USER MOD reduce.3.24.130724 H: found=0, std=0, add=1344, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1346 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 10 LYS NZ :NH3+ -155:sc= 0.332 (180deg=-3.39!) USER MOD Set 1.2: B 71 TYR OH : rot 58:sc= 1.16 USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 THR OG1 : rot -84:sc= 0.0782 USER MOD Single : A 9 ASN : amide:sc= 0 X(o=0,f=-0.035) USER MOD Single : A 15 LYS NZ :NH3+ 152:sc= 1.23 (180deg=1.16) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot 86:sc= 1.22 USER MOD Single : A 25 LYS NZ :NH3+ -166:sc= -0.035 (180deg=-0.22) USER MOD Single : A 26 LYS NZ :NH3+ 170:sc= 1.16 (180deg=0.928) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot 73:sc= 0.41 USER MOD Single : A 39 ASN : amide:sc= 1.07 K(o=1.1,f=-1.2!) USER MOD Single : A 42 SER OG : rot 83:sc= 1.23 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ -136:sc= 1.21 (180deg=-0.456!) USER MOD Single : A 47 THR OG1 : rot 79:sc= 1.17 USER MOD Single : A 50 GLN : amide:sc= -0.298 X(o=-0.3,f=-0.064) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= 0.122 K(o=0.12,f=-0.39) USER MOD Single : A 57 LYS NZ :NH3+ 144:sc= -1.57! (180deg=-2.12!) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 70:sc= 0.839 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -173:sc= 0.945 (180deg=0.606) USER MOD Single : A 71 TYR OH : rot 180:sc= -0.404 USER MOD Single : A 73 SER OG : rot 73:sc= 0.755 USER MOD Single : A 76 SER OG : rot 180:sc= 0.02 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 167:sc= -0.0996 (180deg=-0.396) USER MOD Single : A 84 THR OG1 : rot 67:sc= 1.24 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : B 10 LYS NZ :NH3+ 160:sc= 0.11 (180deg=-1.07!) USER MOD Single : B 15 LYS NZ :NH3+ -141:sc= 1.31 (180deg=0.274) USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 SER OG : rot 88:sc= 0.183 USER MOD Single : B 25 LYS NZ :NH3+ -135:sc= -0.168 (180deg=-0.902) USER MOD Single : B 26 LYS NZ :NH3+ -168:sc= 1.18 (180deg=0.527) USER MOD Single : B 35 LYS NZ :NH3+ 161:sc= -0.0227 (180deg=-0.269) USER MOD Single : B 37 SER OG : rot 72:sc= 1.21 USER MOD Single : B 39 ASN : amide:sc= 1.21 K(o=1.2,f=-0.23) USER MOD Single : B 42 SER OG : rot 92:sc= 1.21 USER MOD Single : B 44 LYS NZ :NH3+ 173:sc= 1.99 (180deg=1.95) USER MOD Single : B 46 LYS NZ :NH3+ -150:sc= -0.181 (180deg=-0.665) USER MOD Single : B 47 THR OG1 : rot 88:sc= 1.23 USER MOD Single : B 50 GLN : amide:sc= -0.122 X(o=-0.12,f=0) USER MOD Single : B 54 LYS NZ :NH3+ 166:sc= -0.0358 (180deg=-0.249) USER MOD Single : B 56 ASN : amide:sc= 0.752 K(o=0.75,f=-0.16) USER MOD Single : B 57 LYS NZ :NH3+ 146:sc= 0.925 (180deg=0.0758) USER MOD Single : B 62 TYR OH : rot 180:sc= 0.0859 USER MOD Single : B 63 THR OG1 : rot 82:sc= 1.27 USER MOD Single : B 64 TYR OH : rot 180:sc= 0 USER MOD Single : B 69 LYS NZ :NH3+ 176:sc= 1.23 (180deg=1.2) USER MOD Single : B 73 SER OG : rot 83:sc= 1.24 USER MOD Single : B 76 SER OG : rot 180:sc= -0.0943 USER MOD Single : B 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 80 LYS NZ :NH3+ 169:sc= 2.31 (180deg=2.22) USER MOD Single : B 84 THR OG1 : rot 81:sc= 1.24 USER MOD Single : B 86 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 77 N GLN A 6 -20.421 15.757 -9.371 1.00 1.91 N ATOM 78 CA GLN A 6 -20.042 14.371 -9.627 1.00 1.87 C ATOM 79 C GLN A 6 -18.841 14.279 -10.569 1.00 1.83 C ATOM 80 O GLN A 6 -17.935 13.477 -10.347 1.00 1.77 O ATOM 81 CB GLN A 6 -21.231 13.606 -10.217 1.00 1.89 C ATOM 82 CG GLN A 6 -20.931 12.154 -10.547 1.00 1.95 C ATOM 83 CD GLN A 6 -22.169 11.402 -10.981 1.00 1.96 C ATOM 84 OE1 GLN A 6 -22.546 11.418 -12.152 1.00 2.22 O ATOM 85 NE2 GLN A 6 -22.815 10.738 -10.038 1.00 2.13 N ATOM 0 HA GLN A 6 -19.754 13.922 -8.677 1.00 1.87 H new ATOM 0 HB2 GLN A 6 -22.060 13.643 -9.510 1.00 1.89 H new ATOM 0 HB3 GLN A 6 -21.562 14.113 -11.124 1.00 1.89 H new ATOM 0 HG2 GLN A 6 -20.184 12.110 -11.340 1.00 1.95 H new ATOM 0 HG3 GLN A 6 -20.498 11.666 -9.674 1.00 1.95 H new ATOM 0 HE21 GLN A 6 -22.470 10.750 -9.078 1.00 2.13 H new ATOM 0 HE22 GLN A 6 -23.659 10.214 -10.270 1.00 2.13 H new ATOM 94 N THR A 7 -18.825 15.106 -11.608 1.00 1.86 N ATOM 95 CA THR A 7 -17.735 15.086 -12.579 1.00 1.83 C ATOM 96 C THR A 7 -16.402 15.500 -11.951 1.00 1.79 C ATOM 97 O THR A 7 -15.392 14.810 -12.110 1.00 1.71 O ATOM 98 CB THR A 7 -18.045 15.999 -13.787 1.00 1.88 C ATOM 99 OG1 THR A 7 -19.041 16.974 -13.438 1.00 2.15 O ATOM 100 CG2 THR A 7 -18.530 15.180 -14.972 1.00 1.95 C ATOM 0 H THR A 7 -19.551 15.796 -11.800 1.00 1.86 H new ATOM 0 HA THR A 7 -17.645 14.056 -12.925 1.00 1.83 H new ATOM 0 HB THR A 7 -17.124 16.511 -14.065 1.00 1.88 H new ATOM 0 HG1 THR A 7 -19.933 16.581 -13.539 1.00 2.15 H new ATOM 0 HG21 THR A 7 -18.742 15.843 -15.810 1.00 1.95 H new ATOM 0 HG22 THR A 7 -17.759 14.466 -15.261 1.00 1.95 H new ATOM 0 HG23 THR A 7 -19.437 14.643 -14.696 1.00 1.95 H new ATOM 108 N ARG A 8 -16.405 16.608 -11.219 1.00 1.84 N ATOM 109 CA ARG A 8 -15.185 17.104 -10.590 1.00 1.82 C ATOM 110 C ARG A 8 -14.726 16.193 -9.454 1.00 1.75 C ATOM 111 O ARG A 8 -13.531 15.951 -9.291 1.00 1.69 O ATOM 112 CB ARG A 8 -15.383 18.531 -10.067 1.00 1.94 C ATOM 113 CG ARG A 8 -14.087 19.211 -9.639 1.00 2.03 C ATOM 114 CD ARG A 8 -13.085 19.288 -10.784 1.00 2.06 C ATOM 115 NE ARG A 8 -13.647 19.960 -11.958 1.00 2.06 N ATOM 116 CZ ARG A 8 -13.415 19.593 -13.221 1.00 2.08 C ATOM 117 NH1 ARG A 8 -12.597 18.587 -13.496 1.00 2.10 N ATOM 118 NH2 ARG A 8 -13.999 20.245 -14.217 1.00 2.22 N ATOM 0 H ARG A 8 -17.233 17.178 -11.047 1.00 1.84 H new ATOM 0 HA ARG A 8 -14.408 17.110 -11.355 1.00 1.82 H new ATOM 0 HB2 ARG A 8 -15.859 19.131 -10.843 1.00 1.94 H new ATOM 0 HB3 ARG A 8 -16.067 18.506 -9.219 1.00 1.94 H new ATOM 0 HG2 ARG A 8 -14.306 20.216 -9.279 1.00 2.03 H new ATOM 0 HG3 ARG A 8 -13.646 18.663 -8.806 1.00 2.03 H new ATOM 0 HD2 ARG A 8 -12.195 19.822 -10.452 1.00 2.06 H new ATOM 0 HD3 ARG A 8 -12.769 18.281 -11.058 1.00 2.06 H new ATOM 0 HE ARG A 8 -14.257 20.762 -11.800 1.00 2.06 H new ATOM 0 HH11 ARG A 8 -12.136 18.083 -12.739 1.00 2.10 H new ATOM 0 HH12 ARG A 8 -12.429 18.317 -14.465 1.00 2.10 H new ATOM 0 HH21 ARG A 8 -14.624 21.026 -14.018 1.00 2.22 H new ATOM 0 HH22 ARG A 8 -13.823 19.966 -15.182 1.00 2.22 H new ATOM 132 N ASN A 9 -15.677 15.681 -8.679 1.00 1.76 N ATOM 133 CA ASN A 9 -15.361 14.803 -7.554 1.00 1.72 C ATOM 134 C ASN A 9 -14.768 13.482 -8.032 1.00 1.61 C ATOM 135 O ASN A 9 -13.833 12.961 -7.428 1.00 1.56 O ATOM 136 CB ASN A 9 -16.618 14.555 -6.706 1.00 1.78 C ATOM 137 CG ASN A 9 -16.439 13.450 -5.679 1.00 1.75 C ATOM 138 OD1 ASN A 9 -16.769 12.295 -5.935 1.00 1.75 O ATOM 139 ND2 ASN A 9 -15.928 13.799 -4.507 1.00 1.84 N ATOM 0 H ASN A 9 -16.673 15.858 -8.808 1.00 1.76 H new ATOM 0 HA ASN A 9 -14.612 15.299 -6.937 1.00 1.72 H new ATOM 0 HB2 ASN A 9 -16.890 15.478 -6.194 1.00 1.78 H new ATOM 0 HB3 ASN A 9 -17.448 14.299 -7.365 1.00 1.78 H new ATOM 0 HD21 ASN A 9 -15.796 13.097 -3.779 1.00 1.84 H new ATOM 0 HD22 ASN A 9 -15.666 14.769 -4.333 1.00 1.84 H new ATOM 146 N LYS A 10 -15.303 12.949 -9.124 1.00 1.60 N ATOM 147 CA LYS A 10 -14.824 11.689 -9.674 1.00 1.52 C ATOM 148 C LYS A 10 -13.393 11.830 -10.192 1.00 1.47 C ATOM 149 O LYS A 10 -12.537 10.986 -9.917 1.00 1.41 O ATOM 150 CB LYS A 10 -15.754 11.211 -10.794 1.00 1.53 C ATOM 151 CG LYS A 10 -15.415 9.830 -11.331 1.00 1.59 C ATOM 152 CD LYS A 10 -15.598 8.750 -10.274 1.00 1.70 C ATOM 153 CE LYS A 10 -14.267 8.273 -9.726 1.00 2.07 C ATOM 154 NZ LYS A 10 -13.370 7.792 -10.804 1.00 2.48 N ATOM 0 H LYS A 10 -16.070 13.372 -9.646 1.00 1.60 H new ATOM 0 HA LYS A 10 -14.824 10.945 -8.877 1.00 1.52 H new ATOM 0 HB2 LYS A 10 -16.779 11.204 -10.423 1.00 1.53 H new ATOM 0 HB3 LYS A 10 -15.717 11.928 -11.614 1.00 1.53 H new ATOM 0 HG2 LYS A 10 -16.049 9.609 -12.190 1.00 1.59 H new ATOM 0 HG3 LYS A 10 -14.384 9.821 -11.685 1.00 1.59 H new ATOM 0 HD2 LYS A 10 -16.210 9.138 -9.459 1.00 1.70 H new ATOM 0 HD3 LYS A 10 -16.138 7.907 -10.705 1.00 1.70 H new ATOM 0 HE2 LYS A 10 -13.783 9.087 -9.186 1.00 2.07 H new ATOM 0 HE3 LYS A 10 -14.436 7.470 -9.008 1.00 2.07 H new ATOM 0 HZ1 LYS A 10 -12.689 7.111 -10.411 1.00 2.48 H new ATOM 0 HZ2 LYS A 10 -13.935 7.329 -11.545 1.00 2.48 H new ATOM 0 HZ3 LYS A 10 -12.856 8.598 -11.214 1.00 2.48 H new ATOM 168 N GLU A 11 -13.146 12.908 -10.928 1.00 1.52 N ATOM 169 CA GLU A 11 -11.826 13.179 -11.491 1.00 1.50 C ATOM 170 C GLU A 11 -10.779 13.285 -10.388 1.00 1.45 C ATOM 171 O GLU A 11 -9.728 12.645 -10.446 1.00 1.38 O ATOM 172 CB GLU A 11 -11.867 14.486 -12.295 1.00 1.58 C ATOM 173 CG GLU A 11 -10.525 14.896 -12.884 1.00 1.63 C ATOM 174 CD GLU A 11 -10.033 16.232 -12.359 1.00 1.77 C ATOM 175 OE1 GLU A 11 -10.868 17.129 -12.115 1.00 1.96 O ATOM 176 OE2 GLU A 11 -8.804 16.398 -12.201 1.00 1.90 O ATOM 0 H GLU A 11 -13.848 13.614 -11.151 1.00 1.52 H new ATOM 0 HA GLU A 11 -11.552 12.353 -12.148 1.00 1.50 H new ATOM 0 HB2 GLU A 11 -12.589 14.380 -13.104 1.00 1.58 H new ATOM 0 HB3 GLU A 11 -12.228 15.286 -11.649 1.00 1.58 H new ATOM 0 HG2 GLU A 11 -9.785 14.128 -12.659 1.00 1.63 H new ATOM 0 HG3 GLU A 11 -10.611 14.947 -13.969 1.00 1.63 H new ATOM 183 N LEU A 12 -11.103 14.072 -9.375 1.00 1.51 N ATOM 184 CA LEU A 12 -10.213 14.306 -8.250 1.00 1.50 C ATOM 185 C LEU A 12 -9.887 13.020 -7.495 1.00 1.40 C ATOM 186 O LEU A 12 -8.716 12.700 -7.287 1.00 1.33 O ATOM 187 CB LEU A 12 -10.853 15.319 -7.295 1.00 1.62 C ATOM 188 CG LEU A 12 -10.000 15.716 -6.090 1.00 1.65 C ATOM 189 CD1 LEU A 12 -8.891 16.669 -6.509 1.00 1.69 C ATOM 190 CD2 LEU A 12 -10.872 16.338 -5.010 1.00 1.82 C ATOM 0 H LEU A 12 -11.992 14.567 -9.310 1.00 1.51 H new ATOM 0 HA LEU A 12 -9.276 14.699 -8.645 1.00 1.50 H new ATOM 0 HB2 LEU A 12 -11.097 16.220 -7.858 1.00 1.62 H new ATOM 0 HB3 LEU A 12 -11.794 14.906 -6.932 1.00 1.62 H new ATOM 0 HG LEU A 12 -9.535 14.819 -5.681 1.00 1.65 H new ATOM 0 HD11 LEU A 12 -8.295 16.940 -5.637 1.00 1.69 H new ATOM 0 HD12 LEU A 12 -8.253 16.183 -7.248 1.00 1.69 H new ATOM 0 HD13 LEU A 12 -9.329 17.568 -6.943 1.00 1.69 H new ATOM 0 HD21 LEU A 12 -10.252 16.616 -4.157 1.00 1.82 H new ATOM 0 HD22 LEU A 12 -11.364 17.226 -5.406 1.00 1.82 H new ATOM 0 HD23 LEU A 12 -11.625 15.618 -4.691 1.00 1.82 H new ATOM 202 N LEU A 