 -22.707 -20.214 1.00 22.54 H new ATOM 0 HA THR A 108 7.851 -21.771 -22.858 1.00 44.44 H new ATOM 0 HB THR A 108 10.156 -21.191 -21.080 1.00 64.21 H new ATOM 0 HG1 THR A 108 9.009 -20.785 -19.339 1.00 42.23 H new ATOM 0 HG21 THR A 108 9.532 -18.866 -21.614 1.00 33.24 H new ATOM 0 HG22 THR A 108 9.673 -19.864 -23.081 1.00 33.24 H new ATOM 0 HG23 THR A 108 8.066 -19.453 -22.436 1.00 33.24 H new ATOM 1381 N PHE A 109 9.949 -24.097 -22.096 1.00 11.31 N ATOM 1382 CA PHE A 109 11.005 -24.966 -22.599 1.00 3.11 C ATOM 1383 C PHE A 109 10.470 -25.907 -23.674 1.00 53.24 C ATOM 1384 O PHE A 109 11.117 -26.128 -24.698 1.00 23.14 O ATOM 1385 CB PHE A 109 11.615 -25.778 -21.455 1.00 4.13 C ATOM 1386 CG PHE A 109 13.115 -25.851 -21.504 1.00 75.52 C ATOM 1387 CD1 PHE A 109 13.882 -24.706 -21.367 1.00 21.05 C ATOM 1388 CD2 PHE A 109 13.756 -27.066 -21.689 1.00 1.04 C ATOM 1389 CE1 PHE A 109 15.263 -24.770 -21.411 1.00 11.02 C ATOM 1390 CE2 PHE A 109 15.135 -27.136 -21.734 1.00 63.14 C ATOM 1391 CZ PHE A 109 15.890 -25.987 -21.597 1.00 1.34 C ATOM 0 H PHE A 109 9.489 -24.438 -21.252 1.00 11.31 H new ATOM 0 HA PHE A 109 11.777 -24.337 -23.042 1.00 3.11 H new ATOM 0 HB2 PHE A 109 11.312 -25.337 -20.505 1.00 4.13 H new ATOM 0 HB3 PHE A 109 11.209 -26.789 -21.481 1.00 4.13 H new ATOM 0 HD1 PHE A 109 13.396 -23.752 -21.224 1.00 21.05 H new ATOM 0 HD2 PHE A 109 13.171 -27.967 -21.799 1.00 1.04 H new ATOM 0 HE1 PHE A 109 15.850 -23.870 -21.300 1.00 11.02 H new ATOM 0 HE2 PHE A 109 15.623 -28.089 -21.876 1.00 63.14 H new ATOM 0 HZ PHE A 109 16.968 -26.040 -21.635 1.00 1.34 H new ATOM 1401 N GLN A 110 9.283 -26.455 -23.435 1.00 71.45 N ATOM 1402 CA GLN A 110 8.661 -27.372 -24.382 1.00 61.24 C ATOM 1403 C GLN A 110 8.369 -26.673 -25.706 1.00 5.20 C ATOM 1404 O GLN A 110 8.924 -27.031 -26.744 1.00 20.44 O ATOM 1405 CB GLN A 110 7.367 -27.943 -23.797 1.00 62.24 C ATOM 1406 CG GLN A 110 7.507 -29.369 -23.290 1.00 30.35 C ATOM 1407 CD GLN A 110 8.406 -29.470 -22.073 1.00 54.11 C ATOM 1408 OE1 GLN A 110 9.425 -28.785 -21.981 1.00 2.21 O ATOM 1409 NE2 GLN A 110 8.033 -30.327 -21.130 1.00 73.33 N ATOM 0 H GLN A 110 8.733 -26.280 -22.594 1.00 71.45 H new ATOM 0 HA GLN A 110 9.358 -28.188 -24.569 1.00 61.24 H new ATOM 0 HB2 GLN A 110 7.036 -27.305 -22.977 1.00 62.24 H new ATOM 0 HB3 GLN A 110 6.588 -27.912 -24.559 1.00 62.24 H new ATOM 0 HG2 GLN A 110 6.521 -29.761 -23.042 1.00 30.35 H new ATOM 0 HG3 GLN A 110 7.908 -29.996 -24.086 1.00 30.35 H new ATOM 0 HE21 GLN A 110 7.181 -30.875 -21.247 1.00 73.33 H new ATOM 0 HE22 GLN A 110 8.599 -30.437 -20.288 1.00 73.33 H new ATOM 1418 N ALA A 111 7.494 -25.673 -25.661 1.00 21.44 N ATOM 