USER MOD reduce.3.24.130724 H: found=0, std=0, add=1082, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1084 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 98 SER OG : rot 69:sc= -2.7! USER MOD Set 1.2: A 107 GLN : amide:sc= -2.51! C(o=-5.2!,f=-5.4!) USER MOD Set 2.1: A 83 HIS :FLIP no HE2:sc=-0.00283 F(o=-0.7,f=-0.0028) USER MOD Set 2.2: A 89 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 35 ASN : amide:sc= -0.726 K(o=-0.49,f=-6.5!) USER MOD Set 3.2: A 77 TYR OH : rot 6:sc= 0.236 USER MOD Set 4.1: A 34 ASN :FLIP amide:sc= -0.411 F(o=-6.4,f=-4.3) USER MOD Set 4.2: A 57 ASN :FLIP amide:sc= -3.93! C(o=-6!,f=-4.3!) USER MOD Single : A 14 CYS SG : rot 130:sc= -4.48! USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl 152:sc= -5.58! (180deg=-7.52!) USER MOD Single : A 41 LYS NZ :NH3+ -177:sc= 0.744 (180deg=0.738) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 MET CE :methyl -127:sc= 0 (180deg=-0.222) USER MOD Single : A 56 GLN : amide:sc= -0.505 X(o=-0.51,f=-0.88) USER MOD Single : A 59 SER OG : rot 180:sc= -0.373 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 GLN : amide:sc= -0.0663 X(o=-0.066,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= -0.196 USER MOD Single : A 79 TYR OH : rot 180:sc= -0.804 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 150:sc= -0.0557 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 CYS SG : rot -136:sc= -3.64 USER MOD Single : A 97 SER OG : rot -170:sc= 0 USER MOD Single : A 102 CYS SG : rot -175:sc= -1.82 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= -0.15 X(o=-0.15,f=0) USER MOD Single : A 108 MET CE :methyl -167:sc= 0 (180deg=-0.22) USER MOD Single : A 109 MET CE :methyl -172:sc= -0.76 (180deg=-0.993) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 118:sc= 1.13 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 ASN : amide:sc= 0 X(o=0,f=-0.0036) USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 THR OG1 : rot 80:sc= -1.13 USER MOD Single : A 124 THR OG1 : rot -32:sc= 0.365 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 THR OG1 : rot 180:sc= -1 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 135 N VAL A 13 17.628 -1.011 -0.664 1.00 72.43 N ATOM 136 CA VAL A 13 17.080 0.335 -0.564 1.00 53.15 C ATOM 137 C VAL A 13 17.038 1.015 -1.929 1.00 64.10 C ATOM 138 O VAL A 13 18.065 1.464 -2.441 1.00 71.11 O ATOM 139 CB VAL A 13 17.901 1.206 0.405 1.00 23.31 C ATOM 140 CG1 VAL A 13 17.385 2.635 0.408 1.00 10.45 C ATOM 141 CG2 VAL A 13 17.870 0.615 1.807 1.00 61.12 C ATOM 0 HA VAL A 13 16.065 0.235 -0.179 1.00 53.15 H new ATOM 0 HB VAL A 13 18.936 1.222 0.064 1.00 23.31 H new ATOM 0 HG11 VAL A 13 17.978 3.234 1.099 1.00 10.45 H new ATOM 0 HG12 VAL A 13 17.465 3.053 -0.596 1.00 10.45 H new ATOM 0 HG13 VAL A 13 16.342 2.644 0.723 1.00 10.45 H new ATOM 0 HG21 VAL A 13 18.455 1.243 2.479 1.00 61.12 H new ATOM 0 HG22 VAL A 13 16.840 0.568 2.159 1.00 61.12 H new ATOM 0 HG23 VAL A 13 18.293 -0.389 1.788 1.00 61.12 H new ATOM 151 N CYS A 14 15.847 1.087 -2.511 1.00 64.11 N ATOM 152 CA CYS A 14 15.672 1.712 -3.818 1.00 73.21 C ATOM 153 C CYS A 14 15.129 3.130 -3.674 1.00 22.44 C ATOM 154 O CYS A 14 14.937 3.621 -2.561 1.00 70.02 O ATOM 155 CB CYS A 14 14.727 0.876 -4.683 1.00 13.51 C ATOM 156 SG CYS A 14 15.453 -0.663 -5.293 1.00 33.52 S ATOM 0 H CYS A 14 14.988 0.721 -2.100 1.00 64.11 H new ATOM 0 HA CYS A 14 16.647 1.763 -4.303 1.00 73.21 H new ATOM 0 HB2 CYS A 14 13.835 0.640 -4.103 1.00 13.51 H new ATOM 0 HB3 CYS A 14 14.405 1.476 -5.534 1.00 13.51 H new ATOM 0 HG CYS A 14 14.648 -1.652 -5.041 1.00 33.52 H new ATOM 162 N GLU A 15 14.885 3.782 -4.805 1.00 53.50 N ATOM 163 CA GLU A 15 14.366 5.146 -4.804 1.00 22.34 C ATOM 164 C GLU A 15 12.903 5.171 -5.234 1.00 50.42 C ATOM 165 O GLU A 15 12.370 4.175 -5.723 1.00 64.13 O ATOM 166 CB GLU A 15 15.198 6.033 -5.733 1.00 62.43 C ATOM 167 CG GLU A 15 15.202 5.565 -7.178 1.00 51.41 C ATOM 168 CD GLU A 15 16.502 5.882 -7.891 1.00 41.15 C ATOM 169 OE1 GLU A 15 17.496 5.163 -7.658 1.00 45.34 O ATOM 170 OE2 GLU A 15 16.525 6.849 -8.682 1.00 0.20 O ATOM 0 H GLU A 15 15.038 3.389 -5.734 1.00 53.50 H new ATOM 0 HA GLU A 15 14.435 5.533 -3.787 1.00 22.34 H new ATOM 0 HB2 GLU A 15 14.812 7.052 -5.691 1.00 62.43 H new ATOM 0 HB3 GLU A 15 16.224 6.066 -5.368 1.00 62.43 H new ATOM 0 HG2 GLU A 15 15.029 4.489 -7.208 1.00 51.41 H new ATOM 0 HG3 GLU A 15 14.376 6.036 -7.711 1.00 51.41 H new ATOM 177 N VAL A 16 12.257 6.318 -5.049 1.00 3.32 N ATOM 178 CA VAL A 16 10.855 6.476 -5.418 1.00 24.33 C ATOM 179 C VAL A 16 10.717 7.162 -6.772 1.00 44.32 C ATOM 180 O VAL A 16 10.895 8.375 -6.885 1.00 63.45 O ATOM 181 CB VAL A 16 10.085 7.289 -4.362 1.00 15.15 C ATOM 182 CG1 VAL A 16 8.645 7.508 -4.801 1.00 1.24 C ATOM 183 CG2 VAL A 16 10.139 6.593 -3.009 1.00 55.54 C ATOM 0 H VAL A 16 12.683 7.152 -4.645 1.00 3.32 H new ATOM 0 HA VAL A 16 10.428 5.475 -5.476 1.00 24.33 H new ATOM 0 HB VAL A 16 10.561 8.264 -4.262 1.00 15.15 H new ATOM 0 HG11 VAL A 16 8.117 8.085 -4.042 1.00 1.24 H new ATOM 0 HG12 VAL A 16 8.631 8.053 -5.745 1.00 1.24 H new ATOM 0 HG13 VAL A 16 8.154 6.544 -4.931 1.00 1.24 H new ATOM 0 HG21 VAL A 16 9.589 7.182 -2.275 1.00 55.54 H new ATOM 0 HG22 VAL A 16 9.689 5.603 -3.091 1.00 55.54 H new ATOM 0 HG23 VAL A 16 11.177 6.495 -2.692 1.00 55.54 H new ATOM 193 N ASP A 17 10.398 6.378 -7.796 1.00 42.42 N ATOM 194 CA ASP A 17 10.235 6.910 -9.144 1.00 53.41 C ATOM 195 C ASP A 17 9.646 8.317 -9.105 1.00 11.42 C ATOM 196 O ASP A 17 8.766 8.627 -8.301 1.00 60.13 O ATOM 197 CB ASP A 17 9.335 5.991 -9.972 1.00 2.42 C ATOM 198 CG ASP A 17 9.302 6.380 -11.437 1.00 43.50 C ATOM 199 OD1 ASP A 17 8.450 7.215 -11.810 1.00 24.22 O ATOM 200 OD2 ASP A 17 10.127 5.850 -12.211 1.00 10.42 O ATOM 0 H ASP A 17 10.247 5.372 -7.718 1.00 42.42 H new ATOM 0 HA ASP A 17 11.219 6.960 -9.610 1.00 53.41 H new ATOM 0 HB2 ASP A 17 9.687 4.963 -9.880 1.00 2.42 H new ATOM 0 HB3 ASP A 17 8.323 6.019 -9.569 1.00 2.42 H new ATOM 205 N PRO A 18 10.143 9.192 -9.992 1.00 44.02 N ATOM 206 CA PRO A 18 9.682 10.581 -10.079 1.00 34.12 C ATOM 207 C PRO A 18 8.261 10.686 -10.622 1.00 51.22 C ATOM 208 O PRO A 18 7.526 11.613 -10.284 1.00 53.44 O ATOM 209 CB PRO A 18 10.675 11.225 -11.049 1.00 20.34 C ATOM 210 CG PRO A 18 11.178 10.096 -11.881 1.00 43.10 C ATOM 211 CD PRO A 18 11.194 8.892 -10.979 1.00 61.20 C ATOM 0 HA PRO A 18 9.649 11.062 -9.101 1.00 34.12 H new ATOM 0 HB2 PRO A 18 10.192 11.985 -11.663 1.00 20.34 H new ATOM 0 HB3 PRO A 18 11.488 11.716 -10.515 1.00 20.34 H new ATOM 0 HG2 PRO A 18 10.533 9.929 -12.743 1.00 43.10 H new ATOM 0 HG3 PRO A 18 12.175 10.309 -12.266 1.00 43.10 H new ATOM 0 HD2 PRO A 18 10.980 7.975 -11.528 1.00 61.20 H new ATOM 0 HD3 PRO A 18 12.166 8.759 -10.504 1.00 61.20 H new ATOM 219 N GLU A 19 7.883 9.732 -11.466 1.00 72.21 N ATOM 220 CA GLU A 19 6.549 9.719 -12.057 1.00 2.23 C ATOM 221 C GLU A 19 5.511 9.244 -11.044 1.00 50.04 C ATOM 222 O GLU A 19 4.331 9.586 -11.142 1.00 2.44 O ATOM 223 CB GLU A 19 6.523 8.818 -13.293 1.00 14.12 C ATOM 224 CG GLU A 19 6.144 7.378 -12.989 1.00 13.01 C ATOM 225 CD GLU A 19 4.718 7.054 -13.389 1.00 73.44 C ATOM 226 OE1 GLU A 19 4.324 7.411 -14.519 1.00 14.00 O ATOM 227 OE2 GLU A 19 3.996 6.443 -12.573 1.00 53.40 O ATOM 0 H GLU A 19 8.481 8.958 -11.756 1.00 72.21 H new ATOM 0 HA GLU A 19 6.301 10.738 -12.355 1.00 2.23 H new ATOM 0 HB2 GLU A 19 5.816 9.226 -14.015 1.00 14.12 H new ATOM 0 HB3 GLU A 19 7.505 8.834 -13.765 1.00 14.12 H new ATOM 0 HG2 GLU A 19 6.826 6.708 -13.513 1.00 13.01 H new ATOM 0 HG3 GLU A 19 6.270 7.190 -11.923 1.00 13.01 H new ATOM 234 N LEU A 20 5.957 8.453 -10.075 1.00 3.43 N ATOM 235 CA LEU A 20 5.066 7.929 -9.045 1.00 5.35 C ATOM 236 C LEU A 20 4.979 8.889 -7.862 1.00 72.34 C ATOM 237 O LEU A 20 3.900 9.118 -7.314 1.00 45.30 O ATOM 238 CB LEU A 20 5.555 6.560 -8.570 1.00 25.23 C ATOM 239 CG LEU A 20 4.481 5.614 -8.031 1.00 11.21 C ATOM 240 CD1 LEU A 20 5.096 4.286 -7.619 1.00 43.10 C ATOM 241 CD2 LEU A 20 3.750 6.252 -6.858 1.00 20.42 C ATOM 0 H LEU A 20 6.929 8.160 -9.980 1.00 3.43 H new ATOM 0 HA LEU A 20 4.071 7.823 -9.478 1.00 5.35 H new ATOM 0 HB2 LEU A 20 6.060 6.068 -9.401 1.00 25.23 H new ATOM 0 HB3 LEU A 20 6.301 6.713 -7.790 1.00 25.23 H new ATOM 0 HG LEU A 20 3.759 5.425 -8.825 1.00 11.21 H new ATOM 0 HD11 LEU A 20 4.316 3.626 -7.238 1.00 43.10 H new ATOM 0 HD12 LEU A 20 5.573 3.823 -8.482 1.00 43.10 H new ATOM 0 HD13 LEU A 20 5.840 4.455 -6.841 1.00 43.10 H new ATOM 0 HD21 LEU A 20 2.989 5.565 -6.487 1.00 20.42 H new ATOM 0 HD22 LEU A 20 4.461 6.471 -6.062 1.00 20.42 H new ATOM 0 HD23 LEU A 20 3.275 7.177 -7.185 1.00 20.42 H new ATOM 253 N LYS A 21 6.120 9.448 -7.475 1.00 12.12 N ATOM 254 CA LYS A 21 6.173 10.386 -6.359 1.00 64.14 C ATOM 255 C LYS A 21 4.979 11.334 -6.389 1.00 13.52 C ATOM 256 O LYS A 21 4.351 11.587 -5.361 1.00 61.12 O ATOM 257 CB LYS A 21 7.476 11.188 -6.403 1.00 14.10 C ATOM 258 CG LYS A 21 7.789 11.910 -5.103 1.00 60.42 C ATOM 259 CD LYS A 21 8.524 13.215 -5.354 1.00 24.22 C ATOM 260 CE LYS A 21 10.009 13.086 -5.047 1.00 43.13 C ATOM 261 NZ LYS A 21 10.569 14.342 -4.476 1.00 2.02 N ATOM 0 H LYS A 21 7.021 9.268 -7.918 1.00 12.12 H new ATOM 0 HA LYS A 21 6.137 9.813 -5.432 1.00 64.14 H new ATOM 0 HB2 LYS A 21 8.299 10.515 -6.643 1.00 14.10 H new ATOM 0 HB3 LYS A 21 7.416 11.919 -7.210 1.00 14.10 H new ATOM 0 HG2 LYS A 21 6.863 12.111 -4.565 1.00 60.42 H new ATOM 0 HG3 LYS A 21 8.395 11.267 -4.465 1.00 60.42 H new ATOM 0 HD2 LYS A 21 8.391 13.515 -6.393 1.00 24.22 H new ATOM 0 HD3 LYS A 21 8.091 14.002 -4.737 1.00 24.22 H new ATOM 0 HE2 LYS A 21 10.165 12.267 -4.345 1.00 43.13 H new ATOM 0 HE3 LYS A 21 10.548 12.830 -5.960 1.00 43.13 H new ATOM 0 HZ1 LYS A 21 11.582 14.213 -4.281 1.00 2.02 H new ATOM 0 HZ2 LYS A 21 10.444 15.119 -5.156 1.00 2.02 H new ATOM 0 HZ3 LYS A 21 10.073 14.573 -3.592 1.00 2.02 H new ATOM 275 N GLU A 22 4.670 11.854 -7.572 1.00 62.43 N ATOM 276 CA GLU A 22 3.550 12.773 -7.734 1.00 52.22 C ATOM 277 C GLU A 22 2.224 12.069 -7.461 1.00 13.23 C ATOM 278 O GLU A 22 1.351 12.606 -6.778 1.00 12.14 O ATOM 279 CB GLU A 22 3.544 13.363 -9.146 1.00 41.24 C ATOM 280 CG GLU A 22 4.922 13.771 -9.640 1.00 60.02 C ATOM 281 CD GLU A 22 4.862 14.831 -10.723 1.00 4.25 C ATOM 282 OE1 GLU A 22 4.444 15.968 -10.416 1.00 71.31 O ATOM 283 OE2 GLU A 22 5.235 14.526 -11.875 1.00 1.52 O ATOM 0 H GLU A 22 5.180 11.655 -8.433 1.00 62.43 H new ATOM 0 HA GLU A 22 3.670 13.580 -7.011 1.00 52.22 H new ATOM 0 HB2 GLU A 22 3.122 12.631 -9.835 1.00 41.24 H new ATOM 0 HB3 GLU A 22 2.888 14.233 -9.164 1.00 41.24 H new ATOM 0 HG2 GLU A 22 5.508 14.146 -8.801 1.00 60.02 H new ATOM 0 HG3 GLU A 22 5.441 12.893 -10.024 1.00 60.02 H new ATOM 290 N THR A 23 2.079 10.862 -7.998 1.00 61.41 N ATOM 291 CA THR A 23 0.861 10.084 -7.815 1.00 34.22 C ATOM 292 C THR A 23 0.448 10.048 -6.348 1.00 75.34 C ATOM 293 O THR A 23 -0.740 10.107 -6.025 1.00 72.12 O ATOM 294 CB THR A 23 1.035 8.640 -8.323 1.00 32.32 C ATOM 295 OG1 THR A 23 0.973 8.613 -9.753 1.00 43.04 O ATOM 296 CG2 THR A 23 -0.041 7.731 -7.747 1.00 23.32 C ATOM 0 H THR A 23 2.792 10.402 -8.564 1.00 61.41 H new ATOM 0 HA THR A 23 0.081 10.575 -8.398 1.00 34.22 H new ATOM 0 HB THR A 23 2.009 8.278 -7.995 1.00 32.32 H new ATOM 0 HG1 THR A 23 1.086 7.692 -10.068 1.00 43.04 H new ATOM 0 HG21 THR A 23 0.102 6.717 -8.120 1.00 23.32 H new ATOM 0 HG22 THR A 23 0.027 7.731 -6.659 1.00 23.32 H new ATOM 0 HG23 THR A 23 -1.024 8.093 -8.049 1.00 23.32 H new ATOM 304 N LEU A 24 1.432 9.952 -5.462 1.00 43.43 N ATOM 305 CA LEU A 24 1.171 9.910 -4.028 1.00 3.43 C ATOM 306 C LEU A 24 0.690 11.266 -3.522 1.00 43.52 C ATOM 307 O LEU A 24 -0.351 11.365 -2.874 1.00 75.14 O ATOM 308 CB LEU A 24 2.431 9.488 -3.272 1.00 23.14 C ATOM 309 CG LEU A 24 3.201 8.303 -3.858 1.00 0.30 C ATOM 310 CD1 LEU A 24 4.350 7.909 -2.943 1.00 44.11 C ATOM 311 CD2 LEU A 24 2.269 7.122 -4.085 1.00 55.43 C ATOM 0 H LEU A 24 2.420 9.902 -5.712 1.00 43.43 H new ATOM 0 HA LEU A 24 0.385 9.176 -3.848 1.00 3.43 H new ATOM 0 HB2 LEU A 24 3.104 10.344 -3.222 1.00 23.14 H new ATOM 0 HB3 LEU A 24 2.151 9.243 -2.248 1.00 23.14 H new ATOM 0 HG LEU A 24 3.616 8.603 -4.820 1.00 0.30 H new ATOM 0 HD11 LEU A 24 4.887 7.065 -3.376 1.00 44.11 H new ATOM 0 HD12 LEU A 24 5.031 8.752 -2.830 1.00 44.11 H new ATOM 0 HD13 LEU A 24 3.957 7.627 -1.966 1.00 44.11 H new ATOM 0 HD21 LEU A 24 2.833 6.288 -4.502 1.00 55.43 H new ATOM 0 HD22 LEU A 24 1.825 6.821 -3.136 1.00 55.43 H new ATOM 0 HD23 LEU A 24 1.480 7.410 -4.780 1.00 55.43 H new ATOM 323 N ARG A 25 1.456 12.310 -3.824 1.00 30.25 N ATOM 324 CA ARG A 25 1.108 13.660 -3.400 1.00 42.42 C ATOM 325 C ARG A 25 -0.267 14.058 -3.927 1.00 42.24 C ATOM 326 O ARG A 25 -0.998 14.812 -3.283 1.00 64.10 O ATOM 327 CB ARG A 25 2.161 14.658 -3.887 1.00 21.23 C ATOM 328 CG ARG A 25 1.873 16.094 -3.483 1.00 10.31 C ATOM 329 CD ARG A 25 2.351 17.077 -4.540 1.00 74.04 C ATOM 330 NE ARG A 25 3.671 17.616 -4.230 1.00 65.20 N ATOM 331 CZ ARG A 25 4.289 18.525 -4.977 1.00 61.34 C ATOM 332 NH1 ARG A 25 3.707 18.994 -6.072 1.00 71.14 N ATOM 333 NH2 ARG A 25 5.492 18.966 -4.629 1.00 73.54 N ATOM 0 H ARG A 25 2.321 12.246 -4.361 1.00 30.25 H new ATOM 0 HA ARG A 25 1.079 13.675 -2.310 1.00 42.42 H new ATOM 0 HB2 ARG A 25 3.135 14.367 -3.493 1.00 21.23 H new ATOM 0 HB3 ARG A 25 2.227 14.602 -4.974 1.00 21.23 H new ATOM 0 HG2 ARG A 25 0.802 16.221 -3.325 1.00 10.31 H new ATOM 0 HG3 ARG A 25 2.363 16.311 -2.534 1.00 10.31 H new ATOM 0 HD2 ARG A 25 2.381 16.580 -5.510 1.00 74.04 H new ATOM 0 HD3 ARG A 25 1.636 17.895 -4.623 1.00 74.04 H new ATOM 0 HE ARG A 25 4.146 17.276 -3.394 1.00 65.20 H new ATOM 0 HH11 ARG A 25 2.783 18.657 -6.343 1.00 71.14 H new ATOM 0 HH12 ARG A 25 4.183 19.692 -6.644 1.00 71.14 H new ATOM 0 HH21 ARG A 25 5.943 18.607 -3.787 1.00 73.54 H new ATOM 0 HH22 ARG A 25 5.965 19.664 -5.203 1.00 73.54 H new ATOM 347 N LYS A 26 -0.613 13.548 -5.105 1.00 15.53 N ATOM 348 CA LYS A 26 -1.902 13.849 -5.719 1.00 44.12 C ATOM 349 C LYS A 26 -3.009 12.998 -5.107 1.00 34.13 C ATOM 350 O LYS A 26 -4.125 13.472 -4.895 1.00 2.11 O ATOM 351 CB LYS A 26 -1.836 13.610 -7.229 1.00 60.54 C ATOM 352 CG LYS A 26 -0.537 14.075 -7.864 1.00 12.21 C ATOM 353 CD LYS A 26 -0.779 15.159 -8.900 1.00 50.54 C ATOM 354 CE LYS A 26 0.185 15.038 -10.070 1.00 74.20 C ATOM 355 NZ LYS A 26 -0.522 15.096 -11.380 1.00 32.30 N ATOM 0 H LYS A 26 -0.020 12.925 -5.653 1.00 15.53 H new ATOM 0 HA LYS A 26 -2.130 14.898 -5.531 1.00 44.12 H new ATOM 0 HB2 LYS A 26 -1.966 12.546 -7.426 1.00 60.54 H new ATOM 0 HB3 LYS A 26 -2.669 14.126 -7.706 1.00 60.54 H new ATOM 0 HG2 LYS A 26 0.132 14.452 -7.091 1.00 12.21 H new ATOM 0 HG3 LYS A 26 -0.037 13.228 -8.333 1.00 12.21 H new ATOM 0 HD2 LYS A 26 -1.804 15.093 -9.264 1.00 50.54 H new ATOM 0 HD3 LYS A 26 -0.668 16.139 -8.436 1.00 50.54 H new ATOM 0 HE2 LYS A 26 0.921 15.840 -10.019 1.00 74.20 H new ATOM 0 HE3 LYS A 26 0.732 14.098 -9.994 1.00 74.20 H new ATOM 0 HZ1 LYS A 26 0.170 15.010 -12.152 1.00 32.30 H new ATOM 0 HZ2 LYS A 26 -1.206 14.315 -11.440 1.00 32.30 H new ATOM 0 HZ3 LYS A 26 -1.024 16.003 -11.464 1.00 32.30 H new ATOM 369 N PHE A 27 -2.692 11.738 -4.823 1.00 13.21 N ATOM 370 CA PHE A 27 -3.661 10.822 -4.233 1.00 75.04 C ATOM 371 C PHE A 27 -4.176 11.357 -2.900 1.00 21.55 C ATOM 372 O PHE A 27 -5.357 11.225 -2.580 1.00 73.05 O ATOM 373 CB PHE A 27 -3.032 9.441 -4.033 1.00 74.21 C ATOM 374 CG PHE A 27 -4.042 8.341 -3.868 1.00 2.22 C ATOM 375 CD1 PHE A 27 -5.131 8.248 -4.719 1.00 41.23 C ATOM 376 CD2 