13 -10.922 12.278 -7.113 1.00 1.41 N ATOM 203 CA LEU A 13 -10.756 11.050 -6.339 1.00 1.35 C ATOM 204 C LEU A 13 -9.855 10.026 -7.033 1.00 1.23 C ATOM 205 O LEU A 13 -8.978 9.435 -6.392 1.00 1.18 O ATOM 206 CB LEU A 13 -12.127 10.422 -6.061 1.00 1.43 C ATOM 207 CG LEU A 13 -12.111 9.172 -5.174 1.00 1.43 C ATOM 208 CD1 LEU A 13 -11.819 9.537 -3.725 1.00 1.81 C ATOM 209 CD2 LEU A 13 -13.431 8.429 -5.275 1.00 1.76 C ATOM 0 H LEU A 13 -11.892 12.507 -7.328 1.00 1.41 H new ATOM 0 HA LEU A 13 -10.268 11.327 -5.405 1.00 1.35 H new ATOM 0 HB2 LEU A 13 -12.763 11.172 -5.591 1.00 1.43 H new ATOM 0 HB3 LEU A 13 -12.590 10.165 -7.014 1.00 1.43 H new ATOM 0 HG LEU A 13 -11.315 8.517 -5.529 1.00 1.43 H new ATOM 0 HD11 LEU A 13 -11.813 8.633 -3.116 1.00 1.81 H new ATOM 0 HD12 LEU A 13 -10.846 10.024 -3.661 1.00 1.81 H new ATOM 0 HD13 LEU A 13 -12.589 10.216 -3.359 1.00 1.81 H new ATOM 0 HD21 LEU A 13 -13.400 7.545 -4.638 1.00 1.76 H new ATOM 0 HD22 LEU A 13 -14.242 9.082 -4.951 1.00 1.76 H new ATOM 0 HD23 LEU A 13 -13.600 8.126 -6.308 1.00 1.76 H new ATOM 221 N LEU A 14 -10.044 9.837 -8.333 1.00 1.21 N ATOM 222 CA LEU A 14 -9.241 8.861 -9.064 1.00 1.13 C ATOM 223 C LEU A 14 -7.798 9.325 -9.192 1.00 1.11 C ATOM 224 O LEU A 14 -6.872 8.546 -8.976 1.00 1.04 O ATOM 225 CB LEU A 14 -9.827 8.586 -10.451 1.00 1.16 C ATOM 226 CG LEU A 14 -9.128 7.462 -11.232 1.00 1.09 C ATOM 227 CD1 LEU A 14 -9.359 6.109 -10.566 1.00 1.11 C ATOM 228 CD2 LEU A 14 -9.605 7.431 -12.673 1.00 1.23 C ATOM 0 H LEU A 14 -10.733 10.336 -8.896 1.00 1.21 H new ATOM 0 HA LEU A 14 -9.259 7.933 -8.492 1.00 1.13 H new ATOM 0 HB2 LEU A 14 -10.881 8.332 -10.341 1.00 1.16 H new ATOM 0 HB3 LEU A 14 -9.779 9.503 -11.039 1.00 1.16 H new ATOM 0 HG LEU A 14 -8.057 7.667 -11.227 1.00 1.09 H new ATOM 0 HD11 LEU A 14 -8.854 5.331 -11.138 1.00 1.11 H new ATOM 0 HD12 LEU A 14 -8.960 6.130 -9.552 1.00 1.11 H new ATOM 0 HD13 LEU A 14 -10.428 5.898 -10.532 1.00 1.11 H new ATOM 0 HD21 LEU A 14 -9.097 6.628 -13.207 1.00 1.23 H new ATOM 0 HD22 LEU A 14 -10.681 7.259 -12.696 1.00 1.23 H new ATOM 0 HD23 LEU A 14 -9.380 8.384 -13.151 1.00 1.23 H new ATOM 240 N LYS A 15 -7.604 10.598 -9.521 1.00 1.19 N ATOM 241 CA LYS A 15 -6.263 11.147 -9.681 1.00 1.19 C ATOM 242 C LYS A 15 -5.518 11.193 -8.351 1.00 1.14 C ATOM 243 O LYS A 15 -4.285 11.114 -8.318 1.00 1.09 O ATOM 244 CB LYS A 15 -6.329 12.534 -10.310 1.00 1.32 C ATOM 245 CG LYS A 15 -6.409 12.493 -11.831 1.00 1.56 C ATOM 246 CD LYS A 15 -6.776 13.844 -12.422 1.00 1.68 C ATOM 247 CE LYS A 15 -5.862 14.946 -11.915 1.00 1.70 C ATOM 248 NZ LYS A 15 -6.182 16.257 -12.531 1.00 1.93 N ATOM 0 H LYS A 15 -8.357 11.267 -9.682 1.00 1.19 H new ATOM 0 HA LYS A 15 -5.707 10.487 -10.347 1.00 1.19 H new ATOM 0 HB2 LYS A 15 -7.198 13.063 -9.920 1.00 1.32 H new ATOM 0 HB3 LYS A 15 -5.449 13.104 -10.013 1.00 1.32 H new ATOM 0 HG2 LYS A 15 -5.450 12.170 -12.235 1.00 1.56 H new ATOM 0 HG3 LYS A 15 -7.149 11.752 -12.135 1.00 1.56 H new ATOM 0 HD2 LYS A 15 -6.717 13.794 -13.509 1.00 1.68 H new ATOM 0 HD3 LYS A 15 -7.809 14.083 -12.170 1.00 1.68 H new ATOM 0 HE2 LYS A 15 -5.952 15.022 -10.831 1.00 1.70 H new ATOM 0 HE3 LYS A 15 -4.826 14.686 -12.131 1.00 1.70 H new ATOM 0 HZ1 LYS A 15 -5.916 17.022 -11.878 1.00 1.93 H new ATOM 0 HZ2 LYS A 15 -5.652 16.361 -13.420 1.00 1.93 H new ATOM 0 HZ3 LYS A 15 -7.202 16.309 -12.728 1.00 1.93 H new ATOM 262 N LYS A 16 -6.260 11.320 -7.261 1.00 1.17 N ATOM 263 CA LYS A 16 -5.662 11.361 -5.933 1.00 1.16 C ATOM 264 C LYS A 16 -5.033 10.015 -5.586 1.00 1.04 C ATOM 265 O LYS A 16 -3.865 9.944 -5.196 1.00 1.05 O ATOM 266 CB LYS A 16 -6.709 11.730 -4.880 1.00 1.26 C ATOM 267 CG LYS A 16 -7.004 13.224 -4.801 1.00 1.32 C ATOM 268 CD LYS A 16 -5.895 13.985 -4.085 1.00 1.30 C ATOM 269 CE LYS A 16 -5.858 13.657 -2.599 1.00 1.50 C ATOM 270 NZ LYS A 16 -5.102 14.671 -1.819 1.00 1.62 N ATOM 0 H LYS A 16 -7.277 11.397 -7.269 1.00 1.17 H new ATOM 0 HA LYS A 16 -4.884 12.124 -5.938 1.00 1.16 H new ATOM 0 HB2 LYS A 16 -7.635 11.198 -5.100 1.00 1.26 H new ATOM 0 HB3 LYS A 16 -6.367 11.385 -3.904 1.00 1.26 H new ATOM 0 HG2 LYS A 16 -7.127 13.623 -5.808 1.00 1.32 H new ATOM 0 HG3 LYS A 16 -7.948 13.381 -4.278 1.00 1.32 H new ATOM 0 HD2 LYS A 16 -4.934 13.738 -4.536 1.00 1.30 H new ATOM 0 HD3 LYS A 16 -6.044 15.057 -4.218 1.00 1.30 H new ATOM 0 HE2 LYS A 16 -6.877 13.593 -2.217 1.00 1.50 H new ATOM 0 HE3 LYS A 16 -5.402 12.677 -2.456 1.00 1.50 H new ATOM 0 HZ1 LYS A 16 -5.103 14.407 -0.813 1.00 1.62 H new ATOM 0 HZ2 LYS A 16 -4.122 14.715 -2.164 1.00 1.62 H new ATOM 0 HZ3 LYS A 16 -5.551 15.602 -1.933 1.00 1.62 H new ATOM 284 N ILE A 17 -5.805 8.949 -5.752 1.00 0.96 N ATOM 285 CA ILE A 17 -5.327 7.605 -5.444 1.00 0.88 C ATOM 286 C ILE A 17 -4.318 7.122 -6.490 1.00 0.85 C ATOM 287 O ILE A 17 -3.380 6.390 -6.168 1.00 0.83 O ATOM 288 CB ILE A 17 -6.503 6.607 -5.322 1.00 0.85 C ATOM 289 CG1 ILE A 17 -7.411 7.021 -4.154 1.00 1.01 C ATOM 290 CG2 ILE A 17 -5.989 5.181 -5.136 1.00 0.89 C ATOM 291 CD1 ILE A 17 -8.567 6.076 -3.895 1.00 1.02 C ATOM 0 H ILE A 17 -6.764 8.987 -6.098 1.00 0.96 H new ATOM 0 HA ILE A 17 -4.820 7.652 -4.480 1.00 0.88 H new ATOM 0 HB ILE A 17 -7.084 6.629 -6.244 1.00 0.85 H new ATOM 0 HG12 ILE A 17 -6.808 7.094 -3.249 1.00 1.01 H new ATOM 0 HG13 ILE A 17 -7.809 8.016 -4.354 1.00 1.01 H new ATOM 0 HG21 ILE A 17 -6.834 4.498 -5.053 1.00 0.89 H new ATOM 0 HG22 ILE A 17 -5.378 4.900 -5.994 1.00 0.89 H new ATOM 0 HG23 ILE A 17 -5.387 5.127 -4.229 1.00 0.89 H new ATOM 0 HD11 ILE A 17 -9.156 6.443 -3.055 1.00 1.02 H new ATOM 0 HD12 ILE A 17 -9.197 6.020 -4.783 1.00 1.02 H new ATOM 0 HD13 ILE A 17 -8.181 5.084 -3.661 1.00 1.02 H new ATOM 303 N ASP A 18 -4.507 7.542 -7.736 1.00 0.90 N ATOM 304 CA ASP A 18 -3.597 7.168 -8.820 1.00 0.93 C ATOM 305 C ASP A 18 -2.178 7.620 -8.499 1.00 0.93 C ATOM 306 O ASP A 18 -1.220 6.858 -8.627 1.00 0.93 O ATOM 307 CB ASP A 18 -4.058 7.798 -10.137 1.00 1.04 C ATOM 308 CG ASP A 18 -3.099 7.546 -11.281 1.00 1.20 C ATOM 309 OD1 ASP A 18 -3.181 6.468 -11.904 1.00 1.66 O ATOM 310 OD2 ASP A 18 -2.270 8.431 -11.574 1.00 1.62 O ATOM 0 H ASP A 18 -5.281 8.141 -8.024 1.00 0.90 H new ATOM 0 HA ASP A 18 -3.607 6.083 -8.922 1.00 0.93 H new ATOM 0 HB2 ASP A 18 -5.039 7.402 -10.399 1.00 1.04 H new ATOM 0 HB3 ASP A 18 -4.175 8.873 -9.998 1.00 1.04 H new ATOM 315 N SER A 19 -2.062 8.859 -8.049 1.00 0.99 N ATOM 316 CA SER A 19 -0.773 9.430 -7.694 1.00 1.03 C ATOM 317 C SER A 19 -0.246 8.805 -6.404 1.00 0.96 C ATOM 318 O SER A 19 0.964 8.677 -6.211 1.00 0.96 O ATOM 319 CB SER A 19 -0.901 10.943 -7.532 1.00 1.17 C ATOM 320 OG SER A 19 -1.596 11.518 -8.630 1.00 1.28 O ATOM 0 H SER A 19 -2.851 9.492 -7.920 1.00 0.99 H new ATOM 0 HA SER A 19 -0.065 9.216 -8.494 1.00 1.03 H new ATOM 0 HB2 SER A 19 -1.428 11.169 -6.605 1.00 1.17 H new ATOM 0 HB3 SER A 19 0.091 11.388 -7.452 1.00 1.17 H new ATOM 0 HG SER A 19 -2.561 11.472 -8.467 1.00 1.28 H new ATOM 326 N LEU A 20 -1.172 8.409 -5.538 1.00 0.92 N ATOM 327 CA LEU A 20 -0.841 7.806 -4.253 1.00 0.90 C ATOM 328 C LEU A 20 0.034 6.561 -4.435 1.00 0.84 C ATOM 329 O LEU A 20 1.122 6.468 -3.862 1.00 0.86 O ATOM 330 CB LEU A 20 -2.141 7.448 -3.525 1.00 0.92 C ATOM 331 CG LEU A 20 -2.020 7.116 -2.039 1.00 1.01 C ATOM 332 CD1 LEU A 20 -1.567 8.337 -1.252 1.00 1.37 C ATOM 333 CD2 LEU A 20 -3.356 6.601 -1.523 1.00 1.14 C ATOM 0 H LEU A 20 -2.174 8.497 -5.708 1.00 0.92 H new ATOM 0 HA LEU A 20 -0.271 8.521 -3.659 1.00 0.90 H new ATOM 0 HB2 LEU A 20 -2.834 8.283 -3.633 1.00 0.92 H new ATOM 0 HB3 LEU A 20 -2.591 6.593 -4.030 1.00 0.92 H new ATOM 0 HG LEU A 20 -1.268 6.339 -1.906 1.00 1.01 H new ATOM 0 HD11 LEU A 20 -1.487 8.080 -0.196 1.00 1.37 H new ATOM 0 HD12 LEU A 20 -0.595 8.667 -1.620 1.00 1.37 H new ATOM 0 HD13 LEU A 20 -2.294 9.140 -1.376 1.00 1.37 H new ATOM 0 HD21 LEU A 20 -3.270 6.364 -0.463 1.00 1.14 H new ATOM 0 HD22 LEU A 20 -4.119 7.366 -1.663 1.00 1.14 H new ATOM 0 HD23 LEU A 20 -3.637 5.703 -2.074 1.00 1.14 H new ATOM 345 N ILE A 21 -0.423 5.625 -5.265 1.00 0.80 N ATOM 346 CA ILE A 21 0.330 4.395 -5.513 1.00 0.79 C ATOM 347 C ILE A 21 1.559 4.666 -6.382 1.00 0.81 C ATOM 348 O ILE A 21 2.543 3.923 -6.335 1.00 0.83 O ATOM 349 CB ILE A 21 -0.542 3.292 -6.164 1.00 0.81 C ATOM 350 CG1 ILE A 21 -1.277 3.828 -7.400 1.00 1.06 C ATOM 351 CG2 ILE A 21 -1.535 2.734 -5.149 1.00 1.04 C ATOM 352 CD1 ILE A 21 -2.173 2.801 -8.064 1.00 1.23 C ATOM 0 H ILE A 21 -1.304 5.693 -5.774 1.00 0.80 H new ATOM 0 HA ILE A 21 0.656 4.031 -4.539 1.00 0.79 H new ATOM 0 HB ILE A 21 0.116 2.486 -6.489 1.00 0.81 H new ATOM 0 HG12 ILE A 21 -1.878 4.690 -7.110 1.00 1.06 H new ATOM 0 HG13 ILE A 21 -0.543 4.181 -8.125 1.00 1.06 H new ATOM 0 HG21 ILE A 21 -2.141 1.960 -5.620 1.00 1.04 H new ATOM 0 HG22 ILE A 21 -0.992 2.307 -4.306 1.00 1.04 H new ATOM 0 HG23 ILE A 21 -2.182 3.536 -4.795 1.00 1.04 H new ATOM 0 HD11 ILE A 21 -2.660 3.249 -8.930 1.00 1.23 H new ATOM 0 HD12 ILE A 21 -1.574 1.949 -8.385 1.00 1.23 H new ATOM 0 HD13 ILE A 21 -2.930 2.466 -7.355 1.00 1.23 H new ATOM 364 N GLU A 22 1.492 5.727 -7.181 1.00 0.84 N ATOM 365 CA GLU A 22 2.603 6.105 -8.045 1.00 0.90 C ATOM 366 C GLU A 22 3.778 6.589 -7.208 1.00 0.90 C ATOM 367 O GLU A 22 4.936 6.293 -7.514 1.00 0.93 O ATOM 368 CB GLU A 22 2.177 7.203 -9.023 1.00 0.98 C ATOM 369 CG GLU A 22 1.680 6.668 -10.354 1.00 1.29 C ATOM 370 CD GLU A 22 2.768 5.965 -11.134 1.00 1.78 C ATOM 371 OE1 GLU A 22 3.612 6.656 -11.742 1.00 2.29 O ATOM 372 OE2 GLU A 22 2.787 4.719 -11.142 1.00 2.22 O ATOM 0 H GLU A 22 0.679 6.340 -7.247 1.00 0.84 H new ATOM 0 HA GLU A 22 2.907 5.227 -8.615 1.00 0.90 H new ATOM 0 HB2 GLU A 22 1.390 7.802 -8.564 1.00 0.98 H new ATOM 0 HB3 GLU A 22 3.022 7.869 -9.200 1.00 0.98 H new ATOM 0 HG2 GLU A 22 0.856 5.976 -10.180 1.00 1.29 H new ATOM 0 HG3 GLU A 22 1.284 7.491 -10.949 1.00 1.29 H new ATOM 379 N ALA A 23 3.466 7.324 -6.145 1.00 0.89 N ATOM 380 CA ALA A 23 4.482 7.859 -5.257 1.00 0.92 C ATOM 381 C ALA A 23 5.205 6.743 -4.512 1.00 0.88 C ATOM 382 O ALA A 23 6.435 6.729 -4.445 1.00 0.89 O ATOM 383 CB ALA A 23 3.860 8.842 -4.276 1.00 0.94 C ATOM 0 H ALA A 23 2.510 7.562 -5.880 1.00 0.89 H new ATOM 0 HA ALA A 23 5.219 8.387 -5.863 1.00 0.92 H new ATOM 0 HB1 ALA A 23 4.633 9.236 -3.616 1.00 0.94 H new ATOM 0 HB2 ALA A 23 3.400 9.663 -4.826 1.00 0.94 H new ATOM 0 HB3 ALA A 23 3.101 8.333 -3.682 1.00 0.94 H new ATOM 389 N ILE A 24 4.439 5.807 -3.957 1.00 0.86 N ATOM 390 CA ILE A 24 5.015 4.685 -3.217 1.00 0.85 C ATOM 391 C ILE A 24 5.925 3.853 -4.124 1.00 0.83 C ATOM 392 O ILE A 24 7.010 3.426 -3.719 1.00 0.83 O ATOM 393 CB ILE A 24 3.922 3.772 -2.615 1.00 0.87 C ATOM 394 CG1 ILE A 24 2.828 4.623 -1.967 1.00 1.12 C ATOM 395 CG2 ILE A 24 4.538 2.820 -1.596 1.00 1.03 C ATOM 396 CD1 ILE A 24 1.691 3.824 -1.366 1.00 1.05 C ATOM 0 H ILE A 24 3.420 5.802 -4.005 1.00 0.86 H new ATOM 0 HA ILE A 24 5.599 5.108 -2.399 1.00 0.85 H new ATOM 0 HB ILE A 24 3.473 3.180 -3.412 1.00 0.87 H new ATOM 0 HG12 ILE A 24 3.277 5.238 -1.187 1.00 1.12 H new ATOM 0 HG13 ILE A 24 2.422 5.304 -2.715 1.00 1.12 H new ATOM 0 HG21 ILE A 24 3.760 2.181 -1.178 1.00 1.03 H new ATOM 0 HG22 ILE A 24 5.291 2.202 -2.085 1.00 1.03 H new ATOM 0 HG23 ILE A 24 5.004 3.395 -0.796 1.00 1.03 H new ATOM 0 HD11 ILE A 24 0.960 4.504 -0.928 1.00 1.05 H new ATOM 0 HD12 ILE A 24 1.213 3.229 -2.144 1.00 1.05 H new ATOM 0 HD13 ILE A 24 2.080 3.163 -0.592 1.00 1.05 H new ATOM 408 N LYS A 25 5.482 3.650 -5.359 1.00 0.83 N ATOM 409 CA LYS A 25 6.249 2.887 -6.332 1.00 0.84 C ATOM 410 C LYS A 25 7.546 3.611 -6.680 1.00 0.86 C ATOM 411 O LYS A 25 8.568 2.983 -6.956 1.00 0.86 O ATOM 412 CB LYS A 25 5.419 2.649 -7.596 1.00 0.88 C ATOM 413 CG LYS A 25 6.167 1.899 -8.683 1.00 0.96 C ATOM 414 CD LYS A 25 6.475 0.464 -8.275 1.00 1.13 C ATOM 415 CE LYS A 25 7.190 -0.284 -9.387 1.00 1.39 C ATOM 416 NZ LYS A 25 6.350 -0.400 -10.607 1.00 1.61 N ATOM 0 H LYS A 25 4.592 4.005 -5.710 1.00 0.83 H new ATOM 0 HA LYS A 25 6.500 1.922 -5.891 1.00 0.84 H new ATOM 0 HB2 LYS A 25 4.522 2.089 -7.331 1.00 0.88 H new ATOM 0 HB3 LYS A 25 5.090 3.610 -7.990 1.00 0.88 H new ATOM 0 HG2 LYS A 25 5.573 1.897 -9.597 1.00 0.96 H new ATOM 0 HG3 LYS A 25 7.098 2.420 -8.909 1.00 0.96 H new ATOM 0 HD2 LYS A 25 7.093 0.464 -7.377 1.00 1.13 H new ATOM 0 HD3 LYS A 25 5.548 -0.052 -8.024 1.00 1.13 H new ATOM 0 HE2 LYS A 25 8.118 0.232 -9.633 1.00 1.39 H new ATOM 0 HE3 LYS A 25 7.462 -1.280 -9.038 1.00 1.39 H new ATOM 0 HZ1 LYS A 25 6.764 -1.107 -11.248 1.00 1.61 H new ATOM 0 HZ2 LYS A 25 5.389 -0.695 -10.340 1.00 1.61 H new ATOM 0 HZ3 LYS A 25 6.308 0.521 -11.088 1.00 1.61 H new ATOM 430 N LYS A 26 7.508 4.934 -6.654 1.00 0.87 N ATOM 431 CA LYS A 26 8.690 5.720 -6.960 1.00 0.91 C ATOM 432 C LYS A 26 9.725 5.584 -5.851 1.00 0.90 C ATOM 433 O LYS A 26 10.924 5.549 -6.117 1.00 0.91 O ATOM 434 CB LYS A 26 8.334 7.194 -7.177 1.00 0.97 C ATOM 435 CG LYS A 26 8.772 7.724 -8.531 1.00 1.07 C ATOM 436 CD LYS A 26 10.288 7.731 -8.661 1.00 1.21 C ATOM 437 CE LYS A 26 10.733 7.339 -10.064 1.00 1.35 C ATOM 438 NZ LYS A 26 12.196 7.517 -10.259 1.00 1.42 N ATOM 0 H LYS A 26 6.678 5.481 -6.426 1.00 0.87 H new ATOM 0 HA LYS A 26 9.116 5.335 -7.886 1.00 0.91 H new ATOM 0 HB2 LYS A 26 7.256 7.319 -7.077 1.00 0.97 H new ATOM 0 HB3 LYS A 26 8.798 7.792 -6.393 1.00 0.97 H new ATOM 0 HG2 LYS A 26 8.341 7.109 -9.321 1.00 1.07 H new ATOM 0 HG3 LYS A 26 8.389 8.735 -8.669 1.00 1.07 H new ATOM 0 HD2 LYS A 26 10.670 8.724 -8.422 1.00 1.21 H new ATOM 0 HD3 LYS A 26 10.719 7.041 -7.936 1.00 1.21 H new ATOM 0 HE2 LYS A 26 10.467 6.298 -10.250 1.00 1.35 H new ATOM 0 HE3 LYS A 26 10.195 7.941 -10.796 1.00 1.35 H new ATOM 0 HZ1 LYS A 26 12.481 7.084 -11.160 1.00 1.42 H new ATOM 0 HZ2 LYS A 26 12.423 8.532 -10.276 1.00 1.42 H new ATOM 0 HZ3 LYS A 26 12.708 7.060 -9.478 1.00 1.42 H new ATOM 452 N ILE A 27 9.255 5.500 -4.609 1.00 0.88 N ATOM 453 CA ILE A 27 10.148 5.361 -3.464 1.00 0.89 C ATOM 454 C ILE A 27 11.023 4.116 -3.618 1.00 0.87 C ATOM 455 O ILE A 27 12.245 4.178 -3.468 1.00 0.90 O ATOM 456 CB ILE A 27 9.369 5.271 -2.129 1.00 0.90 C ATOM 457 CG1 ILE A 27 8.495 6.516 -1.921 1.00 0.90 C ATOM 458 CG2 ILE A 27 10.334 5.091 -0.959 1.00 0.93 C ATOM 459 CD1 ILE A 27 7.709 6.487 -0.626 1.00 1.31 C ATOM 0 H ILE A 27 8.263 5.526 -4.371 1.00 0.88 H new ATOM 0 HA ILE A 27 10.772 6.254 -3.437 1.00 0.89 H new ATOM 0 HB ILE A 27 8.714 4.401 -2.175 1.00 0.90 H new ATOM 0 HG12 ILE A 27 9.129 7.403 -1.933 1.00 0.90 H new ATOM 0 HG13 ILE A 27 7.802 6.608 -2.757 1.00 0.90 H new ATOM 0 HG21 ILE A 27 9.770 5.030 -0.028 1.00 0.93 H new ATOM 0 HG22 ILE A 27 10.907 4.174 -1.097 1.00 0.93 H new ATOM 0 HG23 ILE A 27 11.015 5.941 -0.915 1.00 0.93 H new ATOM 0 HD11 ILE A 27 7.113 7.396 -0.542 1.00 1.31 H new ATOM 0 HD12 ILE A 27 7.050 5.619 -0.620 1.00 1.31 H new ATOM 0 HD13 ILE A 27 8.398 6.426 0.216 1.00 1.31 H new ATOM 471 N ILE A 28 10.389 2.990 -3.942 1.00 0.83 N ATOM 472 CA ILE A 28 11.105 1.732 -4.120 1.00 0.82 C ATOM 473 C ILE A 28 12.080 1.818 -5.302 1.00 0.83 C ATOM 474 O ILE A 28 13.166 1.230 -5.278 1.00 0.84 O ATOM 475 CB ILE A 28 10.126 0.538 -4.296 1.00 0.82 C ATOM 476 CG1 ILE A 28 10.775 -0.753 -3.788 1.00 0.88 C ATOM 477 CG2 ILE A 28 9.681 0.365 -5.747 1.00 0.88 C ATOM 478 CD1 ILE A 28 10.799 -0.873 -2.276 1.00 1.05 C ATOM 0 H ILE A 28 9.381 2.925 -4.086 1.00 0.83 H new ATOM 0 HA ILE A 28 11.683 1.553 -3.213 1.00 0.82 H new ATOM 0 HB ILE A 28 9.236 0.757 -3.706 1.00 0.82 H new ATOM 0 HG12 ILE A 28 10.238 -1.606 -4.202 1.00 0.88 H new ATOM 0 HG13 ILE A 28 11.797 -0.807 -4.164 1.00 0.88 H new ATOM 0 HG21 ILE A 28 8.998 -0.481 -5.820 1.00 0.88 H new ATOM 0 HG22 ILE A 28 9.174 1.270 -6.083 1.00 0.88 H new ATOM 0 HG23 ILE A 28 10.553 0.183 -6.376 1.00 0.88 H new ATOM 0 HD11 ILE A 28 11.273 -1.813 -1.993 1.00 1.05 H new ATOM 0 HD12 ILE A 28 11.362 -0.041 -1.854 1.00 1.05 H new ATOM 0 HD13 ILE A 28 9.779 -0.852 -1.893 1.00 1.05 H new ATOM 490 N ALA A 29 11.694 2.577 -6.322 1.00 0.84 N ATOM 491 CA ALA A 29 12.522 2.747 -7.506 1.00 0.87 C ATOM 492 C ALA A 29 13.791 3.518 -7.161 1.00 0.90 C ATOM 493 O ALA A 29 14.881 3.179 -7.625 1.00 0.93 O ATOM 494 CB ALA A 29 11.744 3.452 -8.605 1.00 0.90 C ATOM 0 H ALA A 29 10.810 3.085 -6.350 1.00 0.84 H new ATOM 0 HA ALA A 29 12.809 1.761 -7.872 1.00 0.87 H new ATOM 0 HB1 ALA A 29 12.380 3.570 -9.482 1.00 0.90 H new ATOM 0 HB2 ALA A 29 10.868 2.859 -8.869 1.00 0.90 H new ATOM 0 HB3 ALA A 29 11.425 4.433 -8.253 1.00 0.90 H new ATOM 500 N GLU A 30 13.645 4.542 -6.329 1.00 0.93 N ATOM 501 CA GLU A 30 14.779 5.355 -5.910 1.00 0.99 C ATOM 502 C GLU A 30 15.760 4.515 -5.106 1.00 0.99 C ATOM 503 O GLU A 30 16.973 4.702 -5.196 1.00 1.01 O ATOM 504 CB GLU A 30 14.305 6.558 -5.088 1.00 1.06 C ATOM 505 CG GLU A 30 13.372 7.482 -5.853 1.00 1.10 C ATOM 506 CD GLU A 30 13.875 7.808 -7.246 1.00 1.18 C ATOM 507 OE1 GLU A 30 13.620 7.017 -8.176 1.00 1.25 O ATOM 508 OE2 GLU A 30 14.513 8.869 -7.423 1.00 1.46 O ATOM 0 H GLU A 30 12.751 4.829 -5.931 1.00 0.93 H new ATOM 0 HA GLU A 30 15.286 5.727 -6.800 1.00 0.99 H new ATOM 0 HB2 GLU A 30 13.796 6.199 -4.193 1.00 1.06 H new ATOM 0 HB3 GLU A 30 15.174 7.126 -4.755 1.00 1.06 H new ATOM 0 HG2 GLU A 30 12.389 7.017 -5.927 1.00 1.10 H new ATOM 0 HG3 GLU A 30 13.246 8.408 -5.292 1.00 1.10 H new ATOM 515 N PHE A 31 15.228 3.580 -4.328 1.00 0.97 N ATOM 516 CA PHE A 31 16.057 2.692 -3.524 1.00 1.00 C ATOM 517 C PHE A 31 17.020 1.919 -4.418 1.00 0.97 C ATOM 518 O PHE A 31 18.170 1.680 -4.050 1.00 1.00 O ATOM 519 CB PHE A 31 15.188 1.721 -2.723 1.00 1.02 C ATOM 520 CG PHE A 31 14.812 2.223 -1.357 1.00 1.10 C ATOM 521 CD1 PHE A 31 14.222 3.467 -1.196 1.00 1.42 C ATOM 522 CD2 PHE A 31 15.043 1.449 -0.232 1.00 1.79 C ATOM 523 CE1 PHE A 31 13.868 3.928 0.057 1.00 1.58 C ATOM 524 CE2 PHE A 31 14.693 1.904 1.026 1.00 1.98 C ATOM 525 CZ PHE A 31 14.103 3.147 1.169 1.00 1.54 C ATOM 0 H PHE A 31 14.225 3.417 -4.237 1.00 0.97 H new ATOM 0 HA PHE A 31 16.633 3.298 -2.824 1.00 1.00 H new ATOM 0 HB2 PHE A 31 14.278 1.514 -3.286 1.00 1.02 H new ATOM 0 HB3 PHE A 31 15.720 0.775 -2.618 1.00 1.02 H new ATOM 0 HD1 PHE A 31 14.037 4.084 -2.062 1.00 1.42 H new ATOM 0 HD2 PHE A 31 15.502 0.477 -0.339 1.00 1.79 H new ATOM 0 HE1 PHE A 31 13.408 4.899 0.166 1.00 1.58 H new ATOM 0 HE2 PHE A 31 14.880 1.290 1.895 1.00 1.98 H new ATOM 0 HZ PHE A 31 13.827 3.505 2.150 1.00 1.54 H new ATOM 535 N ASP A 32 16.534 1.526 -5.593 1.00 0.93 N ATOM 536 CA ASP A 32 17.354 0.799 -6.559 1.00 0.92 C ATOM 537 C ASP A 32 18.406 1.727 -7.166 1.00 0.92 C ATOM 538 O ASP A 32 19.567 1.349 -7.335 1.00 0.93 O ATOM 539 CB ASP A 32 16.474 0.202 -7.664 1.00 0.94 C ATOM 540 CG ASP A 32 17.276 -0.465 -8.765 1.00 1.15 C ATOM 541 OD1 ASP A 32 17.848 -1.548 -8.518 1.00 1.54 O ATOM 542 OD2 ASP A 32 17.316 0.076 -9.891 1.00 1.45 O ATOM 0 H ASP A 32 15.577 1.699 -5.899 1.00 0.93 H new ATOM 0 HA ASP A 32 17.862 -0.014 -6.040 1.00 0.92 H new ATOM 0 HB2 ASP A 32 15.794 -0.528 -7.225 1.00 0.94 H new ATOM 0 HB3 ASP A 32 15.859 0.991 -8.097 1.00 0.94 H new ATOM 547 N VAL A 33 17.995 2.956 -7.452 1.00 0.93 N ATOM 548 CA VAL A 33 18.888 3.955 -8.035 1.00 0.95 C ATOM 549 C VAL A 33 20.026 4.308 -7.078 1.00 0.96 C ATOM 550 O VAL A 33 21.192 4.338 -7.470 1.00 0.97 O ATOM 551 CB VAL A 33 18.126 5.252 -8.395 1.00 0.99 C ATOM 552 CG1 VAL A 33 19.044 6.252 -9.075 1.00 1.06 C ATOM 553 CG2 VAL A 33 16.926 4.946 -9.276 1.00 0.98 C ATOM 0 H VAL A 33 17.044 3.288 -7.289 1.00 0.93 H new ATOM 0 HA VAL A 33 19.299 3.513 -8.943 1.00 0.95 H new ATOM 0 HB VAL A 33 17.767 5.697 -7.467 1.00 0.99 H new ATOM 0 HG11 VAL A 33 18.483 7.155 -9.317 1.00 1.06 H new ATOM 0 HG12 VAL A 33 19.866 6.505 -8.406 1.00 1.06 H new ATOM 0 HG13 VAL A 33 19.443 5.816 -9.991 1.00 1.06 H new ATOM 0 HG21 VAL A 33 16.405 5.873 -9.516 1.00 0.98 H new ATOM 0 HG22 VAL A 33 17.263 4.470 -10.197 1.00 0.98 H new ATOM 0 HG23 VAL A 33 16.248 4.276 -8.748 1.00 0.98 H new ATOM 563 N VAL A 34 19.675 4.566 -5.825 1.00 0.98 N ATOM 564 CA VAL A 34 20.651 4.934 -4.802 1.00 1.02 C ATOM 565 C VAL A 34 21.704 3.845 -4.617 1.00 1.02 C ATOM 566 O VAL A 34 22.878 4.146 -4.418 1.00 1.04 O ATOM 567 CB VAL A 34 19.965 5.232 -3.449 1.00 1.07 C ATOM 568 CG1 VAL A 34 20.992 5.469 -2.346 1.00 1.14 C ATOM 569 CG2 VAL A 34 19.042 6.439 -3.571 1.00 1.08 C ATOM 0 H VAL A 34 18.713 4.527 -5.488 1.00 0.98 H new ATOM 0 HA VAL A 34 21.146 5.841 -5.150 1.00 1.02 H new ATOM 0 HB VAL A 34 19.372 4.358 -3.180 1.00 1.07 H new ATOM 0 HG11 VAL A 34 20.477 5.676 -1.408 1.00 1.14 H new ATOM 0 HG12 VAL A 34 21.614 4.581 -2.231 1.00 1.14 H new ATOM 0 HG13 VAL A 34 21.620 