1419 CA ALA A 111 7.130 -24.923 -26.856 1.00 5.43 C ATOM 1420 C ALA A 111 8.370 -24.414 -27.584 1.00 25.20 C ATOM 1421 O ALA A 111 8.359 -24.242 -28.803 1.00 62.43 O ATOM 1422 CB ALA A 111 6.216 -23.762 -26.491 1.00 44.32 C ATOM 0 H ALA A 111 7.025 -25.364 -24.810 1.00 21.44 H new ATOM 0 HA ALA A 111 6.596 -25.595 -27.529 1.00 5.43 H new ATOM 0 HB1 ALA A 111 5.951 -23.210 -27.393 1.00 44.32 H new ATOM 0 HB2 ALA A 111 5.310 -24.146 -26.022 1.00 44.32 H new ATOM 0 HB3 ALA A 111 6.731 -23.098 -25.797 1.00 44.32 H new ATOM 1428 N HIS A 112 9.437 -24.175 -26.829 1.00 4.34 N ATOM 1429 CA HIS A 112 10.686 -23.685 -27.403 1.00 64.41 C ATOM 1430 C HIS A 112 11.306 -24.731 -28.324 1.00 63.51 C ATOM 1431 O HIS A 112 11.759 -24.413 -29.423 1.00 55.54 O ATOM 1432 CB HIS A 112 11.672 -23.316 -26.294 1.00 31.42 C ATOM 1433 CG HIS A 112 13.034 -22.955 -26.800 1.00 50.12 C ATOM 1434 ND1 HIS A 112 14.188 -23.175 -26.078 1.00 21.22 N ATOM 1435 CD2 HIS A 112 13.424 -22.387 -27.965 1.00 40.05 C ATOM 1436 CE1 HIS A 112 15.229 -22.756 -26.776 1.00 13.14 C ATOM 1437 NE2 HIS A 112 14.792 -22.274 -27.925 1.00 44.03 N ATOM 0 H HIS A 112 9.462 -24.312 -25.819 1.00 4.34 H new ATOM 0 HA HIS A 112 10.463 -22.794 -27.991 1.00 64.41 H new ATOM 0 HB2 HIS A 112 11.270 -22.477 -25.726 1.00 31.42 H new ATOM 0 HB3 HIS A 112 11.760 -24.155 -25.604 1.00 31.42 H new ATOM 0 HD2 HIS A 112 12.779 -22.080 -28.775 1.00 40.05 H new ATOM 0 HE1 HIS A 112 16.261 -22.800 -26.461 1.00 13.14 H new ATOM 0 HE2 HIS A 112 15.376 -21.881 -28.663 1.00 44.03 H new ATOM 1445 N GLN A 113 11.325 -25.980 -27.867 1.00 52.45 N ATOM 1446 CA GLN A 113 11.891 -27.071 -28.651 1.00 61.23 C ATOM 1447 C GLN A 113 10.844 -27.676 -29.580 1.00 55.33 C ATOM 1448 O GLN A 113 11.176 -28.381 -30.531 1.00 45.03 O ATOM 1449 CB GLN A 113 12.455 -28.151 -27.726 1.00 53.12 C ATOM 1450 CG GLN A 113 13.631 -27.680 -26.886 1.00 61.43 C ATOM 1451 CD GLN A 113 14.101 -28.731 -25.900 1.00 61.23 C ATOM 1452 OE1 GLN A 113 14.921 -29.588 -26.233 1.00 12.04 O ATOM 1453 NE2 GLN A 113 13.585 -28.670 -24.678 1.00 73.42 N ATOM 0 H GLN A 113 10.955 -26.261 -26.959 1.00 52.45 H new ATOM 0 HA GLN A 113 12.699 -26.666 -29.261 1.00 61.23 H new ATOM 0 HB2 GLN A 113 11.663 -28.500 -27.064 1.00 53.12 H new ATOM 0 HB3 GLN A 113 12.767 -29.005 -28.327 1.00 53.12 H new ATOM 0 HG2 GLN A 113 14.457 -27.409 -27.544 1.00 61.43 H new ATOM 0 HG3 GLN A 113 13.347 -26.779 -26.343 1.00 61.43 H new ATOM 0 HE21 GLN A 113 12.908 -27.943 -24.446 1.00 73.42 H new ATOM 0 HE22 GLN A 113 13.865 -29.350 -23.972 1.00 73.42 H new ATOM 1462 N ASN A 114 9.575 -27.395 -29.297 1.00 2.54 N ATOM 1463 CA ASN A 114 8.478 -27.911 -30.107 1.00 32.45 C ATOM 1464 C ASN A 114 8.132 -26.945 -31.234 1.00 64.35 C ATOM 1465 O ASN A 114 7.466 -27.315 -32.200 1.00 43.42 O ATOM 1466 CB ASN A 114 7.245 -28.156 -29.235 1.00 24.25 C ATOM 1467 CG ASN A 114 7.174 -29.583 -28.723 1.00 11.24 C ATOM 1468 OD1 ASN A 114 7.221 -30.536 -29.500 1.00 73.30 O ATOM 1469 ND2 ASN A 114 7.058 -29.734 -27.408 1.00 23.10 N ATOM 0 H ASN A 114 9.282 -26.813 -28.513 1.00 2.54 H new ATOM 0 HA ASN A 114 8.798 -28.855 -30.548 1.00 32.45 H new ATOM 0 HB2 ASN A 114 7.259 -27.469 -28.389 1.00 24.25 H new ATOM 0 HB3 ASN A 114 6.346 -27.934 -29.810 1.00 24.25 H new ATOM 0 HD21 ASN A 114 7.004 -30.669 -27.005 1.00 23.10 H new ATOM 0 HD22 ASN A 114 7.023 -28.915 -26.802 1.00 23.10 H new ATOM 1476 N GLY A 115 8.592 -25.704 -31.106 1.00 21.33 N ATOM 1477 CA GLY A 115 8.323 -24.703 -32.122 1.00 73.31 C ATOM 1478 C GLY A 115 7.022 -23.964 -31.877 1.00 24.43 C ATOM 1479 O GLY A 115 6.656 -23.068 -32.637 1.00 44.45 O ATOM 0 H GLY A 115 9.147 -25.374 -30.316 1.00 21.33 H new ATOM 0 HA2 GLY A 115 9.145 -23.987 -32.149 1.00 73.31 H new ATOM 0 HA3 GLY A 115 8.286 -25.183 -33.100 1.00 73.31 H new ATOM 1483 N LEU A 116 6.321 -24.341 -30.814 1.00 12.03 N ATOM 1484 CA LEU A 116 5.051 -23.709 -30.471 1.00 11.14 C ATOM 1485 C LEU A 116 5.279 -22.346 -29.827 1.00 2.32 C ATOM 1486 O LEU A 116 4.363 -21.526 -29.742 1.00 22.54 O ATOM 1487 CB LEU A 116 4.251 -24.606 -29.524 1.00 44.12 C ATOM 1488 CG LEU A 116 2.824 -24.152 -29.216 1.00 72.35 C ATOM 1489 CD1 LEU A 116 1.919 -25.354 -28.989 1.00 4.34 C ATOM 1490 CD2 LEU A 116 2.807 -23.232 -28.005 1.00 35.15 C ATOM 0 H LEU A 116 6.610 -25.081 -30.174 1.00 12.03 H new ATOM 0 HA LEU A 116 4.484 -23.566 -31.391 1.00 11.14 H new ATOM 0 HB2 LEU A 116 4.208 -25.607 -29.953 1.00 44.12 H new ATOM 0 HB3 LEU A 116 4.797 -24.686 -28.584 1.00 44.12 H new ATOM 0 HG LEU A 116 2.446 -23.596 -30.074 1.00 72.35 H new ATOM 0 HD11 LEU A 116 0.907 -25.012 -28.771 1.00 4.34 H new ATOM 0 HD12 LEU A 116 1.907 -25.975 -29.885 1.00 4.34 H new ATOM 0 HD13 LEU A 116 2.294 -25.938 -28.148 1.00 4.34 H new ATOM 0 HD21 LEU A 116 1.783 -22.919 -27.800 1.00 35.15 H new ATOM 0 HD22 LEU A 116 3.204 -23.762 -27.139 1.00 35.15 H new ATOM 0 HD23 LEU A 116 3.422 -22.355 -28.206 1.00 35.15 H new ATOM 1502 N LEU A 117 6.506 -22.107 -29.376 1.00 75.31 N ATOM 1503 CA LEU A 117 6.855 -20.841 -28.741 1.00 64.11 C ATOM 1504 C LEU A 117 7.310 -19.819 -29.778 1.00 73.12 C ATOM 1505 O LEU A 117 6.849 -18.678 -29.782 1.00 31.21 O ATOM 1506 CB LEU A 117 7.958 -21.056 -27.702 1.00 70.44 C ATOM 1507 CG LEU A 117 7.842 -20.232 -26.420 1.00 11.35 C ATOM 1508 CD1 LEU A 117 6.468 -20.413 -25.792 1.00 2.15 C ATOM 1509 CD2 LEU A 117 8.936 -20.619 -25.435 1.00 71.54 C ATOM 0 H LEU A 117 7.276 -22.773 -29.438 1.00 75.31 H new ATOM 0 HA LEU A 117 5.965 -20.455 -28.243 1.00 64.11 H new ATOM 0 HB2 LEU A 117 7.974 -22.112 -27.431 1.00 70.44 H new ATOM 0 HB3 LEU A 117 8.917 -20.832 -28.168 1.00 70.44 H new ATOM 0 HG LEU A 117 7.967 -19.180 -26.675 1.00 11.35 H new ATOM 0 HD11 LEU A 117 6.404 -19.819 -24.880 1.00 2.15 H new ATOM 0 HD12 LEU A 117 5.701 -20.085 -26.494 1.00 2.15 H new ATOM 0 HD13 LEU A 117 6.314 -21.465 -25.551 1.00 2.15 H new ATOM 0 HD21 LEU A 117 8.837 -20.022 -24.528 1.00 71.54 H new ATOM 0 HD22 LEU A 117 8.843 -21.676 -25.185 1.00 71.54 H new ATOM 0 HD23 LEU A 117 9.912 -20.437 -25.885 1.00 71.54 H new ATOM 1521 N GLN A 118 8.216 -20.238 -30.656 1.00 12.30 N ATOM 1522 CA GLN A 118 8.730 -19.359 -31.699 1.00 44.42 C ATOM 1523 C GLN A 118 7.592 -18.768 -32.525 1.00 24.32 C ATOM 1524 O GLN A 118 7.668 -17.626 -32.979 1.00 22.44 O ATOM 1525 CB GLN A 118 9.693 -20.123 -32.610 1.00 45.51 C ATOM 1526 CG GLN A 118 8.996 -21.045 -33.596 1.00 61.01 C ATOM 1527 CD GLN A 118 9.964 -21.724 -34.546 1.00 52.40 C ATOM 1528 OE1 GLN A 118 10.007 -21.409 -35.736 1.00 21.41 O ATOM 1529 NE2 GLN A 118 10.746 -22.660 -34.024 1.00 62.11 N ATOM 0 H GLN A 118 8.608 -21.179 -30.666 1.00 12.30 H new ATOM 0 HA GLN A 118 9.267 -18.542 -31.217 1.00 44.42 H new ATOM 0 HB2 GLN A 118 10.302 -19.407 -33.163 1.00 45.51 H new ATOM 0 HB3 GLN A 118 10.373 -20.711 -31.994 1.00 45.51 H new ATOM 0 HG2 GLN A 118 8.440 -21.804 -33.046 1.00 61.01 H new ATOM 0 HG3 GLN A 118 8.269 -20.472 -34.172 1.00 61.01 H new ATOM 0 HE21 GLN A 118 10.676 -22.888 -33.032 1.00 62.11 H new ATOM 0 HE22 GLN A 118 11.417 -23.151 -34.614 1.00 62.11 H new ATOM 1538 N LYS A 119 6.538 -19.553 -32.717 1.00 34.22 N ATOM 1539 CA LYS A 119 5.382 -19.108 -33.487 1.00 61.11 C ATOM 1540 C LYS A 119 4.502 -18.177 -32.659 1.00 44.22 C ATOM 1541 O LYS A 119 3.725 -17.394 -33.205 1.00 53.51 O ATOM 1542 CB LYS A 119 4.565 -20.313 -33.960 1.00 50.52 C ATOM 1543 CG LYS A 119 4.096 -21.212 -32.829 1.00 44.22 C ATOM 1544 CD LYS A 119 3.297 -22.394 -33.351 1.00 63.24 C ATOM 1545 CE LYS A 119 4.175 -23.357 -34.137 1.00 12.21 C ATOM 1546 NZ LYS A 119 3.547 -23.752 -35.427 1.00 73.13 N ATOM 0 H LYS A 119 6.460 -20.501 -32.350 1.00 34.22 H new ATOM 0 HA LYS A 119 5.745 -18.558 -34.356 1.00 61.11 H new ATOM 0 HB2 LYS A 119 3.696 -19.957 -34.514 1.00 50.52 H new ATOM 0 HB3 LYS A 119 5.167 -20.900 -34.654 1.00 50.52 H new ATOM 0 HG2 LYS A 119 4.958 -21.574 -32.269 1.00 44.22 H new ATOM 0 HG3 LYS A 119 3.484 -20.636 -32.135 1.00 44.22 H new ATOM 0 HD2 LYS A 119 2.836 -22.920 -32.515 1.00 63.24 H new ATOM 0 HD3 LYS A 119 2.488 -22.035 -33.988 1.00 63.24 H new ATOM 0 HE2 LYS A 119 5.141 -22.892 -34.331 1.00 12.21 H new ATOM 0 HE3 LYS A 119 4.365 -24.247 -33.538 1.00 12.21 H new ATOM 0 HZ1 LYS A 119 4.176 -24.408 -35.933 1.00 73.13 H new ATOM 0 HZ2 LYS A 119 2.636 -24.219 -35.241 1.00 73.13 H new ATOM 0 HZ3 LYS A 119 3.389 -22.905 -36.010 1.00 73.13 H new ATOM 1560 N LEU A 120 4.631 -18.266 -31.339 1.00 63.54 N ATOM 1561 CA LEU A 120 3.849 -17.430 -30.436 1.00 33.51 C ATOM 1562 C LEU A 120 4.502 -16.063 -30.256 1.00 63.35 C ATOM 1563 O LEU A 120 3.829 -15.033 -30.294 1.00 12.40 O ATOM 1564 CB LEU A 120 3.695 -18.117 -29.079 1.00 32.44 C ATOM 1565 CG LEU A 120 2.904 -17.346 -28.022 1.00 32.32 C ATOM 1566 CD1 LEU A 120 3.812 -16.385 -27.271 1.00 41.14 C ATOM 1567 CD2 LEU A 120 1.746 -16.597 -28.664 1.00 54.53 C ATOM 0 H LEU A 120 5.270 -18.909 -30.871 1.00 63.54 H new ATOM 0 HA LEU A 120 2.863 -17.285 -30.877 1.00 33.51 H new ATOM 0 HB2 LEU A 120 3.210 -19.081 -29.235 1.00 32.44 H new ATOM 0 HB3 LEU A 120 4.690 -18.321 -28.683 1.00 32.44 H new ATOM 0 HG LEU A 120 2.496 -18.061 -27.307 1.00 32.32 H new ATOM 0 HD11 LEU A 120 3.231 -15.845 -26.523 1.00 41.14 H new ATOM 0 HD12 LEU A 120 4.607 -16.945 -26.779 1.00 41.14 H new ATOM 0 HD13 LEU A 120 4.250 -15.675 -27.972 1.00 41.14 H new ATOM 0 HD21 LEU A 120 1.194 -16.054 -27.897 1.00 54.53 H new ATOM 0 HD22 LEU A 120 2.132 -15.892 -29.401 1.00 54.53 H new ATOM 0 HD23 LEU A 120 1.081 -17.307 -29.155 1.00 54.53 H new ATOM 1579 N LEU A 121 5.816 -16.063 -30.063 1.00 20.32 N ATOM 1580 CA LEU A 121 6.562 -14.822 -29.880 1.00 73.43 C ATOM 1581 C LEU A 121 6.453 -13.934 -31.115 1.00 41.03 C ATOM 1582 O LEU A 121 6.606 -12.716 -31.029 1.00 73.25 O ATOM 1583 CB LEU A 121 8.031 -15.127 -29.584 1.00 4.20 C ATOM 1584 CG LEU A 121 8.301 -16.021 -28.373 1.00 2.30 C ATOM 1585 CD1 LEU A 121 9.757 -15.919 -27.948 1.00 22.21 C ATOM 1586 CD2 LEU A 121 7.380 -15.649 -27.220 1.00 21.25 C ATOM 0 H LEU A 121 6.387 -16.907 -30.029 1.00 20.32 H new ATOM 0 HA LEU A 121 6.130 -14.288 -29.033 1.00 73.43 H new ATOM 0 HB2 LEU A 121 8.467 -15.600 -30.464 1.00 4.20 H new ATOM 0 HB3 LEU A 121 8.555 -14.182 -29.437 1.00 4.20 H new ATOM 0 HG LEU A 121 8.098 -17.054 -28.656 1.00 2.30 H new ATOM 0 HD11 LEU A 121 9.930 -16.562 -27.085 1.00 22.21 H new ATOM 0 HD12 LEU A 121 10.399 -16.235 -28.770 1.00 22.21 H new ATOM 0 HD13 LEU A 121 9.987 -14.887 -27.684 1.00 22.21 H new ATOM 0 HD21 LEU A 121 7.586 -16.295 -26.367 1.00 21.25 H new ATOM 0 HD22 LEU A 121 7.551 -14.610 -26.938 1.00 21.25 H new ATOM 0 HD23 LEU A 121 6.342 -15.775 -27.528 1.00 21.25 H new