PHE A 27 -3.901 7.399 -2.861 1.00 43.33 C ATOM 377 CE1 PHE A 27 -6.061 7.238 -4.569 1.00 73.44 C ATOM 378 CE2 PHE A 27 -4.828 6.386 -2.707 1.00 21.22 C ATOM 379 CZ PHE A 27 -5.909 6.304 -3.562 1.00 5.01 C ATOM 0 H PHE A 27 -1.773 11.329 -4.992 1.00 13.21 H new ATOM 0 HA PHE A 27 -4.504 10.735 -4.918 1.00 75.04 H new ATOM 0 HB2 PHE A 27 -2.395 9.213 -4.888 1.00 74.21 H new ATOM 0 HB3 PHE A 27 -2.388 9.467 -3.154 1.00 74.21 H new ATOM 0 HD1 PHE A 27 -5.254 8.974 -5.509 1.00 41.23 H new ATOM 0 HD2 PHE A 27 -3.057 7.457 -2.189 1.00 43.33 H new ATOM 0 HE1 PHE A 27 -6.906 7.178 -5.238 1.00 73.44 H new ATOM 0 HE2 PHE A 27 -4.707 5.659 -1.918 1.00 21.22 H new ATOM 0 HZ PHE A 27 -6.634 5.512 -3.444 1.00 5.01 H new ATOM 389 N ARG A 28 -3.280 11.959 -2.126 1.00 4.54 N ATOM 390 CA ARG A 28 -3.641 12.513 -0.827 1.00 3.41 C ATOM 391 C ARG A 28 -4.446 13.800 -0.989 1.00 5.33 C ATOM 392 O ARG A 28 -5.263 14.144 -0.135 1.00 55.24 O ATOM 393 CB ARG A 28 -2.385 12.785 0.004 1.00 52.53 C ATOM 394 CG ARG A 28 -1.290 11.749 -0.191 1.00 54.33 C ATOM 395 CD ARG A 28 -0.660 11.348 1.133 1.00 1.34 C ATOM 396 NE ARG A 28 -0.033 12.482 1.807 1.00 61.14 N ATOM 397 CZ ARG A 28 -0.619 13.179 2.775 1.00 62.43 C ATOM 398 NH1 ARG A 28 -1.840 12.857 3.181 1.00 44.45 N ATOM 399 NH2 ARG A 28 0.017 14.197 3.338 1.00 1.55 N ATOM 0 H ARG A 28 -2.298 12.076 -2.376 1.00 4.54 H new ATOM 0 HA ARG A 28 -4.259 11.781 -0.308 1.00 3.41 H new ATOM 0 HB2 ARG A 28 -1.994 13.768 -0.256 1.00 52.53 H new ATOM 0 HB3 ARG A 28 -2.658 12.819 1.059 1.00 52.53 H new ATOM 0 HG2 ARG A 28 -1.705 10.867 -0.680 1.00 54.33 H new ATOM 0 HG3 ARG A 28 -0.523 12.149 -0.854 1.00 54.33 H new ATOM 0 HD2 ARG A 28 -1.423 10.917 1.782 1.00 1.34 H new ATOM 0 HD3 ARG A 28 0.086 10.572 0.959 1.00 1.34 H new ATOM 0 HE ARG A 28 0.907 12.754 1.519 1.00 61.14 H new ATOM 0 HH11 ARG A 28 -2.331 12.073 2.750 1.00 44.45 H new ATOM 0 HH12 ARG A 28 -2.288 13.393 3.924 1.00 44.45 H new ATOM 0 HH21 ARG A 28 0.956 14.446 3.028 1.00 1.55 H new ATOM 0 HH22 ARG A 28 -0.433 14.732 4.081 1.00 1.55 H new ATOM 413 N PHE A 29 -4.206 14.507 -2.087 1.00 61.04 N ATOM 414 CA PHE A 29 -4.907 15.757 -2.361 1.00 65.31 C ATOM 415 C PHE A 29 -5.565 15.721 -3.737 1.00 72.22 C ATOM 416 O PHE A 29 -5.543 16.707 -4.474 1.00 31.34 O ATOM 417 CB PHE A 29 -3.937 16.938 -2.278 1.00 74.02 C ATOM 418 CG PHE A 29 -2.748 16.676 -1.399 1.00 43.20 C ATOM 419 CD1 PHE A 29 -2.916 16.220 -0.102 1.00 3.35 C ATOM 420 CD2 PHE A 29 -1.462 16.887 -1.870 1.00 73.42 C ATOM 421 CE1 PHE A 29 -1.823 15.980 0.710 1.00 72.13 C ATOM 422 CE2 PHE A 29 -0.365 16.649 -1.064 1.00 22.34 C ATOM 423 CZ PHE A 29 -0.546 16.194 0.229 1.00 63.33 C ATOM 0 H PHE A 29 -3.531 14.236 -2.803 1.00 61.04 H new ATOM 0 HA PHE A 29 -5.686 15.881 -1.608 1.00 65.31 H new ATOM 0 HB2 PHE A 29 -3.590 17.184 -3.282 1.00 74.02 H new ATOM 0 HB3 PHE A 29 -4.471 17.811 -1.903 1.00 74.02 H new ATOM 0 HD1 PHE A 29 -3.912 16.050 0.279 1.00 3.35 H new ATOM 0 HD2 PHE A 29 -1.315 17.242 -2.879 1.00 73.42 H new ATOM 0 HE1 PHE A 29 -1.968 15.625 1.720 1.00 72.13 H new ATOM 0 HE2 PHE A 29 0.632 16.818 -1.443 1.00 22.34 H new ATOM 0 HZ PHE A 29 0.309 16.006 0.861 1.00 63.33 H new ATOM 433 N ARG A 30 -6.152 14.576 -4.076 1.00 3.55 N ATOM 434 CA ARG A 30 -6.816 14.412 -5.363 1.00 34.52 C ATOM 435 C ARG A 30 -8.196 15.061 -5.350 1.00 35.33 C ATOM 436 O ARG A 30 -8.678 15.502 -4.306 1.00 10.00 O ATOM 437 CB ARG A 30 -6.943 12.926 -5.708 1.00 33.44 C ATOM 438 CG ARG A 30 -7.752 12.132 -4.694 1.00 24.22 C ATOM 439 CD ARG A 30 -7.408 10.652 -4.745 1.00 34.31 C ATOM 440 NE ARG A 30 -8.573 9.831 -5.062 1.00 34.32 N ATOM 441 CZ ARG A 30 -9.486 9.472 -4.164 1.00 51.32 C ATOM 442 NH1 ARG A 30 -9.369 9.862 -2.903 1.00 3.15 N ATOM 443 NH2 ARG A 30 -10.518 8.723 -4.529 1.00 72.14 N ATOM 0 H ARG A 30 -6.181 13.750 -3.478 1.00 3.55 H new ATOM 0 HA ARG A 30 -6.209 14.905 -6.122 1.00 34.52 H new ATOM 0 HB2 ARG A 30 -7.409 12.828 -6.689 1.00 33.44 H new ATOM 0 HB3 ARG A 30 -5.946 12.493 -5.784 1.00 33.44 H new ATOM 0 HG2 ARG A 30 -7.561 12.517 -3.692 1.00 24.22 H new ATOM 0 HG3 ARG A 30 -8.816 12.267 -4.890 1.00 24.22 H new ATOM 0 HD2 ARG A 30 -6.633 10.485 -5.493 1.00 34.31 H new ATOM 0 HD3 ARG A 30 -6.996 10.342 -3.784 1.00 34.31 H new ATOM 0 HE ARG A 30 -8.693 9.516 -6.025 1.00 34.32 H new ATOM 0 HH11 ARG A 30 -8.577 10.439 -2.619 1.00 3.15 H new ATOM 0 HH12 ARG A 30 -10.071 9.585 -2.216 1.00 3.15 H new ATOM 0 HH21 ARG A 30 -10.612 8.422 -5.499 1.00 72.14 H new ATOM 0 HH22 ARG A 30 -11.218 8.448 -3.840 1.00 72.14 H new ATOM 508 N ASN A 34 -14.123 8.922 -3.589 1.00 50.13 N ATOM 509 CA ASN A 34 -14.465 7.507 -3.499 1.00 44.00 C ATOM 510 C ASN A 34 -13.253 6.680 -3.079 1.00 4.41 C ATOM 511 O ASN A 34 -12.144 7.201 -2.966 1.00 33.34 O ATOM 512 CB ASN A 34 -15.001 7.003 -4.840 1.00 4.10 C ATOM 513 CG ASN A 34 -14.098 7.376 -6.001 1.00 3.24 C ATOM 514 OD1 ASN A 34 -13.499 6.373 -6.631 1.00 72.43 O flip ATOM 515 ND2 ASN A 34 -13.940 8.554 -6.325 1.00 61.51 N flip ATOM 0 HA ASN A 34 -15.240 7.394 -2.741 1.00 44.00 H new ATOM 0 HB2 ASN A 34 -15.109 5.919 -4.801 1.00 4.10 H new ATOM 0 HB3 ASN A 34 -15.995 7.416 -5.009 1.00 4.10 H new ATOM 0 HD21 ASN A 34 -14.421 9.293 -5.812 1.00 61.51 H new ATOM 0 HD22 ASN A 34 -13.328 8.790 -7.106 1.00 61.51 H new ATOM 522 N ASN A 35 -13.474 5.390 -2.852 1.00 32.33 N ATOM 523 CA ASN A 35 -12.400 4.491 -2.445 1.00 63.54 C ATOM 524 C ASN A 35 -11.529 4.109 -3.639 1.00 21.12 C ATOM 525 O ASN A 35 -12.028 3.627 -4.655 1.00 62.32 O ATOM 526 CB ASN A 35 -12.979 3.231 -1.799 1.00 21.31 C ATOM 527 CG ASN A 35 -13.428 3.468 -0.370 1.00 0.54 C ATOM 528 OD1 ASN A 35 -13.141 4.511 0.218 1.00 43.44 O ATOM 529 ND2 ASN A 35 -14.138 2.499 0.196 1.00 70.10 N ATOM 0 H ASN A 35 -14.387 4.943 -2.943 1.00 32.33 H new ATOM 0 HA ASN A 35 -11.779 5.013 -1.716 1.00 63.54 H new ATOM 0 HB2 ASN A 35 -13.825 2.879 -2.389 1.00 21.31 H new ATOM 0 HB3 ASN A 35 -12.229 2.440 -1.815 1.00 21.31 H new ATOM 0 HD21 ASN A 35 -14.469 2.603 1.155 1.00 70.10 H new ATOM 0 HD22 ASN A 35 -14.353 1.651 -0.329 1.00 70.10 H new ATOM 536 N ALA A 36 -10.225 4.328 -3.506 1.00 42.10 N ATOM 537 CA ALA A 36 -9.284 4.005 -4.572 1.00 74.11 C ATOM 538 C ALA A 36 -8.011 3.381 -4.010 1.00 3.03 C ATOM 539 O ALA A 36 -7.695 3.546 -2.832 1.00 10.33 O ATOM 540 CB ALA A 36 -8.952 5.251 -5.379 1.00 4.15 C ATOM 0 H ALA A 36 -9.796 4.728 -2.671 1.00 42.10 H new ATOM 0 HA ALA A 36 -9.755 3.275 -5.230 1.00 74.11 H new ATOM 0 HB1 ALA A 36 -8.249 4.995 -6.171 1.00 4.15 H new ATOM 0 HB2 ALA A 36 -9.864 5.653 -5.820 1.00 4.15 H new ATOM 0 HB3 ALA A 36 -8.505 6.000 -4.725 1.00 4.15 H new ATOM 546 N ALA A 37 -7.284 2.663 -4.859 1.00 73.14 N ATOM 547 CA ALA A 37 -6.046 2.015 -4.447 1.00 60.54 C ATOM 548 C ALA A 37 -4.959 2.183 -5.505 1.00 15.31 C ATOM 549 O ALA A 37 -5.254 2.309 -6.695 1.00 22.41 O ATOM 550 CB ALA A 37 -6.289 0.539 -4.169 1.00 11.12 C ATOM 0 H ALA A 37 -7.532 2.515 -5.837 1.00 73.14 H new ATOM 0 HA ALA A 37 -5.703 2.495 -3.530 1.00 60.54 H new ATOM 0 HB1 ALA A 37 -5.355 0.068 -3.862 1.00 11.12 H new ATOM 0 HB2 ALA A 37 -7.026 0.435 -3.373 1.00 11.12 H new ATOM 0 HB3 ALA A 37 -6.660 0.055 -5.072 1.00 11.12 H new ATOM 556 N ILE A 38 -3.706 2.185 -5.064 1.00 40.23 N ATOM 557 CA ILE A 38 -2.578 2.338 -5.974 1.00 44.03 C ATOM 558 C ILE A 38 -1.505 1.289 -5.700 1.00 11.15 C ATOM 559 O ILE A 38 -0.803 1.355 -4.689 1.00 73.45 O ATOM 560 CB ILE A 38 -1.950 3.740 -5.862 1.00 41.44 C ATOM 561 CG1 ILE A 38 -3.035 4.816 -5.930 1.00 35.24 C ATOM 562 CG2 ILE A 38 -0.921 3.949 -6.962 1.00 50.15 C ATOM 563 CD1 ILE A 38 -2.488 6.222 -6.043 1.00 24.43 C ATOM 0 H ILE A 38 -3.446 2.082 -4.083 1.00 40.23 H new ATOM 0 HA ILE A 38 -2.966 2.203 -6.984 1.00 44.03 H new ATOM 0 HB ILE A 38 -1.445 3.819 -4.899 1.00 41.44 H new ATOM 0 HG12 ILE A 38 -3.680 4.616 -6.786 1.00 35.24 H new ATOM 0 HG13 ILE A 38 -3.658 4.748 -5.038 1.00 35.24 H new ATOM 0 HG21 ILE A 38 -0.486 4.944 -6.869 1.00 50.15 H new ATOM 0 HG22 ILE A 38 -0.135 3.200 -6.872 1.00 50.15 H new ATOM 0 HG23 ILE A 38 -1.404 3.853 -7.935 1.00 50.15 H new ATOM 0 HD11 ILE A 38 -3.314 6.931 -6.087 1.00 24.43 H new ATOM 0 HD12 ILE A 38 -1.867 6.442 -5.175 1.00 24.43 H new ATOM 0 HD13 ILE A 38 -1.888 6.307 -6.949 1.00 24.43 H new ATOM 575 N ILE A 39 -1.382 0.326 -6.607 1.00 12.14 N ATOM 576 CA ILE A 39 -0.393 -0.735 -6.464 1.00 5.44 C ATOM 577 C ILE A 39 0.920 -0.356 -7.140 1.00 63.33 C ATOM 578 O ILE A 39 0.987 -0.234 -8.364 1.00 1.44 O ATOM 579 CB ILE A 39 -0.900 -2.062 -7.058 1.00 52.31 C ATOM 580 CG1 ILE A 39 -2.221 -2.469 -6.400 1.00 14.31 C ATOM 581 CG2 ILE A 39 0.143 -3.154 -6.883 1.00 2.20 C ATOM 582 CD1 ILE A 39 -3.218 -3.069 -7.366 1.00 21.42 C ATOM 0 H ILE A 39 -1.955 0.259 -7.448 1.00 12.14 H new ATOM 0 HA ILE A 39 -0.224 -0.867 -5.395 1.00 5.44 H new ATOM 0 HB ILE A 39 -1.075 -1.922 -8.125 1.00 52.31 H new ATOM 0 HG12 ILE A 39 -2.016 -3.189 -5.608 1.00 14.31 H new ATOM 0 HG13 ILE A 39 -2.667 -1.594 -5.927 1.00 14.31 H new ATOM 0 HG21 ILE A 39 -0.231 -4.086 -7.308 1.00 2.20 H new ATOM 0 HG22 ILE A 39 1.062 -2.865 -7.394 1.00 2.20 H new ATOM 0 HG23 ILE A 39 0.347 -3.296 -5.822 1.00 2.20 H new ATOM 0 HD11 ILE A 39 -4.130 -3.334 -6.830 1.00 21.42 H new ATOM 0 HD12 ILE A 39 -3.452 -2.343 -8.145 1.00 21.42 H new ATOM 0 HD13 ILE A 39 -2.792 -3.963 -7.820 1.00 21.42 H new ATOM 594 N MET A 40 1.963 -0.175 -6.337 1.00 30.00 N ATOM 595 CA MET A 40 3.276 0.186 -6.860 1.00 23.22 C ATOM 596 C MET A 40 4.262 -0.966 -6.696 1.00 21.33 C ATOM 597 O MET A 40 4.201 -1.716 -5.722 1.00 31.12 O ATOM 598 CB MET A 40 3.807 1.432 -6.148 1.00 11.35 C ATOM 599 CG MET A 40 2.753 2.507 -5.939 1.00 42.42 C ATOM 600 SD MET A 40 2.997 3.431 -4.409 1.00 70.34 S ATOM 601 CE MET A 40 1.604 2.856 -3.441 1.00 33.11 C ATOM 0 H MET A 40 1.925 -0.272 -5.322 1.00 30.00 H new ATOM 0 HA MET A 40 3.169 0.401 -7.923 1.00 23.22 H new ATOM 0 HB2 MET A 40 4.215 1.141 -5.180 1.00 11.35 H new ATOM 0 HB3 MET A 40 4.630 1.849 -6.728 1.00 11.35 H new ATOM 0 HG2 MET A 40 2.771 3.197 -6.783 1.00 42.42 H new ATOM 0 HG3 MET A 40 1.766 2.045 -5.926 1.00 42.42 H new ATOM 0 HE1 MET A 40 1.851 2.908 -2.381 1.00 33.11 H new ATOM 0 HE2 MET A 40 0.737 3.484 -3.643 1.00 33.11 H new ATOM 0 HE3 MET A 40 1.375 1.825 -3.710 1.00 33.11 H new ATOM 611 N LYS A 41 5.170 -1.102 -7.656 1.00 24.05 N ATOM 612 CA LYS A 41 6.171 -2.162 -7.619 1.00 22.33 C ATOM 613 C LYS A 41 7.580 -1.583 -7.693 1.00 65.42 C ATOM 614 O LYS A 41 7.759 -0.373 -7.831 1.00 73.54 O ATOM 615 CB LYS A 41 5.949 -3.142 -8.773 1.00 43.15 C ATOM 616 CG LYS A 41 6.292 -2.564 -10.136 1.00 0.14 C ATOM 617 CD LYS A 41 6.875 -3.621 -11.059 1.00 73.31 C ATOM 618 CE LYS A 41 6.483 -3.372 -12.507 1.00 63.42 C ATOM 619 NZ LYS A 41 7.333 -4.149 -13.452 1.00 43.14 N ATOM 0 H LYS A 41 5.234 -0.491 -8.470 1.00 24.05 H new ATOM 0 HA LYS A 41 6.065 -2.694 -6.674 1.00 22.33 H new ATOM 0 HB2 LYS A 41 6.553 -4.033 -8.603 1.00 43.15 H new ATOM 0 HB3 LYS A 41 4.906 -3.459 -8.774 1.00 43.15 H new ATOM 0 HG2 LYS A 41 5.396 -2.139 -10.588 1.00 0.14 H new ATOM 0 HG3 LYS A 41 7.006 -1.749 -10.017 1.00 0.14 H new ATOM 0 HD2 LYS A 41 7.961 -3.624 -10.970 1.00 73.31 H new ATOM 0 HD3 LYS A 41 6.527 -4.607 -10.751 1.00 73.31 H new ATOM 0 HE2 LYS A 41 5.437 -3.643 -12.652 1.00 63.42 H new ATOM 0 HE3 LYS A 41 6.571 -2.309 -12.730 1.00 63.42 H new ATOM 0 HZ1 LYS A 41 7.069 -3.914 -14.430 1.00 43.14 H new ATOM 0 HZ2 LYS A 41 8.333 -3.910 -13.296 1.00 43.14 H new ATOM 0 HZ3 LYS A 41 7.191 -5.167 -13.290 1.00 43.14 H new ATOM 633 N VAL A 42 8.579 -2.456 -7.601 1.00 5.34 N ATOM 634 CA VAL A 42 9.973 -2.031 -7.660 1.00 62.30 C ATOM 635 C VAL A 42 10.750 -2.838 -8.694 1.00 71.45 C ATOM 636 O VAL A 42 10.953 -4.041 -8.532 1.00 25.52 O ATOM 637 CB VAL A 42 10.661 -2.174 -6.290 1.00 24.42 C ATOM 638 CG1 VAL A 42 10.131 -3.393 -5.550 1.00 63.21 C ATOM 639 CG2 VAL A 42 12.172 -2.257 -6.460 1.00 34.12 C ATOM 0 H VAL A 42 8.449 -3.461 -7.485 1.00 5.34 H new ATOM 0 HA VAL A 42 9.972 -0.980 -7.950 1.00 62.30 H new ATOM 0 HB VAL A 42 10.433 -1.291 -5.694 1.00 24.42 H new ATOM 0 HG11 VAL A 42 10.629 -3.477 -4.584 1.00 63.21 H new ATOM 0 HG12 VAL A 42 9.057 -3.287 -5.396 1.00 63.21 H new ATOM 0 HG13 VAL A 42 10.327 -4.289 -6.139 1.00 63.21 H new ATOM 0 HG21 VAL A 42 12.643 -2.358 -5.482 1.00 34.12 H new ATOM 0 HG22 VAL A 42 12.422 -3.122 -7.074 1.00 34.12 H new ATOM 0 HG23 VAL A 42 12.534 -1.351 -6.945 1.00 34.12 H new ATOM 649 N ASP A 43 11.181 -2.169 -9.758 1.00 15.15 N ATOM 650 CA ASP A 43 11.937 -2.823 -10.819 1.00 12.32 C ATOM 651 C ASP A 43 13.366 -3.111 -10.370 1.00 2.22 C ATOM 652 O ASP A 43 14.123 -2.195 -10.046 1.00 31.41 O ATOM 653 CB ASP A 43 11.950 -1.953 -12.076 1.00 52.30 C ATOM 654 CG ASP A 43 10.778 -2.244 -12.995 1.00 23.44 C ATOM 655 OD1 ASP A 43 10.024 -3.198 -12.709 1.00 60.42 O ATOM 656 OD2 ASP A 43 10.617 -1.519 -13.998 1.00 31.12 O ATOM 0 H ASP A 43 11.019 -1.173 -9.908 1.00 15.15 H new ATOM 0 HA ASP A 43 11.449 -3.771 -11.048 1.00 12.32 H new ATOM 0 HB2 ASP A 43 11.929 -0.902 -11.787 1.00 52.30 H new ATOM 0 HB3 ASP A 43 12.882 -2.116 -12.618 1.00 52.30 H new ATOM 661 N LYS A 44 13.728 -4.388 -10.351 1.00 23.51 N ATOM 662 CA LYS A 44 15.066 -4.799 -9.942 1.00 2.41 C ATOM 663 C LYS A 44 16.120 -4.261 -10.906 1.00 40.35 C ATOM 664 O LYS A 44 17.288 -4.122 -10.548 1.00 63.24 O ATOM 665 CB LYS A 44 15.155 -6.325 -9.872 1.00 21.00 C ATOM 666 CG LYS A 44 16.383 -6.829 -9.133 1.00 10.15 C ATOM 667 CD LYS A 44 17.110 -7.901 -9.926 1.00 60.44 C ATOM 668 CE LYS A 44 18.283 -8.474 -9.145 1.00 4.11 C ATOM 669 NZ LYS A 44 18.611 -9.862 -9.575 1.00 1.35 N ATOM 0 H LYS A 44 13.113 -5.158 -10.614 1.00 23.51 H new ATOM 0 HA LYS A 44 15.259 -4.384 -8.953 1.00 2.41 H new ATOM 0 HB2 LYS A 44 14.262 -6.711 -9.381 1.00 21.00 H new ATOM 0 HB3 LYS A 44 15.160 -6.727 -10.885 1.00 21.00 H new ATOM 0 HG2 LYS A 44 17.060 -5.997 -8.940 1.00 10.15 H new ATOM 0 HG3 LYS A 44 16.086 -7.230 -8.164 1.00 10.15 H new ATOM 0 HD2 LYS A 44 16.415 -8.701 -10.180 1.00 60.44 H new ATOM 0 HD3 LYS A 44 17.468 -7.480 -10.865 1.00 60.44 H new ATOM 0 HE2 LYS A 44 19.156 -7.836 -9.281 1.00 4.11 H new ATOM 0 HE3 LYS A 44 18.048 -8.470 -8.081 1.00 4.11 H new ATOM 0 HZ1 LYS A 44 19.415 -10.217 -9.019 1.00 1.35 H new ATOM 0 HZ2 LYS A 44 17.786 -10.477 -9.422 1.00 1.35 H new ATOM 0 HZ3 LYS A 44 18.861 -9.863 -10.585 1.00 1.35 H new ATOM 683 N ASP A 45 15.696 -3.957 -12.128 1.00 31.51 N ATOM 684 CA ASP A 45 16.601 -3.432 -13.143 1.00 45.05 C ATOM 685 C ASP A 45 16.931 -1.967 -12.872 1.00 71.42 C ATOM 686 O ASP A 45 18.079 -1.544 -13.003 1.00 73.14 O ATOM 687 CB ASP A 45 15.984 -3.580 -14.534 1.00 70.13 C ATOM 688 CG ASP A 45 17.021 -3.871 -15.601 1.00 30.23 C ATOM 689 OD1 ASP A 45 17.519 -5.015 -15.648 1.00 25.34 O ATOM 690 OD2 ASP A 45 17.336 -2.955 -16.389 1.00 2.35 O ATOM 0 H ASP A 45 14.731 -4.065 -12.439 1.00 31.51 H new ATOM 0 HA ASP A 45 17.526 -4.008 -13.102 1.00 45.05 H new ATOM 0 HB2 ASP A 45 15.248 -4.384 -14.518 1.00 70.13 H new ATOM 0 HB3 ASP A 45 15.450 -2.665 -14.791 1.00 70.13 H new ATOM 695 N ARG A 46 15.915 -1.198 -12.495 1.00 75.52 N ATOM 696 CA ARG A 46 16.096 0.220 -12.208 1.00 13.01 C ATOM 697 C ARG A 46 16.131 0.469 -10.703 1.00 53.33 C ATOM 698 O ARG A 46 16.188 1.615 -10.256 1.00 72.32 O ATOM 699 CB ARG A 46 14.971 1.038 -12.845 1.00 50.33 C ATOM 700 CG ARG A 46 14.794 0.775 -14.332 1.00 32.13 C ATOM 701 CD ARG A 46 13.660 1.605 -14.913 1.00 11.13 C ATOM 702 NE ARG A 46 14.134 2.880 -15.447 1.00 11.23 N ATOM 703 CZ ARG A 46 13.388 3.688 -16.192 1.00 63.32 C ATOM 