6.320 -2.610 1.00 1.14 H new ATOM 0 HG21 VAL A 34 18.568 6.633 -2.609 1.00 1.08 H new ATOM 0 HG22 VAL A 34 19.622 7.311 -3.873 1.00 1.08 H new ATOM 0 HG23 VAL A 34 18.275 6.237 -4.319 1.00 1.08 H new ATOM 579 N LYS A 35 21.284 2.585 -4.703 1.00 1.00 N ATOM 580 CA LYS A 35 22.205 1.466 -4.541 1.00 1.02 C ATOM 581 C LYS A 35 23.271 1.484 -5.639 1.00 1.01 C ATOM 582 O LYS A 35 24.452 1.258 -5.381 1.00 1.04 O ATOM 583 CB LYS A 35 21.448 0.131 -4.554 1.00 1.02 C ATOM 584 CG LYS A 35 22.159 -0.978 -3.790 1.00 1.06 C ATOM 585 CD LYS A 35 21.291 -2.221 -3.657 1.00 1.23 C ATOM 586 CE LYS A 35 22.013 -3.323 -2.892 1.00 1.45 C ATOM 587 NZ LYS A 35 21.085 -4.406 -2.461 1.00 1.92 N ATOM 0 H LYS A 35 20.317 2.315 -4.883 1.00 1.00 H new ATOM 0 HA LYS A 35 22.699 1.571 -3.575 1.00 1.02 H new ATOM 0 HB2 LYS A 35 20.457 0.280 -4.124 1.00 1.02 H new ATOM 0 HB3 LYS A 35 21.303 -0.185 -5.587 1.00 1.02 H new ATOM 0 HG2 LYS A 35 23.086 -1.235 -4.302 1.00 1.06 H new ATOM 0 HG3 LYS A 35 22.432 -0.618 -2.798 1.00 1.06 H new ATOM 0 HD2 LYS A 35 20.364 -1.966 -3.143 1.00 1.23 H new ATOM 0 HD3 LYS A 35 21.017 -2.583 -4.648 1.00 1.23 H new ATOM 0 HE2 LYS A 35 22.797 -3.746 -3.520 1.00 1.45 H new ATOM 0 HE3 LYS A 35 22.502 -2.896 -2.017 1.00 1.45 H new ATOM 0 HZ1 LYS A 35 21.618 -5.135 -1.944 1.00 1.92 H new ATOM 0 HZ2 LYS A 35 20.352 -4.008 -1.840 1.00 1.92 H new ATOM 0 HZ3 LYS A 35 20.637 -4.832 -3.297 1.00 1.92 H new ATOM 601 N GLU A 36 22.846 1.766 -6.861 1.00 0.99 N ATOM 602 CA GLU A 36 23.762 1.823 -7.993 1.00 1.00 C ATOM 603 C GLU A 36 24.635 3.084 -7.926 1.00 0.99 C ATOM 604 O GLU A 36 25.803 3.071 -8.321 1.00 1.01 O ATOM 605 CB GLU A 36 22.973 1.791 -9.301 1.00 1.03 C ATOM 606 CG GLU A 36 23.737 1.154 -10.450 1.00 1.31 C ATOM 607 CD GLU A 36 24.190 -0.256 -10.133 1.00 1.41 C ATOM 608 OE1 GLU A 36 25.240 -0.420 -9.472 1.00 1.44 O ATOM 609 OE2 GLU A 36 23.505 -1.211 -10.548 1.00 1.71 O ATOM 0 H GLU A 36 21.872 1.959 -7.096 1.00 0.99 H new ATOM 0 HA GLU A 36 24.419 0.955 -7.952 1.00 1.00 H new ATOM 0 HB2 GLU A 36 22.044 1.243 -9.143 1.00 1.03 H new ATOM 0 HB3 GLU A 36 22.699 2.809 -9.577 1.00 1.03 H new ATOM 0 HG2 GLU A 36 23.105 1.138 -11.338 1.00 1.31 H new ATOM 0 HG3 GLU A 36 24.606 1.767 -10.688 1.00 1.31 H new ATOM 616 N SER A 37 24.076 4.158 -7.411 1.00 0.00 N ATOM 617 CA SER A 37 24.764 5.439 -7.279 1.00 0.00 C ATOM 618 C SER A 37 25.941 5.326 -6.339 1.00 0.00 C ATOM 619 O SER A 37 27.054 5.784 -6.643 1.00 0.00 O ATOM 620 CB SER A 37 23.781 6.549 -6.830 1.00 0.00 C ATOM 621 OG SER A 37 22.790 6.848 -7.819 1.00 0.00 O ATOM 0 H SER A 37 23.117 4.173 -7.065 1.00 0.00 H new ATOM 0 HA SER A 37 25.153 5.720 -8.258 1.00 0.00 H new ATOM 0 HB2 SER A 37 23.287 6.239 -5.909 1.00 0.00 H new ATOM 0 HB3 SER A 37 24.343 7.454 -6.601 1.00 0.00 H new ATOM 0 HG SER A 37 22.142 6.114 -7.865 1.00 0.00 H new ATOM 627 N VAL A 38 25.724 4.735 -5.163 1.00 1.03 N ATOM 628 CA VAL A 38 26.785 4.605 -4.170 1.00 1.06 C ATOM 629 C VAL A 38 27.938 3.757 -4.699 1.00 1.07 C ATOM 630 O VAL A 38 29.081 3.942 -4.290 1.00 1.09 O ATOM 631 CB VAL A 38 26.283 4.035 -2.822 1.00 1.10 C ATOM 632 CG1 VAL A 38 25.215 4.938 -2.226 1.00 1.12 C ATOM 633 CG2 VAL A 38 25.768 2.611 -2.977 1.00 1.10 C ATOM 0 H VAL A 38 24.827 4.341 -4.878 1.00 1.03 H new ATOM 0 HA VAL A 38 27.144 5.617 -3.981 1.00 1.06 H new ATOM 0 HB VAL A 38 27.129 4.003 -2.136 1.00 1.10 H new ATOM 0 HG11 VAL A 38 24.874 4.521 -1.278 1.00 1.12 H new ATOM 0 HG12 VAL A 38 25.631 5.931 -2.057 1.00 1.12 H new ATOM 0 HG13 VAL A 38 24.373 5.010 -2.915 1.00 1.12 H new ATOM 0 HG21 VAL A 38 25.423 2.242 -2.011 1.00 1.10 H new ATOM 0 HG22 VAL A 38 24.941 2.599 -3.687 1.00 1.10 H new ATOM 0 HG23 VAL A 38 26.571 1.972 -3.344 1.00 1.10 H new ATOM 643 N ASN A 39 27.637 2.836 -5.611 1.00 1.05 N ATOM 644 CA ASN A 39 28.667 1.988 -6.203 1.00 1.08 C ATOM 645 C ASN A 39 29.674 2.845 -6.963 1.00 1.07 C ATOM 646 O ASN A 39 30.883 2.721 -6.772 1.00 1.10 O ATOM 647 CB ASN A 39 28.048 0.952 -7.149 1.00 1.10 C ATOM 648 CG ASN A 39 27.387 -0.195 -6.411 1.00 1.41 C ATOM 649 OD1 ASN A 39 27.831 -0.597 -5.334 1.00 1.68 O ATOM 650 ND2 ASN A 39 26.324 -0.736 -6.984 1.00 1.72 N ATOM 0 H ASN A 39 26.693 2.659 -5.955 1.00 1.05 H new ATOM 0 HA ASN A 39 29.176 1.458 -5.398 1.00 1.08 H new ATOM 0 HB2 ASN A 39 27.311 1.442 -7.785 1.00 1.10 H new ATOM 0 HB3 ASN A 39 28.823 0.557 -7.806 1.00 1.10 H new ATOM 0 HD21 ASN A 39 25.842 -1.514 -6.533 1.00 1.72 H new ATOM 0 HD22 ASN A 39 25.987 -0.375 -7.876 1.00 1.72 H new ATOM 657 N GLU A 40 29.156 3.736 -7.800 1.00 1.06 N ATOM 658 CA GLU A 40 29.989 4.630 -8.596 1.00 1.08 C ATOM 659 C GLU A 40 30.769 5.594 -7.703 1.00 1.06 C ATOM 660 O GLU A 40 31.926 5.921 -7.976 1.00 1.09 O ATOM 661 CB GLU A 40 29.116 5.419 -9.569 1.00 1.11 C ATOM 662 CG GLU A 40 28.601 4.588 -10.728 1.00 1.33 C ATOM 663 CD GLU A 40 29.709 4.181 -11.677 1.00 1.77 C ATOM 664 OE1 GLU A 40 30.067 4.991 -12.556 1.00 2.13 O ATOM 665 OE2 GLU A 40 30.229 3.053 -11.548 1.00 2.31 O ATOM 0 H GLU A 40 28.154 3.859 -7.946 1.00 1.06 H new ATOM 0 HA GLU A 40 30.704 4.025 -9.154 1.00 1.08 H new ATOM 0 HB2 GLU A 40 28.268 5.837 -9.027 1.00 1.11 H new ATOM 0 HB3 GLU A 40 29.690 6.259 -9.961 1.00 1.11 H new ATOM 0 HG2 GLU A 40 28.109 3.695 -10.342 1.00 1.33 H new ATOM 0 HG3 GLU A 40 27.848 5.156 -11.274 1.00 1.33 H new ATOM 672 N LEU A 41 30.121 6.050 -6.640 1.00 1.04 N ATOM 673 CA LEU A 41 30.737 6.980 -5.703 1.00 1.05 C ATOM 674 C LEU A 41 31.923 6.332 -4.991 1.00 1.08 C ATOM 675 O LEU A 41 32.975 6.951 -4.825 1.00 1.12 O ATOM 676 CB LEU A 41 29.707 7.456 -4.679 1.00 1.04 C ATOM 677 CG LEU A 41 30.202 8.530 -3.706 1.00 1.04 C ATOM 678 CD1 LEU A 41 30.378 9.863 -4.415 1.00 1.19 C ATOM 679 CD2 LEU A 41 29.244 8.672 -2.532 1.00 1.07 C ATOM 0 H LEU A 41 29.164 5.789 -6.404 1.00 1.04 H new ATOM 0 HA LEU A 41 31.103 7.838 -6.266 1.00 1.05 H new ATOM 0 HB2 LEU A 41 28.840 7.845 -5.213 1.00 1.04 H new ATOM 0 HB3 LEU A 41 29.367 6.596 -4.103 1.00 1.04 H new ATOM 0 HG LEU A 41 31.173 8.218 -3.323 1.00 1.04 H new ATOM 0 HD11 LEU A 41 30.730 10.610 -3.703 1.00 1.19 H new ATOM 0 HD12 LEU A 41 31.107 9.755 -5.218 1.00 1.19 H new ATOM 0 HD13 LEU A 41 29.423 10.182 -4.833 1.00 1.19 H new ATOM 0 HD21 LEU A 41 29.613 9.440 -1.852 1.00 1.07 H new ATOM 0 HD22 LEU A 41 28.258 8.956 -2.899 1.00 1.07 H new ATOM 0 HD23 LEU A 41 29.174 7.722 -2.003 1.00 1.07 H new ATOM 691 N SER A 42 31.746 5.081 -4.587 1.00 1.07 N ATOM 692 CA SER A 42 32.785 4.336 -3.887 1.00 1.12 C ATOM 693 C SER A 42 33.996 4.113 -4.781 1.00 1.16 C ATOM 694 O SER A 42 35.129 4.093 -4.302 1.00 1.20 O ATOM 695 CB SER A 42 32.234 2.991 -3.409 1.00 1.13 C ATOM 696 OG SER A 42 31.055 3.170 -2.642 1.00 1.47 O ATOM 0 H SER A 42 30.884 4.556 -4.734 1.00 1.07 H new ATOM 0 HA SER A 42 33.101 4.923 -3.025 1.00 1.12 H new ATOM 0 HB2 SER A 42 32.020 2.355 -4.268 1.00 1.13 H new ATOM 0 HB3 SER A 42 32.987 2.477 -2.811 1.00 1.13 H new ATOM 0 HG SER A 42 30.286 3.265 -3.242 1.00 1.47 H new ATOM 702 N GLU A 43 33.756 3.961 -6.079 1.00 1.16 N ATOM 703 CA GLU A 43 34.842 3.749 -7.028 1.00 1.22 C ATOM 704 C GLU A 43 35.769 4.963 -7.052 1.00 1.21 C ATOM 705 O GLU A 43 36.986 4.828 -7.192 1.00 1.25 O ATOM 706 CB GLU A 43 34.286 3.469 -8.430 1.00 1.27 C ATOM 707 CG GLU A 43 35.263 2.741 -9.339 1.00 1.60 C ATOM 708 CD GLU A 43 35.915 1.552 -8.660 1.00 1.71 C ATOM 709 OE1 GLU A 43 35.208 0.769 -7.995 1.00 1.94 O ATOM 710 OE2 GLU A 43 37.148 1.401 -8.775 1.00 1.98 O ATOM 0 H GLU A 43 32.825 3.980 -6.496 1.00 1.16 H new ATOM 0 HA GLU A 43 35.417 2.880 -6.708 1.00 1.22 H new ATOM 0 HB2 GLU A 43 33.376 2.875 -8.339 1.00 1.27 H new ATOM 0 HB3 GLU A 43 34.005 4.414 -8.895 1.00 1.27 H new ATOM 0 HG2 GLU A 43 34.739 2.402 -10.233 1.00 1.60 H new ATOM 0 HG3 GLU A 43 36.036 3.436 -9.667 1.00 1.60 H new ATOM 717 N LYS A 44 35.182 6.145 -6.903 1.00 1.18 N ATOM 718 CA LYS A 44 35.953 7.384 -6.894 1.00 1.20 C ATOM 719 C LYS A 44 36.619 7.599 -5.536 1.00 1.20 C ATOM 720 O LYS A 44 37.757 8.061 -5.457 1.00 1.25 O ATOM 721 CB LYS A 44 35.051 8.578 -7.212 1.00 1.22 C ATOM 722 CG LYS A 44 34.456 8.540 -8.610 1.00 1.25 C ATOM 723 CD LYS A 44 34.902 9.735 -9.437 1.00 1.46 C ATOM 724 CE LYS A 44 34.025 9.923 -10.663 1.00 1.75 C ATOM 725 NZ LYS A 44 34.463 11.079 -11.486 1.00 2.12 N ATOM 0 H LYS A 44 34.177 6.272 -6.787 1.00 1.18 H new ATOM 0 HA LYS A 44 36.726 7.302 -7.659 1.00 1.20 H new ATOM 0 HB2 LYS A 44 34.241 8.614 -6.483 1.00 1.22 H new ATOM 0 HB3 LYS A 44 35.626 9.497 -7.096 1.00 1.22 H new ATOM 0 HG2 LYS A 44 34.755 7.618 -9.109 1.00 1.25 H new ATOM 0 HG3 LYS A 44 33.368 8.528 -8.544 1.00 1.25 H new ATOM 0 HD2 LYS A 44 34.869 10.636 -8.824 1.00 1.46 H new ATOM 0 HD3 LYS A 44 35.938 9.598 -9.747 1.00 1.46 H new ATOM 0 HE2 LYS A 44 34.048 9.017 -11.268 1.00 1.75 H new ATOM 0 HE3 LYS A 44 32.991 10.071 -10.351 1.00 1.75 H new ATOM 0 HZ1 LYS A 44 33.839 11.173 -12.313 1.00 2.12 H new ATOM 0 HZ2 LYS A 44 34.417 11.948 -10.917 1.00 2.12 H new ATOM 0 HZ3 LYS A 44 35.441 10.927 -11.806 1.00 2.12 H new ATOM 739 N ALA A 45 35.911 7.241 -4.470 1.00 1.17 N ATOM 740 CA ALA A 45 36.413 7.413 -3.106 1.00 1.18 C ATOM 741 C ALA A 45 37.562 6.460 -2.782 1.00 1.18 C ATOM 742 O ALA A 45 38.335 6.700 -1.859 1.00 1.19 O ATOM 743 CB ALA A 45 35.282 7.226 -2.107 1.00 1.21 C ATOM 0 H ALA A 45 34.980 6.827 -4.523 1.00 1.17 H new ATOM 0 HA ALA A 45 36.806 8.427 -3.032 1.00 1.18 H new ATOM 0 HB1 ALA A 45 35.665 7.356 -1.095 1.00 1.21 H new ATOM 0 HB2 ALA A 45 34.503 7.964 -2.297 1.00 1.21 H new ATOM 0 HB3 ALA A 45 34.866 6.224 -2.212 1.00 1.21 H new ATOM 749 N LYS A 46 37.683 5.391 -3.555 1.00 1.21 N ATOM 750 CA LYS A 46 38.736 4.396 -3.340 1.00 1.24 C ATOM 751 C LYS A 46 40.128 4.987 -3.560 1.00 1.24 C ATOM 752 O LYS A 46 41.115 4.491 -3.017 1.00 1.27 O ATOM 753 CB LYS A 46 38.537 3.210 -4.281 1.00 1.32 C ATOM 754 CG LYS A 46 37.635 2.122 -3.718 1.00 1.61 C ATOM 755 CD LYS A 46 37.114 1.201 -4.814 1.00 2.02 C ATOM 756 CE LYS A 46 38.245 0.597 -5.635 1.00 2.38 C ATOM 757 NZ LYS A 46 37.732 -0.272 -6.724 1.00 2.75 N ATOM 0 H LYS A 46 37.065 5.185 -4.340 1.00 1.21 H new ATOM 0 HA LYS A 46 38.666 4.065 -2.304 1.00 1.24 H new ATOM 0 HB2 LYS A 46 38.114 3.570 -5.219 1.00 1.32 H new ATOM 0 HB3 LYS A 46 39.510 2.777 -4.515 1.00 1.32 H new ATOM 0 HG2 LYS A 46 38.186 1.537 -2.982 1.00 1.61 H new ATOM 0 HG3 LYS A 46 36.794 2.580 -3.197 1.00 1.61 H new ATOM 0 HD2 LYS A 46 36.524 0.402 -4.366 1.00 2.02 H new ATOM 0 HD3 LYS A 46 36.447 1.760 -5.471 1.00 2.02 H new ATOM 0 HE2 LYS A 46 38.851 1.396 -6.062 1.00 2.38 H new ATOM 0 HE3 LYS A 46 38.897 0.016 -4.983 1.00 2.38 H new ATOM 0 HZ1 LYS A 46 38.292 -1.148 -6.762 1.00 2.75 H new ATOM 0 HZ2 LYS A 46 36.735 -0.506 -6.541 1.00 2.75 H new ATOM 0 HZ3 LYS A 46 37.809 0.228 -7.633 1.00 2.75 H new ATOM 771 N THR A 47 40.191 6.054 -4.337 1.00 1.23 N ATOM 772 CA THR A 47 41.452 6.700 -4.658 1.00 1.26 C ATOM 773 C THR A 47 41.920 7.652 -3.554 1.00 1.21 C ATOM 774 O THR A 47 42.930 8.340 -3.711 1.00 1.30 O ATOM 775 CB THR A 47 41.329 7.475 -5.983 1.00 1.39 C ATOM 776 OG1 THR A 47 40.075 7.164 -6.616 1.00 1.54 O ATOM 777 CG2 THR A 47 42.472 7.116 -6.918 1.00 1.62 C ATOM 0 H THR A 47 39.375 6.495 -4.761 1.00 1.23 H new ATOM 0 HA THR A 47 42.197 5.910 -4.753 1.00 1.26 H new ATOM 0 HB THR A 47 41.373 8.542 -5.765 1.00 1.39 H new ATOM 0 HG1 THR A 47 39.357 7.674 -6.187 1.00 1.54 H new ATOM 0 HG21 THR A 47 42.369 7.673 -7.849 1.00 1.62 H new ATOM 0 HG22 THR A 47 43.421 7.370 -6.446 1.00 1.62 H new ATOM 0 HG23 THR A 47 42.447 6.047 -7.130 1.00 1.62 H new ATOM 785 N ASP A 48 41.196 7.690 -2.443 1.00 1.15 N ATOM 786 CA ASP A 48 41.555 8.562 -1.333 1.00 1.15 C ATOM 787 C ASP A 48 41.106 7.962 0.000 1.00 1.09 C ATOM 788 O ASP A 48 39.912 7.779 0.234 1.00 1.06 O ATOM 789 CB ASP A 48 40.928 9.944 -1.535 1.00 1.24 C ATOM 790 CG ASP A 48 40.987 10.807 -0.292 1.00 1.32 C ATOM 791 OD1 ASP A 48 42.028 10.808 0.394 1.00 1.50 O ATOM 792 OD2 ASP A 48 39.984 11.488 0.004 1.00 1.41 O ATOM 0 H ASP A 48 40.359 7.129 -2.287 1.00 1.15 H new ATOM 0 HA ASP A 48 42.640 8.663 -1.307 1.00 1.15 H new ATOM 0 HB2 ASP A 48 41.441 10.454 -2.350 1.00 1.24 H new ATOM 0 HB3 ASP A 48 39.888 9.824 -1.839 1.00 1.24 H new ATOM 797 N PRO A 49 42.060 7.653 0.897 1.00 1.12 N ATOM 798 CA PRO A 49 41.760 7.070 2.213 1.00 1.13 C ATOM 799 C PRO A 49 40.820 7.945 3.043 1.00 1.17 C ATOM 800 O PRO A 49 40.097 7.451 3.912 1.00 1.18 O ATOM 801 CB PRO A 49 43.132 6.960 2.892 1.00 1.22 C ATOM 802 CG PRO A 49 44.045 7.832 2.099 1.00 1.25 C ATOM 803 CD PRO A 49 43.508 7.839 0.701 1.00 1.19 C ATOM 0 HA PRO A 49 41.245 6.114 2.117 1.00 1.13 H new ATOM 0 HB2 PRO A 49 43.082 7.287 3.931 1.00 1.22 H new ATOM 0 HB3 PRO A 49 43.484 5.928 2.899 1.00 1.22 H new ATOM 0 HG2 PRO A 49 44.073 8.841 2.510 1.00 1.25 H new ATOM 0 HG3 PRO A 49 45.065 7.450 2.122 1.00 1.25 H new ATOM 0 HD2 PRO A 49 43.728 8.776 0.190 1.00 1.19 H new ATOM 0 HD3 PRO A 49 43.939 7.039 0.100 1.00 1.19 H new ATOM 811 N GLN A 50 40.836 9.247 2.782 1.00 1.23 N ATOM 812 CA GLN A 50 39.971 10.173 3.499 1.00 1.30 C ATOM 813 C GLN A 50 38.529 9.969 3.053 1.00 1.21 C ATOM 814 O GLN A 50 37.615 9.864 3.875 1.00 1.22 O ATOM 815 CB GLN A 50 40.398 11.625 3.249 1.00 1.43 C ATOM 816 CG GLN A 50 41.428 12.153 4.238 1.00 1.59 C ATOM 817 CD GLN A 50 42.814 11.558 4.049 1.00 1.77 C ATOM 818 OE1 GLN A 50 43.565 11.397 5.012 1.00 2.00 O ATOM 819 NE2 GLN A 50 43.183 11.250 2.816 1.00 1.96 N ATOM 0 H GLN A 50 41.436 9.683 2.082 1.00 1.23 H new ATOM 0 HA GLN A 50 40.055 9.974 4.567 1.00 1.30 H new ATOM 0 HB2 GLN A 50 40.805 11.703 2.241 1.00 1.43 H new ATOM 0 HB3 GLN A 50 39.515 12.263 3.286 1.00 1.43 H new ATOM 0 HG2 GLN A 50 41.491 13.237 4.141 1.00 1.59 H new ATOM 0 HG3 GLN A 50 41.087 11.943 5.252 1.00 1.59 H new ATOM 0 HE21 GLN A 50 42.538 11.395 2.039 1.00 1.96 H new ATOM 0 HE22 GLN A 50 44.112 10.868 2.642 1.00 1.96 H new ATOM 828 N ALA A 51 38.342 9.907 1.740 1.00 1.16 N ATOM 829 CA ALA A 51 37.030 9.706 1.152 1.00 1.11 C ATOM 830 C ALA A 51 36.492 8.317 1.477 1.00 1.02 C ATOM 831 O ALA A 51 35.291 8.139 1.669 1.00 1.00 O ATOM 832 CB ALA A 51 37.084 9.922 -0.353 1.00 1.15 C ATOM 0 H ALA A 51 39.095 9.995 1.058 1.00 1.16 H new ATOM 0 HA ALA A 51 36.348 10.439 1.583 1.00 1.11 H new ATOM 0 HB1 ALA A 51 36.092 9.768 -0.779 1.00 1.15 H new ATOM 0 HB2 ALA A 51 37.415 10.939 -0.563 1.00 1.15 H new ATOM 0 HB3 ALA A 51 37.784 9.214 -0.797 1.00 1.15 H new ATOM 838 N ALA A 52 37.388 7.336 1.537 1.00 1.01 N ATOM 839 CA ALA A 52 37.008 5.966 1.859 1.00 1.01 C ATOM 840 C ALA A 52 36.349 5.901 3.232 1.00 1.04 C ATOM 841 O ALA A 52 35.354 5.200 3.428 1.00 1.05 O ATOM 842 CB ALA A 52 38.224 5.054 1.806 1.00 1.07 C ATOM 0 H ALA A 52 38.385 7.466 1.366 1.00 1.01 H new ATOM 0 HA ALA A 52 36.286 5.624 1.117 1.00 1.01 H new ATOM 0 HB1 ALA A 52 37.925 4.034 2.049 1.00 1.07 H new ATOM 0 HB2 ALA A 52 38.653 5.078 0.804 1.00 1.07 H new ATOM 0 HB3 ALA A 52 38.967 5.396 2.527 1.00 1.07 H new ATOM 848 N GLU A 53 36.898 6.655 4.176 1.00 1.10 N ATOM 849 CA GLU A 53 36.361 6.702 5.530 1.00 1.20 C ATOM 850 C GLU A 53 34.992 7.390 5.545 1.00 1.18 C ATOM 851 O GLU A 53 34.144 7.090 6.387 1.00 1.23 O ATOM 852 CB GLU A 53 37.345 7.414 6.464 1.00 1.32 C ATOM 853 CG GLU A 53 36.911 7.467 7.923 1.00 1.52 C ATOM 854 CD GLU A 53 36.259 6.187 8.413 1.00 1.64 C ATOM 855 OE1 GLU A 53 36.800 5.092 8.150 1.00 1.87 O ATOM 856 OE2 GLU A 53 35.188 6.279 9.052 1.00 1.65 O ATOM 0 H GLU A 53 37.717 7.244 4.028 1.00 1.10 H new ATOM 0 HA GLU A 53 36.225 5.682 5.889 1.00 1.20 H new ATOM 0 HB2 GLU A 53 38.310 6.912 6.404 1.00 1.32 H new ATOM 0 HB3 GLU A 53 37.493 8.433 6.106 1.00 1.32 H new ATOM 0 HG2 GLU A 53 37.781 7.682 8.544 1.00 1.52 H new ATOM 0 HG3 GLU A 53 36.213 8.294 8.055 1.00 1.52 H new ATOM 863 N LYS A 54 34.775 8.309 4.610 1.00 1.14 N ATOM 864 CA LYS A 54 33.495 9.008 4.519 1.00 1.15 C ATOM 865 C LYS A 54 32.393 8.010 4.176 1.00 1.06 C ATOM 866 O LYS A 54 31.258 8.131 4.637 1.00 1.08 O ATOM 867 CB LYS A 54 33.543 10.118 3.466 1.00 1.20 C ATOM 868 CG LYS A 54 34.601 11.176 3.730 1.00 1.43 C ATOM 869 CD LYS A 54 34.658 12.183 2.596 1.00 1.56 C ATOM 870 CE LYS A 54 35.892 13.063 2.695 1.00 1.86 C ATOM 871 NZ LYS A 54 36.010 13.988 1.538 1.00 2.25 N ATOM 0 H LYS A 54 35.462 8.587 3.909 1.00 1.14 H new ATOM 0 HA LYS A 54 33.285 9.470 5.484 1.00 1.15 H new ATOM 0 HB2 LYS A 54 33.728 9.670 2.489 1.00 1.20 H new ATOM 0 HB3 LYS A 54 32.567 10.600 3.416 1.00 1.20 H new ATOM 0 HG2 LYS A 54 34.381 11.689 4.666 1.00 1.43 H new ATOM 0 HG3 LYS A 54 35.575 10.700 3.848 1.00 1.43 H new ATOM 0 HD2 LYS A 54 34.660 11.657 1.641 1.00 1.56 H new ATOM 0 HD3 LYS A 54 33.763 12.805 2.615 1.00 1.56 H new ATOM 0 HE2 LYS A 54 35.852 13.641 3.618 1.00 1.86 H new ATOM 0 HE3 LYS A 54 36.781 12.435 2.750 1.00 1.86 H new ATOM 0 HZ1 LYS A 54 36.865 14.570 1.645 1.00 2.25 H new ATOM 0 HZ2 LYS A 54 36.074 13.437 0.658 1.00 2.25 H new ATOM 0 HZ3 LYS A 54 35.174 14.605 1.500 1.00 2.25 H new ATOM 885 N LEU A 55 32.747 7.012 3.376 1.00 0.98 N ATOM 886 CA LEU A 55 31.801 5.977 2.972 1.00 0.95 C ATOM 887 C LEU A 55 31.565 4.995 4.116 1.00 0.98 C ATOM 888 O LEU A 55 30.469 4.453 4.271 1.00 1.00 O ATOM 889 CB LEU A 55 32.318 5.231 1.740 1.00 0.93 C ATOM 890 CG LEU A 55 31.718 5.669 0.397 1.00 1.05 C ATOM 891 CD1 LEU A 55 30.226 5.374 0.352 1.00 1.34 C ATOM 892 CD2 LEU A 55 31.971 7.146 0.147 1.00 1.22 C ATOM 0 H LEU A 55 33.685 6.896 2.993 1.00 0.98 H new ATOM 0 HA LEU A 55 30.855 6.457 2.720 1.00 0.95 H new ATOM 0 HB2 LEU A 55 33.400 5.354 1.691 1.00 0.93 H new ATOM 0 HB3 LEU A 55 32.124 4.167 1.874 1.00 0.93 H new ATOM 0 HG LEU A 55 32.208 5.098 -0.392 1.00 1.05 H new ATOM 0 HD11 LEU A 55 29.821 5.692 -0.609 1.00 1.34 H new ATOM 0 HD12 LEU A 55 30.063 4.304 0.478 1.00 1.34 H new ATOM 0 HD13 LEU A 55 29.724 5.914 1.154 1.00 1.34 H new ATOM 0 HD21 LEU A 55 31.536 7.433 -0.811 1.00 1.22 H new ATOM 0 HD22 LEU A 55 31.514 7.733 0.943 1.00 1.22 H new ATOM 0 HD23 LEU A 55 33.045 7.333 0.129 1.00 1.22 H new ATOM 904 N ASN A 56 32.601 4.777 4.915 1.00 1.04 N ATOM 905 CA ASN A 56 32.527 3.867 6.056 1.00 1.14 C ATOM 906 C ASN A 56 31.476 4.333 7.063 1.00 1.19 C ATOM 907 O ASN A 56 30.629 3.554 7.504 1.00 1.25 O ATOM 908 CB ASN A 56 33.898 3.776 6.730 1.00 1.25 C ATOM 909 CG ASN A 56 33.917 2.820 7.910 1.00 1.42 C ATOM 910 OD1 ASN A 56 33.206 1.815 7.921 1.00 1.48 O ATOM 911 ND2 ASN A 56 34.723 3.128 8.915 1.00 1.57 N ATOM 0 H ASN A 56 33.511 5.221 4.794 1.00 1.04 H new ATOM 0 HA ASN A 56 32.233 2.882 5.694 1.00 1.14 H new ATOM 0 HB2 ASN A 56 34.637 3.453 5.996 1.00 1.25 H new ATOM 0 HB3 ASN A 56 34.197 4.768 7.068 1.00 1.25 H new ATOM 0 HD21 ASN A 56 34.770 2.523 9.735 1.00 1.57 H new ATOM 0 HD22 ASN A 56 35.297 3.970 8.869 1.00 1.57 H new ATOM 918 N LYS A 57 31.526 5.609 7.412 1.00 1.20 N ATOM 919 CA LYS A 57 30.570 6.177 8.358 1.00 1.28 C ATOM 920 C LYS A 57 29.193 6.308 7.719 1.00 1.22 C ATOM 921 O LYS A 57 28.173 6.192 8.396 1.00 1.27 O ATOM 922 CB LYS A 57 31.053 7.535 8.878 1.00 1.39 C ATOM 923 CG LYS A 57 31.591 8.455 7.797 1.00 1.52 C ATOM 924 CD LYS A 57 31.956 9.822 8.355 1.00 1.63 C ATOM 925 CE LYS A 57 33.056 9.735 9.408 1.00 1.74 C ATOM 926 NZ LYS A 57 34.297 9.115 8.869 1.00 1.86 N ATOM 0 H LYS A 57 32.215 6.272 7.057 1.00 1.20 H new ATOM 0 HA LYS A 57 30.493 5.497 9.207 1.00 1.28 H new ATOM 0 HB2 LYS A 57 30.227 8.033 9.386 1.00 1.39 H new ATOM 0 HB3 LYS A 57 31.832 7.371 9.622 1.00 1.39 H new ATOM 0 HG2 LYS A 57 32.470 8.002 7.338 1.00 1.52 H new ATOM 0 HG3 LYS A 57 30.844 8.570 7.011 1.00 1.52 H new ATOM 0 HD2 LYS A 57 32.283 10.470 7.542 1.00 1.63 H new ATOM 0 HD3 LYS A 57 31.071 10.283 8.793 1.00 1.63 H new ATOM 0 HE2 LYS A 57 33.282 10.735 9.779 1.00 1.74 H new ATOM 0 HE3 LYS A 57 32.699 9.152 10.257 1.00 1.74 H new ATOM 0 HZ1 LYS A 57 35.128 9.575 9.293 1.00 1.86 H new ATOM 0 HZ2 LYS A 57 34.307 8.101 9.101 1.00 1.86 H new ATOM 0 HZ3 LYS A 57 34.325 9.235 7.836 1.00 1.86 H new ATOM 940 N LEU A 58 29.173 6.540 6.408 1.00 1.12 N ATOM 941 CA LEU A 58 27.927 6.691 5.664 1.00 1.10 C ATOM 942 C LEU A 58 27.039 5.453 5.827 1.00 1.08 C ATOM 943 O LEU A 58 25.868 5.562 6.192 1.00 1.11 O ATOM 944 CB LEU A 58 28.227 6.941 4.180 1.00 1.06 C ATOM 945 CG LEU A 58 27.150 7.696 3.393 1.00 1.22 C ATOM 946 CD1 LEU A 58 26.047 6.755 2.937 1.00 1.35 C ATOM 947 CD2 LEU A 58 26.573 8.836 4.222 1.00 1.39 C ATOM 0 H LEU A 58 30.013 6.628 5.837 1.00 1.12 H new ATOM 0 HA LEU A 58 27.388 7.549 6.066 1.00 1.10 H new ATOM 0 HB2 LEU A 58 29.160 7.500 4.108 1.00 1.06 H new ATOM 0 HB3 LEU A 58 28.394 5.978 3.697 1.00 1.06 H