704 NH1 ARG A 46 12.139 3.355 -16.490 1.00 64.04 N ATOM 705 NH2 ARG A 46 13.891 4.830 -16.640 1.00 52.24 N ATOM 0 H ARG A 46 14.958 -1.533 -12.381 1.00 75.52 H new ATOM 0 HA ARG A 46 17.050 0.533 -12.633 1.00 13.01 H new ATOM 0 HB2 ARG A 46 14.036 0.816 -12.331 1.00 50.33 H new ATOM 0 HB3 ARG A 46 15.173 2.098 -12.694 1.00 50.33 H new ATOM 0 HG2 ARG A 46 15.721 1.006 -14.856 1.00 32.13 H new ATOM 0 HG3 ARG A 46 14.592 -0.284 -14.494 1.00 32.13 H new ATOM 0 HD2 ARG A 46 13.167 1.041 -15.705 1.00 11.13 H new ATOM 0 HD3 ARG A 46 12.913 1.790 -14.141 1.00 11.13 H new ATOM 0 HE ARG A 46 15.090 3.165 -15.236 1.00 11.23 H new ATOM 0 HH11 ARG A 46 11.750 2.477 -16.147 1.00 64.04 H new ATOM 0 HH12 ARG A 46 11.568 3.977 -17.062 1.00 64.04 H new ATOM 0 HH21 ARG A 46 14.851 5.088 -16.413 1.00 52.24 H new ATOM 0 HH22 ARG A 46 13.318 5.450 -17.212 1.00 52.24 H new ATOM 719 N GLN A 47 16.096 -0.609 -9.928 1.00 31.42 N ATOM 720 CA GLN A 47 16.123 -0.507 -8.474 1.00 73.00 C ATOM 721 C GLN A 47 15.350 0.720 -8.000 1.00 53.32 C ATOM 722 O GLN A 47 15.858 1.520 -7.216 1.00 35.23 O ATOM 723 CB GLN A 47 17.566 -0.440 -7.973 1.00 1.44 C ATOM 724 CG GLN A 47 18.471 -1.500 -8.579 1.00 3.23 C ATOM 725 CD GLN A 47 18.876 -2.562 -7.576 1.00 61.33 C ATOM 726 OE1 GLN A 47 19.934 -2.472 -6.953 1.00 51.40 O ATOM 727 NE2 GLN A 47 18.036 -3.578 -7.417 1.00 0.25 N ATOM 0 H GLN A 47 16.049 -1.564 -10.283 1.00 31.42 H new ATOM 0 HA GLN A 47 15.645 -1.396 -8.064 1.00 73.00 H new ATOM 0 HB2 GLN A 47 17.974 0.545 -8.197 1.00 1.44 H new ATOM 0 HB3 GLN A 47 17.570 -0.547 -6.888 1.00 1.44 H new ATOM 0 HG2 GLN A 47 17.960 -1.973 -9.417 1.00 3.23 H new ATOM 0 HG3 GLN A 47 19.366 -1.023 -8.979 1.00 3.23 H new ATOM 0 HE21 GLN A 47 17.170 -3.612 -7.954 1.00 0.25 H new ATOM 0 HE22 GLN A 47 18.257 -4.324 -6.758 1.00 0.25 H new ATOM 736 N MET A 48 14.120 0.862 -8.485 1.00 31.42 N ATOM 737 CA MET A 48 13.277 1.991 -8.110 1.00 11.31 C ATOM 738 C MET A 48 11.811 1.577 -8.042 1.00 34.42 C ATOM 739 O MET A 48 11.396 0.615 -8.689 1.00 64.34 O ATOM 740 CB MET A 48 13.449 3.137 -9.110 1.00 31.12 C ATOM 741 CG MET A 48 12.407 3.140 -10.215 1.00 73.23 C ATOM 742 SD MET A 48 13.060 3.740 -11.785 1.00 2.33 S ATOM 743 CE MET A 48 13.400 5.451 -11.377 1.00 64.32 C ATOM 0 H MET A 48 13.686 0.210 -9.138 1.00 31.42 H new ATOM 0 HA MET A 48 13.586 2.330 -7.121 1.00 11.31 H new ATOM 0 HB2 MET A 48 13.402 4.085 -8.575 1.00 31.12 H new ATOM 0 HB3 MET A 48 14.441 3.072 -9.557 1.00 31.12 H new ATOM 0 HG2 MET A 48 12.022 2.129 -10.349 1.00 73.23 H new ATOM 0 HG3 MET A 48 11.566 3.764 -9.914 1.00 73.23 H new ATOM 0 HE1 MET A 48 12.916 6.102 -12.105 1.00 64.32 H new ATOM 0 HE2 MET A 48 13.015 5.671 -10.381 1.00 64.32 H new ATOM 0 HE3 MET A 48 14.476 5.622 -11.395 1.00 64.32 H new ATOM 753 N VAL A 49 11.030 2.307 -7.253 1.00 74.13 N ATOM 754 CA VAL A 49 9.609 2.016 -7.101 1.00 20.20 C ATOM 755 C VAL A 49 8.785 2.722 -8.171 1.00 43.10 C ATOM 756 O VAL A 49 8.702 3.950 -8.197 1.00 63.50 O ATOM 757 CB VAL A 49 9.095 2.437 -5.712 1.00 4.44 C ATOM 758 CG1 VAL A 49 7.777 1.747 -5.397 1.00 65.10 C ATOM 759 CG2 VAL A 49 10.135 2.131 -4.643 1.00 72.44 C ATOM 0 H VAL A 49 11.357 3.105 -6.709 1.00 74.13 H new ATOM 0 HA VAL A 49 9.494 0.938 -7.211 1.00 20.20 H new ATOM 0 HB VAL A 49 8.921 3.513 -5.720 1.00 4.44 H new ATOM 0 HG11 VAL A 49 7.430 2.057 -4.411 1.00 65.10 H new ATOM 0 HG12 VAL A 49 7.034 2.022 -6.146 1.00 65.10 H new ATOM 0 HG13 VAL A 49 7.920 0.667 -5.407 1.00 65.10 H new ATOM 0 HG21 VAL A 49 9.755 2.435 -3.668 1.00 72.44 H new ATOM 0 HG22 VAL A 49 10.343 1.061 -4.634 1.00 72.44 H new ATOM 0 HG23 VAL A 49 11.053 2.677 -4.861 1.00 72.44 H new ATOM 769 N VAL A 50 8.176 1.938 -9.055 1.00 63.41 N ATOM 770 CA VAL A 50 7.356 2.488 -10.128 1.00 62.42 C ATOM 771 C VAL A 50 5.933 1.946 -10.065 1.00 33.41 C ATOM 772 O VAL A 50 5.717 0.768 -9.775 1.00 70.44 O ATOM 773 CB VAL A 50 7.954 2.168 -11.511 1.00 41.13 C ATOM 774 CG1 VAL A 50 9.281 2.890 -11.699 1.00 72.43 C ATOM 775 CG2 VAL A 50 8.125 0.667 -11.683 1.00 64.10 C ATOM 0 H VAL A 50 8.235 0.920 -9.049 1.00 63.41 H new ATOM 0 HA VAL A 50 7.337 3.569 -9.989 1.00 62.42 H new ATOM 0 HB VAL A 50 7.264 2.522 -12.277 1.00 41.13 H new ATOM 0 HG11 VAL A 50 9.689 2.652 -12.682 1.00 72.43 H new ATOM 0 HG12 VAL A 50 9.124 3.966 -11.622 1.00 72.43 H new ATOM 0 HG13 VAL A 50 9.982 2.570 -10.928 1.00 72.43 H new ATOM 0 HG21 VAL A 50 8.549 0.459 -12.666 1.00 64.10 H new ATOM 0 HG22 VAL A 50 8.794 0.286 -10.912 1.00 64.10 H new ATOM 0 HG23 VAL A 50 7.155 0.178 -11.595 1.00 64.10 H new ATOM 785 N LEU A 51 4.963 2.812 -10.338 1.00 3.33 N ATOM 786 CA LEU A 51 3.558 2.421 -10.312 1.00 42.10 C ATOM 787 C LEU A 51 3.335 1.142 -11.112 1.00 21.31 C ATOM 788 O LEU A 51 3.977 0.920 -12.138 1.00 11.00 O ATOM 789 CB LEU A 51 2.686 3.545 -10.873 1.00 21.11 C ATOM 790 CG LEU A 51 1.196 3.229 -11.022 1.00 25.32 C ATOM 791 CD1 LEU A 51 0.393 3.923 -9.934 1.00 13.54 C ATOM 792 CD2 LEU A 51 0.699 3.640 -12.400 1.00 21.40 C ATOM 0 H LEU A 51 5.124 3.790 -10.580 1.00 3.33 H new ATOM 0 HA LEU A 51 3.277 2.234 -9.276 1.00 42.10 H new ATOM 0 HB2 LEU A 51 2.789 4.416 -10.225 1.00 21.11 H new ATOM 0 HB3 LEU A 51 3.077 3.827 -11.851 1.00 21.11 H new ATOM 0 HG LEU A 51 1.059 2.153 -10.915 1.00 25.32 H new ATOM 0 HD11 LEU A 51 -0.664 3.687 -10.056 1.00 13.54 H new ATOM 0 HD12 LEU A 51 0.731 3.579 -8.957 1.00 13.54 H new ATOM 0 HD13 LEU A 51 0.535 5.001 -10.009 1.00 13.54 H new ATOM 0 HD21 LEU A 51 -0.362 3.408 -12.488 1.00 21.40 H new ATOM 0 HD22 LEU A 51 0.849 4.711 -12.536 1.00 21.40 H new ATOM 0 HD23 LEU A 51 1.254 3.096 -13.164 1.00 21.40 H new ATOM 804 N GLU A 52 2.419 0.304 -10.636 1.00 13.44 N ATOM 805 CA GLU A 52 2.110 -0.952 -11.307 1.00 25.30 C ATOM 806 C GLU A 52 0.667 -0.964 -11.804 1.00 20.11 C ATOM 807 O GLU A 52 0.388 -1.391 -12.924 1.00 64.41 O ATOM 808 CB GLU A 52 2.345 -2.133 -10.363 1.00 3.33 C ATOM 809 CG GLU A 52 1.954 -3.475 -10.957 1.00 3.15 C ATOM 810 CD GLU A 52 2.831 -3.873 -12.127 1.00 25.30 C ATOM 811 OE1 GLU A 52 2.989 -3.054 -13.056 1.00 33.11 O ATOM 812 OE2 GLU A 52 3.362 -5.004 -12.115 1.00 32.43 O ATOM 0 H GLU A 52 1.878 0.473 -9.788 1.00 13.44 H new ATOM 0 HA GLU A 52 2.773 -1.046 -12.167 1.00 25.30 H new ATOM 0 HB2 GLU A 52 3.399 -2.161 -10.086 1.00 3.33 H new ATOM 0 HB3 GLU A 52 1.778 -1.972 -9.446 1.00 3.33 H new ATOM 0 HG2 GLU A 52 2.015 -4.242 -10.185 1.00 3.15 H new ATOM 0 HG3 GLU A 52 0.915 -3.434 -11.284 1.00 3.15 H new ATOM 819 N ASP A 53 -0.246 -0.492 -10.961 1.00 70.41 N ATOM 820 CA ASP A 53 -1.660 -0.448 -11.314 1.00 15.52 C ATOM 821 C ASP A 53 -2.399 0.582 -10.464 1.00 50.11 C ATOM 822 O ASP A 53 -1.907 1.004 -9.418 1.00 13.10 O ATOM 823 CB ASP A 53 -2.296 -1.826 -11.134 1.00 22.31 C ATOM 824 CG ASP A 53 -2.120 -2.709 -12.355 1.00 44.51 C ATOM 825 OD1 ASP A 53 -2.398 -2.232 -13.475 1.00 2.11 O ATOM 826 OD2 ASP A 53 -1.705 -3.875 -12.189 1.00 73.35 O ATOM 0 H ASP A 53 -0.032 -0.135 -10.030 1.00 70.41 H new ATOM 0 HA ASP A 53 -1.739 -0.155 -12.361 1.00 15.52 H new ATOM 0 HB2 ASP A 53 -1.853 -2.317 -10.267 1.00 22.31 H new ATOM 0 HB3 ASP A 53 -3.359 -1.708 -10.925 1.00 22.31 H new ATOM 831 N GLU A 54 -3.582 0.981 -10.922 1.00 1.43 N ATOM 832 CA GLU A 54 -4.387 1.962 -10.204 1.00 1.32 C ATOM 833 C GLU A 54 -5.875 1.658 -10.351 1.00 24.44 C ATOM 834 O GLU A 54 -6.444 1.795 -11.435 1.00 1.03 O ATOM 835 CB GLU A 54 -4.090 3.373 -10.718 1.00 35.51 C ATOM 836 CG GLU A 54 -3.208 4.187 -9.787 1.00 52.51 C ATOM 837 CD GLU A 54 -3.286 5.676 -10.064 1.00 52.52 C ATOM 838 OE1 GLU A 54 -4.411 6.187 -10.244 1.00 1.43 O ATOM 839 OE2 GLU A 54 -2.223 6.330 -10.101 1.00 23.23 O ATOM 0 H GLU A 54 -4.003 0.640 -11.786 1.00 1.43 H new ATOM 0 HA GLU A 54 -4.125 1.905 -9.147 1.00 1.32 H new ATOM 0 HB2 GLU A 54 -3.607 3.301 -11.692 1.00 35.51 H new ATOM 0 HB3 GLU A 54 -5.031 3.902 -10.867 1.00 35.51 H new ATOM 0 HG2 GLU A 54 -3.503 3.997 -8.755 1.00 52.51 H new ATOM 0 HG3 GLU A 54 -2.175 3.856 -9.889 1.00 52.51 H new ATOM 846 N LEU A 55 -6.499 1.243 -9.254 1.00 22.05 N ATOM 847 CA LEU A 55 -7.921 0.917 -9.259 1.00 41.42 C ATOM 848 C LEU A 55 -8.723 1.973 -8.506 1.00 75.21 C ATOM 849 O LEU A 55 -8.386 2.335 -7.379 1.00 51.31 O ATOM 850 CB LEU A 55 -8.152 -0.459 -8.632 1.00 43.15 C ATOM 851 CG LEU A 55 -7.264 -1.590 -9.151 1.00 62.53 C ATOM 852 CD1 LEU A 55 -7.015 -2.618 -8.058 1.00 44.22 C ATOM 853 CD2 LEU A 55 -7.895 -2.247 -10.370 1.00 32.32 C ATOM 0 H LEU A 55 -6.043 1.124 -8.350 1.00 22.05 H new ATOM 0 HA LEU A 55 -8.261 0.898 -10.294 1.00 41.42 H new ATOM 0 HB2 LEU A 55 -8.006 -0.375 -7.555 1.00 43.15 H new ATOM 0 HB3 LEU A 55 -9.193 -0.739 -8.792 1.00 43.15 H new ATOM 0 HG LEU A 55 -6.305 -1.166 -9.447 1.00 62.53 H new ATOM 0 HD11 LEU A 55 -6.381 -3.415 -8.446 1.00 44.22 H new ATOM 0 HD12 LEU A 55 -6.519 -2.139 -7.214 1.00 44.22 H new ATOM 0 HD13 LEU A 55 -7.966 -3.038 -7.730 1.00 44.22 H new ATOM 0 HD21 LEU A 55 -7.249 -3.050 -10.726 1.00 32.32 H new ATOM 0 HD22 LEU A 55 -8.868 -2.657 -10.100 1.00 32.32 H new ATOM 0 HD23 LEU A 55 -8.020 -1.505 -11.159 1.00 32.32 H new ATOM 865 N GLN A 56 -9.788 2.461 -9.135 1.00 60.22 N ATOM 866 CA GLN A 56 -10.639 3.474 -8.523 1.00 34.33 C ATOM 867 C GLN A 56 -12.006 2.896 -8.173 1.00 11.41 C ATOM 868 O GLN A 56 -12.418 1.874 -8.719 1.00 21.11 O ATOM 869 CB GLN A 56 -10.803 4.669 -9.463 1.00 64.23 C ATOM 870 CG GLN A 56 -9.591 5.585 -9.500 1.00 21.25 C ATOM 871 CD GLN A 56 -8.593 5.190 -10.571 1.00 0.40 C ATOM 872 OE1 GLN A 56 -8.972 4.791 -11.672 1.00 14.12 O ATOM 873 NE2 GLN A 56 -7.308 5.302 -10.252 1.00 73.24 N ATOM 0 H GLN A 56 -10.082 2.171 -10.068 1.00 60.22 H new ATOM 0 HA GLN A 56 -10.159 3.808 -7.603 1.00 34.33 H new ATOM 0 HB2 GLN A 56 -11.003 4.303 -10.470 1.00 64.23 H new ATOM 0 HB3 GLN A 56 -11.675 5.246 -9.155 1.00 64.23 H new ATOM 0 HG2 GLN A 56 -9.920 6.609 -9.675 1.00 21.25 H new ATOM 0 HG3 GLN A 56 -9.099 5.570 -8.527 1.00 21.25 H new ATOM 0 HE21 GLN A 56 -7.040 5.637 -9.327 1.00 73.24 H new ATOM 0 HE22 GLN A 56 -6.590 5.053 -10.932 1.00 73.24 H new ATOM 882 N ASN A 57 -12.706 3.558 -7.257 1.00 22.41 N ATOM 883 CA ASN A 57 -14.027 3.109 -6.833 1.00 14.45 C ATOM 884 C ASN A 57 -14.036 1.605 -6.581 1.00 33.11 C ATOM 885 O ASN A 57 -14.837 0.872 -7.162 1.00 44.22 O ATOM 886 CB ASN A 57 -15.074 3.467 -7.890 1.00 21.11 C ATOM 887 CG ASN A 57 -14.472 3.613 -9.274 1.00 5.11 C ATOM 888 OD1 ASN A 57 -13.817 4.742 -9.518 1.00 63.24 O flip ATOM 889 ND2 ASN A 57 -14.593 2.721 -10.113 1.00 13.34 N flip ATOM 0 H ASN A 57 -12.380 4.407 -6.794 1.00 22.41 H new ATOM 0 HA ASN A 57 -14.274 3.617 -5.900 1.00 14.45 H new ATOM 0 HB2 ASN A 57 -15.844 2.695 -7.911 1.00 21.11 H new ATOM 0 HB3 ASN A 57 -15.565 4.399 -7.610 1.00 21.11 H new ATOM 0 HD21 ASN A 57 -15.105 1.870 -9.882 1.00 13.34 H new ATOM 0 HD22 ASN A 57 -14.181 2.833 -11.039 1.00 13.34 H new ATOM 896 N ILE A 58 -13.141 1.151 -5.710 1.00 62.03 N ATOM 897 CA ILE A 58 -13.047 -0.266 -5.380 1.00 41.11 C ATOM 898 C ILE A 58 -13.107 -0.484 -3.872 1.00 40.04 C ATOM 899 O ILE A 58 -12.497 0.258 -3.102 1.00 41.13 O ATOM 900 CB ILE A 58 -11.747 -0.885 -5.926 1.00 30.42 C ATOM 901 CG1 ILE A 58 -11.118 -1.808 -4.880 1.00 11.34 C ATOM 902 CG2 ILE A 58 -10.770 0.207 -6.335 1.00 22.20 C ATOM 903 CD1 ILE A 58 -10.376 -1.065 -3.789 1.00 35.11 C ATOM 0 H ILE A 58 -12.471 1.744 -5.220 1.00 62.03 H new ATOM 0 HA ILE A 58 -13.899 -0.757 -5.850 1.00 41.11 H new ATOM 0 HB ILE A 58 -11.987 -1.478 -6.809 1.00 30.42 H new ATOM 0 HG12 ILE A 58 -11.900 -2.417 -4.427 1.00 11.34 H new ATOM 0 HG13 ILE A 58 -10.429 -2.491 -5.377 1.00 11.34 H new ATOM 0 HG21 ILE A 58 -9.856 -0.247 -6.719 1.00 22.20 H new ATOM 0 HG22 ILE A 58 -11.221 0.827 -7.110 1.00 22.20 H new ATOM 0 HG23 ILE A 58 -10.532 0.825 -5.469 1.00 22.20 H new ATOM 0 HD11 ILE A 58 -9.956 -1.781 -3.082 1.00 35.11 H new ATOM 0 HD12 ILE A 58 -9.572 -0.477 -4.231 1.00 35.11 H new ATOM 0 HD13 ILE A 58 -11.066 -0.402 -3.267 1.00 35.11 H new ATOM 915 N SER A 59 -13.846 -1.509 -3.456 1.00 43.35 N ATOM 916 CA SER A 59 -13.986 -1.824 -2.040 1.00 14.42 C ATOM 917 C SER A 59 -12.787 -2.623 -1.539 1.00 33.22 C ATOM 918 O SER A 59 -11.950 -3.086 -2.314 1.00 13.13 O ATOM 919 CB SER A 59 -15.276 -2.612 -1.798 1.00 73.32 C ATOM 920 OG SER A 59 -16.226 -1.831 -1.094 1.00 71.12 O ATOM 0 H SER A 59 -14.356 -2.134 -4.080 1.00 43.35 H new ATOM 0 HA SER A 59 -14.031 -0.886 -1.487 1.00 14.42 H new ATOM 0 HB2 SER A 59 -15.697 -2.929 -2.752 1.00 73.32 H new ATOM 0 HB3 SER A 59 -15.053 -3.516 -1.232 1.00 73.32 H new ATOM 0 HG SER A 59 -17.041 -2.356 -0.953 1.00 71.12 H new ATOM 926 N PRO A 60 -12.701 -2.789 -0.210 1.00 43.54 N ATOM 927 CA PRO A 60 -11.609 -3.531 0.425 1.00 73.44 C ATOM 928 C PRO A 60 -11.685 -5.029 0.144 1.00 14.43 C ATOM 929 O PRO A 60 -10.880 -5.806 0.654 1.00 33.23 O ATOM 930 CB PRO A 60 -11.813 -3.256 1.917 1.00 52.24 C ATOM 931 CG PRO A 60 -13.265 -2.950 2.050 1.00 74.31 C ATOM 932 CD PRO A 60 -13.663 -2.264 0.772 1.00 0.34 C ATOM 0 HA PRO A 60 -10.634 -3.221 0.050 1.00 73.44 H new ATOM 0 HB2 PRO A 60 -11.533 -4.119 2.521 1.00 52.24 H new ATOM 0 HB3 PRO A 60 -11.200 -2.420 2.253 1.00 52.24 H new ATOM 0 HG2 PRO A 60 -13.844 -3.861 2.200 1.00 74.31 H new ATOM 0 HG3 PRO A 60 -13.451 -2.309 2.911 1.00 74.31 H new ATOM 0 HD2 PRO A 60 -14.690 -2.498 0.493 1.00 0.34 H new ATOM 0 HD3 PRO A 60 -13.596 -1.180 0.860 1.00 0.34 H new ATOM 940 N GLU A 61 -12.660 -5.424 -0.669 1.00 11.12 N ATOM 941 CA GLU A 61 -12.841 -6.828 -1.016 1.00 72.33 C ATOM 942 C GLU A 61 -12.356 -7.106 -2.436 1.00 3.34 C ATOM 943 O GLU A 61 -12.061 -8.247 -2.790 1.00 43.41 O ATOM 944 CB GLU A 61 -14.313 -7.225 -0.882 1.00 24.02 C ATOM 945 CG GLU A 61 -14.615 -8.030 0.370 1.00 12.34 C ATOM 946 CD GLU A 61 -16.032 -8.568 0.391 1.00 52.32 C ATOM 947 OE1 GLU A 61 -16.959 -7.787 0.694 1.00 33.50 O ATOM 948 OE2 GLU A 61 -16.215 -9.769 0.103 1.00 23.13 O ATOM 0 H GLU A 61 -13.336 -4.792 -1.099 1.00 11.12 H new ATOM 0 HA GLU A 61 -12.246 -7.425 -0.324 1.00 72.33 H new ATOM 0 HB2 GLU A 61 -14.925 -6.323 -0.880 1.00 24.02 H new ATOM 0 HB3 GLU A 61 -14.605 -7.806 -1.757 1.00 24.02 H new ATOM 0 HG2 GLU A 61 -13.914 -8.862 0.440 1.00 12.34 H new ATOM 0 HG3 GLU A 61 -14.455 -7.403 1.247 1.00 12.34 H new ATOM 955 N GLU A 62 -12.277 -6.053 -3.244 1.00 13.12 N ATOM 956 CA GLU A 62 -11.829 -6.183 -4.626 1.00 12.21 C ATOM 957 C GLU A 62 -10.309 -6.083 -4.716 1.00 72.24 C ATOM 958 O GLU A 62 -9.667 -6.857 -5.426 1.00 65.02 O ATOM 959 CB GLU A 62 -12.475 -5.104 -5.498 1.00 3.14 C ATOM 960 CG GLU A 62 -13.793 -5.533 -6.121 1.00 40.20 C ATOM 961 CD GLU A 62 -14.815 -5.963 -5.087 1.00 3.24 C ATOM 962 OE1 GLU A 62 -15.319 -5.087 -4.353 1.00 20.14 O ATOM 963 OE2 GLU A 62 -15.110 -7.174 -5.010 1.00 43.42 O ATOM 0 H GLU A 62 -12.517 -5.102 -2.966 1.00 13.12 H new ATOM 0 HA GLU A 62 -12.134 -7.164 -4.990 1.00 12.21 H new ATOM 0 HB2 GLU A 62 -12.642 -4.212 -4.894 1.00 3.14 H new ATOM 0 HB3 GLU A 62 -11.781 -4.826 -6.291 1.00 3.14 H new ATOM 0 HG2 GLU A 62 -14.199 -4.708 -6.707 1.00 40.20 H new ATOM 0 HG3 GLU A 62 -13.613 -6.356 -6.812 1.00 40.20 H new ATOM 970 N LEU A 63 -9.741 -5.124 -3.994 1.00 0.14 N ATOM 971 CA LEU A 63 -8.296 -4.921 -3.991 1.00 71.25 C ATOM 972 C LEU A 63 -7.564 -6.224 -3.684 1.00 74.13 C ATOM 973 O LEU A 63 -6.658 -6.626 -4.415 1.00 30.52 O ATOM 974 CB LEU A 63 -7.912 -3.854 -2.966 1.00 55.25 C ATOM 975 CG LEU A 63 -6.931 -2.784 -3.447 1.00 4.54 C ATOM 976 CD1 LEU A 63 -6.264 -2.101 -2.263 1.00 43.50 C ATOM 977 CD2 LEU A 63 -5.888 -3.394 -4.370 1.00 44.43 C ATOM 0 H LEU A 63 -10.259 -4.474 -3.403 1.00 0.14 H new ATOM 0 HA LEU A 63 -8.000 -4.584 -4.984 1.00 71.25 H new ATOM 0 HB2 LEU A 63 -8.822 -3.359 -2.629 1.00 55.25 H new ATOM 0 HB3 LEU A 63 -7.479 -4.351 -2.098 1.00 55.25 H new ATOM 0 HG LEU A 63 -7.488 -2.033 -4.007 1.00 4.54 H new ATOM 0 HD11 LEU A 63 -5.569 -1.343 -2.624 1.00 43.50 H new ATOM 0 HD12 LEU A 63 -7.024 -1.630 -1.640 1.00 43.50 H new ATOM 0 HD13 LEU A 63 -5.720 -2.841 -1.675 1.00 43.50 H new ATOM 0 HD21 LEU A 63 -5.198 -2.618 -4.703 1.00 44.43 H new ATOM 0 HD22 LEU A 63 -5.335 -4.166 -3.835 1.00 44.43 H new ATOM 0 HD23 LEU A 63 -6.382 -3.836 -5.235 1.00 44.43 H new ATOM 989 N LYS A 64 -7.964 -6.879 -2.600 1.00 60.43 N ATOM 990 CA LYS A 64 -7.349 -8.139 -2.197 1.00 61.14 C ATOM 991 C LYS A 64 -7.315 -9.124 -3.361 1.00 62.45 C ATOM 992 O LYS A 64 -6.319 -9.820 -3.570 1.00 34.01 O ATOM 993 CB LYS A 64 -8.113 -8.750 -1.021 1.00 1.14 C ATOM 994 CG LYS A 64 -8.444 -10.220 -1.207 1.00 74.41 C ATOM 995 CD LYS A 64 -8.759 -10.894 0.118 1.00 43.22 C ATOM 996 CE LYS A 64 -10.229 -11.274 0.215 1.00 40.41 C ATOM 997 NZ LYS A 64 -10.421 -12.750 0.207 1.00 53.12 N ATOM 0 H LYS A 64 -8.711 -6.559 -1.984 1.00 60.43 H new ATOM 0 HA LYS A 64 -6.324 -7.932 -1.888 1.00 61.14 H new ATOM 0 HB2 LYS A 64 -7.521 -8.632 -0.114 1.00 1.14 H new ATOM 0 HB3 LYS A 64 -9.039 -8.194 -0.872 1.00 1.14 H new ATOM 0 HG2 LYS A 64 -9.297 -10.319 -1.878 1.00 74.41 H new ATOM 0 HG3 LYS A 64 -7.603 -10.726 -1.682 1.00 74.41 H new ATOM 0 HD2 LYS A 64 -8.143 -11.787 0.229 1.00 43.22 H new ATOM 0 HD3 LYS A 64 -8.500 -10.225 0.938 1.00 43.22 H new ATOM 0 HE2 LYS A 64 -10.652 -10.858 1.129 1.00 40.41 H new ATOM 0 HE3 LYS A 64 -10.774 -10.832 -0.619 1.00 40.41 H new ATOM 0 HZ1 LYS A 64 -11.436 -12.968 0.275 1.00 53.12 H new ATOM 0 HZ2 LYS A 64 -10.040 -13.145 -0.676 1.00 53.12 H new ATOM 0 HZ3 LYS A 64 -9.922 -13.169 1.017 1.00 53.12 H new ATOM 1011 N LEU A 65 -8.406 -9.179 -4.116 1.00 74.12 N ATOM 1012 CA LEU A 65 -8.500 -10.080 -5.260 1.00 40.53 C ATOM 1013 C LEU A 65 -7.540 -9.655 -6.368 1.00 15.31 C ATOM 1014 O LEU A 65 -6.954 -10.495 -7.049 1.00 32.53 O ATOM 1015 CB LEU A 65 -9.933 -10.107 -5.796 1.00 32.54 C ATOM 1016 CG LEU A 65 -11.025 -10.430 -4.775 1.00 63.52 C ATOM 1017 CD1 LEU A 65 -12.403 -10.228 -5.385 1.00 31.25 C ATOM 1018 CD2 LEU A 65 -10.870 -11.854 -4.261 1.00 61.22 C ATOM 0 H LEU A 65 -9.238 -8.611 -3.957 1.00 74.12 H new ATOM 0 HA LEU A 65 -8.223 -11.080 -4.927 1.00 40.53 H new ATOM 0 HB2 LEU A 65 -10.153 -9.135 -6.238 1.00 32.54 H new ATOM 0 HB3 LEU A 65 -9.986 -10.842 -6.599 1.00 32.54 H new ATOM 0 HG LEU A 65 -10.921 -9.747 -3.932 1.00 63.52 H new ATOM 0 HD11 LEU A 65 -13.167 -10.463 -4.644 1.00 31.25 H new ATOM 0 HD12 LEU A 65 -12.512 -9.191 -5.703 1.00 31.25 H new ATOM 0 HD13 LEU A 65 -12.519 -10.885 -6.247 1.00 31.25 H new ATOM 0 HD21 LEU A 65 -11.655 -12.066 -3.536 1.00 61.22 H new ATOM 0 HD22 LEU A 65 -10.947 -12.552 -5.095 1.00 61.22 H new ATOM 0 HD23 LEU A 65 -9.896 -11.965 -3.784 1.00 61.22 H new ATOM 1030 N GLU A 66 -7.384 -8.346 -6.539 1.00 3.02 N ATOM 1031 CA GLU A 66 -6.493 -7.811 -7.562 1.00 72.25 C ATOM 1032 C GLU A 66 -5.040 -8.162 -7.256 1.00 54.52 C ATOM 1033 O GLU A 66 -4.232 -8.353 -8.165 1.00 24.01 O ATOM 1034 CB GLU A 66 -6.653 -6.292 -7.666 1.00 22.32 C ATOM 1035 CG GLU A 66 -8.035 -5.855 -8.118 1.00 72.34 C ATOM 1036 CD GLU A 66 -8.298 -6.170 -9.578 1.00 54.41 C ATOM 1037 OE1 GLU A 66 -7.442 -5.831 -10.422 1.00 70.11 O ATOM 1038 OE2 GLU A 66 -9.360 -6.755 -9.877 1.00 52.22 O ATOM 0 H GLU A 66 -7.862 -7.637 -5.983 1.00 3.02 H new ATOM 0 HA GLU A 66 -6.764 -8.263 -8.516 1.00 72.25 H new ATOM 0 HB2 GLU A 66 -6.440 -5.845 -6.695 1.00 22.32 H new ATOM 0 HB3 GLU A 66 -5.912 -5.904 -8.365 1.00 22.32 H new ATOM 0 HG2 GLU A 66 -8.787 -6.348 -7.503 1.00 72.34 H new ATOM 0 HG3 GLU A 66 -8.144 -4.783 -7.956 1.00 72.34 H new ATOM 1045 N LEU A 67 -4.716 -8.242 -5.970 1.00 72.05 N ATOM 1046 CA LEU A 67 -3.360 -8.569 -5.543 1.00 22.43 C ATOM 1047 C LEU A 67 -3.036 -10.033 -5.826 1.00 54.55 C ATOM 1048 O LEU A 67 -3.916 -10.894 -5.854 1.00 31.32 O ATOM 1049 CB LEU A 67 -3.191 -8.278 -4.050 1.00 43.52 C ATOM 1050 CG LEU A 67 -3.163 -6.801 -3.654 1.00 71.30 C ATOM 1051 CD1 LEU A 67 -3.399 -6.646 -2.160 1.00 22.44 C ATOM 1052 CD2 LEU A 67 -1.841 -6.165 -4.056 1.00 71.15 C ATOM 0 H LEU A 67 -5.373 -8.085 -5.206 1.00 72.05 H new ATOM 0 HA LEU A 67 -2.668 -7.947 -6.110 1.00 22.43 H new ATOM 0 HB2 LEU A 67 -4.005 -8.763 -3.511 1.00 43.52 H new ATOM 0 HB3 LEU A 67 -2.264 -8.742 -3.712 1.00 43.52 H new ATOM 0 HG LEU A 67 -3.965 -6.287 -4.184 1.00 71.30 H new ATOM 0 HD11 LEU A 67 -3.376 -5.589 -1.896 1.00 22.44 H new ATOM 0 HD12 LEU A 67 -4.372 -7.064 -1.900 1.00 22.44 H new ATOM 0 HD13 LEU A 67 -2.619 -7.174 -1.612 1.00 22.44 H new ATOM 0 HD21 LEU A 67 -1.840 -5.114 -3.766 1.00 71.15 H new ATOM 0 HD22 LEU A 67 -1.022 -6.681 -3.555 1.00 71.15 H new ATOM 0 HD23 LEU A 67 -1.713 -6.244 -5.136 1.00 71.15 H new ATOM 1064 N PRO A 68 -1.745 -10.323 -6.042 1.00 12.33 N ATOM 1065 CA PRO A 68 -1.276 -11.683 -6.325 1.00 10.34 C ATOM 1066 C PRO A 68 -1.380 -12.596 -5.109 1.00 62.21 C ATOM 1067 O PRO A 68 -2.035 -12.260 -4.123 1.00 15.33 O ATOM 1068 CB PRO A 68 0.190 -11.477 -6.716 1.00 51.00 C ATOM 1069 CG PRO A 68 0.588 -10.209 -6.043 1.00 34.10 C ATOM 1070 CD PRO A 68 -0.643 -9.346 -6.025 1.00 51.51 C ATOM 0 HA PRO A 68 -1.873 -12.169 -7.097 1.00 10.34 H new ATOM 0 HB2 PRO A 68 0.809 -12.311 -6.386 1.00 51.00 H new ATOM 0 HB3 PRO A 68 0.305 -11.404 -7.797 1.00 51.00 H new ATOM 0 HG2 PRO A 68 0.946 -10.400 -5.031 1.00 34.10 H new ATOM 0 HG3 PRO A 68 1.400 -9.720 -6.581 1.00 34.10 H new ATOM 0 HD2 PRO A 68 -0.679 -8.715 -5.137 1.00 51.51 H new ATOM 0 HD3 PRO A 68 -0.681 -8.682 -6.889 1.00 51.51 H new ATOM 1078 N GLU A 69 -0.729 -13.753 -5.185 1.00 53.05 N ATOM 1079 CA GLU A 69 -0.750 -14.716 -4.091 1.00 14.53 C ATOM 1080 C GLU A 69 0.646 -14.898 -3.500 1.00 73.44 C ATOM 1081 O GLU A 69 0.798 -15.374 -2.375 1.00 75.34 O ATOM 1082 CB GLU A 69 -1.292 -16.062 -4.575 1.00 1.41 C ATOM 1083 CG GLU A 69 -0.465 -16.686 -5.686 1.00 61.22 C ATOM 1084 CD GLU A 69 -1.264 -17.656 -6.533 1.00 72.11 C ATOM 1085 OE1 GLU A 69 -1.537 -18.777 -6.055 1.00 52.22 O ATOM 1086 OE2 GLU A 69 -1.617 -17.295 -7.676 1.00 51.31 O ATOM 0 H GLU A 69 -0.180 -14.046 -5.994 1.00 53.05 H new ATOM 0 HA GLU A 69 -1.407 -14.329 -3.313 1.00 14.53 H new ATOM 0 HB2 GLU A 69 -1.333 -16.752 -3.732 1.00 1.41 H new ATOM 0 HB3 GLU A 69 -2.315 -15.927 -4.927 1.00 1.41 H new ATOM 0 HG2 GLU A 69 -0.065 -15.897 -6.323 1.00 61.22 H new ATOM 0 HG3 GLU A 69 0.388 -17.207 -5.250 1.00 61.22 H new ATOM 1093 N ARG A 70 1.660 -14.517 -4.268 1.00 44.32 N ATOM 1094 CA ARG A 70 3.043 -14.641 -3.824 1.00 2.41 C ATOM 1095 C ARG A 70 3.926 -13.592 -4.494 1.00 3.31 C ATOM 1096 O ARG A 70 5.008 -13.904 -4.990 1.00 2.40 O ATOM 1097 CB ARG A 70 3.576 -16.041 -4.128 1.00 65.43 C ATOM 1098 CG ARG A 70 3.092 -16.602 -5.456 1.00 14.23 C ATOM 1099 CD ARG A 70 3.985 -16.163 -6.605 1.00 41.32 C ATOM 1100 NE ARG A 70 4.103 -17.195 -7.632 1.00 21.15 N ATOM 1101 CZ ARG A 70 4.947 -17.121 -8.656 1.00 13.14 C ATOM 1102 NH1 ARG A 70 5.742 -16.068 -8.788 1.00 70.54 N ATOM 1103 NH2 ARG A 70 4.995 -18.101 -9.549 1.00 64.02 N ATOM 0 H ARG A 70 1.550 -14.120 -5.201 1.00 44.32 H new ATOM 0 HA ARG A 70 3.067 -14.477 -2.747 1.00 2.41 H new ATOM 0 HB2 ARG A 70 4.666 -16.013 -4.130 1.00 65.43 H new ATOM 0 HB3 ARG A 70 3.276 -16.717 -3.327 1.00 65.43 H new ATOM 0 HG2 ARG A 70 3.070 -17.691 -5.406 1.00 14.23 H new ATOM 0 HG3 ARG A 70 2.070 -16.271 -5.641 1.00 14.23 H new ATOM 0 HD2 ARG A 70 3.582 -15.253 -7.050 1.00 41.32 H new ATOM 0 HD3 ARG A 70 4.976 -15.919 -6.221 1.00 41.32 H new ATOM 0 HE ARG A 70 3.505 -18.018 -7.559 1.00 21.15 H new ATOM 0 HH11 ARG A 70 5.706 -15.313 -8.103 1.00 70.54 H new ATOM 0 HH12 ARG A 70 6.389 -16.013 -9.575 1.00 70.54 H new ATOM 0 HH21 ARG A 70 4.384 -18.912 -9.450 1.00 64.02 H new ATOM 0 HH22 ARG A 70 5.643 -18.044 -10.335 1.00 64.02 H new ATOM 1117 N GLN A 71 3.454 -12.349 -4.505 1.00 45.12 N ATOM 1118 CA GLN A 71 4.202 -11.255 -5.116 1.00 15.32 C ATOM 1119 C GLN A 71 4.172 -10.014 -4.229 1.00 32.52 C ATOM 1120 O GLN A 71 3.162 -9.317 -4.128 1.00 63.35 O ATOM 1121 CB GLN A 71 3.626 -10.925 -6.494 1.00 62.11 C ATOM 1122 CG GLN A 71 4.499 -11.397 -7.646 1.00 21.14 C ATOM 1123 CD GLN A 71 3.811 -11.270 -8.990 1.00 15.50 C ATOM 1124 OE1 GLN A 71 4.304 -10.591 -9.892 1.00 40.12 O ATOM 1125 NE2 GLN A 71 2.663 -11.923 -9.132 1.00 43.32 N ATOM 0 H GLN A 71 2.559 -12.075 -4.099 1.00 45.12 H new ATOM 0 HA GLN A 71 5.238 -11.574 -5.229 1.00 15.32 H new ATOM 0 HB2 GLN A 71 2.640 -11.381 -6.585 1.00 62.11 H new ATOM 0 HB3 GLN A 71 3.487 -9.847 -6.572 1.00 62.11 H new ATOM 0 HG2 GLN A 71 5.422 -10.817 -7.658 1.00 21.14 H new ATOM 0 HG3 GLN A 71 4.778 -12.438 -7.482 1.00 21.14 H new ATOM 0 HE21 GLN A 71 2.291 -12.474 -8.359 1.00 43.32 H new ATOM 0 HE22 GLN A 71 2.154 -11.873 -10.014 1.00 43.32 H new ATOM 1134 N PRO A 72 5.305 -9.730 -3.570 1.00 32.34 N ATOM 1135 CA PRO A 72 5.434 -8.573 -2.679 1.00 51.25 C ATOM 1136 C PRO A 72 5.432 -7.252 -3.442 1.00 74.03 C ATOM 1137 O PRO A 72 6.173 -7.082 -4.410 1.00 25.43 O ATOM 1138 CB PRO A 72 6.789 -8.796 -2.002 1.00 32.21 C ATOM 1139 CG PRO A 72 7.558 -9.638 -2.961 1.00 15.01 C ATOM 1140 CD PRO A 72 6.547 -10.517 -3.643 1.00 24.40 C ATOM 0 HA PRO A 72 4.600 -8.501 -1.981 1.00 51.25 H new ATOM 0 HB2 PRO A 72 7.296 -7.850 -1.811 1.00 32.21 H new ATOM 0 HB3 PRO A 72 6.674 -9.296 -1.040 1.00 32.21 H new ATOM 0 HG2 PRO A 72 8.089 -9.019 -3.685 1.00 15.01 H new ATOM 0 HG3 PRO A 72 8.307 -10.235 -2.442 1.00 15.01 H new ATOM 0 HD2 PRO A 72 6.829 -10.728 -4.675 1.00 24.40 H new ATOM 0 HD3 PRO A 72 6.444 -11.477 -3.138 1.00 24.40 H new ATOM 1148 N ARG A 73 4.594 -6.320 -3.001 1.00 33.34 N ATOM 1149 CA ARG A 73 4.494 -5.015 -3.642 1.00 20.32 C ATOM 1150 C ARG A 73 3.820 -4.005 -2.718 1.00 65.42 C ATOM 1151 O ARG A 73 3.345 -4.357 -1.638 1.00 51.55 O ATOM 1152 CB ARG A 73 3.712 -5.126 -4.952 1.00 52.23 C ATOM 1153 CG ARG A 73 2.363 -5.811 -4.800 1.00 0.12 C ATOM 1154 CD ARG A 73 2.048 -6.694 -5.998 1.00 4.33 C ATOM 1155 NE ARG A 73 0.841 -6.261 -6.695 1.00 14.35 N ATOM 1156 CZ ARG A 73 0.447 -6.759 -7.862 1.00 2.13 C ATOM 1157 NH1 ARG A 73 1.162 -7.703 -8.458 1.00 34.11 N ATOM 1158 NH2 ARG A 73 -0.664 -6.314 -8.433 1.00 13.12 N ATOM 0 H ARG A 73 3.974 -6.445 -2.201 1.00 33.34 H new ATOM 0 HA ARG A 73 5.504 -4.666 -3.858 1.00 20.32 H new ATOM 0 HB2 ARG A 73 3.559 -4.127 -5.360 1.00 52.23 H new ATOM 0 HB3 ARG A 73 4.310 -5.678 -5.677 1.00 52.23 H new ATOM 0 HG2 ARG A 73 2.360 -6.414 -3.892 1.00 0.12 H new ATOM 0 HG3 ARG A 73 1.583 -5.059 -4.686 1.00 0.12 H new ATOM 0 HD2 ARG A 73 2.890 -6.681 -6.690 1.00 4.33 H new ATOM 0 HD3 ARG A 73 1.925 -7.725 -5.666 1.00 4.33 H new ATOM 0 HE ARG A 73 0.268 -5.536 -6.262 1.00 14.35 H new ATOM 0 HH11 ARG A 73 2.016 -8.048 -8.021 1.00 34.11 H new ATOM 0 HH12 ARG A 73 0.858 -8.084 -9.354 1.00 34.11 H new ATOM 0 HH21 ARG A 73 -1.217 -5.589 -7.976 1.00 13.12 H new ATOM 0 HH22 ARG A 73 -0.966 -6.697 -9.329 1.00 13.12 H new ATOM 1172 N PHE A 74 3.784 -2.749 -3.150 1.00 3.01 N ATOM 1173 CA PHE A 74 3.171 -1.686 -2.361 1.00 75.41 C ATOM 1174 C PHE A 74 1.750 -1.404 -2.841 1.00 31.42 C ATOM 1175 O PHE A 74 1.439 -1.560 -4.021 1.00 43.24 O ATOM 1176 CB PHE A 74 4.012 -0.411 -2.442 1.00 53.54 C ATOM 1177 CG PHE A 74 5.476 -0.642 -2.204 1.00 4.24 C ATOM 1178 CD1 PHE A 74 5.925 -1.117 -0.982 1.00 32.31 C ATOM 1179 CD2 PHE A 74 6.404 -0.383 -3.199 1.00 64.42 C ATOM 1180 CE1 PHE A 74 7.273 -1.331 -0.759 1.00 12.50 C ATOM 1181 CE2 PHE A 74 7.753 -0.595 -2.982 1.00 51.10 C ATOM 1182 CZ PHE A 74 8.187 -1.069 -1.760 1.00 72.21 C ATOM 0 H PHE A 74 4.172 -2.442 -4.042 1.00 3.01 H new ATOM 0 HA PHE A 74 3.127 -2.017 -1.323 1.00 75.41 H new ATOM 0 HB2 PHE A 74 3.879 0.040 -3.425 1.00 53.54 H new ATOM 0 HB3 PHE A 74 3.642 0.306 -1.709 1.00 53.54 H new ATOM 0 HD1 PHE A 74 5.214 -1.322 -0.195 1.00 32.31 H new ATOM 0 HD2 PHE A 74 6.070 -0.011 -4.156 1.00 64.42 H new ATOM 0 HE1 PHE A 74 7.610 -1.703 0.197 1.00 12.50 H new ATOM 0 HE2 PHE A 74 8.466 -0.390 -3.767 1.00 51.10 H new ATOM 0 HZ PHE A 74 9.240 -1.235 -1.587 1.00 72.21 H new ATOM 1192 N VAL A 75 0.891 -0.989 -1.915 1.00 60.01 N ATOM 1193 CA VAL A 75 -0.497 -0.685 -2.243 1.00 11.22 C ATOM 1194 C VAL A 75 -1.076 0.342 -1.276 1.00 41.31 C ATOM 1195 O VAL A 75 -1.116 0.119 -0.066 1.00 53.10 O ATOM 1196 CB VAL A 75 -1.371 -1.952 -2.214 1.00 14.22 C ATOM 1197 CG1 VAL A 75 -2.768 -1.649 -2.734 1.00 41.33 C ATOM 1198 CG2 VAL A 75 -0.722 -3.066 -3.021 1.00 31.05 C ATOM 0 H VAL A 75 1.132 -0.856 -0.933 1.00 60.01 H new ATOM 0 HA VAL A 75 -0.502 -0.273 -3.252 1.00 11.22 H new ATOM 0 HB VAL A 75 -1.459 -2.288 -1.181 1.00 14.22 H new ATOM 0 HG11 VAL A 75 -3.371 -2.556 -2.706 1.00 41.33 H new ATOM 0 HG12 VAL A 75 -3.231 -0.886 -2.109 1.00 41.33 H new ATOM 0 HG13 VAL A 75 -2.704 -1.287 -3.760 1.00 41.33 H new ATOM 0 HG21 VAL A 75 -1.354 -3.954 -2.989 1.00 31.05 H new ATOM 0 HG22 VAL A 75 -0.601 -2.743 -4.055 1.00 31.05 H new ATOM 0 HG23 VAL A 75 0.255 -3.300 -2.598 1.00 31.05 H new ATOM 1208 N VAL A 76 -1.525 1.470 -1.819 1.00 12.03 N ATOM 1209 CA VAL A 76 -2.105 2.532 -1.006 1.00 33.54 C ATOM 1210 C VAL A 76 -3.619 2.588 -1.173 1.00 55.51 C ATOM 1211 O VAL A 76 -4.126 3.166 -2.135 1.00 42.41 O ATOM 1212 CB VAL A 76 -1.508 3.905 -1.366 1.00 24.14 C ATOM 1213 CG1 VAL A 76 -2.235 5.015 -0.623 1.00 31.02 C ATOM 1214 CG2 VAL A 76 -0.017 3.934 -1.060 1.00 75.24 C ATOM 0 H VAL A 76 -1.498 1.671 -2.819 1.00 12.03 H new ATOM 0 HA VAL A 76 -1.866 2.302 0.032 1.00 33.54 H new ATOM 0 HB VAL A 76 -1.640 4.070 -2.435 1.00 24.14 H new ATOM 0 HG11 VAL A 76 -1.799 5.978 -0.890 1.00 31.02 H new ATOM 0 HG12 VAL A 76 -3.290 5.006 -0.897 1.00 31.02 H new ATOM 0 HG13 VAL A 76 -2.138 4.858 0.451 1.00 31.02 H new ATOM 0 HG21 VAL A 76 0.389 4.912 -1.320 1.00 75.24 H new ATOM 0 HG22 VAL A 76 0.140 3.747 0.002 1.00 75.24 H new ATOM 0 HG23 VAL A 76 0.489 3.164 -1.643 1.00 75.24 H new ATOM 1224 N TYR A 77 -4.336 1.986 -0.231 1.00 72.34 N ATOM 1225 CA TYR A 77 -5.793 1.966 -0.276 1.00 21.45 C ATOM 1226 C TYR A 77 -6.378 3.162 0.470 1.00 65.34 C ATOM 1227 O TYR A 77 -5.954 3.483 1.579 1.00 32.24 O ATOM 1228 CB TYR A 77 -6.326 0.665 0.328 1.00 13.01 C ATOM 1229 CG TYR A 77 -7.818 0.486 0.164 1.00 52.51 C ATOM 1230 CD1 TYR A 77 -8.439 0.751 -1.049 1.00 53.05 C ATOM 1231 CD2 TYR A 77 -8.607 0.052 1.223 1.00 64.31 C ATOM 1232 CE1 TYR A 77 -9.804 0.590 -1.204 1.00 41.41 C ATOM 1233 CE2 TYR A 77 -9.970 -0.114 1.077 1.00 40.43 C ATOM 1234 CZ TYR A 77 -10.564 0.157 -0.138 1.00 41.54 C ATOM 1235 OH TYR A 77 -11.922 -0.006 -0.288 1.00 15.51 O ATOM 0 H TYR A 77 -3.932 1.505 0.573 1.00 72.34 H new ATOM 0 HA TYR A 77 -6.099 2.026 -1.320 1.00 21.45 H new ATOM 0 HB2 TYR A 77 -5.815 -0.178 -0.137 1.00 13.01 H new ATOM 0 HB3 TYR A 77 -6.080 0.640 1.390 1.00 13.01 H new ATOM 0 HD1 TYR A 77 -7.846 1.089 -1.886 1.00 53.05 H new ATOM 0 HD2 TYR A 77 -8.146 -0.159 2.177 1.00 64.31 H new ATOM 0 HE1 TYR A 77 -10.272 0.802 -2.154 1.00 41.41 H new ATOM 0 HE2 TYR A 77 -10.568 -0.454 1.910 1.00 40.43 H new ATOM 0 HH TYR A 77 -12.168 0.141 -1.225 1.00 15.51 H new ATOM 1245 N SER A 78 -7.354 3.817 -0.151 1.00 0.05 N ATOM 1246 CA SER A 78 -7.995 4.980 0.451 1.00 40.40 C ATOM 1247 C SER A 78 -9.456 4.686 0.779 1.00 11.31 C ATOM 1248 O SER A 78 -10.330 4.792 -0.082 1.00 61.41 O ATOM 1249 CB SER A 78 -7.904 6.183 -0.490 1.00 11.12 C ATOM 1250 OG SER A 78 -8.334 7.369 