new ATOM 0 HG LEU A 58 27.620 8.121 2.506 1.00 1.22 H new ATOM 0 HD11 LEU A 58 25.296 7.317 2.381 1.00 1.35 H new ATOM 0 HD12 LEU A 58 26.470 5.982 2.296 1.00 1.35 H new ATOM 0 HD13 LEU A 58 25.582 6.291 3.807 1.00 1.35 H new ATOM 0 HD21 LEU A 58 25.811 9.357 3.643 1.00 1.39 H new ATOM 0 HD22 LEU A 58 26.126 8.435 5.132 1.00 1.39 H new ATOM 0 HD23 LEU A 58 27.368 9.533 4.486 1.00 1.39 H new ATOM 959 N ILE A 59 27.607 4.279 5.567 1.00 1.07 N ATOM 960 CA ILE A 59 26.866 3.028 5.691 1.00 1.12 C ATOM 961 C ILE A 59 26.481 2.765 7.150 1.00 1.22 C ATOM 962 O ILE A 59 25.418 2.206 7.436 1.00 1.28 O ATOM 963 CB ILE A 59 27.656 1.827 5.114 1.00 1.15 C ATOM 964 CG1 ILE A 59 26.768 0.582 5.045 1.00 1.28 C ATOM 965 CG2 ILE A 59 28.909 1.537 5.931 1.00 1.26 C ATOM 966 CD1 ILE A 59 25.704 0.654 3.968 1.00 1.39 C ATOM 0 H ILE A 59 28.576 4.168 5.270 1.00 1.07 H new ATOM 0 HA ILE A 59 25.955 3.135 5.102 1.00 1.12 H new ATOM 0 HB ILE A 59 27.969 2.094 4.105 1.00 1.15 H new ATOM 0 HG12 ILE A 59 27.395 -0.292 4.867 1.00 1.28 H new ATOM 0 HG13 ILE A 59 26.285 0.436 6.011 1.00 1.28 H new ATOM 0 HG21 ILE A 59 29.438 0.688 5.497 1.00 1.26 H new ATOM 0 HG22 ILE A 59 29.559 2.412 5.924 1.00 1.26 H new ATOM 0 HG23 ILE A 59 28.628 1.303 6.958 1.00 1.26 H new ATOM 0 HD11 ILE A 59 25.113 -0.262 3.978 1.00 1.39 H new ATOM 0 HD12 ILE A 59 25.053 1.508 4.156 1.00 1.39 H new ATOM 0 HD13 ILE A 59 26.179 0.768 2.994 1.00 1.39 H new ATOM 978 N GLU A 60 27.348 3.184 8.064 1.00 1.27 N ATOM 979 CA GLU A 60 27.105 3.010 9.489 1.00 1.41 C ATOM 980 C GLU A 60 25.827 3.737 9.891 1.00 1.39 C ATOM 981 O GLU A 60 24.990 3.199 10.612 1.00 1.49 O ATOM 982 CB GLU A 60 28.288 3.556 10.287 1.00 1.52 C ATOM 983 CG GLU A 60 28.432 2.958 11.678 1.00 1.73 C ATOM 984 CD GLU A 60 29.341 3.783 12.566 1.00 2.09 C ATOM 985 OE1 GLU A 60 30.564 3.553 12.556 1.00 2.61 O ATOM 986 OE2 GLU A 60 28.837 4.677 13.274 1.00 2.28 O ATOM 0 H GLU A 60 28.229 3.648 7.841 1.00 1.27 H new ATOM 0 HA GLU A 60 26.991 1.947 9.704 1.00 1.41 H new ATOM 0 HB2 GLU A 60 29.205 3.371 9.728 1.00 1.52 H new ATOM 0 HB3 GLU A 60 28.182 4.637 10.378 1.00 1.52 H new ATOM 0 HG2 GLU A 60 27.448 2.880 12.141 1.00 1.73 H new ATOM 0 HG3 GLU A 60 28.828 1.946 11.597 1.00 1.73 H new ATOM 993 N GLY A 61 25.683 4.957 9.389 1.00 1.30 N ATOM 994 CA GLY A 61 24.509 5.758 9.676 1.00 1.30 C ATOM 995 C GLY A 61 23.247 5.156 9.096 1.00 1.26 C ATOM 996 O GLY A 61 22.168 5.316 9.648 1.00 1.27 O ATOM 0 H GLY A 61 26.366 5.410 8.782 1.00 1.30 H new ATOM 0 HA2 GLY A 61 24.397 5.861 10.755 1.00 1.30 H new ATOM 0 HA3 GLY A 61 24.649 6.761 9.273 1.00 1.30 H new ATOM 1000 N TYR A 62 23.390 4.471 7.967 1.00 1.25 N ATOM 1001 CA TYR A 62 22.254 3.829 7.314 1.00 1.31 C ATOM 1002 C TYR A 62 21.787 2.629 8.128 1.00 1.43 C ATOM 1003 O TYR A 62 20.594 2.332 8.213 1.00 1.47 O ATOM 1004 CB TYR A 62 22.629 3.388 5.895 1.00 1.39 C ATOM 1005 CG TYR A 62 21.528 2.641 5.168 1.00 1.59 C ATOM 1006 CD1 TYR A 62 20.385 3.295 4.729 1.00 2.27 C ATOM 1007 CD2 TYR A 62 21.640 1.279 4.919 1.00 2.03 C ATOM 1008 CE1 TYR A 62 19.383 2.613 4.063 1.00 2.80 C ATOM 1009 CE2 TYR A 62 20.645 0.590 4.255 1.00 2.60 C ATOM 1010 CZ TYR A 62 19.517 1.262 3.828 1.00 2.80 C ATOM 1011 OH TYR A 62 18.521 0.578 3.168 1.00 3.54 O ATOM 0 H TYR A 62 24.280 4.346 7.485 1.00 1.25 H new ATOM 0 HA TYR A 62 21.440 4.551 7.250 1.00 1.31 H new ATOM 0 HB2 TYR A 62 22.902 4.268 5.313 1.00 1.39 H new ATOM 0 HB3 TYR A 62 23.513 2.752 5.945 1.00 1.39 H new ATOM 0 HD1 TYR A 62 20.276 4.354 4.911 1.00 2.27 H new ATOM 0 HD2 TYR A 62 22.521 0.750 5.251 1.00 2.03 H new ATOM 0 HE1 TYR A 62 18.500 3.137 3.729 1.00 2.80 H new ATOM 0 HE2 TYR A 62 20.748 -0.469 4.071 1.00 2.60 H new ATOM 0 HH TYR A 62 18.773 -0.365 3.083 1.00 3.54 H new ATOM 1021 N THR A 63 22.747 1.944 8.731 1.00 1.55 N ATOM 1022 CA THR A 63 22.467 0.768 9.540 1.00 1.74 C ATOM 1023 C THR A 63 21.793 1.150 10.859 1.00 1.68 C ATOM 1024 O THR A 63 20.929 0.429 11.363 1.00 1.81 O ATOM 1025 CB THR A 63 23.763 -0.008 9.834 1.00 1.96 C ATOM 1026 OG1 THR A 63 24.485 -0.230 8.613 1.00 2.00 O ATOM 1027 CG2 THR A 63 23.464 -1.345 10.502 1.00 2.37 C ATOM 0 H THR A 63 23.736 2.186 8.674 1.00 1.55 H new ATOM 0 HA THR A 63 21.787 0.134 8.971 1.00 1.74 H new ATOM 0 HB THR A 63 24.369 0.589 10.516 1.00 1.96 H new ATOM 0 HG1 THR A 63 24.850 0.620 8.290 1.00 2.00 H new ATOM 0 HG21 THR A 63 24.398 -1.871 10.698 1.00 2.37 H new ATOM 0 HG22 THR A 63 22.941 -1.173 11.443 1.00 2.37 H new ATOM 0 HG23 THR A 63 22.839 -1.949 9.844 1.00 2.37 H new ATOM 1035 N TYR A 64 22.169 2.301 11.402 1.00 1.56 N ATOM 1036 CA TYR A 64 21.608 2.775 12.664 1.00 1.61 C ATOM 1037 C TYR A 64 20.724 3.991 12.441 1.00 1.32 C ATOM 1038 O TYR A 64 20.610 4.852 13.313 1.00 1.40 O ATOM 1039 CB TYR A 64 22.737 3.120 13.633 1.00 1.89 C ATOM 1040 CG TYR A 64 23.579 1.921 14.020 1.00 2.36 C ATOM 1041 CD1 TYR A 64 23.131 1.004 14.962 1.00 2.88 C ATOM 1042 CD2 TYR A 64 24.823 1.710 13.438 1.00 2.94 C ATOM 1043 CE1 TYR A 64 23.900 -0.090 15.316 1.00 3.56 C ATOM 1044 CE2 TYR A 64 25.596 0.617 13.785 1.00 3.61 C ATOM 1045 CZ TYR A 64 25.128 -0.276 14.725 1.00 3.79 C ATOM 1046 OH TYR A 64 25.889 -1.365 15.073 1.00 4.61 O ATOM 0 H TYR A 64 22.861 2.926 10.988 1.00 1.56 H new ATOM 0 HA TYR A 64 20.995 1.981 13.090 1.00 1.61 H new ATOM 0 HB2 TYR A 64 23.379 3.875 13.179 1.00 1.89 H new ATOM 0 HB3 TYR A 64 22.312 3.563 14.534 1.00 1.89 H new ATOM 0 HD1 TYR A 64 22.166 1.147 15.426 1.00 2.88 H new ATOM 0 HD2 TYR A 64 25.192 2.410 12.703 1.00 2.94 H new ATOM 0 HE1 TYR A 64 23.539 -0.793 16.052 1.00 3.56 H new ATOM 0 HE2 TYR A 64 26.560 0.464 13.323 1.00 3.61 H new ATOM 0 HH TYR A 64 26.728 -1.353 14.566 1.00 4.61 H new ATOM 1056 N GLY A 65 20.098 4.043 11.273 1.00 1.16 N ATOM 1057 CA GLY A 65 19.236 5.160 10.937 1.00 1.08 C ATOM 1058 C GLY A 65 17.899 5.106 11.645 1.00 1.03 C ATOM 1059 O GLY A 65 17.115 4.173 11.449 1.00 1.02 O ATOM 0 H GLY A 65 20.172 3.328 10.549 1.00 1.16 H new ATOM 0 HA2 GLY A 65 19.740 6.092 11.194 1.00 1.08 H new ATOM 0 HA3 GLY A 65 19.071 5.174 9.860 1.00 1.08 H new ATOM 1063 N GLU A 66 17.637 6.120 12.457 1.00 1.04 N ATOM 1064 CA GLU A 66 16.397 6.214 13.214 1.00 1.03 C ATOM 1065 C GLU A 66 15.211 6.452 12.282 1.00 0.98 C ATOM 1066 O GLU A 66 14.108 5.949 12.514 1.00 0.98 O ATOM 1067 CB GLU A 66 16.499 7.352 14.235 1.00 1.10 C ATOM 1068 CG GLU A 66 15.306 7.451 15.173 1.00 1.55 C ATOM 1069 CD GLU A 66 15.360 6.449 16.313 1.00 1.48 C ATOM 1070 OE1 GLU A 66 15.980 5.378 16.159 1.00 1.73 O ATOM 1071 OE2 GLU A 66 14.764 6.721 17.376 1.00 1.79 O ATOM 0 H GLU A 66 18.277 6.900 12.610 1.00 1.04 H new ATOM 0 HA GLU A 66 16.237 5.272 13.738 1.00 1.03 H new ATOM 0 HB2 GLU A 66 17.403 7.215 14.828 1.00 1.10 H new ATOM 0 HB3 GLU A 66 16.608 8.296 13.701 1.00 1.10 H new ATOM 0 HG2 GLU A 66 15.258 8.459 15.585 1.00 1.55 H new ATOM 0 HG3 GLU A 66 14.390 7.295 14.604 1.00 1.55 H new ATOM 1078 N GLU A 67 15.446 7.202 11.209 1.00 0.98 N ATOM 1079 CA GLU A 67 14.393 7.502 10.246 1.00 0.98 C ATOM 1080 C GLU A 67 13.986 6.245 9.493 1.00 0.95 C ATOM 1081 O GLU A 67 12.817 6.061 9.156 1.00 0.93 O ATOM 1082 CB GLU A 67 14.836 8.584 9.256 1.00 1.05 C ATOM 1083 CG GLU A 67 15.647 9.695 9.896 1.00 1.33 C ATOM 1084 CD GLU A 67 17.128 9.536 9.631 1.00 1.79 C ATOM 1085 OE1 GLU A 67 17.640 8.404 9.762 1.00 2.37 O ATOM 1086 OE2 GLU A 67 17.779 10.534 9.257 1.00 2.46 O ATOM 0 H GLU A 67 16.353 7.611 10.986 1.00 0.98 H new ATOM 0 HA GLU A 67 13.534 7.879 10.801 1.00 0.98 H new ATOM 0 HB2 GLU A 67 15.428 8.122 8.466 1.00 1.05 H new ATOM 0 HB3 GLU A 67 13.954 9.015 8.783 1.00 1.05 H new ATOM 0 HG2 GLU A 67 15.311 10.658 9.512 1.00 1.33 H new ATOM 0 HG3 GLU A 67 15.469 9.701 10.971 1.00 1.33 H new ATOM 1093 N ARG A 68 14.957 5.374 9.240 1.00 0.97 N ATOM 1094 CA ARG A 68 14.697 4.117 8.551 1.00 0.99 C ATOM 1095 C ARG A 68 13.762 3.260 9.406 1.00 0.96 C ATOM 1096 O ARG A 68 12.924 2.515 8.890 1.00 0.97 O ATOM 1097 CB ARG A 68 16.011 3.378 8.274 1.00 1.06 C ATOM 1098 CG ARG A 68 15.847 2.090 7.479 1.00 1.17 C ATOM 1099 CD ARG A 68 15.941 0.869 8.379 1.00 1.27 C ATOM 1100 NE ARG A 68 15.689 -0.371 7.653 1.00 1.43 N ATOM 1101 CZ ARG A 68 14.585 -1.104 7.791 1.00 1.40 C ATOM 1102 NH1 ARG A 68 13.592 -0.681 8.568 1.00 1.41 N ATOM 1103 NH2 ARG A 68 14.468 -2.251 7.133 1.00 1.70 N ATOM 0 H ARG A 68 15.932 5.517 9.503 1.00 0.97 H new ATOM 0 HA ARG A 68 14.219 4.319 7.592 1.00 0.99 H new ATOM 0 HB2 ARG A 68 16.682 4.044 7.731 1.00 1.06 H new ATOM 0 HB3 ARG A 68 16.492 3.146 9.224 1.00 1.06 H new ATOM 0 HG2 ARG A 68 14.884 2.095 6.969 1.00 1.17 H new ATOM 0 HG3 ARG A 68 16.615 2.036 6.708 1.00 1.17 H new ATOM 0 HD2 ARG A 68 16.932 0.828 8.831 1.00 1.27 H new ATOM 0 HD3 ARG A 68 15.223 0.964 9.193 1.00 1.27 H new ATOM 0 HE ARG A 68 16.402 -0.697 7.000 1.00 1.43 H new ATOM 0 HH11 ARG A 68 13.674 0.208 9.061 1.00 1.41 H new ATOM 0 HH12 ARG A 68 12.749 -1.246 8.671 1.00 1.41 H new ATOM 0 HH21 ARG A 68 15.222 -2.569 6.524 1.00 1.70 H new ATOM 0 HH22 ARG A 68 13.624 -2.815 7.236 1.00 1.70 H new ATOM 1117 N LYS A 69 13.921 3.383 10.717 1.00 0.95 N ATOM 1118 CA LYS A 69 13.092 2.661 11.671 1.00 0.97 C ATOM 1119 C LYS A 69 11.673 3.231 11.647 1.00 0.91 C ATOM 1120 O LYS A 69 10.689 2.494 11.726 1.00 0.92 O ATOM 1121 CB LYS A 69 13.689 2.787 13.073 1.00 1.04 C ATOM 1122 CG LYS A 69 13.055 1.866 14.102 1.00 1.31 C ATOM 1123 CD LYS A 69 13.659 2.082 15.479 1.00 1.43 C ATOM 1124 CE LYS A 69 13.181 3.382 16.104 1.00 1.48 C ATOM 1125 NZ LYS A 69 14.044 3.805 17.234 1.00 1.54 N ATOM 0 H LYS A 69 14.625 3.983 11.147 1.00 0.95 H new ATOM 0 HA LYS A 69 13.056 1.606 11.398 1.00 0.97 H new ATOM 0 HB2 LYS A 69 14.757 2.576 13.022 1.00 1.04 H new ATOM 0 HB3 LYS A 69 13.583 3.818 13.410 1.00 1.04 H new ATOM 0 HG2 LYS A 69 11.981 2.045 14.141 1.00 1.31 H new ATOM 0 HG3 LYS A 69 13.194 0.828 13.800 1.00 1.31 H new ATOM 0 HD2 LYS A 69 13.394 1.247 16.128 1.00 1.43 H new ATOM 0 HD3 LYS A 69 14.746 2.093 15.402 1.00 1.43 H new ATOM 0 HE2 LYS A 69 13.167 4.165 15.346 1.00 1.48 H new ATOM 0 HE3 LYS A 69 12.157 3.260 16.456 1.00 1.48 H new ATOM 0 HZ1 LYS A 69 13.619 4.628 17.707 1.00 1.54 H new ATOM 0 HZ2 LYS A 69 14.134 3.023 17.914 1.00 1.54 H new ATOM 0 HZ3 LYS A 69 14.986 4.061 16.875 1.00 1.54 H new ATOM 1139 N LEU A 70 11.590 4.554 11.515 1.00 0.90 N ATOM 1140 CA LEU A 70 10.311 5.253 11.466 1.00 0.88 C ATOM 1141 C LEU A 70 9.510 4.824 10.239 1.00 0.85 C ATOM 1142 O LEU A 70 8.293 4.656 10.313 1.00 0.85 O ATOM 1143 CB LEU A 70 10.539 6.770 11.460 1.00 0.93 C ATOM 1144 CG LEU A 70 9.272 7.631 11.453 1.00 1.01 C ATOM 1145 CD1 LEU A 70 8.373 7.279 12.630 1.00 1.14 C ATOM 1146 CD2 LEU A 70 9.638 9.107 11.489 1.00 1.15 C ATOM 0 H LEU A 70 12.402 5.166 11.440 1.00 0.90 H new ATOM 0 HA LEU A 70 9.736 4.991 12.354 1.00 0.88 H new ATOM 0 HB2 LEU A 70 11.131 7.034 12.337 1.00 0.93 H new ATOM 0 HB3 LEU A 70 11.135 7.026 10.584 1.00 0.93 H new ATOM 0 HG LEU A 70 8.724 7.428 10.533 1.00 1.01 H new ATOM 0 HD11 LEU A 70 7.480 7.903 12.605 1.00 1.14 H new ATOM 0 HD12 LEU A 70 8.085 6.230 12.567 1.00 1.14 H new ATOM 0 HD13 LEU A 70 8.910 7.452 13.563 1.00 1.14 H new ATOM 0 HD21 LEU A 70 8.728 9.708 11.484 1.00 1.15 H new ATOM 0 HD22 LEU A 70 10.207 9.319 12.394 1.00 1.15 H new ATOM 0 HD23 LEU A 70 10.241 9.354 10.615 1.00 1.15 H new ATOM 1158 N TYR A 71 10.198 4.636 9.111 1.00 0.84 N ATOM 1159 CA TYR A 71 9.545 4.211 7.874 1.00 0.86 C ATOM 1160 C TYR A 71 8.935 2.833 8.056 1.00 0.85 C ATOM 1161 O TYR A 71 7.825 2.566 7.597 1.00 0.85 O ATOM 1162 CB TYR A 71 10.539 4.177 6.705 1.00 0.91 C ATOM 1163 CG TYR A 71 11.224 5.497 6.428 1.00 0.92 C ATOM 1164 CD1 TYR A 71 10.604 6.711 6.717 1.00 0.94 C ATOM 1165 CD2 TYR A 71 12.494 5.530 5.867 1.00 0.99 C ATOM 1166 CE1 TYR A 71 11.231 7.910 6.454 1.00 1.01 C ATOM 1167 CE2 TYR A 71 13.126 6.729 5.603 1.00 1.05 C ATOM 1168 CZ TYR A 71 12.492 7.915 5.898 1.00 1.05 C ATOM 1169 OH TYR A 71 13.122 9.108 5.635 1.00 1.16 O ATOM 0 H TYR A 71 11.206 4.771 9.030 1.00 0.84 H new ATOM 0 HA TYR A 71 8.762 4.934 7.643 1.00 0.86 H new ATOM 0 HB2 TYR A 71 11.299 3.424 6.912 1.00 0.91 H new ATOM 0 HB3 TYR A 71 10.012 3.859 5.805 1.00 0.91 H new ATOM 0 HD1 TYR A 71 9.616 6.712 7.154 1.00 0.94 H new ATOM 0 HD2 TYR A 71 12.996 4.603 5.633 1.00 0.99 H new ATOM 0 HE1 TYR A 71 10.736 8.842 6.683 1.00 1.01 H new ATOM 0 HE2 TYR A 71 14.114 6.736 5.167 1.00 1.05 H new ATOM 0 HH TYR A 71 14.004 8.933 5.245 1.00 1.16 H new ATOM 1179 N ASP A 72 9.666 1.961 8.744 1.00 0.86 N ATOM 1180 CA ASP A 72 9.201 0.602 8.999 1.00 0.90 C ATOM 1181 C ASP A 72 7.961 0.622 9.881 1.00 0.87 C ATOM 1182 O ASP A 72 7.019 -0.143 9.669 1.00 0.87 O ATOM 1183 CB ASP A 72 10.299 -0.216 9.674 1.00 0.98 C ATOM 1184 CG ASP A 72 10.350 -1.648 9.183 1.00 1.21 C ATOM 1185 OD1 ASP A 72 9.284 -2.236 8.912 1.00 1.47 O ATOM 1186 OD2 ASP A 72 11.465 -2.193 9.054 1.00 1.48 O ATOM 0 H ASP A 72 10.584 2.172 9.135 1.00 0.86 H new ATOM 0 HA ASP A 72 8.949 0.141 8.044 1.00 0.90 H new ATOM 0 HB2 ASP A 72 11.263 0.260 9.494 1.00 0.98 H new ATOM 0 HB3 ASP A 72 10.138 -0.212 10.752 1.00 0.98 H new ATOM 1191 N SER A 73 7.970 1.517 10.864 1.00 0.85 N ATOM 1192 CA SER A 73 6.852 1.659 11.785 1.00 0.85 C ATOM 1193 C SER A 73 5.612 2.167 11.047 1.00 0.81 C ATOM 1194 O SER A 73 4.484 1.815 11.395 1.00 0.80 O ATOM 1195 CB SER A 73 7.214 2.614 12.923 1.00 0.90 C ATOM 1196 OG SER A 73 8.455 2.256 13.511 1.00 0.96 O ATOM 0 H SER A 73 8.744 2.157 11.042 1.00 0.85 H new ATOM 0 HA SER A 73 6.630 0.679 12.208 1.00 0.85 H new ATOM 0 HB2 SER A 73 7.268 3.634 12.543 1.00 0.90 H new ATOM 0 HB3 SER A 73 6.430 2.597 13.680 1.00 0.90 H new ATOM 0 HG SER A 73 9.186 2.492 12.902 1.00 0.96 H new ATOM 1202 N ALA A 74 5.834 2.985 10.021 1.00 0.80 N ATOM 1203 CA ALA A 74 4.748 3.531 9.223 1.00 0.79 C ATOM 1204 C ALA A 74 4.082 2.427 8.408 1.00 0.76 C ATOM 1205 O ALA A 74 2.867 2.442 8.201 1.00 0.75 O ATOM 1206 CB ALA A 74 5.263 4.634 8.308 1.00 0.82 C ATOM 0 H ALA A 74 6.763 3.284 9.724 1.00 0.80 H new ATOM 0 HA ALA A 74 4.005 3.961 9.895 1.00 0.79 H new ATOM 0 HB1 ALA A 74 4.438 5.032 7.718 1.00 0.82 H new ATOM 0 HB2 ALA A 74 5.697 5.433 8.910 1.00 0.82 H new ATOM 0 HB3 ALA A 74 6.023 4.228 7.641 1.00 0.82 H new ATOM 1212 N LEU A 75 4.883 1.463 7.962 1.00 0.77 N ATOM 1213 CA LEU A 75 4.367 0.346 7.184 1.00 0.78 C ATOM 1214 C LEU A 75 3.427 -0.489 8.046 1.00 0.77 C ATOM 1215 O LEU A 75 2.436 -1.034 7.561 1.00 0.77 O ATOM 1216 CB LEU A 75 5.516 -0.520 6.651 1.00 0.83 C ATOM 1217 CG LEU A 75 5.500 -0.779 5.143 1.00 0.92 C ATOM 1218 CD1 LEU A 75 4.204 -1.453 4.719 1.00 1.13 C ATOM 1219 CD2 LEU A 75 5.703 0.522 4.379 1.00 1.15 C ATOM 0 H LEU A 75 5.889 1.435 8.127 1.00 0.77 H new ATOM 0 HA LEU A 75 3.815 0.737 6.330 1.00 0.78 H new ATOM 0 HB2 LEU A 75 6.460 -0.040 6.910 1.00 0.83 H new ATOM 0 HB3 LEU A 75 5.494 -1.480 7.167 1.00 0.83 H new ATOM 0 HG LEU A 75 6.323 -1.453 4.905 1.00 0.92 H new ATOM 0 HD11 LEU A 75 4.219 -1.626 3.643 1.00 1.13 H new ATOM 0 HD12 LEU A 75 4.103 -2.406 5.238 1.00 1.13 H new ATOM 0 HD13 LEU A 75 3.360 -0.811 4.972 1.00 1.13 H new ATOM 0 HD21 LEU A 75 5.689 0.321 3.308 1.00 1.15 H new ATOM 0 HD22 LEU A 75 4.903 1.219 4.628 1.00 1.15 H new ATOM 0 HD23 LEU A 75 6.663 0.959 4.654 1.00 1.15 H new ATOM 1231 N SER A 76 3.733 -0.565 9.339 1.00 0.78 N ATOM 1232 CA SER A 76 2.912 -1.318 10.277 1.00 0.80 C ATOM 1233 C SER A 76 1.537 -0.668 10.414 1.00 0.76 C ATOM 1234 O SER A 76 0.534 -1.342 10.664 1.00 0.77 O ATOM 1235 CB SER A 76 3.613 -1.402 11.633 1.00 0.85 C ATOM 1236 OG SER A 76 5.018 -1.474 11.458 1.00 0.88 O ATOM 0 H SER A 76 4.545 -0.113 9.759 1.00 0.78 H new ATOM 0 HA SER A 76 2.773 -2.330 9.898 1.00 0.80 H new ATOM 0 HB2 SER A 76 3.359 -0.530 12.236 1.00 0.85 H new ATOM 0 HB3 SER A 76 3.262 -2.279 12.177 1.00 0.85 H new ATOM 0 HG SER A 76 5.455 -1.526 12.334 1.00 0.88 H new ATOM 1242 N LYS A 77 1.499 0.651 10.228 1.00 0.75 N ATOM 1243 CA LYS A 77 0.254 1.402 10.307 1.00 0.74 C ATOM 1244 C LYS A 77 -0.619 1.069 9.107 1.00 0.71 C ATOM 1245 O LYS A 77 -1.842 0.986 9.219 1.00 0.70 O ATOM 1246 CB LYS A 77 0.524 2.908 10.365 1.00 0.76 C ATOM 1247 CG LYS A 77 1.472 3.309 11.483 1.00 0.90 C ATOM 1248 CD LYS A 77 1.674 4.816 11.530 1.00 0.98 C ATOM 1249 CE LYS A 77 2.717 5.212 12.565 1.00 1.35 C ATOM 1250 NZ LYS A 77 2.599 6.644 12.954 1.00 1.61 N ATOM 0 H LYS A 77 2.320 1.220 10.021 1.00 0.75 H new ATOM 0 HA LYS A 77 -0.266 1.119 11.222 1.00 0.74 H new ATOM 0 HB2 LYS A 77 0.941 3.232 9.411 1.00 0.76 H new ATOM 0 HB3 LYS A 77 -0.422 3.434 10.494 1.00 0.76 H new ATOM 0 HG2 LYS A 77 1.076 2.964 12.438 1.00 0.90 H new ATOM 0 HG3 LYS A 77 2.434 2.816 11.340 1.00 0.90 H new ATOM 0 HD2 LYS A 77 1.983 5.173 10.547 1.00 0.98 H new ATOM 0 HD3 LYS A 77 0.727 5.303 11.763 1.00 0.98 H new ATOM 0 HE2 LYS A 77 2.606 4.585 13.450 1.00 1.35 H new ATOM 0 HE3 LYS A 77 3.714 5.026 12.165 1.00 1.35 H new ATOM 0 HZ1 LYS A 77 3.327 6.873 13.660 1.00 1.61 H new ATOM 0 HZ2 LYS A 77 2.730 7.244 12.115 1.00 1.61 H new ATOM 0 HZ3 LYS A 77 1.657 6.817 13.359 1.00 1.61 H new ATOM 1264 N ILE A 78 0.023 0.860 7.962 1.00 0.71 N ATOM 1265 CA ILE A 78 -0.687 0.511 6.741 1.00 0.71 C ATOM 1266 C ILE A 78 -1.315 -0.870 6.892 1.00 0.70 C ATOM 1267 O ILE A 78 -2.440 -1.106 6.451 1.00 0.69 O ATOM 1268 CB ILE A 78 0.248 0.542 5.509 1.00 0.77 C ATOM 1269 CG1 ILE A 78 0.777 1.963 5.293 1.00 1.04 C ATOM 1270 CG2 ILE A 78 -0.480 0.043 4.263 1.00 0.84 C ATOM 1271 CD1 ILE A 78 1.864 2.062 4.243 1.00 1.33 C ATOM 0 H ILE A 78 1.035 0.927 7.856 1.00 0.71 H new ATOM 0 HA ILE A 78 -1.469 1.253 6.578 1.00 0.71 H new ATOM 0 HB ILE A 78 1.091 -0.124 5.693 1.00 0.77 H new ATOM 0 HG12 ILE A 78 -0.052 2.609 5.005 1.00 1.04 H new ATOM 0 HG13 ILE A 78 1.163 2.344 6.238 1.00 1.04 H new ATOM 0 HG21 ILE A 78 0.197 0.074 3.409 1.00 0.84 H new ATOM 0 HG22 ILE A 78 -0.815 -0.982 4.423 1.00 0.84 H new ATOM 0 HG23 ILE A 78 -1.342 0.680 4.066 1.00 0.84 H new ATOM 0 HD11 ILE A 78 2.186 3.099 4.149 1.00 1.33 H new ATOM 0 HD12 ILE A 78 2.712 1.444 4.538 1.00 1.33 H new ATOM 0 HD13 ILE A 78 1.477 1.714 3.285 1.00 1.33 H new ATOM 1283 N GLU A 79 -0.582 -1.770 7.545 1.00 0.72 N ATOM 1284 CA GLU A 79 -1.069 -3.125 7.792 1.00 0.74 C ATOM 1285 C GLU A 79 -2.315 -3.065 8.681 1.00 0.73 C ATOM 1286 O GLU A 79 -3.212 -3.903 8.578 1.00 0.74 O ATOM 1287 CB GLU A 79 0.026 -3.984 8.442 1.00 0.79 C ATOM 1288 CG GLU A 79 -0.364 -5.443 8.658 1.00 1.00 C ATOM 1289 CD GLU A 79 -0.433 -6.244 7.368 1.00 1.32 C ATOM 1290 OE1 GLU A 79 0.630 -6.645 6.857 1.00 1.93 O ATOM 1291 OE2 GLU A 79 -1.551 -6.491 6.872 1.00 1.95 O ATOM 0 H GLU A 79 0.351 -1.585 7.912 1.00 0.72 H new ATOM 0 HA GLU A 79 -1.334 -3.589 6.842 1.00 0.74 H new ATOM 0 HB2 GLU A 79 0.918 -3.948 7.817 1.00 0.79 H new ATOM 0 HB3 GLU A 79 0.292 -3.545 9.404 1.00 0.79 H new ATOM 0 HG2 GLU A 79 0.358 -5.909 9.329 1.00 1.00 H new ATOM 0 HG3 GLU A 79 -1.333 -5.483 9.155 1.00 1.00 H new ATOM 1298 N LYS A 80 -2.363 -2.057 9.558 1.00 0.72 N ATOM 1299 CA LYS A 80 -3.508 -1.865 10.446 1.00 0.73 C ATOM 1300 C LYS A 80 -4.757 -1.553 9.632 1.00 0.72 C ATOM 1301 O LYS A 80 -5.856 -1.978 9.980 1.00 0.75 O ATOM 1302 CB LYS A 80 -3.250 -0.737 11.449 1.00 0.74 C ATOM 1303 CG LYS A 80 -2.195 -1.073 12.486 1.00 0.81 C ATOM 1304 CD LYS A 80 -2.094 0.007 13.552 1.00 0.96 C ATOM 1305 CE LYS A 80 -3.356 0.096 14.402 1.00 1.35 C ATOM 1306 NZ LYS A 80 -3.736 -1.217 14.991 1.00 1.71 N ATOM 0 H LYS A 80 -1.623 -1.364 9.670 1.00 0.72 H new ATOM 0 HA LYS A 80 -3.659 -2.790 11.002 1.00 0.73 H new ATOM 0 HB2 LYS A 80 -2.942 0.157 10.906 1.00 0.74 H new ATOM 0 HB3 LYS A 80 -4.183 -0.495 11.958 1.00 0.74 H new ATOM 0 HG2 LYS A 80 -2.436 -2.027 12.955 1.00 0.81 H new ATOM 0 HG3 LYS A 80 -1.228 -1.194 11.997 1.00 0.81 H new ATOM 0 HD2 LYS A 80 -1.238 -0.199 14.195 1.00 0.96 H new ATOM 0 HD3 LYS A 80 -1.910 0.970 13.075 1.00 0.96 H new ATOM 0 HE2 LYS A 80 -3.202 0.819 15.203 1.00 1.35 H new ATOM 0 HE3 LYS A 80 -4.178 0.468 13.790 1.00 1.35 H new ATOM 0 HZ1 LYS A 80 -4.457 -1.072 15.727 1.00 1.71 H new ATOM 0 HZ2 LYS A 80 -4.120 -1.833 14.247 1.00 1.71 H new ATOM 0 HZ3 LYS A 80 -2.897 -1.665 15.412 1.00 1.71 H new ATOM 1320 N LEU A 81 -4.579 -0.816 8.541 1.00 0.69 N ATOM 1321 CA LEU A 81 -5.687 -0.465 7.661 1.00 0.71 C ATOM 1322 C LEU A 81 -6.207 -1.724 6.984 1.00 0.72 C ATOM 1323 O LEU A 81 -7.416 -1.925 6.867 1.00 0.76 O ATOM 1324 CB LEU A 81 -5.238 0.554 6.610 1.00 0.71 C ATOM 1325 CG LEU A 81 -6.227 1.691 6.324 1.00 0.78 C ATOM 1326 CD1 LEU A 81 -7.534 1.144 5.772 1.00 1.00 C ATOM 1327 CD2 LEU A 81 -6.474 2.525 7.575 1.00 0.94 C ATOM 