0.155 1.00 3.32 O ATOM 0 H SER A 78 -7.718 3.562 -1.069 1.00 0.05 H new ATOM 0 HA SER A 78 -7.472 5.213 1.379 1.00 40.40 H new ATOM 0 HB2 SER A 78 -6.876 6.304 -0.832 1.00 11.12 H new ATOM 0 HB3 SER A 78 -8.516 6.004 -1.374 1.00 11.12 H new ATOM 0 HG SER A 78 -8.265 8.123 -0.467 1.00 3.32 H new ATOM 1256 N TYR A 79 -9.712 4.316 2.028 1.00 4.32 N ATOM 1257 CA TYR A 79 -11.066 4.004 2.471 1.00 2.12 C ATOM 1258 C TYR A 79 -11.812 5.271 2.878 1.00 13.13 C ATOM 1259 O TYR A 79 -11.214 6.337 3.029 1.00 31.23 O ATOM 1260 CB TYR A 79 -11.028 3.023 3.643 1.00 24.33 C ATOM 1261 CG TYR A 79 -12.371 2.825 4.312 1.00 51.14 C ATOM 1262 CD1 TYR A 79 -13.288 1.907 3.815 1.00 55.41 C ATOM 1263 CD2 TYR A 79 -12.720 3.556 5.441 1.00 21.21 C ATOM 1264 CE1 TYR A 79 -14.515 1.725 4.422 1.00 33.40 C ATOM 1265 CE2 TYR A 79 -13.944 3.378 6.055 1.00 40.10 C ATOM 1266 CZ TYR A 79 -14.840 2.462 5.542 1.00 62.11 C ATOM 1267 OH TYR A 79 -16.060 2.283 6.150 1.00 73.53 O ATOM 0 H TYR A 79 -9.000 4.225 2.752 1.00 4.32 H new ATOM 0 HA TYR A 79 -11.596 3.544 1.637 1.00 2.12 H new ATOM 0 HB2 TYR A 79 -10.663 2.059 3.287 1.00 24.33 H new ATOM 0 HB3 TYR A 79 -10.312 3.382 4.383 1.00 24.33 H new ATOM 0 HD1 TYR A 79 -13.037 1.326 2.940 1.00 55.41 H new ATOM 0 HD2 TYR A 79 -12.023 4.275 5.845 1.00 21.21 H new ATOM 0 HE1 TYR A 79 -15.217 1.009 4.022 1.00 33.40 H new ATOM 0 HE2 TYR A 79 -14.199 3.953 6.933 1.00 40.10 H new ATOM 0 HH TYR A 79 -16.130 2.878 6.925 1.00 73.53 H new ATOM 1277 N LYS A 80 -13.123 5.147 3.055 1.00 60.52 N ATOM 1278 CA LYS A 80 -13.954 6.279 3.447 1.00 41.11 C ATOM 1279 C LYS A 80 -14.621 6.024 4.794 1.00 73.45 C ATOM 1280 O LYS A 80 -15.495 5.164 4.912 1.00 11.31 O ATOM 1281 CB LYS A 80 -15.018 6.550 2.381 1.00 74.32 C ATOM 1282 CG LYS A 80 -16.001 7.642 2.766 1.00 32.32 C ATOM 1283 CD LYS A 80 -17.027 7.879 1.672 1.00 14.20 C ATOM 1284 CE LYS A 80 -18.240 6.976 1.840 1.00 54.12 C ATOM 1285 NZ LYS A 80 -18.954 6.762 0.551 1.00 62.15 N ATOM 0 H LYS A 80 -13.633 4.272 2.933 1.00 60.52 H new ATOM 0 HA LYS A 80 -13.311 7.154 3.541 1.00 41.11 H new ATOM 0 HB2 LYS A 80 -14.525 6.829 1.450 1.00 74.32 H new ATOM 0 HB3 LYS A 80 -15.568 5.629 2.187 1.00 74.32 H new ATOM 0 HG2 LYS A 80 -16.510 7.366 3.690 1.00 32.32 H new ATOM 0 HG3 LYS A 80 -15.459 8.567 2.965 1.00 32.32 H new ATOM 0 HD2 LYS A 80 -17.343 8.922 1.688 1.00 14.20 H new ATOM 0 HD3 LYS A 80 -16.571 7.700 0.699 1.00 14.20 H new ATOM 0 HE2 LYS A 80 -17.924 6.014 2.244 1.00 54.12 H new ATOM 0 HE3 LYS A 80 -18.924 7.417 2.565 1.00 54.12 H new ATOM 0 HZ1 LYS A 80 -19.774 6.142 0.707 1.00 62.15 H new ATOM 0 HZ2 LYS A 80 -19.278 7.677 0.178 1.00 62.15 H new ATOM 0 HZ3 LYS A 80 -18.309 6.318 -0.133 1.00 62.15 H new ATOM 1299 N TYR A 81 -14.205 6.777 5.807 1.00 73.34 N ATOM 1300 CA TYR A 81 -14.763 6.631 7.146 1.00 41.22 C ATOM 1301 C TYR A 81 -15.656 7.817 7.497 1.00 75.04 C ATOM 1302 O TYR A 81 -15.280 8.972 7.298 1.00 12.32 O ATOM 1303 CB TYR A 81 -13.641 6.502 8.177 1.00 61.30 C ATOM 1304 CG TYR A 81 -13.915 5.466 9.244 1.00 41.33 C ATOM 1305 CD1 TYR A 81 -14.953 5.635 10.154 1.00 62.14 C ATOM 1306 CD2 TYR A 81 -13.139 4.319 9.344 1.00 64.53 C ATOM 1307 CE1 TYR A 81 -15.207 4.693 11.131 1.00 33.23 C ATOM 1308 CE2 TYR A 81 -13.387 3.370 10.316 1.00 62.40 C ATOM 1309 CZ TYR A 81 -14.421 3.562 11.208 1.00 73.13 C ATOM 1310 OH TYR A 81 -14.671 2.620 12.179 1.00 63.42 O ATOM 0 H TYR A 81 -13.484 7.494 5.726 1.00 73.34 H new ATOM 0 HA TYR A 81 -15.369 5.725 7.162 1.00 41.22 H new ATOM 0 HB2 TYR A 81 -12.715 6.246 7.663 1.00 61.30 H new ATOM 0 HB3 TYR A 81 -13.484 7.470 8.654 1.00 61.30 H new ATOM 0 HD1 TYR A 81 -15.571 6.519 10.095 1.00 62.14 H new ATOM 0 HD2 TYR A 81 -12.327 4.166 8.649 1.00 64.53 H new ATOM 0 HE1 TYR A 81 -16.016 4.841 11.831 1.00 33.23 H new ATOM 0 HE2 TYR A 81 -12.775 2.482 10.377 1.00 62.40 H new ATOM 0 HH TYR A 81 -14.410 1.734 11.850 1.00 63.42 H new ATOM 1320 N VAL A 82 -16.842 7.523 8.021 1.00 73.54 N ATOM 1321 CA VAL A 82 -17.789 8.564 8.401 1.00 71.32 C ATOM 1322 C VAL A 82 -17.665 8.905 9.882 1.00 73.04 C ATOM 1323 O VAL A 82 -17.219 8.085 10.684 1.00 32.40 O ATOM 1324 CB VAL A 82 -19.240 8.138 8.104 1.00 61.05 C ATOM 1325 CG1 VAL A 82 -20.202 9.280 8.395 1.00 63.42 C ATOM 1326 CG2 VAL A 82 -19.373 7.673 6.662 1.00 61.21 C ATOM 0 H VAL A 82 -17.170 6.572 8.192 1.00 73.54 H new ATOM 0 HA VAL A 82 -17.547 9.445 7.806 1.00 71.32 H new ATOM 0 HB VAL A 82 -19.496 7.303 8.757 1.00 61.05 H new ATOM 0 HG11 VAL A 82 -21.222 8.961 8.179 1.00 63.42 H new ATOM 0 HG12 VAL A 82 -20.124 9.562 9.445 1.00 63.42 H new ATOM 0 HG13 VAL A 82 -19.950 10.136 7.769 1.00 63.42 H new ATOM 0 HG21 VAL A 82 -20.404 7.376 6.469 1.00 61.21 H new ATOM 0 HG22 VAL A 82 -19.098 8.486 5.991 1.00 61.21 H new ATOM 0 HG23 VAL A 82 -18.712 6.823 6.491 1.00 61.21 H new ATOM 1336 N HIS A 83 -18.063 10.123 10.237 1.00 25.13 N ATOM 1337 CA HIS A 83 -17.996 10.574 11.623 1.00 44.20 C ATOM 1338 C HIS A 83 -19.300 10.272 12.355 1.00 54.04 C ATOM 1339 O HIS A 83 -19.419 9.253 13.035 1.00 34.21 O ATOM 1340 CB HIS A 83 -17.701 12.073 11.680 1.00 54.33 C ATOM 1341 CG HIS A 83 -16.315 12.428 11.237 1.00 51.24 C ATOM 1342 ND1 HIS A 83 -15.695 12.255 10.046 1.00 51.21 N flip ATOM 1343 CD2 HIS A 83 -15.393 13.036 12.062 1.00 21.11 C flip ATOM 1344 CE1 HIS A 83 -14.423 12.759 10.172 1.00 71.00 C flip ATOM 1345 NE2 HIS A 83 -14.267 13.224 11.398 1.00 62.52 N flip ATOM 0 H HIS A 83 -18.435 10.814 9.585 1.00 25.13 H new ATOM 0 HA HIS A 83 -17.188 10.034 12.117 1.00 44.20 H new ATOM 0 HB2 HIS A 83 -18.420 12.601 11.053 1.00 54.33 H new ATOM 0 HB3 HIS A 83 -17.849 12.425 12.701 1.00 54.33 H new ATOM 0 HD1 HIS A 83 -16.097 11.830 9.211 1.00 51.21 H new ATOM 0 HD2 HIS A 83 -15.565 13.315 13.091 1.00 21.11 H new ATOM 0 HE1 HIS A 83 -13.673 12.773 9.395 1.00 71.00 H new ATOM 1354 N ASP A 84 -20.274 11.165 12.213 1.00 62.44 N ATOM 1355 CA ASP A 84 -21.569 10.993 12.860 1.00 1.11 C ATOM 1356 C ASP A 84 -22.376 12.288 12.811 1.00 23.40 C ATOM 1357 O ASP A 84 -23.588 12.267 12.601 1.00 0.22 O ATOM 1358 CB ASP A 84 -21.382 10.548 14.311 1.00 54.02 C ATOM 1359 CG ASP A 84 -21.812 9.111 14.535 1.00 5.41 C ATOM 1360 OD1 ASP A 84 -22.799 8.682 13.905 1.00 44.12 O ATOM 1361 OD2 ASP A 84 -21.158 8.416 15.342 1.00 12.51 O ATOM 0 H ASP A 84 -20.191 12.015 11.656 1.00 62.44 H new ATOM 0 HA ASP A 84 -22.119 10.222 12.320 1.00 1.11 H new ATOM 0 HB2 ASP A 84 -20.334 10.658 14.590 1.00 54.02 H new ATOM 0 HB3 ASP A 84 -21.957 11.203 14.966 1.00 54.02 H new ATOM 1366 N ASP A 85 -21.694 13.411 13.009 1.00 72.55 N ATOM 1367 CA ASP A 85 -22.347 14.715 12.987 1.00 75.11 C ATOM 1368 C ASP A 85 -22.736 15.104 11.565 1.00 74.12 C ATOM 1369 O ASP A 85 -23.517 16.033 11.356 1.00 62.41 O ATOM 1370 CB ASP A 85 -21.428 15.779 13.587 1.00 32.34 C ATOM 1371 CG ASP A 85 -22.015 17.174 13.488 1.00 61.11 C ATOM 1372 OD1 ASP A 85 -23.244 17.314 13.660 1.00 45.32 O ATOM 1373 OD2 ASP A 85 -21.245 18.124 13.240 1.00 3.15 O ATOM 0 H ASP A 85 -20.690 13.445 13.186 1.00 72.55 H new ATOM 0 HA ASP A 85 -23.254 14.650 13.587 1.00 75.11 H new ATOM 0 HB2 ASP A 85 -21.237 15.542 14.634 1.00 32.34 H new ATOM 0 HB3 ASP A 85 -20.466 15.755 13.074 1.00 32.34 H new ATOM 1378 N GLY A 86 -22.187 14.389 10.588 1.00 24.31 N ATOM 1379 CA GLY A 86 -22.487 14.675 9.198 1.00 3.31 C ATOM 1380 C GLY A 86 -21.237 14.876 8.364 1.00 11.35 C ATOM 1381 O GLY A 86 -21.306 15.371 7.239 1.00 15.23 O ATOM 0 H GLY A 86 -21.539 13.615 10.735 1.00 24.31 H new ATOM 0 HA2 GLY A 86 -23.071 13.855 8.780 1.00 3.31 H new ATOM 0 HA3 GLY A 86 -23.106 15.570 9.140 1.00 3.31 H new ATOM 1385 N ARG A 87 -20.091 14.493 8.917 1.00 74.22 N ATOM 1386 CA ARG A 87 -18.819 14.635 8.217 1.00 55.41 C ATOM 1387 C ARG A 87 -18.203 13.270 7.926 1.00 71.02 C ATOM 1388 O ARG A 87 -18.274 12.356 8.748 1.00 54.10 O ATOM 1389 CB ARG A 87 -17.849 15.479 9.046 1.00 32.14 C ATOM 1390 CG ARG A 87 -18.248 16.941 9.149 1.00 52.43 C ATOM 1391 CD ARG A 87 -18.146 17.642 7.803 1.00 3.22 C ATOM 1392 NE ARG A 87 -18.561 19.040 7.881 1.00 41.41 N ATOM 1393 CZ ARG A 87 -18.951 19.751 6.828 1.00 13.43 C ATOM 1394 NH1 ARG A 87 -18.981 19.197 5.624 1.00 31.31 N ATOM 1395 NH2 ARG A 87 -19.315 21.018 6.979 1.00 5.23 N ATOM 0 H ARG A 87 -20.017 14.082 9.848 1.00 74.22 H new ATOM 0 HA ARG A 87 -19.008 15.138 7.269 1.00 55.41 H new ATOM 0 HB2 ARG A 87 -17.781 15.058 10.049 1.00 32.14 H new ATOM 0 HB3 ARG A 87 -16.855 15.413 8.604 1.00 32.14 H new ATOM 0 HG2 ARG A 87 -19.269 17.015 9.523 1.00 52.43 H new ATOM 0 HG3 ARG A 87 -17.606 17.444 9.872 1.00 52.43 H new ATOM 0 HD2 ARG A 87 -17.118 17.588 7.443 1.00 3.22 H new ATOM 0 HD3 ARG A 87 -18.766 17.120 7.074 1.00 3.22 H new ATOM 0 HE ARG A 87 -18.551 19.496 8.793 1.00 41.41 H new ATOM 0 HH11 ARG A 87 -18.704 18.223 5.504 1.00 31.31 H new ATOM 0 HH12 ARG A 87 -19.281 19.745 4.818 1.00 31.31 H new ATOM 0 HH21 ARG A 87 -19.296 21.447 7.904 1.00 5.23 H new ATOM 0 HH22 ARG A 87 -19.614 21.563 6.170 1.00 5.23 H new ATOM 1409 N VAL A 88 -17.598 13.139 6.750 1.00 40.03 N ATOM 1410 CA VAL A 88 -16.968 11.887 6.350 1.00 64.23 C ATOM 1411 C VAL A 88 -15.639 12.140 5.648 1.00 64.13 C ATOM 1412 O VAL A 88 -15.574 12.874 4.662 1.00 14.55 O ATOM 1413 CB VAL A 88 -17.883 11.072 5.415 1.00 43.11 C ATOM 1414 CG1 VAL A 88 -18.347 11.926 4.245 1.00 72.11 C ATOM 1415 CG2 VAL A 88 -17.165 9.825 4.923 1.00 73.22 C ATOM 0 H VAL A 88 -17.531 13.885 6.058 1.00 40.03 H new ATOM 0 HA VAL A 88 -16.791 11.316 7.262 1.00 64.23 H new ATOM 0 HB VAL A 88 -18.763 10.759 5.977 1.00 43.11 H new ATOM 0 HG11 VAL A 88 -18.992 11.334 3.596 1.00 72.11 H new ATOM 0 HG12 VAL A 88 -18.901 12.787 4.620 1.00 72.11 H new ATOM 0 HG13 VAL A 88 -17.481 12.270 3.680 1.00 72.11 H new ATOM 0 HG21 VAL A 88 -17.825 9.261 4.264 1.00 73.22 H new ATOM 0 HG22 VAL A 88 -16.267 10.114 4.377 1.00 73.22 H new ATOM 0 HG23 VAL A 88 -16.887 9.205 5.775 1.00 73.22 H new ATOM 1425 N SER A 89 -14.578 11.525 6.162 1.00 33.23 N ATOM 1426 CA SER A 89 -13.247 11.686 5.587 1.00 75.10 C ATOM 1427 C SER A 89 -12.706 10.350 5.087 1.00 52.21 C ATOM 1428 O SER A 89 -13.161 9.286 5.509 1.00 4.52 O ATOM 1429 CB SER A 89 -12.291 12.282 6.621 1.00 50.32 C ATOM 1430 OG SER A 89 -12.717 13.573 7.025 1.00 25.41 O ATOM 0 H SER A 89 -14.614 10.911 6.975 1.00 33.23 H new ATOM 0 HA SER A 89 -13.324 12.367 4.739 1.00 75.10 H new ATOM 0 HB2 SER A 89 -12.235 11.626 7.490 1.00 50.32 H new ATOM 0 HB3 SER A 89 -11.287 12.342 6.201 1.00 50.32 H new ATOM 0 HG SER A 89 -12.090 13.932 7.687 1.00 25.41 H new ATOM 1436 N TYR A 90 -11.733 10.413 4.186 1.00 52.01 N ATOM 1437 CA TYR A 90 -11.131 9.209 3.626 1.00 63.24 C ATOM 1438 C TYR A 90 -9.733 8.985 4.194 1.00 24.23 C ATOM 1439 O TYR A 90 -8.742 9.534 3.711 1.00 1.52 O ATOM 1440 CB TYR A 90 -11.063 9.309 2.101 1.00 1.24 C ATOM 1441 CG TYR A 90 -12.221 10.067 1.492 1.00 13.01 C ATOM 1442 CD1 TYR A 90 -13.508 9.543 1.515 1.00 32.44 C ATOM 1443 CD2 TYR A 90 -12.029 11.306 0.893 1.00 64.41 C ATOM 1444 CE1 TYR A 90 -14.569 10.231 0.960 1.00 10.20 C ATOM 1445 CE2 TYR A 90 -13.084 12.001 0.337 1.00 75.31 C ATOM 1446 CZ TYR A 90 -14.352 11.460 0.372 1.00 72.20 C ATOM 1447 OH TYR A 90 -15.407 12.149 -0.182 1.00 44.44 O ATOM 0 H TYR A 90 -11.344 11.285 3.827 1.00 52.01 H new ATOM 0 HA TYR A 90 -11.756 8.359 3.900 1.00 63.24 H new ATOM 0 HB2 TYR A 90 -10.131 9.798 1.819 1.00 1.24 H new ATOM 0 HB3 TYR A 90 -11.036 8.304 1.680 1.00 1.24 H new ATOM 0 HD1 TYR A 90 -13.681 8.581 1.975 1.00 32.44 H new ATOM 0 HD2 TYR A 90 -11.037 11.733 0.862 1.00 64.41 H new ATOM 0 HE1 TYR A 90 -15.563 9.809 0.986 1.00 10.20 H new ATOM 0 HE2 TYR A 90 -12.917 12.964 -0.123 1.00 75.31 H new ATOM 0 HH TYR A 90 -15.085 12.997 -0.553 1.00 44.44 H new ATOM 1457 N PRO A 91 -9.648 8.156 5.246 1.00 52.41 N ATOM 1458 CA PRO A 91 -8.377 7.838 5.903 1.00 14.25 C ATOM 1459 C PRO A 91 -7.472 6.978 5.029 1.00 11.12 C ATOM 1460 O PRO A 91 -7.619 5.756 4.979 1.00 65.23 O ATOM 1461 CB PRO A 91 -8.807 7.065 7.151 1.00 35.53 C ATOM 1462 CG PRO A 91 -10.130 6.478 6.796 1.00 24.44 C ATOM 1463 CD PRO A 91 -10.787 7.467 5.874 1.00 30.21 C ATOM 0 HA PRO A 91 -7.795 8.734 6.119 1.00 14.25 H new ATOM 0 HB2 PRO A 91 -8.085 6.289 7.404 1.00 35.53 H new ATOM 0 HB3 PRO A 91 -8.885 7.723 8.017 1.00 35.53 H new ATOM 0 HG2 PRO A 91 -10.010 5.510 6.309 1.00 24.44 H new ATOM 0 HG3 PRO A 91 -10.736 6.313 7.687 1.00 24.44 H new ATOM 0 HD2 PRO A 91 -11.414 6.971 5.134 1.00 30.21 H new ATOM 0 HD3 PRO A 91 -11.426 8.162 6.419 1.00 30.21 H new ATOM 1471 N LEU A 92 -6.535 7.623 4.341 1.00 75.43 N ATOM 1472 CA LEU A 92 -5.604 6.915 3.468 1.00 55.12 C ATOM 1473 C LEU A 92 -4.585 6.127 4.283 1.00 22.24 C ATOM 1474 O LEU A 92 -3.988 6.652 5.224 1.00 5.13 O ATOM 1475 CB LEU A 92 -4.886 7.904 2.549 1.00 5.31 C ATOM 1476 CG LEU A 92 -5.343 7.920 1.090 1.00 23.24 C ATOM 1477 CD1 LEU A 92 -6.018 9.241 0.756 1.00 2.40 C ATOM 1478 CD2 LEU A 92 -4.164 7.670 0.159 1.00 12.33 C ATOM 0 H LEU A 92 -6.400 8.634 4.371 1.00 75.43 H new ATOM 0 HA LEU A 92 -6.175 6.213 2.861 1.00 55.12 H new ATOM 0 HB2 LEU A 92 -5.011 8.906 2.959 1.00 5.31 H new ATOM 0 HB3 LEU A 92 -3.819 7.681 2.572 1.00 5.31 H new ATOM 0 HG LEU A 92 -6.069 7.119 0.948 1.00 23.24 H new ATOM 0 HD11 LEU A 92 -6.336 9.234 -0.286 1.00 2.40 H new ATOM 0 HD12 LEU A 92 -6.887 9.379 1.400 1.00 2.40 H new ATOM 0 HD13 LEU A 92 -5.315 10.059 0.915 1.00 2.40 H new ATOM 0 HD21 LEU A 92 -4.508 7.685 -0.875 1.00 12.33 H new ATOM 0 HD22 LEU A 92 -3.415 8.448 0.304 1.00 12.33 H new ATOM 0 HD23 LEU A 92 -3.725 6.698 0.381 1.00 12.33 H new ATOM 1490 N CYS A 93 -4.389 4.866 3.916 1.00 61.52 N ATOM 1491 CA CYS A 93 -3.440 4.005 4.613 1.00 0.24 C ATOM 1492 C CYS A 93 -2.537 3.278 3.623 1.00 74.14 C ATOM 1493 O CYS A 93 -2.913 3.054 2.472 1.00 41.32 O ATOM 1494 CB CYS A 93 -4.185 2.991 5.483 1.00 22.33 C ATOM 1495 SG CYS A 93 -5.172 3.734 6.804 1.00 63.11 S ATOM 0 H CYS A 93 -4.875 4.417 3.140 1.00 61.52 H new ATOM 0 HA CYS A 93 -2.817 4.632 5.251 1.00 0.24 H new ATOM 0 HB2 CYS A 93 -4.839 2.394 4.847 1.00 22.33 H new ATOM 0 HB3 CYS A 93 -3.461 2.307 5.926 1.00 22.33 H new ATOM 0 HG CYS A 93 -4.998 3.065 7.905 1.00 63.11 H new ATOM 1501 N PHE A 94 -1.344 2.912 4.076 1.00 31.21 N ATOM 1502 CA PHE A 94 -0.385 2.212 3.230 1.00 72.52 C ATOM 1503 C PHE A 94 -0.468 0.704 3.446 1.00 64.13 C ATOM 1504 O PHE A 94 -0.012 0.187 4.465 1.00 23.25 O ATOM 1505 CB PHE A 94 1.035 2.703 3.518 1.00 64.34 C ATOM 1506 CG PHE A 94 2.062 2.162 2.562 1.00 15.34 C ATOM 1507 CD1 PHE A 94 2.290 2.783 1.346 1.00 52.55 C ATOM 1508 CD2 PHE A 94 2.798 1.034 2.882 1.00 2.33 C ATOM 1509 CE1 PHE A 94 3.233 2.288 0.465 1.00 71.04 C ATOM 1510 CE2 PHE A 94 3.743 0.534 2.006 1.00 10.23 C ATOM 1511 CZ PHE A 94 3.960 1.163 0.796 1.00 63.31 C ATOM 0 H PHE A 94 -1.017 3.089 5.026 1.00 31.21 H new ATOM 0 HA PHE A 94 -0.632 2.426 2.190 1.00 72.52 H new ATOM 0 HB2 PHE A 94 1.050 3.792 3.477 1.00 64.34 H new ATOM 0 HB3 PHE A 94 1.310 2.419 4.534 1.00 64.34 H new ATOM 0 HD1 PHE A 94 1.724 3.665 1.083 1.00 52.55 H new ATOM 0 HD2 PHE A 94 2.632 0.539 3.827 1.00 2.33 H new ATOM 0 HE1 PHE A 94 3.401 2.781 -0.481 1.00 71.04 H new ATOM 0 HE2 PHE A 94 4.311 -0.347 2.267 1.00 10.23 H new ATOM 0 HZ PHE A 94 4.698 0.775 0.110 1.00 63.31 H new ATOM 1521 N ILE A 95 -1.052 0.005 2.479 1.00 14.11 N ATOM 1522 CA ILE A 95 -1.195 -1.444 2.563 1.00 12.31 C ATOM 1523 C ILE A 95 -0.034 -2.151 1.871 1.00 41.33 C ATOM 1524 O ILE A 95 0.161 -2.011 0.663 1.00 51.31 O ATOM 1525 CB ILE A 95 -2.518 -1.917 1.933 1.00 13.10 C ATOM 1526 CG1 ILE A 95 -3.709 -1.375 2.727 1.00 4.10 C ATOM 1527 CG2 ILE A 95 -2.562 -3.436 1.873 1.00 73.22 C ATOM 1528 CD1 ILE A 95 -5.048 -1.710 2.111 1.00 15.04 C ATOM 0 H ILE A 95 -1.434 0.418 1.628 1.00 14.11 H new ATOM 0 HA ILE A 95 -1.195 -1.700 3.622 1.00 12.31 H new ATOM 0 HB ILE A 95 -2.578 -1.531 0.916 1.00 13.10 H new ATOM 0 HG12 ILE A 95 -3.673 -1.777 3.740 1.00 4.10 H new ATOM 0 HG13 ILE A 95 -3.617 -0.292 2.810 1.00 4.10 H new ATOM 0 HG21 ILE A 95 -3.503 -3.755 1.425 1.00 73.22 H new ATOM 0 HG22 ILE A 95 -1.731 -3.801 1.269 1.00 73.22 H new ATOM 0 HG23 ILE A 95 -2.484 -3.842 2.881 1.00 73.22 H new ATOM 0 HD11 ILE A 95 -5.846 -1.295 2.727 1.00 15.04 H new ATOM 0 HD12 ILE A 95 -5.104 -1.285 1.109 1.00 15.04 H new ATOM 0 HD13 ILE A 95 -5.161 -2.793 2.053 1.00 15.04 H new ATOM 1540 N PHE A 96 0.732 -2.912 2.644 1.00 23.32 N ATOM 1541 CA PHE A 96 1.874 -3.643 2.106 1.00 41.02 C ATOM 1542 C PHE A 96 1.528 -5.114 1.896 1.00 75.52 C ATOM 1543 O PHE A 96 1.403 -5.877 2.854 1.00 2.41 O ATOM 1544 CB PHE A 96 3.075 -3.520 3.045 1.00 12.22 C ATOM 1545 CG PHE A 96 4.281 -4.285 2.581 1.00 63.52 C ATOM 1546 CD1 PHE A 96 4.336 -4.806 1.297 1.00 2.34 C ATOM 1547 CD2 PHE A 96 5.359 -4.484 3.427 1.00 64.34 C ATOM 1548 CE1 PHE A 96 5.444 -5.511 0.869 1.00 51.22 C ATOM 1549 CE2 PHE A 96 6.471 -5.189 3.003 1.00 1.44 C ATOM 1550 CZ PHE A 96 6.514 -5.701 1.722 1.00 73.52 C ATOM 0 H PHE A 96 0.583 -3.039 3.645 1.00 23.32 H new ATOM 0 HA PHE A 96 2.130 -3.206 1.141 1.00 41.02 H new ATOM 0 HB2 PHE A 96 3.340 -2.468 3.147 1.00 12.22 H new ATOM 0 HB3 PHE A 96 2.789 -3.874 4.035 1.00 12.22 H new ATOM 0 HD1 PHE A 96 3.504 -4.659 0.625 1.00 2.34 H new ATOM 0 HD2 PHE A 96 5.331 -4.084 4.430 1.00 64.34 H new ATOM 0 HE1 PHE A 96 5.474 -5.914 -0.133 1.00 51.22 H new ATOM 0 HE2 PHE A 96 7.304 -5.339 3.673 1.00 1.44 H new ATOM 0 HZ PHE A 96 7.382 -6.249 1.387 1.00 73.52 H new ATOM 1560 N SER A 97 1.374 -5.506 0.635 1.00 52.14 N ATOM 1561 CA SER A 97 1.037 -6.884 0.298 1.00 50.35 C ATOM 1562 C SER A 97 2.273 -7.776 0.364 1.00 34.53 C ATOM 1563 O SER A 97 3.039 -7.867 -0.596 1.00 30.23 O ATOM 1564 CB SER A 97 0.419 -6.953 -1.100 1.00 33.02 C ATOM 1565 OG SER A 97 0.012 -8.274 -1.412 1.00 52.14 O ATOM 0 H SER A 97 1.477 -4.888 -0.170 1.00 52.14 H new ATOM 0 HA SER A 97 0.310 -7.243 1.027 1.00 50.35 H new ATOM 0 HB2 SER A 97 -0.438 -6.282 -1.156 1.00 33.02 H new ATOM 0 HB3 SER A 97 1.143 -6.608 -1.839 1.00 33.02 H new ATOM 0 HG SER A 97 -0.232 -8.326 -2.360 1.00 52.14 H new ATOM 1571 N SER A 98 2.460 -8.433 1.504 1.00 23.13 N ATOM 1572 CA SER A 98 3.604 -9.315 1.700 1.00 62.34 C ATOM 1573 C SER A 98 3.148 -10.729 2.045 1.00 31.13 C ATOM 1574 O SER A 98 2.900 -11.063 3.203 1.00 23.25 O ATOM 1575 CB SER A 98 4.510 -8.775 2.808 1.00 53.15 C ATOM 1576 OG SER A 98 5.851 -9.192 2.620 1.00 10.31 O ATOM 0 H SER A 98 1.833 -8.371 2.306 1.00 23.13 H new ATOM 0 HA SER A 98 4.166 -9.350 0.767 1.00 62.34 H new ATOM 0 HB2 SER A 98 4.463 -7.686 2.822 1.00 53.15 H new ATOM 0 HB3 SER A 98 4.151 -9.122 3.777 1.00 53.15 H new ATOM 0 HG SER A 98 6.225 -8.746 1.832 1.00 10.31 H new ATOM 1582 N PRO A 99 3.032 -11.581 1.016 1.00 54.31 N ATOM 1583 CA PRO A 99 2.605 -12.974 1.184 1.00 51.20 C ATOM 1584 C PRO A 99 3.655 -13.820 1.894 1.00 63.23 C ATOM 1585 O PRO A 99 4.575 -13.292 2.519 1.00 10.33 O ATOM 1586 CB PRO A 99 2.408 -13.460 -0.254 1.00 72.31 C ATOM 1587 CG PRO A 99 3.299 -12.592 -1.074 1.00 33.32 C ATOM 1588 CD PRO A 99 3.310 -11.251 -0.393 1.00 23.22 C ATOM 0 HA PRO A 99 1.711 -13.055 1.802 1.00 51.20 H new ATOM 0 HB2 PRO A 99 2.676 -14.511 -0.357 1.00 72.31 H new ATOM 0 HB3 PRO A 99 1.368 -13.365 -0.565 1.00 72.31 H new ATOM 0 HG2 PRO A 99 4.305 -13.009 -1.132 1.00 33.32 H new ATOM 0 HG3 PRO A 99 2.929 -12.508 -2.096 1.00 33.32 H new ATOM 0 HD2 PRO A 99 4.272 -10.751 -0.506 1.00 23.22 H new ATOM 0 HD3 PRO A 99 2.553 -10.584 -0.806 1.00 23.22 H new ATOM 1596 N VAL A 100 3.513 -15.138 1.794 1.00 13.22 N ATOM 1597 CA VAL A 100 4.451 -16.058 2.426 1.00 72.14 C ATOM 1598 C VAL A 100 5.062 -17.008 1.402 1.00 74.54 C ATOM 1599 O VAL A 100 6.200 -17.451 1.552 1.00 50.01 O ATOM 1600 CB VAL A 100 3.768 -16.884 3.532 1.00 60.04 C ATOM 1601 CG1 VAL A 100 4.659 -18.038 3.963 1.00 23.43 C ATOM 1602 CG2 VAL A 100 3.418 -15.998 4.718 1.00 14.43 C ATOM 0 H VAL A 100 2.757 -15.592 1.281 1.00 13.22 H new ATOM 0 HA VAL A 100 5.239 -15.451 2.871 1.00 72.14 H new ATOM 0 HB VAL A 100 2.843 -17.300 3.133 1.00 60.04 H new ATOM 0 HG11 VAL A 100 4.160 -18.610 4.745 1.00 23.43 H new ATOM 0 HG12 VAL A 100 4.855 -18.685 3.108 1.00 23.43 H new ATOM 0 HG13 VAL A 100 5.602 -17.647 4.345 1.00 23.43 H new ATOM 0 HG21 VAL A 100 2.936 -16.598 5.490 1.00 14.43 H new ATOM 0 HG22 VAL A 100 4.328 -15.552 5.120 1.00 14.43 H new ATOM 0 HG23 VAL A 100 2.739 -15.209 4.395 1.00 14.43 H new ATOM 1612 N GLY A 101 4.297 -17.318 0.359 1.00 21.42 N ATOM 1613 CA GLY A 101 4.780 -18.214 -0.675 1.00 64.03 C ATOM 1614 C GLY A 101 5.777 -17.546 -1.602 1.00 50.42 C ATOM 1615 O GLY A 101 6.219 -18.144 -2.585 1.00 14.52 O ATOM 0 H GLY A 101 3.352 -16.964 0.212 1.00 21.42 H new ATOM 0 HA2 GLY A 101 5.246 -19.083 -0.210 1.00 64.03 H new ATOM 0 HA3 GLY A 101 3.935 -18.580 -1.258 1.00 64.03 H new ATOM 1619 N CYS A 102 6.131 -16.304 -1.290 1.00 61.32 N ATOM 1620 CA CYS A 102 7.081 -15.553 -2.104 1.00 71.31 C ATOM 1621 C CYS A 102 8.516 -15.906 -1.729 1.00 42.41 C ATOM 1622 O CYS A 102 8.755 -16.760 -0.876 1.00 31.23 O ATOM 1623 CB CYS A 102 6.851 -14.051 -1.937 1.00 1.55 C ATOM 1624 SG CYS A 102 6.822 -13.496 -0.216 1.00 41.21 S ATOM 0 H CYS A 102 5.775 -15.796 -0.480 1.00 61.32 H new ATOM 0 HA CYS A 102 6.921 -15.823 -3.148 1.00 71.31 H new ATOM 0 HB2 CYS A 102 7.636 -13.513 -2.468 1.00 1.55 H new ATOM 0 HB3 CYS A 102 5.906 -13.784 -2.410 1.00 1.55 H new ATOM 0 HG CYS A 102 6.519 -12.233 -0.173 1.00 41.21 H new ATOM 1630 N LYS A 103 9.471 -15.243 -2.374 1.00 15.05 N ATOM 1631 CA LYS A 103 10.883 -15.484 -2.109 1.00 23.41 C ATOM 1632 C LYS A 103 11.484 -14.353 -1.281 1.00 62.24 C ATOM 1633 O LYS A 103 11.051 -13.203 -1.351 1.00 40.25 O ATOM 1634 CB LYS A 103 11.652 -15.631 -3.425 1.00 33.11 C ATOM 1635 CG LYS A 103 10.898 -16.414 -4.485 1.00 63.45 C ATOM 1636 CD LYS A 103 10.803 -15.639 -5.788 1.00 75.31 C ATOM 1637 CE LYS A 103 12.177 -15.385 -6.387 1.00 43.30 C ATOM 1638 NZ LYS A 103 12.438 -16.255 -7.567 1.00 64.04 N ATOM 0 H LYS A 103 9.291 -14.534 -3.085 1.00 15.05 H new ATOM 0 HA LYS A 103 10.966 -16.410 -1.540 1.00 23.41 H new ATOM 0 HB2 LYS A 103 11.883 -14.639 -3.814 1.00 33.11 H new ATOM 0 HB3 LYS A 103 12.603 -16.126 -3.227 1.00 33.11 H new ATOM 0 HG2 LYS A 103 11.400 -17.365 -4.662 1.00 63.45 H new ATOM 0 HG3 LYS A 103 9.896 -16.645 -4.124 1.00 63.45 H new ATOM 0 HD2 LYS A 103 10.192 -16.195 -6.499 1.00 75.31 H new ATOM 0 HD3 LYS A 103 10.301 -14.688 -5.611 1.00 75.31 H new ATOM 0 HE2 LYS A 103 12.256 -14.339 -6.683 1.00 43.30 H new ATOM 0 HE3 LYS A 103 12.941 -15.561 -5.630 1.00 43.30 H new ATOM 0 HZ1 LYS A 103 13.385 -16.051 -7.946 1.00 64.04 H new ATOM 0 HZ2 LYS A 103 12.388 -17.253 -7.280 1.00 64.04 H new ATOM 0 HZ3 LYS A 103 11.724 -16.069 -8.300 1.00 64.04 H new ATOM 1652 N PRO A 104 12.506 -14.684 -0.478 1.00 32.44 N ATOM 1653 CA PRO A 104 13.188 -13.708 0.377 1.00 21.53 C ATOM 1654 C PRO A 104 14.015 -12.711 -0.426 1.00 62.02 C ATOM 1655 O PRO A 104 14.439 -11.680 0.095 1.00 21.21 O ATOM 1656 CB PRO A 104 14.098 -14.577 1.250 1.00 23.14 C ATOM 1657 CG PRO A 104 14.335 -15.807 0.443 1.00 73.31 C ATOM 1658 CD PRO A 104 13.074 -16.036 -0.343 1.00 35.41 C ATOM 0 HA PRO A 104 12.483 -13.100 0.944 1.00 21.53 H new ATOM 0 HB2 PRO A 104 15.034 -14.066 1.477 1.00 23.14 H new ATOM 0 HB3 PRO A 104 13.624 -14.814 2.203 1.00 23.14 H new ATOM 0 HG2 PRO A 104 15.191 -15.680 -0.220 1.00 73.31 H new ATOM 0 HG3 PRO A 104 14.554 -16.659 1.086 1.00 73.31 H new ATOM 0 HD2 PRO A 104 13.282 -16.483 -1.315 1.00 35.41 H new ATOM 0 HD3 PRO A 104 12.392 -16.708 0.178 1.00 35.41 H new ATOM 1666 N GLU A 105 14.241 -13.025 -1.698 1.00 42.03 N ATOM 1667 CA GLU A 105 15.017 -12.155 -2.574 1.00 23.15 C ATOM 1668 C GLU A 105 14.206 -10.931 -2.984 1.00 12.33 C ATOM 1669 O GLU A 105 14.747 -9.837 -3.135 1.00 3.42 O ATOM 1670 CB GLU A 105 15.472 -12.920 -3.818 1.00 72.31 C ATOM 1671 CG GLU A 105 16.474 -14.025 -3.523 1.00 14.23 C ATOM 1672 CD GLU A 105 17.873 -13.683 -3.994 1.00 25.04 C ATOM 1673 OE1 GLU A 105 18.001 -12.999 -5.030 1.00 4.50 O ATOM 1674 OE2 GLU A 105 18.842 -14.099 -3.323 1.00 62.10 O ATOM 0 H GLU A 105 13.898 -13.875 -2.145 1.00 42.03 H new ATOM 0 HA GLU A 105 15.895 -11.819 -2.023 1.00 23.15 H new ATOM 0 HB2 GLU A 105 14.599 -13.354 -4.306 1.00 72.31 H new ATOM 0 HB3 GLU A 105 15.916 -12.218 -4.523 1.00 72.31 H new ATOM 0 HG2 GLU A 105 16.492 -14.217 -2.450 1.00 14.23 H new ATOM 0 HG3 GLU A 105 16.147 -14.946 -4.006 1.00 14.23 H new ATOM 1681 N GLN A 106 12.902 -11.125 -3.163 1.00 3.32 N ATOM 1682 CA GLN A 106 12.016 -10.037 -3.556 1.00 40.23 C ATOM 1683 C GLN A 106 11.457 -9.319 -2.333 1.00 14.22 C ATOM 1684 O GLN A 106 11.662 -8.118 -2.159 1.00 24.01 O ATOM 1685 CB GLN A 106 10.869 -10.571 -4.417 1.00 24.33 C ATOM 1686 CG GLN A 106 11.281 -11.700 -5.348 1.00 24.13 C ATOM 1687 CD GLN A 106 12.037 -11.206 -6.566 1.00 34.14 C ATOM 1688 OE1 GLN A 106 13.161 -11.632 -6.829 1.00 45.24 O ATOM 1689 NE2 GLN A 106 11.420 -10.302 -7.317 1.00 52.42 N ATOM 0 H GLN A 106 12.437 -12.025 -3.042 1.00 3.32 H new ATOM 0 HA GLN A 106 12.597 -9.322 -4.139 1.00 40.23 H new ATOM 0 HB2 GLN A 106 10.070 -10.923 -3.765 1.00 24.33 H new ATOM 0 HB3 GLN A 106 10.460 -9.753 -5.010 1.00 24.33 H new ATOM 0 HG2 GLN A 106 11.904 -12.408 -4.801 1.00 24.13 H new ATOM 0 HG3 GLN A 106 10.392 -12.241 -5.672 1.00 24.13 H new ATOM 0 HE21 GLN A 106 10.488 -9.977 -7.061 1.00 52.42 H new ATOM 0 HE22 GLN A 106 11.878 -9.932 -8.150 1.00 52.42 H new ATOM 1698 N GLN A 107 10.750 -10.063 -1.488 1.00 21.11 N ATOM 1699 CA GLN A 107 10.161 -9.496 -0.280 1.00 21.31 C ATOM 1700 C GLN A 107 11.073 -8.434 0.324 1.00 61.52 C ATOM 1701 O GLN A 107 10.607 -7.399 0.799 1.00 71.14 O ATOM 1702 CB GLN A 107 9.892 -10.598 0.746 1.00 14.24 C ATOM 1703 CG GLN A 107 8.446 -10.654 1.214 1.00 64.44 C ATOM 1704 CD GLN A 107 8.272 -10.153 2.633 1.00 32.15 C ATOM 1705 OE1 GLN A 107 7.820 -10.887 3.513 1.00 73.33 O ATOM 1706 NE2 GLN A 107 8.632 -8.897 2.867 1.00 71.12 N ATOM 0 H GLN A 107 10.571 -11.059 -1.617 1.00 21.11 H new ATOM 0 HA GLN A 107 9.217 -9.024 -0.553 1.00 21.31 H new ATOM 0 HB2 GLN A 107 10.162 -11.561 0.312 1.00 14.24 H new ATOM 0 HB3 GLN A 107 10.539 -10.445 1.610 1.00 14.24 H new ATOM 0 HG2 GLN A 107 7.828 -10.057 0.544 1.00 64.44 H new ATOM 0 HG3 GLN A 107 8.087 -11.681 1.149 1.00 64.44 H new ATOM 0 HE21 GLN A 107 9.002 -8.323 2.109 1.00 71.12 H new ATOM 0 HE22 GLN A 107 8.539 -8.506 3.804 1.00 71.12 H new ATOM 1715 N MET A 108 12.375 -8.698 0.302 1.00 2.32 N ATOM 1716 CA MET A 108 13.353 -7.763 0.847 1.00 64.23 C ATOM 1717 C MET A 108 13.373 -6.467 0.043 1.00 12.11 C ATOM 1718 O MET A 108 13.388 -5.375 0.610 1.00 4.53 O ATOM 1719 CB MET A 108 14.747 -8.394 0.851 1.00 33.14 C ATOM 1720 CG MET A 108 15.035 -9.222 2.094 1.00 74.05 C ATOM 1721 SD MET A 108 16.748 -9.082 2.640 1.00 41.25 S ATOM 1722 CE MET A 108 17.618 -9.534 1.141 1.00 43.51 C ATOM 0 H MET A 108 12.777 -9.551 -0.087 1.00 2.32 H new ATOM 0 HA MET A 108 13.064 -7.531 1.872 1.00 64.23 H new ATOM 0 HB2 MET A 108 14.853 -9.027 -0.030 1.00 33.14 H new ATOM 0 HB3 MET A 108 15.494 -7.605 0.769 1.00 33.14 H new ATOM 0 HG2 MET A 108 14.374 -8.903 2.900 1.00 74.05 H new ATOM 0 HG3 MET A 108 14.807 -10.268 1.890 1.00 74.05 H new ATOM 0 HE1 MET A 108 18.667 -9.720 1.371 1.00 43.51 H new ATOM 0 HE2 MET A 108 17.173 -10.436 0.720 1.00 43.51 H new ATOM 0 HE3 MET A 108 17.544 -8.722 0.418 1.00 43.51 H new ATOM 1732 N MET A 109 13.371 -6.595 -1.279 1.00 54.23 N ATOM 1733 CA MET A 109 13.387 -5.433 -2.159 1.00 40.54 C ATOM 1734 C MET A 109 12.326 -4.420 -1.742 1.00 14.11 C ATOM 1735 O MET A 109 12.517 -3.211 -1.885 1.00 34.43 O ATOM 1736 CB MET A 109 13.156 -5.861 -3.611 1.00 21.53 C ATOM 1737 CG MET A 109 14.382 -6.481 -4.263 1.00 10.32 C ATOM 1738 SD MET A 109 13.989 -7.348 -5.794 1.00 21.51 S ATOM 1739 CE MET A 109 13.369 -6.001 -6.797 1.00 72.34 C ATOM 0 H MET A 109 13.358 -7.492 -1.765 1.00 54.23 H new ATOM 0 HA MET A 109 14.367 -4.962 -2.078 1.00 40.54 H new ATOM 0 HB2 MET A 109 12.335 -6.577 -3.644 1.00 21.53 H new ATOM 0 HB3 MET A 109 12.845 -4.993 -4.192 1.00 21.53 H new ATOM 0 HG2 MET A 109 15.113 -5.700 -4.470 1.00 10.32 H new ATOM 0 HG3 MET A 109 14.848 -7.177 -3.565 1.00 10.32 H new ATOM 0 HE1 MET A 109 12.953 -6.398 -7.723 1.00 72.34 H new ATOM 0 HE2 MET A 109 12.592 -5.467 -6.249 1.00 72.34 H new ATOM 0 HE3 MET A 109 14.184 -5.316 -7.030 1.00 72.34 H new ATOM 1749 N TYR A 110 11.208 -4.919 -1.227 1.00 0.04 N ATOM 1750 CA TYR A 110 10.115 -4.057 -0.792 1.00 5.42 C ATOM 1751 C TYR A 110 10.204 -3.780 0.707 1.00 75.15 C ATOM 1752 O TYR A 110 9.882 -2.685 1.166 1.00 11.41 O ATOM 1753 CB TYR A 110 8.767 -4.700 -1.124 1.00 4.43 C ATOM 1754 CG TYR A 110 8.663 -5.184 -2.552 1.00 60.14 C ATOM 1755 CD1 TYR A 110 9.231 -6.392 -2.940 1.00 44.53 C ATOM 1756 CD2 TYR A 110 7.998 -4.434 -3.514 1.00 52.41 C ATOM 1757 CE1 TYR A 110 9.139 -6.837 -4.244 1.00 34.52 C ATOM 1758 CE2 TYR A 110 7.900 -4.873 -4.820 1.00 60.11 C ATOM 1759 CZ TYR A 110 8.473 -6.076 -5.180 1.00 54.31 C ATOM 1760 OH TYR A 110 8.377 -6.516 -6.480 1.00 44.35 O ATOM 0 H TYR A 110 11.035 -5.916 -1.100 1.00 0.04 H new ATOM 0 HA TYR A 110 10.199 -3.110 -1.324 1.00 5.42 H new ATOM 0 HB2 TYR A 110 8.599 -5.541 -0.451 1.00 4.43 H new ATOM 0 HB3 TYR A 110 7.973 -3.978 -0.935 1.00 4.43 H new ATOM 0 HD1 TYR A 110 9.753 -6.992 -2.210 1.00 44.53 H new ATOM 0 HD2 TYR A 110 7.550 -3.491 -3.236 1.00 52.41 H new ATOM 0 HE1 TYR A 110 9.587 -7.777 -4.529 1.00 34.52 H new ATOM 0 HE2 TYR A 110 7.378 -4.278 -5.555 1.00 60.11 H new ATOM 0 HH TYR A 110 7.875 -5.862 -7.010 1.00 44.35 H new ATOM 1770 N ALA A 111 10.644 -4.781 1.462 1.00 51.03 N ATOM 1771 CA ALA A 111 10.779 -4.646 2.906 1.00 10.32 C ATOM 1772 C ALA A 111 11.775 -3.548 3.266 1.00 62.55 C ATOM 1773 O ALA A 111 11.683 -2.937 4.328 1.00 24.04 O ATOM 1774 CB ALA A 111 11.204 -5.970 3.523 1.00 72.31 C ATOM 0 H ALA A 111 10.913 -5.695 1.097 1.00 51.03 H new ATOM 0 HA ALA A 111 9.807 -4.364 3.311 1.00 10.32 H new ATOM 0 HB1 ALA A 111 11.301 -5.854 4.602 1.00 72.31 H new ATOM 0 HB2 ALA A 111 10.454 -6.730 3.306 1.00 72.31 H new ATOM 0 HB3 ALA A 111 12.162 -6.276 3.104 1.00 72.31 H new ATOM 1780 N GLY A 112 12.728 -3.306 2.370 1.00 52.33 N ATOM 1781 CA GLY A 112 13.729 -2.282 2.612 1.00 52.25 C ATOM 1782 C GLY A 112 13.361 -0.952 1.984 1.00 21.32 C ATOM 1783 O GLY A 112 13.745 0.105 2.485 1.00 63.31 O ATOM 0 H GLY A 112 12.825 -3.800 1.483 1.00 52.33 H new ATOM 0 HA2 GLY A 112 13.857 -2.150 3.686 1.00 52.25 H new ATOM 0 HA3 GLY A 112 14.688 -2.615 2.215 1.00 52.25 H new ATOM 1787 N SER A 113 12.616 -1.004 0.885 1.00 41.41 N ATOM 1788 CA SER A 113 12.201 0.206 0.185 1.00 62.25 C ATOM 1789 C SER A 113 10.818 0.651 0.645 1.00 55.41 C ATOM 1790 O SER A 113 10.361 1.746 0.311 1.00 62.20 O ATOM 1791 CB SER A 113 12.198 -0.030 -1.327 1.00 3.52 C ATOM 1792 OG SER A 113 13.266 -0.876 -1.713 1.00 44.54 O ATOM 0 H SER A 113 12.287 -1.871 0.460 1.00 41.41 H new ATOM 0 HA SER A 113 12.914 0.996 0.420 1.00 62.25 H new ATOM 0 HB2 SER A 113 11.250 -0.476 -1.627 1.00 3.52 H new ATOM 0 HB3 SER A 113 12.280 0.924 -1.847 1.00 3.52 H new ATOM 0 HG SER A 113 12.906 -1.697 -2.108 1.00 44.54 H new ATOM 1798 N LYS A 114 10.151 -0.204 1.414 1.00 3.42 N ATOM 1799 CA LYS A 114 8.819 0.099 1.923 1.00 51.24 C ATOM 1800 C LYS A 114 8.811 1.428 2.671 1.00 22.14 C ATOM 1801 O LYS A 114 8.186 2.394 2.235 1.00 21.44 O ATOM 1802 CB LYS A 114 8.336 -1.021 2.847 1.00 62.14 C ATOM 1803 CG LYS A 114 7.076 -0.672 3.618 1.00 15.14 C ATOM 1804 CD LYS A 114 6.624 -1.824 4.499 1.00 32.22 C ATOM 1805 CE LYS A 114 7.117 -1.661 5.928 1.00 32.14 C ATOM 1806 NZ LYS A 114 6.487 -2.647 6.849 1.00 31.33 N ATOM 0 H LYS A 114 10.513 -1.114 1.699 1.00 3.42 H new ATOM 0 HA LYS A 114 8.142 0.177 1.072 1.00 51.24 H new ATOM 0 HB2 LYS A 114 8.152 -1.916 2.253 1.00 62.14 H new ATOM 0 HB3 LYS A 114 9.129 -1.264 3.554 1.00 62.14 H new ATOM 0 HG2 LYS A 114 7.258 0.209 4.234 1.00 15.14 H new ATOM 0 HG3 LYS A 114 6.281 -0.414 2.919 1.00 15.14 H new ATOM 0 HD2 LYS A 114 5.536 -1.882 4.493 1.00 32.22 H new ATOM 0 HD3 LYS A 114 6.996 -2.763 4.090 1.00 32.22 H new ATOM 0 HE2 LYS A 114 8.200 -1.781 5.954 1.00 32.14 H new ATOM 0 HE3 LYS A 114 6.899 -0.651 6.274 1.00 32.14 H new ATOM 0 HZ1 LYS A 114 6.850 -2.503 7.813 1.00 31.33 H new ATOM 0 HZ2 LYS A 114 5.455 -2.517 6.844 1.00 31.33 H new ATOM 0 HZ3 LYS A 114 6.716 -3.611 6.534 1.00 31.33 H new ATOM 1820 N ASN A 115 9.514 1.471 3.799 1.00 35.50 N ATOM 1821 CA ASN A 115 9.588 2.682 4.608 1.00 43.02 C ATOM 1822 C ASN A 115 10.049 3.870 3.767 1.00 65.40 C ATOM 1823 O ASN A 115 9.538 4.980 3.910 1.00 35.54 O ATOM 1824 CB ASN A 115 10.543 2.476 5.785 1.00 50.11 C ATOM 1825 CG ASN A 115 9.939 1.613 6.875 1.00 32.22 C ATOM 1826 OD1 ASN A 115 8.963 1.998 7.518 1.00 34.22 O ATOM 1827 ND2 ASN A 115 10.518 0.437 7.088 1.00 63.33 N ATOM 0 H ASN A 115 10.040 0.681 4.173 1.00 35.50 H new ATOM 0 HA ASN A 115 8.590 2.895 4.991 1.00 43.02 H new ATOM 0 HB2 ASN A 115 11.462 2.013 5.427 1.00 50.11 H new ATOM 0 HB3 ASN A 115 10.816 3.445 6.202 1.00 50.11 H new ATOM 0 HD21 ASN A 115 10.155 -0.187 7.808 1.00 63.33 H new ATOM 0 HD22 ASN A 115 11.326 0.158 6.531 1.00 63.33 H new ATOM 1834 N ARG A 116 11.018 3.627 2.891 1.00 64.24 N ATOM 1835 CA ARG A 116 11.548 4.676 2.027 1.00 22.51 C ATOM 1836 C ARG A 116 10.438 5.302 1.188 1.00 15.12 C ATOM 1837 O ARG A 116 10.252 6.519 1.193 1.00 1.15 O ATOM 1838 CB ARG A 116 12.637 4.112 1.112 1.00 31.23 C ATOM 1839 CG ARG A 116 12.934 4.988 -0.093 1.00 75.14 C ATOM 1840 CD ARG A 116 13.680 6.251 0.307 1.00 72.13 C ATOM 1841 NE ARG A 116 15.083 5.984 0.613 1.00 50.12 N ATOM 1842 CZ ARG A 116 16.021 6.924 0.637 1.00 72.15 C ATOM 1843 NH1 ARG A 116 15.708 8.186 0.375 1.00 64.44 N ATOM 1844 NH2 ARG A 116 17.276 6.603 0.924 1.00 2.24 N ATOM 0 H ARG A 116 11.452 2.713 2.760 1.00 64.24 H new ATOM 0 HA ARG A 116 11.981 5.449 2.661 1.00 22.51 H new ATOM 0 HB2 ARG A 116 13.552 3.980 1.689 1.00 31.23 H new ATOM 0 HB3 ARG A 116 12.333 3.124 0.766 1.00 31.23 H new ATOM 0 HG2 ARG A 116 13.527 4.427 -0.815 1.00 75.14 H new ATOM 0 HG3 ARG A 116 12.001 5.257 -0.588 1.00 75.14 H new ATOM 0 HD2 ARG A 116 13.618 6.980 -0.501 1.00 72.13 H new ATOM 0 HD3 ARG A 116 13.198 6.697 1.177 1.00 72.13 H new ATOM 0 HE ARG A 116 15.357 5.024 0.819 1.00 50.12 H new ATOM 0 HH11 ARG A 116 14.744 8.437 0.154 1.00 64.44 H new ATOM 0 HH12 ARG A 116 16.431 8.905 0.394 1.00 64.44 H new ATOM 0 HH21 ARG A 116 17.521 5.634 1.126 1.00 2.24 H new ATOM 0 HH22 ARG A 116 17.996 7.325 0.942 1.00 2.24 H new ATOM 1858 N LEU A 117 9.702 4.462 0.468 1.00 45.12 N ATOM 1859 CA LEU A 117 8.610 4.932 -0.378 1.00 3.25 C ATOM 1860 C LEU A 117 7.505 5.564 0.463 1.00 45.31 C ATOM 1861 O LEU A 117 7.166 6.733 0.283 1.00 0.23 O ATOM 1862 CB LEU A 117 8.043 3.776 -1.202 1.00 20.00 C ATOM 1863 CG LEU A 117 6.813 4.097 -2.051 1.00 12.10 C ATOM 1864 CD1 LEU A 117 7.229 4.639 -3.409 1.00 42.54 C ATOM 1865 CD2 LEU A 117 5.938 2.863 -2.213 1.00 70.11 C ATOM 0 H LEU A 117 9.842 3.452 0.453 1.00 45.12 H new ATOM 0 HA LEU A 117 9.006 5.690 -1.054 1.00 3.25 H new ATOM 0 HB2 LEU A 117 8.828 3.407 -1.861 1.00 20.00 H new ATOM 0 HB3 LEU A 117 7.789 2.963 -0.523 1.00 20.00 H new ATOM 0 HG LEU A 117 6.232 4.864 -1.538 1.00 12.10 H new ATOM 0 HD11 LEU A 117 6.340 4.862 -4.000 1.00 42.54 H new ATOM 0 HD12 LEU A 117 7.813 5.550 -3.274 1.00 42.54 H new ATOM 0 HD13 LEU A 117 7.833 3.895 -3.928 1.00 42.54 H new ATOM 0 HD21 LEU A 117 5.068 3.111 -2.820 1.00 70.11 H new ATOM 0 HD22 LEU A 117 6.509 2.074 -2.703 1.00 70.11 H new ATOM 0 HD23 LEU A 117 5.610 2.518 -1.232 1.00 70.11 H new ATOM 1877 N VAL A 118 6.947 4.782 1.382 1.00 5.34 N ATOM 1878 CA VAL A 118 5.883 5.266 2.253 1.00 63.04 C ATOM 1879 C VAL A 118 6.156 6.693 2.714 1.00 4.23 C ATOM 1880 O VAL A 118 5.296 7.567 2.601 1.00 62.42 O ATOM 1881 CB VAL A 118 5.714 4.362 3.489 1.00 44.25 C ATOM 1882 CG1 VAL A 118 4.645 4.918 4.416 1.00 10.12 C ATOM 1883 CG2 VAL A 118 5.379 2.940 3.066 1.00 70.30 C ATOM 0 H VAL A 118 7.214 3.811 1.542 1.00 5.34 H new ATOM 0 HA VAL A 118 4.963 5.246 1.669 1.00 63.04 H new ATOM 0 HB VAL A 118 6.657 4.342 4.035 1.00 44.25 H new ATOM 0 HG11 VAL A 118 4.540 4.266 5.283 1.00 10.12 H new ATOM 0 HG12 VAL A 118 4.933 5.916 4.746 1.00 10.12 H new ATOM 0 HG13 VAL A 118 3.695 4.971 3.885 1.00 10.12 H new ATOM 0 HG21 VAL A 118 5.263 2.315 3.951 1.00 70.30 H new ATOM 0 HG22 VAL A 118 4.449 2.939 2.497 1.00 70.30 H new ATOM 0 HG23 VAL A 118 6.184 2.546 2.446 1.00 70.30 H new ATOM 1893 N GLN A 119 7.357 6.921 3.234 1.00 42.31 N ATOM 1894 CA GLN A 119 7.744 8.244 3.713 1.00 35.03 C ATOM 1895 C GLN A 119 7.485 9.305 2.648 1.00 61.51 C ATOM 1896 O GLN A 119 6.965 10.382 2.942 1.00 32.30 O ATOM 1897 CB GLN A 119 9.220 8.254 4.113 1.00 14.33 C ATOM 1898 CG GLN A 119 9.450 8.010 5.596 1.00 63.43 C ATOM 1899 CD GLN A 119 10.290 9.094 6.242 1.00 33.53 C ATOM 1900 OE1 GLN A 119 9.763 10.001 6.888 1.00 64.13 O ATOM 1901 NE2 GLN A 119 11.603 9.006 6.072 1.00 63.21 N ATOM 0 H GLN A 119 8.079 6.208 3.335 1.00 42.31 H new ATOM 0 HA GLN A 119 7.137 8.478 4.588 1.00 35.03 H new ATOM 0 HB2 GLN A 119 9.748 7.491 3.541 1.00 14.33 H new ATOM 0 HB3 GLN A 119 9.656 9.215 3.840 1.00 14.33 H new ATOM 0 HG2 GLN A 119 8.488 7.950 6.104 1.00 63.43 H new ATOM 0 HG3 GLN A 119 9.942 7.046 5.730 1.00 63.43 H new ATOM 0 HE21 GLN A 119 11.997 8.237 5.529 1.00 63.21 H new ATOM 0 HE22 GLN A 119 12.219 9.707 6.484 1.00 63.21 H new ATOM 1910 N THR A 120 7.854 8.994 1.409 1.00 12.43 N ATOM 1911 CA THR A 120 7.664 9.922 0.301 1.00 72.55 C ATOM 1912 C THR A 120 6.191 10.275 0.125 1.00 62.14 C ATOM 1913 O THR A 120 5.841 11.439 -0.065 1.00 5.11 O ATOM 1914 CB THR A 120 8.200 9.336 -1.019 1.00 64.32 C ATOM 1915 OG1 THR A 120 9.529 8.837 -0.830 1.00 5.23 O ATOM 1916 CG2 THR A 120 8.201 10.388 -2.117 1.00 43.43 C ATOM 0 H THR A 120 8.286 8.107 1.148 1.00 12.43 H new ATOM 0 HA THR A 120 8.224 10.825 0.545 1.00 72.55 H new ATOM 0 HB THR A 120 7.544 8.519 -1.320 1.00 64.32 H new ATOM 0 HG1 THR A 120 9.490 7.957 -0.400 1.00 5.23 H new ATOM 0 HG21 THR A 120 8.584 9.951 -3.039 1.00 43.43 H new ATOM 0 HG22 THR A 120 7.184 10.745 -2.279 1.00 43.43 H new ATOM 0 HG23 THR A 120 8.836 11.223 -1.820 1.00 43.43 H new ATOM 1924 N ALA A 121 5.333 9.262 0.190 1.00 13.23 N ATOM 1925 CA ALA A 121 3.897 9.467 0.041 1.00 44.10 C ATOM 1926 C ALA A 121 3.338 10.289 1.197 1.00 50.31 C ATOM 1927 O ALA A 121 2.262 10.877 1.087 1.00 34.44 O ATOM 1928 CB ALA A 121 3.181 8.128 -0.053 1.00 13.12 C ATOM 0 H ALA A 121 5.607 8.292 0.345 1.00 13.23 H new ATOM 0 HA ALA A 121 3.727 10.023 -0.881 1.00 44.10 H new ATOM 0 HB1 ALA A 121 2.110 8.295 -0.164 1.00 13.12 H new ATOM 0 HB2 ALA A 121 3.553 7.576 -0.916 1.00 13.12 H new ATOM 0 HB3 ALA A 121 3.366 7.552 0.854 1.00 13.12 H new ATOM 1934 N GLU A 122 4.074 10.326 2.303 1.00 42.32 N ATOM 1935 CA GLU A 122 3.648 11.076 3.479 1.00 23.22 C ATOM 1936 C GLU A 122 2.465 10.394 4.160 1.00 14.30 C ATOM 1937 O GLU A 122 1.486 11.045 4.526 1.00 62.12 O ATOM 1938 CB GLU A 122 3.272 12.507 3.090 1.00 64.13 C ATOM 1939 CG GLU A 122 3.901 13.565 3.981 1.00 63.12 C ATOM 1940 CD GLU A 122 2.937 14.099 5.022 1.00 33.44 C ATOM 1941 OE1 GLU A 122 1.882 13.463 5.235 1.00 44.12 O ATOM 1942 OE2 GLU A 122 3.236 15.150 5.626 1.00 54.25 O ATOM 0 H GLU A 122 4.968 9.846 2.410 1.00 42.32 H new ATOM 0 HA GLU A 122 4.481 11.106 4.181 1.00 23.22 H new ATOM 0 HB2 GLU A 122 3.575 12.686 2.058 1.00 64.13 H new ATOM 0 HB3 GLU A 122 2.188 12.611 3.126 1.00 64.13 H new ATOM 0 HG2 GLU A 122 4.772 13.142 4.481 1.00 63.12 H new ATOM 0 HG3 GLU A 122 4.257 14.390 3.364 1.00 63.12 H new ATOM 1949 N LEU A 123 2.562 9.079 4.325 1.00 40.42 N ATOM 1950 CA LEU A 123 1.500 8.308 4.961 1.00 3.31 C ATOM 1951 C LEU A 123 1.854 7.985 6.410 1.00 63.34 C ATOM 1952 O LEU A 123 2.766 7.201 6.678 1.00 52.43 O ATOM 1953 CB LEU A 123 1.248 7.014 4.185 1.00 53.23 C ATOM 1954 CG LEU A 123 0.897 7.177 2.706 1.00 64.31 C ATOM 1955 CD1 LEU A 123 1.240 5.911 1.934 1.00 21.14 C ATOM 1956 CD2 LEU A 123 -0.575 7.521 2.540 1.00 1.51 C ATOM 0 H LEU A 123 3.365 8.525 4.027 1.00 40.42 H new ATOM 0 HA LEU A 123 0.592 8.911 4.954 1.00 3.31 H new ATOM 0 HB2 LEU A 123 2.138 6.390 4.260 1.00 53.23 H new ATOM 0 HB3 LEU A 123 0.437 6.473 4.673 1.00 53.23 H new ATOM 0 HG LEU A 123 1.488 7.998 2.301 1.00 64.31 H new ATOM 0 HD11 LEU A 123 0.984 6.045 0.883 1.00 21.14 H new ATOM 0 HD12 LEU A 123 2.307 5.708 2.024 1.00 21.14 H new ATOM 0 HD13 LEU A 123 0.675 5.072 2.341 1.00 21.14 H new ATOM 0 HD21 LEU A 123 -0.805 7.633 1.480 1.00 1.51 H new ATOM 0 HD22 LEU A 123 -1.185 6.722 2.961 1.00 1.51 H new ATOM 0 HD23 LEU A 123 -0.791 8.455 3.059 1.00 1.51 H new ATOM 1968 N THR A 124 1.126 8.592 7.341 1.00 53.35 N ATOM 1969 CA THR A 124 1.361 8.369 8.761 1.00 4.42 C ATOM 1970 C THR A 124 0.806 7.021 9.207 1.00 55.04 C ATOM 1971 O THR A 124 1.101 6.547 10.303 1.00 23.23 O ATOM 1972 CB THR A 124 0.727 9.481 9.618 1.00 40.12 C ATOM 1973 OG1 THR A 124 1.007 9.252 11.004 1.00 42.54 O ATOM 1974 CG2 THR A 124 -0.777 9.538 9.403 1.00 52.41 C ATOM 0 H THR A 124 0.368 9.243 7.136 1.00 53.35 H new ATOM 0 HA THR A 124 2.441 8.380 8.906 1.00 4.42 H new ATOM 0 HB THR A 124 1.159 10.434 9.313 1.00 40.12 H new ATOM 0 HG1 THR A 124 1.052 8.288 11.174 1.00 42.54 H new ATOM 0 HG21 THR A 124 -1.203 10.331 10.018 1.00 52.41 H new ATOM 0 HG22 THR A 124 -0.987 9.742 8.353 1.00 52.41 H new ATOM 0 HG23 THR A 124 -1.221 8.583 9.683 1.00 52.41 H new ATOM 1982 N LYS A 125 -0.002 6.407 8.348 1.00 64.03 N ATOM 1983 CA LYS A 125 -0.599 5.112 8.651 1.00 71.15 C ATOM 1984 C LYS A 125 -0.018 4.023 7.755 1.00 61.15 C ATOM 1985 O LYS A 125 -0.054 4.127 6.529 1.00 54.43 O ATOM 1986 CB LYS A 125 -2.118 5.173 8.475 1.00 10.44 C ATOM 1987 CG LYS A 125 -2.760 6.368 9.160 1.00 64.51 C ATOM 1988 CD LYS A 125 -4.244 6.142 9.396 1.00 13.33 C ATOM 1989 CE LYS A 125 -5.063 7.360 8.998 1.00 41.45 C ATOM 1990 NZ LYS A 125 -5.667 8.033 10.181 1.00 55.31 N ATOM 0 H LYS A 125 -0.258 6.786 7.436 1.00 64.03 H new ATOM 0 HA LYS A 125 -0.369 4.868 9.688 1.00 71.15 H new ATOM 0 HB2 LYS A 125 -2.351 5.206 7.411 1.00 10.44 H new ATOM 0 HB3 LYS A 125 -2.559 4.258 8.870 1.00 10.44 H new ATOM 0 HG2 LYS A 125 -2.263 6.554 10.112 1.00 64.51 H new ATOM 0 HG3 LYS A 125 -2.619 7.259 8.548 1.00 64.51 H new ATOM 0 HD2 LYS A 125 -4.577 5.276 8.824 1.00 13.33 H new ATOM 0 HD3 LYS A 125 -4.416 5.915 10.448 1.00 13.33 H new ATOM 0 HE2 LYS A 125 -4.427 8.066 8.464 1.00 41.45 H new ATOM 0 HE3 LYS A 125 -5.852 7.058 8.310 1.00 41.45 H new ATOM 0 HZ1 LYS A 125 -6.217 8.858 9.868 1.00 55.31 H new ATOM 0 HZ2 LYS A 125 -6.293 7.367 10.677 1.00 55.31 H new ATOM 0 HZ3 LYS A 125 -4.913 8.344 10.826 1.00 55.31 H new ATOM 2004 N VAL A 126 0.518 2.976 8.375 1.00 32.30 N ATOM 2005 CA VAL A 126 1.104 1.865 7.634 1.00 10.33 C ATOM 2006 C VAL A 126 0.651 0.525 8.202 1.00 53.23 C ATOM 2007 O VAL A 126 0.676 0.311 9.414 1.00 2.51 O ATOM 2008 CB VAL A 126 2.643 1.926 7.659 1.00 64.41 C ATOM 2009 CG1 VAL A 126 3.230 1.034 6.575 1.00 74.14 C ATOM 2010 CG2 VAL A 126 3.123 3.361 7.496 1.00 32.33 C ATOM 0 H VAL A 126 0.558 2.874 9.389 1.00 32.30 H new ATOM 0 HA VAL A 126 0.759 1.954 6.604 1.00 10.33 H new ATOM 0 HB VAL A 126 2.988 1.559 8.626 1.00 64.41 H new ATOM 0 HG11 VAL A 126 4.318 1.090 6.608 1.00 74.14 H new ATOM 0 HG12 VAL A 126 2.914 0.004 6.741 1.00 74.14 H new ATOM 0 HG13 VAL A 126 2.879 1.368 5.599 1.00 74.14 H new ATOM 0 HG21 VAL A 126 4.213 3.385 7.516 1.00 32.33 H new ATOM 0 HG22 VAL A 126 2.769 3.757 6.544 1.00 32.33 H new ATOM 0 HG23 VAL A 126 2.732 3.970 8.311 1.00 32.33 H new ATOM 2020 N PHE A 127 0.235 -0.375 7.317 1.00 14.21 N ATOM 2021 CA PHE A 127 -0.226 -1.696 7.729 1.00 41.33 C ATOM 2022 C PHE A 127 0.433 -2.788 6.891 1.00 3.22 C ATOM 2023 O PHE A 127 0.620 -2.631 5.685 1.00 15.14 O ATOM 2024 CB PHE A 127 -1.748 -1.791 7.603 1.00 10.35 C ATOM 2025 CG PHE A 127 -2.478 -0.703 8.338 1.00 54.24 C ATOM 2026 CD1 PHE A 127 -2.062 -0.297 9.595 1.00 21.24 C ATOM 2027 CD2 PHE A 127 -3.582 -0.086 7.770 1.00 22.02 C ATOM 2028 CE1 PHE A 127 -2.732 0.704 10.274 1.00 2.21 C ATOM 2029 CE2 PHE A 127 -4.255 0.915 8.443 1.00 52.52 C ATOM 2030 CZ PHE A 127 -3.831 1.310 9.697 1.00 4.22 C ATOM 0 H PHE A 127 0.208 -0.214 6.310 1.00 14.21 H new ATOM 0 HA PHE A 127 0.056 -1.842 8.772 1.00 41.33 H new ATOM 0 HB2 PHE A 127 -2.021 -1.753 6.548 1.00 10.35 H new ATOM 0 HB3 PHE A 127 -2.077 -2.759 7.982 1.00 10.35 H new ATOM 0 HD1 PHE A 127 -1.204 -0.768 10.051 1.00 21.24 H new ATOM 0 HD2 PHE A 127 -3.919 -0.391 6.791 1.00 22.02 H new ATOM 0 HE1 PHE A 127 -2.397 1.011 11.254 1.00 2.21 H new ATOM 0 HE2 PHE A 127 -5.113 1.389 7.989 1.00 52.52 H new ATOM 0 HZ PHE A 127 -4.358 2.091 10.225 1.00 4.22 H new ATOM 2040 N GLU A 128 0.784 -3.893 7.541 1.00 41.41 N ATOM 2041 CA GLU A 128 1.424 -5.010 6.857 1.00 64.13 C ATOM 2042 C GLU A 128 0.525 -6.243 6.869 1.00 34.22 C ATOM 2043 O GLU A 128 0.106 -6.708 7.930 1.00 71.32 O ATOM 2044 CB GLU A 128 2.767 -5.339 7.513 1.00 54.31 C ATOM 2045 CG GLU A 128 3.679 -6.186 6.643 1.00 53.14 C ATOM 2046 CD GLU A 128 4.403 -7.260 7.431 1.00 73.52 C ATOM 2047 OE1 GLU A 128 4.868 -6.964 8.551 1.00 71.33 O ATOM 2048 OE2 GLU A 128 4.505 -8.398 6.926 1.00 61.50 O ATOM 0 H GLU A 128 0.636 -4.038 8.540 1.00 41.41 H new ATOM 0 HA GLU A 128 1.596 -4.716 5.821 1.00 64.13 H new ATOM 0 HB2 GLU A 128 3.278 -4.409 7.762 1.00 54.31 H new ATOM 0 HB3 GLU A 128 2.585 -5.863 8.451 1.00 54.31 H new ATOM 0 HG2 GLU A 128 3.091 -6.654 5.854 1.00 53.14 H new ATOM 0 HG3 GLU A 128 4.411 -5.542 6.156 1.00 53.14 H new ATOM 2055 N ILE A 129 0.231 -6.766 5.683 1.00 45.40 N ATOM 2056 CA ILE A 129 -0.617 -7.945 5.558 1.00 42.23 C ATOM 2057 C ILE A 129 0.192 -9.161 5.118 1.00 0.44 C ATOM 2058 O ILE A 129 0.924 -9.107 4.130 1.00 5.41 O ATOM 2059 CB ILE A 129 -1.759 -7.711 4.551 1.00 73.01 C ATOM 2060 CG1 ILE A 129 -1.248 -6.928 3.339 1.00 71.11 C ATOM 2061 CG2 ILE A 129 -2.910 -6.972 5.218 1.00 11.10 C ATOM 2062 CD1 ILE A 129 -2.165 -7.008 2.138 1.00 21.12 C ATOM 0 H ILE A 129 0.567 -6.392 4.796 1.00 45.40 H new ATOM 0 HA ILE A 129 -1.044 -8.133 6.543 1.00 42.23 H new ATOM 0 HB ILE A 129 -2.124 -8.679 4.207 1.00 73.01 H new ATOM 0 HG12 ILE A 129 -1.120 -5.882 3.620 1.00 71.11 H new ATOM 0 HG13 ILE A 129 -0.264 -7.306 3.061 1.00 71.11 H new ATOM 0 HG21 ILE A 129 -3.709 -6.814 4.494 1.00 11.10 H new ATOM 0 HG22 ILE A 129 -3.288 -7.564 6.052 1.00 11.10 H new ATOM 0 HG23 ILE A 129 -2.559 -6.008 5.587 1.00 11.10 H new ATOM 0 HD11 ILE A 129 -1.740 -6.430 1.317 1.00 21.12 H new ATOM 0 HD12 ILE A 129 -2.273 -8.048 1.832 1.00 21.12 H new ATOM 0 HD13 ILE A 129 -3.143 -6.603 2.399 1.00 21.12 H new ATOM 2074 N ARG A 130 0.052 -10.255 5.857 1.00 24.34 N ATOM 2075 CA ARG A 130 0.770 -11.485 5.544 1.00 32.21 C ATOM 2076 C ARG A 130 0.106 -12.221 4.383 1.00 32.33 C ATOM 2077 O ARG A 130 0.656 -13.184 3.848 1.00 34.41 O ATOM 2078 CB ARG A 130 0.826 -12.395 6.772 1.00 1.21 C ATOM 2079 CG ARG A 130 1.886 -13.481 6.677 1.00 1.44 C ATOM 2080 CD ARG A 130 3.265 -12.946 7.026 1.00 2.45 C ATOM 2081 NE ARG A 130 3.432 -12.760 8.466 1.00 65.43 N ATOM 2082 CZ ARG A 130 3.796 -13.733 9.295 1.00 75.14 C ATOM 2083 NH1 ARG A 130 4.027 -14.953 8.829 1.00 2.44 N ATOM 2084 NH2 ARG A 130 3.926 -13.488 10.592 1.00 50.22 N ATOM 0 H ARG A 130 -0.552 -10.316 6.677 1.00 24.34 H new ATOM 0 HA ARG A 130 1.786 -11.219 5.251 1.00 32.21 H new ATOM 0 HB2 ARG A 130 1.019 -11.787 7.656 1.00 1.21 H new ATOM 0 HB3 ARG A 130 -0.149 -12.862 6.913 1.00 1.21 H new ATOM 0 HG2 ARG A 130 1.631 -14.299 7.350 1.00 1.44 H new ATOM 0 HG3 ARG A 130 1.899 -13.891 5.667 1.00 1.44 H new ATOM 0 HD2 ARG A 130 4.025 -13.636 6.659 1.00 2.45 H new ATOM 0 HD3 ARG A 130 3.425 -11.996 6.517 1.00 2.45 H new ATOM 0 HE ARG A 130 3.260 -11.833 8.856 1.00 65.43 H new ATOM 0 HH11 ARG A 130 3.925 -15.146 7.833 1.00 2.44 H new ATOM 0 HH12 ARG A 130 4.306 -15.698 9.467 1.00 2.44 H new ATOM 0 HH21 ARG A 130 3.747 -12.552 10.955 1.00 50.22 H new ATOM 0 HH22 ARG A 130 4.205 -14.236 11.227 1.00 50.22 H new ATOM 2098 N THR A 131 -1.081 -11.761 3.998 1.00 4.50 N ATOM 2099 CA THR A 131 -1.821 -12.375 2.904 1.00 45.04 C ATOM 2100 C THR A 131 -3.013 -11.517 2.496 1.00 21.54 C ATOM 2101 O THR A 131 -3.610 -10.831 3.326 1.00 34.32 O ATOM 2102 CB THR A 131 -2.320 -13.783 3.282 1.00 11.44 C ATOM 2103 OG1 THR A 131 -3.289 -14.232 2.329 1.00 52.42 O ATOM 2104 CG2 THR A 131 -2.933 -13.783 4.675 1.00 43.43 C ATOM 0 H THR A 131 -1.550 -10.964 4.429 1.00 4.50 H new ATOM 0 HA THR A 131 -1.132 -12.457 2.064 1.00 45.04 H new ATOM 0 HB THR A 131 -1.466 -14.461 3.277 1.00 11.44 H new ATOM 0 HG1 THR A 131 -3.600 -15.128 2.576 1.00 52.42 H new ATOM 0 HG21 THR A 131 -3.278 -14.787 4.921 1.00 43.43 H new ATOM 0 HG22 THR A 131 -2.184 -13.469 5.402 1.00 43.43 H new ATOM 0 HG23 THR A 131 -3.776 -13.093 4.701 1.00 43.43 H new ATOM 2112 N THR A 132 -3.357 -11.561 1.212 1.00 35.35 N ATOM 2113 CA THR A 132 -4.479 -10.788 0.696 1.00 73.22 C ATOM 2114 C THR A 132 -5.733 -11.012 1.532 1.00 72.51 C ATOM 2115 O THR A 132 -6.489 -10.077 1.798 1.00 4.40 O ATOM 2116 CB THR A 132 -4.782 -11.151 -0.771 1.00 12.22 C ATOM 2117 OG1 THR A 132 -5.013 -12.559 -0.890 1.00 11.43 O ATOM 2118 CG2 THR A 132 -3.632 -10.741 -1.678 1.00 32.43 C ATOM 0 H THR A 132 -2.874 -12.124 0.511 1.00 35.35 H new ATOM 0 HA THR A 132 -4.192 -9.738 0.752 1.00 73.22 H new ATOM 0 HB THR A 132 -5.677 -10.610 -1.079 1.00 12.22 H new ATOM 0 HG1 THR A 132 -5.206 -12.781 -1.825 1.00 11.43 H new ATOM 0 HG21 THR A 132 -3.868 -11.007 -2.708 1.00 32.43 H new ATOM 0 HG22 THR A 132 -3.479 -9.664 -1.607 1.00 32.43 H new ATOM 0 HG23 THR A 132 -2.723 -11.258 -1.369 1.00 32.43 H new ATOM 2126 N ASP A 133 -5.949 -12.257 1.944 1.00 14.22 N ATOM 2127 CA ASP A 133 -7.112 -12.602 2.754 1.00 74.25 C ATOM 2128 C ASP A 133 -7.292 -11.611 3.899 1.00 73.55 C ATOM 2129 O ASP A 133 -8.416 -11.287 4.282 1.00 74.23 O ATOM 2130 CB ASP A 133 -6.971 -14.021 3.306 1.00 32.33 C ATOM 2131 CG ASP A 133 -7.716 -15.045 2.472 1.00 11.05 C ATOM 2132 OD1 ASP A 133 -7.548 -15.038 1.235 1.00 64.23 O ATOM 2133 OD2 ASP A 133 -8.467 -15.854 3.057 1.00 1.42 O ATOM 0 H ASP A 133 -5.335 -13.043 1.731 1.00 14.22 H new ATOM 0 HA ASP A 133 -7.995 -12.554 2.117 1.00 74.25 H new ATOM 0 HB2 ASP A 133 -5.915 -14.289 3.346 1.00 32.33 H new ATOM 0 HB3 ASP A 133 -7.346 -14.048 4.329 1.00 32.33 H new ATOM 2138 N ASP A 134 -6.178 -11.135 4.443 1.00 62.42 N ATOM 2139 CA ASP A 134 -6.211 -10.182 5.545 1.00 15.14 C ATOM 2140 C ASP A 134 -6.951 -8.911 5.142 1.00 54.03 C ATOM 2141 O ASP A 134 -7.719 -8.351 5.925 1.00 50.11 O ATOM 2142 CB ASP A 134 -4.791 -9.839 5.995 1.00 64.24 C ATOM 2143 CG ASP A 134 -4.597 -10.015 7.489 1.00 55.54 C ATOM 2144 OD1 ASP A 134 -4.436 -11.171 7.934 1.00 63.13 O ATOM 2145 OD2 ASP A 134 -4.606 -8.997 8.212 1.00 73.24 O ATOM 0 H ASP A 134 -5.240 -11.394 4.138 1.00 62.42 H new ATOM 0 HA ASP A 134 -6.745 -10.644 6.376 1.00 15.14 H new ATOM 0 HB2 ASP A 134 -4.082 -10.473 5.463 1.00 64.24 H new ATOM 0 HB3 ASP A 134 -4.566 -8.808 5.721 1.00 64.24 H new ATOM 2150 N LEU A 135 -6.715 -8.459 3.914 1.00 4.15 N ATOM 2151 CA LEU A 135 -7.358 -7.253 3.406 1.00 0.14 C ATOM 2152 C LEU A 135 -8.864 -7.453 3.272 1.00 25.03 C ATOM 2153 O LEU A 135 -9.355 -7.877 2.225 1.00 65.20 O ATOM 2154 CB LEU A 135 -6.761 -6.865 2.052 1.00 52.10 C ATOM 2155 CG LEU A 135 -7.552 -5.840 1.239 1.00 42.22 C ATOM 2156 CD1 LEU A 135 -8.027 -4.702 2.130 1.00 20.43 C ATOM 2157 CD2 LEU A 135 -6.709 -5.304 0.091 1.00 45.14 C ATOM 0 H LEU A 135 -6.083 -8.910 3.253 1.00 4.15 H new ATOM 0 HA LEU A 135 -7.180 -6.448 4.119 1.00 0.14 H new ATOM 0 HB2 LEU A 135 -5.758 -6.471 2.219 1.00 52.10 H new ATOM 0 HB3 LEU A 135 -6.653 -7.769 1.453 1.00 52.10 H new ATOM 0 HG LEU A 135 -8.428 -6.336 0.820 1.00 42.22 H new ATOM 0 HD11 LEU A 135 -8.588 -3.983 1.533 1.00 20.43 H new ATOM 0 HD12 LEU A 135 -8.668 -5.099 2.917 1.00 20.43 H new ATOM 0 HD13 LEU A 135 -7.166 -4.208 2.579 1.00 20.43 H new ATOM 0 HD21 LEU A 135 -7.288 -4.576 -0.477 1.00 45.14 H new ATOM 0 HD22 LEU A 135 -5.814 -4.825 0.489 1.00 45.14 H new ATOM 0 HD23 LEU A 135 -6.420 -6.127 -0.563 1.00 45.14 H new ATOM 2169 N THR A 136 -9.594 -7.144 4.339 1.00 71.33 N ATOM 2170 CA THR A 136 -11.044 -7.290 4.340 1.00 11.15 C ATOM 2171 C THR A 136 -11.722 -6.038 4.886 1.00 71.22 C ATOM 2172 O THR A 136 -11.162 -5.335 5.726 1.00 1.14 O ATOM 2173 CB THR A 136 -11.487 -8.504 5.178 1.00 63.50 C ATOM 2174 OG1 THR A 136 -10.665 -8.620 6.346 1.00 70.35 O ATOM 2175 CG2 THR A 136 -11.399 -9.785 4.362 1.00 64.34 C ATOM 0 H THR A 136 -9.205 -6.791 5.213 1.00 71.33 H new ATOM 0 HA THR A 136 -11.346 -7.443 3.304 1.00 11.15 H new ATOM 0 HB THR A 136 -12.524 -8.352 5.477 1.00 63.50 H new ATOM 0 HG1 THR A 136 -10.954 -9.393 6.874 1.00 70.35 H new ATOM 0 HG21 THR A 136 -11.717 -10.629 4.974 1.00 64.34 H new ATOM 0 HG22 THR A 136 -12.047 -9.706 3.489 1.00 64.34 H new ATOM 0 HG23 THR A 136 -10.370 -9.939 4.037 1.00 64.34 H new ATOM 2183 N GLU A 137 -12.930 -5.766 4.402 1.00 51.00 N ATOM 2184 CA GLU A 137 -13.683 -4.597 4.842 1.00 12.33 C ATOM 2185 C GLU A 137 -13.512 -4.373 6.342 1.00 33.42 C ATOM 2186 O GLU A 137 -13.386 -3.238 6.802 1.00 63.21 O ATOM 2187 CB GLU A 137 -15.167 -4.763 4.506 1.00 2.21 C ATOM 2188 CG GLU A 137 -16.001 -3.530 4.811 1.00 30.13 C ATOM 2189 CD GLU A 137 -17.400 -3.875 5.283 1.00 22.23 C ATOM 2190 OE1 GLU A 137 -17.526 -4.662 6.244 1.00 2.24 O ATOM 2191 OE2 GLU A 137 -18.370 -3.357 4.690 1.00 24.14 O ATOM 0 H GLU A 137 -13.408 -6.338 3.706 1.00 51.00 H new ATOM 0 HA GLU A 137 -13.294 -3.726 4.315 1.00 12.33 H new ATOM 0 HB2 GLU A 137 -15.266 -5.006 3.448 1.00 2.21 H new ATOM 0 HB3 GLU A 137 -15.566 -5.609 5.066 1.00 2.21 H new ATOM 0 HG2 GLU A 137 -15.500 -2.937 5.576 1.00 30.13 H new ATOM 0 HG3 GLU A 137 -16.066 -2.909 3.917 1.00 30.13 H new ATOM 2198 N THR A 138 -13.510 -5.464 7.101 1.00 62.54 N ATOM 2199 CA THR A 138 -13.356 -5.389 8.549 1.00 72.14 C ATOM 2200 C THR A 138 -11.906 -5.124 8.935 1.00 1.30 C ATOM 2201 O THR A 138 -11.584 -4.074 9.491 1.00 62.21 O ATOM 2202 CB THR A 138 -13.828 -6.686 9.232 1.00 33.32 C ATOM 2203 OG1 THR A 138 -15.083 -7.102 8.680 1.00 1.54 O ATOM 2204 CG2 THR A 138 -13.971 -6.486 10.733 1.00 64.22 C ATOM 0 H THR A 138 -13.613 -6.411 6.737 1.00 62.54 H new ATOM 0 HA THR A 138 -13.977 -4.561 8.890 1.00 72.14 H new ATOM 0 HB THR A 138 -13.079 -7.458 9.054 1.00 33.32 H new ATOM 0 HG1 THR A 138 -15.375 -7.928 9.118 1.00 1.54 H new ATOM 0 HG21 THR A 138 -14.305 -7.416 11.194 1.00 64.22 H new ATOM 0 HG22 THR A 138 -13.008 -6.198 11.155 1.00 64.22 H new ATOM 0 HG23 THR A 138 -14.702 -5.701 10.927 1.00 64.22 H new ATOM 2212 N TRP A 139 -11.035 -6.080 8.636 1.00 64.34 N ATOM 2213 CA TRP A 139 -9.617 -5.949 8.952 1.00 72.21 C ATOM 2214 C TRP A 139 -9.107 -4.556 8.600 1.00 14.20 C ATOM 2215 O TRP A 139 -8.114 -4.087 9.158 1.00 74.55 O ATOM 2216 CB TRP A 139 -8.805 -7.007 8.200 1.00 15.34 C ATOM 2217 CG TRP A 139 -7.354 -6.659 8.069 1.00 53.40 C ATOM 2218 CD1 TRP A 139 -6.318 -7.175 8.795 1.00 35.51 C ATOM 2219 CD2 TRP A 139 -6.778 -5.716 7.158 1.00 4.13 C ATOM 2220 NE1 TRP A 139 -5.133 -6.610 8.390 1.00 71.21 N ATOM 2221 CE2 TRP A 139 -5.388 -5.713 7.387 1.00 22.12 C ATOM 2222 CE3 TRP A 139 -7.300 -4.877 6.171 1.00 4.35 C ATOM 2223 CZ2 TRP A 139 -4.516 -4.902 6.664 1.00 13.33 C ATOM 2224 CZ3 TRP A 139 -6.435 -4.072 5.456 1.00 44.13 C ATOM 2225 CH2 TRP A 139 -5.056 -4.090 5.704 1.00 43.33 C ATOM 0 H TRP A 139 -11.285 -6.955 8.175 1.00 64.34 H new ATOM 0 HA TRP A 139 -9.494 -6.101 10.024 1.00 72.21 H new ATOM 0 HB2 TRP A 139 -8.897 -7.961 8.718 1.00 15.34 H new ATOM 0 HB3 TRP A 139 -9.230 -7.142 7.205 1.00 15.34 H new ATOM 0 HD1 TRP A 139 -6.416 -7.918 9.573 1.00 35.51 H new ATOM 0 HE1 TRP A 139 -4.213 -6.824 8.774 1.00 71.21 H new ATOM 0 HE3 TRP A 139 -8.361 -4.858 5.970 1.00 4.35 H new ATOM 0 HZ2 TRP A 139 -3.453 -4.914 6.854 1.00 13.33 H new ATOM 0 HZ3 TRP A 139 -6.828 -3.417 4.692 1.00 44.13 H new ATOM 0 HH2 TRP A 139 -4.406 -3.450 5.126 1.00 43.33 H new ATOM 2236 N LEU A 140 -9.794 -3.897 7.672 1.00 20.03 N ATOM 2237 CA LEU A 140 -9.410 -2.555 7.247 1.00 13.33 C ATOM 2238 C LEU A 140 -10.026 -1.498 8.158 1.00 34.03 C ATOM 2239 O LEU A 140 -9.315 -0.710 8.783 1.00 71.13 O ATOM 2240 CB LEU A 140 -9.846 -2.314 5.801 1.00 43.04 C ATOM 2241 CG LEU A 140 -9.825 -0.860 5.327 1.00 44.21 C ATOM 2242 CD1 LEU A 140 -11.110 -0.151 5.722 1.00 33.24 C ATOM 2243 CD2 LEU A 140 -8.616 -0.132 5.894 1.00 24.23 C ATOM 0 H LEU A 140 -10.618 -4.270 7.201 1.00 20.03 H new ATOM 0 HA LEU A 140 -8.325 -2.476 7.312 1.00 13.33 H new ATOM 0 HB2 LEU A 140 -9.200 -2.898 5.146 1.00 43.04 H new ATOM 0 HB3 LEU A 140 -10.858 -2.701 5.678 1.00 43.04 H new ATOM 0 HG LEU A 140 -9.751 -0.854 4.240 1.00 44.21 H new ATOM 0 HD11 LEU A 140 -11.077 0.882 5.376 1.00 33.24 H new ATOM 0 HD12 LEU A 140 -11.960 -0.659 5.267 1.00 33.24 H new ATOM 0 HD13 LEU A 140 -11.216 -0.167 6.807 1.00 33.24 H new ATOM 0 HD21 LEU A 140 -8.617 0.901 5.546 1.00 24.23 H new ATOM 0 HD22 LEU A 140 -8.659 -0.148 6.983 1.00 24.23 H new ATOM 0 HD23 LEU A 140 -7.704 -0.626 5.560 1.00 24.23 H new ATOM 2255 N LYS A 141 -11.352 -1.487 8.232 1.00 73.41 N ATOM 2256 CA LYS A 141 -12.065 -0.530 9.069 1.00 32.42 C ATOM 2257 C LYS A 141 -11.676 -0.693 10.534 1.00 21.34 C ATOM 2258 O LYS A 141 -11.892 0.205 11.348 1.00 75.15 O ATOM 2259 CB LYS A 141 -13.577 -0.708 8.910 1.00 73.14 C ATOM 2260 CG LYS A 141 -14.193 0.221 7.877 1.00 15.44 C ATOM 2261 CD LYS A 141 -15.381 -0.426 7.184 1.00 3.13 C ATOM 2262 CE LYS A 141 -16.697 0.016 7.805 1.00 32.12 C ATOM 2263 NZ LYS A 141 -17.105 -0.872 8.929 1.00 13.32 N ATOM 0 H LYS A 141 -11.956 -2.131 7.721 1.00 73.41 H new ATOM 0 HA LYS A 141 -11.787 0.473 8.746 1.00 32.42 H new ATOM 0 HB2 LYS A 141 -13.785 -1.740 8.628 1.00 73.14 H new ATOM 0 HB3 LYS A 141 -14.058 -0.537 9.873 1.00 73.14 H new ATOM 0 HG2 LYS A 141 -14.511 1.145 8.361 1.00 15.44 H new ATOM 0 HG3 LYS A 141 -13.441 0.492 7.136 1.00 15.44 H new ATOM 0 HD2 LYS A 141 -15.372 -0.166 6.125 1.00 3.13 H new ATOM 0 HD3 LYS A 141 -15.294 -1.511 7.247 1.00 3.13 H new ATOM 0 HE2 LYS A 141 -16.602 1.040 8.167 1.00 32.12 H new ATOM 0 HE3 LYS A 141 -17.476 0.018 7.043 1.00 32.12 H new ATOM 0 HZ1 LYS A 141 -18.006 -0.538 9.326 1.00 13.32 H new ATOM 0 HZ2 LYS A 141 -17.220 -1.845 8.579 1.00 13.32 H new ATOM 0 HZ3 LYS A 141 -16.374 -0.855 9.668 1.00 13.32 H new ATOM 2277 N GLU A 142 -11.098 -1.845 10.865 1.00 54.45 N ATOM 2278 CA GLU A 142 -10.678 -2.123 12.232 1.00 32.01 C ATOM 2279 C GLU A 142 -9.442 -1.308 12.599 1.00 3.13 C ATOM 2280 O GLU A 142 -9.386 -0.685 13.660 1.00 54.45 O ATOM 2281 CB GLU A 142 -10.388 -3.616 12.407 1.00 51.54 C ATOM 2282 CG GLU A 142 -11.614 -4.436 12.769 1.00 3.15 C ATOM 2283 CD GLU A 142 -11.297 -5.563 13.733 1.00 35.11 C ATOM 2284 OE1 GLU A 142 -10.871 -6.640 13.266 1.00 3.23 O ATOM 2285 OE2 GLU A 142 -11.476 -5.369 14.954 1.00 65.55 O ATOM 0 H GLU A 142 -10.911 -2.599 10.204 1.00 54.45 H new ATOM 0 HA GLU A 142 -11.491 -1.837 12.899 1.00 32.01 H new ATOM 0 HB2 GLU A 142 -9.961 -4.005 11.483 1.00 51.54 H new ATOM 0 HB3 GLU A 142 -9.634 -3.742 13.184 1.00 51.54 H new ATOM 0 HG2 GLU A 142 -12.365 -3.783 13.213 1.00 3.15 H new ATOM 0 HG3 GLU A 142 -12.050 -4.852 11.861 1.00 3.15 H new ATOM 2292 N LYS A 143 -8.450 -1.317 11.715 1.00 41.24 N ATOM 2293 CA LYS A 143 -7.214 -0.579 11.941 1.00 25.14 C ATOM 2294 C LYS A 143 -7.484 0.920 12.033 1.00 2.12 C ATOM 2295 O LYS A 143 -6.815 1.637 12.779 1.00 75.01 O ATOM 2296 CB LYS A 143 -6.213 -0.860 10.818 1.00 40.31 C ATOM 2297 CG LYS A 143 -5.901 -2.335 10.637 1.00 71.54 C ATOM 2298 CD LYS A 143 -4.531 -2.687 11.189 1.00 10.03 C ATOM 2299 CE LYS A 143 -3.827 -3.719 10.320 1.00 43.35 C ATOM 2300 NZ LYS A 143 -2.382 -3.836 10.659 1.00 60.41 N ATOM 0 H LYS A 143 -8.479 -1.829 10.833 1.00 41.24 H new ATOM 0 HA LYS A 143 -6.790 -0.913 12.888 1.00 25.14 H new ATOM 0 HB2 LYS A 143 -6.608 -0.463 9.883 1.00 40.31 H new ATOM 0 HB3 LYS A 143 -5.287 -0.324 11.026 1.00 40.31 H new ATOM 0 HG2 LYS A 143 -6.661 -2.933 11.140 1.00 71.54 H new ATOM 0 HG3 LYS A 143 -5.944 -2.590 9.578 1.00 71.54 H new ATOM 0 HD2 LYS A 143 -3.921 -1.786 11.252 1.00 10.03 H new ATOM 0 HD3 LYS A 143 -4.635 -3.074 12.203 1.00 10.03 H new ATOM 0 HE2 LYS A 143 -4.309 -4.689 10.445 1.00 43.35 H new ATOM 0 HE3 LYS A 143 -3.933 -3.443 9.271 1.00 43.35 H new ATOM 0 HZ1 LYS A 143 -1.938 -4.549 10.045 1.00 60.41 H new ATOM 0 HZ2 LYS A 143 -1.916 -2.917 10.516 1.00 60.41 H new ATOM 0 HZ3 LYS A 143 -2.281 -4.124 11.653 1.00 60.41 H new ATOM 2314 N LEU A 144 -8.468 1.387 11.272 1.00 64.34 N ATOM 2315 CA LEU A 144 -8.827 2.800 11.268 1.00 13.13 C ATOM 2316 C LEU A 144 -9.603 3.167 12.530 1.00 42.32 C ATOM 2317 O LEU A 144 -9.273 4.137 13.212 1.00 44.22 O ATOM 2318 CB LEU A 144 -9.660 3.131 10.029 1.00 4.41 C ATOM 2319 CG LEU A 144 -9.174 2.526 8.711 1.00 24.45 C ATOM 2320 CD1 LEU A 144 -10.223 2.699 7.625 1.00 11.35 C ATOM 2321 CD2 LEU A 144 -7.856 3.158 8.289 1.00 13.41 C ATOM 0 H LEU A 144 -9.031 0.807 10.650 1.00 64.34 H new ATOM 0 HA LEU A 144 -7.907 3.384 11.246 1.00 13.13 H new ATOM 0 HB2 LEU A 144 -10.683 2.797 10.204 1.00 4.41 H new ATOM 0 HB3 LEU A 144 -9.694 4.215 9.917 1.00 4.41 H new ATOM 0 HG LEU A 144 -9.011 1.459 8.861 1.00 24.45 H new ATOM 0 HD11 LEU A 144 -9.859 2.262 6.695 1.00 11.35 H new ATOM 0 HD12 LEU A 144 -11.143 2.198 7.925 1.00 11.35 H new ATOM 0 HD13 LEU A 144 -10.420 3.761 7.475 1.00 11.35 H new ATOM 0 HD21 LEU A 144 -7.525 2.716 7.349 1.00 13.41 H new ATOM 0 HD22 LEU A 144 -7.993 4.231 8.157 1.00 13.41 H new ATOM 0 HD23 LEU A 144 -7.105 2.980 9.058 1.00 13.41 H new ATOM 2333 N ALA A 145 -10.633 2.386 12.833 1.00 21.23 N ATOM 2334 CA ALA A 145 -11.452 2.626 14.014 1.00 14.14 C ATOM 2335 C ALA A 145 -10.585 2.931 15.232 1.00 70.13 C ATOM 2336 O ALA A 145 -10.655 4.021 15.799 1.00 70.42 O ATOM 2337 CB ALA A 145 -12.348 1.427 14.289 1.00 32.11 C ATOM 0 H ALA A 145 -10.921 1.581 12.277 1.00 21.23 H new ATOM 0 HA ALA A 145 -12.078 3.497 13.819 1.00 14.14 H new ATOM 0 HB1 ALA A 145 -12.954 1.621 15.174 1.00 32.11 H new ATOM 0 HB2 ALA A 145 -13.001 1.256 13.433 1.00 32.11 H new ATOM 0 HB3 ALA A 145 -11.732 0.544 14.457 1.00 32.11 H new