0 H LEU A 81 -3.675 -0.449 8.244 1.00 0.69 H new ATOM 0 HA LEU A 81 -6.484 -0.014 8.252 1.00 0.71 H new ATOM 0 HB2 LEU A 81 -4.294 0.991 6.934 1.00 0.71 H new ATOM 0 HB3 LEU A 81 -5.041 0.025 5.678 1.00 0.71 H new ATOM 0 HG LEU A 81 -5.785 2.340 5.568 1.00 0.78 H new ATOM 0 HD11 LEU A 81 -8.220 1.968 5.577 1.00 1.00 H new ATOM 0 HD12 LEU A 81 -7.340 0.606 4.844 1.00 1.00 H new ATOM 0 HD13 LEU A 81 -7.980 0.465 6.499 1.00 1.00 H new ATOM 0 HD21 LEU A 81 -7.179 3.325 7.346 1.00 0.94 H new ATOM 0 HD22 LEU A 81 -6.887 1.891 8.359 1.00 0.94 H new ATOM 0 HD23 LEU A 81 -5.533 2.957 7.916 1.00 0.94 H new ATOM 1339 N ILE A 82 -5.280 -2.574 6.557 1.00 0.72 N ATOM 1340 CA ILE A 82 -5.629 -3.831 5.909 1.00 0.76 C ATOM 1341 C ILE A 82 -6.419 -4.701 6.889 1.00 0.80 C ATOM 1342 O ILE A 82 -7.393 -5.360 6.521 1.00 0.84 O ATOM 1343 CB ILE A 82 -4.360 -4.582 5.415 1.00 0.75 C ATOM 1344 CG1 ILE A 82 -3.459 -3.630 4.604 1.00 0.74 C ATOM 1345 CG2 ILE A 82 -4.752 -5.789 4.575 1.00 0.80 C ATOM 1346 CD1 ILE A 82 -2.146 -4.241 4.124 1.00 0.77 C ATOM 0 H ILE A 82 -4.277 -2.414 6.649 1.00 0.72 H new ATOM 0 HA ILE A 82 -6.243 -3.616 5.035 1.00 0.76 H new ATOM 0 HB ILE A 82 -3.802 -4.933 6.283 1.00 0.75 H new ATOM 0 HG12 ILE A 82 -4.017 -3.276 3.737 1.00 0.74 H new ATOM 0 HG13 ILE A 82 -3.234 -2.757 5.216 1.00 0.74 H new ATOM 0 HG21 ILE A 82 -3.853 -6.304 4.237 1.00 0.80 H new ATOM 0 HG22 ILE A 82 -5.356 -6.469 5.175 1.00 0.80 H new ATOM 0 HG23 ILE A 82 -5.328 -5.459 3.711 1.00 0.80 H new ATOM 0 HD11 ILE A 82 -1.581 -3.496 3.564 1.00 0.77 H new ATOM 0 HD12 ILE A 82 -1.561 -4.568 4.984 1.00 0.77 H new ATOM 0 HD13 ILE A 82 -2.356 -5.096 3.481 1.00 0.77 H new ATOM 1358 N GLU A 83 -6.002 -4.661 8.150 1.00 0.80 N ATOM 1359 CA GLU A 83 -6.653 -5.421 9.215 1.00 0.86 C ATOM 1360 C GLU A 83 -8.022 -4.822 9.566 1.00 0.85 C ATOM 1361 O GLU A 83 -8.983 -5.549 9.788 1.00 0.90 O ATOM 1362 CB GLU A 83 -5.759 -5.442 10.458 1.00 0.90 C ATOM 1363 CG GLU A 83 -6.288 -6.311 11.591 1.00 1.24 C ATOM 1364 CD GLU A 83 -5.398 -6.266 12.813 1.00 1.70 C ATOM 1365 OE1 GLU A 83 -5.071 -5.153 13.277 1.00 2.18 O ATOM 1366 OE2 GLU A 83 -5.010 -7.341 13.313 1.00 2.36 O ATOM 0 H GLU A 83 -5.207 -4.104 8.463 1.00 0.80 H new ATOM 0 HA GLU A 83 -6.809 -6.440 8.861 1.00 0.86 H new ATOM 0 HB2 GLU A 83 -4.769 -5.798 10.174 1.00 0.90 H new ATOM 0 HB3 GLU A 83 -5.639 -4.422 10.823 1.00 0.90 H new ATOM 0 HG2 GLU A 83 -7.290 -5.980 11.862 1.00 1.24 H new ATOM 0 HG3 GLU A 83 -6.375 -7.341 11.245 1.00 1.24 H new ATOM 1373 N THR A 84 -8.098 -3.495 9.615 1.00 0.82 N ATOM 1374 CA THR A 84 -9.341 -2.801 9.942 1.00 0.84 C ATOM 1375 C THR A 84 -10.404 -3.058 8.870 1.00 0.89 C ATOM 1376 O THR A 84 -11.605 -3.091 9.158 1.00 0.92 O ATOM 1377 CB THR A 84 -9.104 -1.282 10.096 1.00 0.83 C ATOM 1378 OG1 THR A 84 -8.062 -1.046 11.053 1.00 0.84 O ATOM 1379 CG2 THR A 84 -10.373 -0.564 10.547 1.00 0.85 C ATOM 0 H THR A 84 -7.309 -2.875 9.431 1.00 0.82 H new ATOM 0 HA THR A 84 -9.699 -3.194 10.894 1.00 0.84 H new ATOM 0 HB THR A 84 -8.812 -0.889 9.122 1.00 0.83 H new ATOM 0 HG1 THR A 84 -7.211 -1.380 10.699 1.00 0.84 H new ATOM 0 HG21 THR A 84 -10.172 0.503 10.646 1.00 0.85 H new ATOM 0 HG22 THR A 84 -11.160 -0.718 9.809 1.00 0.85 H new ATOM 0 HG23 THR A 84 -10.695 -0.963 11.509 1.00 0.85 H new ATOM 1387 N LEU A 85 -9.954 -3.247 7.636 1.00 0.93 N ATOM 1388 CA LEU A 85 -10.857 -3.513 6.523 1.00 1.01 C ATOM 1389 C LEU A 85 -11.502 -4.883 6.668 1.00 1.08 C ATOM 1390 O LEU A 85 -12.680 -5.067 6.345 1.00 1.17 O ATOM 1391 CB LEU A 85 -10.115 -3.425 5.183 1.00 1.04 C ATOM 1392 CG LEU A 85 -10.041 -2.023 4.574 1.00 1.05 C ATOM 1393 CD1 LEU A 85 -9.101 -2.012 3.382 1.00 1.22 C ATOM 1394 CD2 LEU A 85 -11.425 -1.549 4.160 1.00 1.13 C ATOM 0 H LEU A 85 -8.967 -3.221 7.380 1.00 0.93 H new ATOM 0 HA LEU A 85 -11.638 -2.753 6.540 1.00 1.01 H new ATOM 0 HB2 LEU A 85 -9.100 -3.798 5.322 1.00 1.04 H new ATOM 0 HB3 LEU A 85 -10.604 -4.089 4.470 1.00 1.04 H new ATOM 0 HG LEU A 85 -9.652 -1.340 5.329 1.00 1.05 H new ATOM 0 HD11 LEU A 85 -9.060 -1.008 2.960 1.00 1.22 H new ATOM 0 HD12 LEU A 85 -8.103 -2.312 3.703 1.00 1.22 H new ATOM 0 HD13 LEU A 85 -9.464 -2.708 2.626 1.00 1.22 H new ATOM 0 HD21 LEU A 85 -11.354 -0.550 3.729 1.00 1.13 H new ATOM 0 HD22 LEU A 85 -11.838 -2.235 3.420 1.00 1.13 H new ATOM 0 HD23 LEU A 85 -12.077 -1.522 5.033 1.00 1.13 H new ATOM 1406 N SER A 86 -10.735 -5.830 7.177 1.00 1.18 N ATOM 1407 CA SER A 86 -11.218 -7.187 7.358 1.00 1.31 C ATOM 1408 C SER A 86 -10.897 -7.695 8.761 1.00 1.73 C ATOM 1409 O SER A 86 -9.865 -8.331 8.970 1.00 2.31 O ATOM 1410 CB SER A 86 -10.587 -8.101 6.307 1.00 1.71 C ATOM 1411 OG SER A 86 -10.395 -7.412 5.078 1.00 1.97 O ATOM 0 H SER A 86 -9.770 -5.683 7.474 1.00 1.18 H new ATOM 0 HA SER A 86 -12.301 -7.192 7.236 1.00 1.31 H new ATOM 0 HB2 SER A 86 -9.630 -8.473 6.672 1.00 1.71 H new ATOM 0 HB3 SER A 86 -11.226 -8.969 6.145 1.00 1.71 H new ATOM 0 HG SER A 86 -9.989 -8.018 4.423 1.00 1.97 H new ATOM 1914 N LYS B 10 16.570 12.751 3.017 1.00 1.52 N ATOM 1915 CA LYS B 10 15.842 12.225 4.168 1.00 1.44 C ATOM 1916 C LYS B 10 14.492 12.909 4.340 1.00 1.38 C ATOM 1917 O LYS B 10 13.489 12.251 4.622 1.00 1.32 O ATOM 1918 CB LYS B 10 16.669 12.394 5.446 1.00 1.48 C ATOM 1919 CG LYS B 10 17.058 11.084 6.112 1.00 1.54 C ATOM 1920 CD LYS B 10 18.069 10.303 5.289 1.00 1.71 C ATOM 1921 CE LYS B 10 18.428 8.989 5.964 1.00 2.08 C ATOM 1922 NZ LYS B 10 19.086 9.196 7.281 1.00 2.41 N ATOM 0 HA LYS B 10 15.666 11.165 3.985 1.00 1.44 H new ATOM 0 HB2 LYS B 10 17.575 12.951 5.208 1.00 1.48 H new ATOM 0 HB3 LYS B 10 16.102 12.996 6.156 1.00 1.48 H new ATOM 0 HG2 LYS B 10 17.475 11.289 7.098 1.00 1.54 H new ATOM 0 HG3 LYS B 10 16.166 10.476 6.263 1.00 1.54 H new ATOM 0 HD2 LYS B 10 17.661 10.106 4.298 1.00 1.71 H new ATOM 0 HD3 LYS B 10 18.969 10.902 5.150 1.00 1.71 H new ATOM 0 HE2 LYS B 10 17.525 8.394 6.100 1.00 2.08 H new ATOM 0 HE3 LYS B 10 19.091 8.418 5.314 1.00 2.08 H new ATOM 0 HZ1 LYS B 10 19.009 8.328 7.848 1.00 2.41 H new ATOM 0 HZ2 LYS B 10 20.090 9.426 7.135 1.00 2.41 H new ATOM 0 HZ3 LYS B 10 18.620 9.979 7.782 1.00 2.41 H new ATOM 1936 N GLU B 11 14.468 14.225 4.163 1.00 1.42 N ATOM 1937 CA GLU B 11 13.235 14.991 4.298 1.00 1.39 C ATOM 1938 C GLU B 11 12.225 14.580 3.230 1.00 1.36 C ATOM 1939 O GLU B 11 11.016 14.572 3.473 1.00 1.30 O ATOM 1940 CB GLU B 11 13.518 16.491 4.189 1.00 1.47 C ATOM 1941 CG GLU B 11 12.376 17.363 4.693 1.00 1.48 C ATOM 1942 CD GLU B 11 12.293 18.692 3.976 1.00 1.62 C ATOM 1943 OE1 GLU B 11 13.000 19.641 4.380 1.00 1.72 O ATOM 1944 OE2 GLU B 11 11.528 18.795 2.992 1.00 1.90 O ATOM 0 H GLU B 11 15.288 14.783 3.926 1.00 1.42 H new ATOM 0 HA GLU B 11 12.815 14.780 5.281 1.00 1.39 H new ATOM 0 HB2 GLU B 11 14.420 16.725 4.755 1.00 1.47 H new ATOM 0 HB3 GLU B 11 13.722 16.739 3.147 1.00 1.47 H new ATOM 0 HG2 GLU B 11 11.434 16.828 4.568 1.00 1.48 H new ATOM 0 HG3 GLU B 11 12.503 17.539 5.761 1.00 1.48 H new ATOM 1951 N LEU B 12 12.726 14.228 2.051 1.00 1.43 N ATOM 1952 CA LEU B 12 11.866 13.821 0.948 1.00 1.45 C ATOM 1953 C LEU B 12 11.111 12.546 1.295 1.00 1.36 C ATOM 1954 O LEU B 12 9.880 12.518 1.276 1.00 1.32 O ATOM 1955 CB LEU B 12 12.700 13.613 -0.321 1.00 1.57 C ATOM 1956 CG LEU B 12 11.933 13.109 -1.545 1.00 1.73 C ATOM 1957 CD1 LEU B 12 10.932 14.148 -2.022 1.00 1.89 C ATOM 1958 CD2 LEU B 12 12.897 12.745 -2.664 1.00 1.89 C ATOM 0 H LEU B 12 13.723 14.217 1.835 1.00 1.43 H new ATOM 0 HA LEU B 12 11.138 14.612 0.769 1.00 1.45 H new ATOM 0 HB2 LEU B 12 13.178 14.558 -0.579 1.00 1.57 H new ATOM 0 HB3 LEU B 12 13.497 12.904 -0.097 1.00 1.57 H new ATOM 0 HG LEU B 12 11.382 12.214 -1.256 1.00 1.73 H new ATOM 0 HD11 LEU B 12 10.399 13.767 -2.893 1.00 1.89 H new ATOM 0 HD12 LEU B 12 10.220 14.360 -1.225 1.00 1.89 H new ATOM 0 HD13 LEU B 12 11.458 15.064 -2.291 1.00 1.89 H new ATOM 0 HD21 LEU B 12 12.335 12.388 -3.527 1.00 1.89 H new ATOM 0 HD22 LEU B 12 13.476 13.625 -2.946 1.00 1.89 H new ATOM 0 HD23 LEU B 12 13.572 11.961 -2.322 1.00 1.89 H new ATOM 1970 N LEU B 13 11.857 11.505 1.646 1.00 1.35 N ATOM 1971 CA LEU B 13 11.266 10.215 1.983 1.00 1.30 C ATOM 1972 C LEU B 13 10.350 10.339 3.200 1.00 1.18 C ATOM 1973 O LEU B 13 9.257 9.773 3.232 1.00 1.15 O ATOM 1974 CB LEU B 13 12.359 9.173 2.276 1.00 1.35 C ATOM 1975 CG LEU B 13 13.706 9.387 1.574 1.00 1.32 C ATOM 1976 CD1 LEU B 13 14.745 8.416 2.116 1.00 1.48 C ATOM 1977 CD2 LEU B 13 13.564 9.226 0.068 1.00 1.50 C ATOM 0 H LEU B 13 12.875 11.529 1.705 1.00 1.35 H new ATOM 0 HA LEU B 13 10.679 9.888 1.125 1.00 1.30 H new ATOM 0 HB2 LEU B 13 12.533 9.153 3.352 1.00 1.35 H new ATOM 0 HB3 LEU B 13 11.979 8.190 1.996 1.00 1.35 H new ATOM 0 HG LEU B 13 14.039 10.405 1.777 1.00 1.32 H new ATOM 0 HD11 LEU B 13 15.696 8.580 1.608 1.00 1.48 H new ATOM 0 HD12 LEU B 13 14.872 8.579 3.186 1.00 1.48 H new ATOM 0 HD13 LEU B 13 14.412 7.393 1.942 1.00 1.48 H new ATOM 0 HD21 LEU B 13 14.532 9.382 -0.408 1.00 1.50 H new ATOM 0 HD22 LEU B 13 13.207 8.221 -0.158 1.00 1.50 H new ATOM 0 HD23 LEU B 13 12.851 9.959 -0.311 1.00 1.50 H new ATOM 1989 N LEU B 14 10.796 11.109 4.186 1.00 1.15 N ATOM 1990 CA LEU B 14 10.051 11.303 5.420 1.00 1.07 C ATOM 1991 C LEU B 14 8.698 11.971 5.188 1.00 1.07 C ATOM 1992 O LEU B 14 7.666 11.448 5.602 1.00 1.02 O ATOM 1993 CB LEU B 14 10.884 12.134 6.400 1.00 1.08 C ATOM 1994 CG LEU B 14 10.290 12.303 7.802 1.00 1.04 C ATOM 1995 CD1 LEU B 14 10.040 10.945 8.447 1.00 1.06 C ATOM 1996 CD2 LEU B 14 11.215 13.146 8.667 1.00 1.14 C ATOM 0 H LEU B 14 11.682 11.614 4.151 1.00 1.15 H new ATOM 0 HA LEU B 14 9.853 10.317 5.840 1.00 1.07 H new ATOM 0 HB2 LEU B 14 11.867 11.672 6.495 1.00 1.08 H new ATOM 0 HB3 LEU B 14 11.038 13.123 5.969 1.00 1.08 H new ATOM 0 HG LEU B 14 9.333 12.818 7.714 1.00 1.04 H new ATOM 0 HD11 LEU B 14 9.618 11.087 9.442 1.00 1.06 H new ATOM 0 HD12 LEU B 14 9.342 10.374 7.835 1.00 1.06 H new ATOM 0 HD13 LEU B 14 10.981 10.401 8.526 1.00 1.06 H new ATOM 0 HD21 LEU B 14 10.781 13.259 9.661 1.00 1.14 H new ATOM 0 HD22 LEU B 14 12.185 12.655 8.748 1.00 1.14 H new ATOM 0 HD23 LEU B 14 11.342 14.129 8.213 1.00 1.14 H new ATOM 2008 N LYS B 15 8.701 13.103 4.506 1.00 1.15 N ATOM 2009 CA LYS B 15 7.471 13.847 4.261 1.00 1.18 C ATOM 2010 C LYS B 15 6.511 13.088 3.347 1.00 1.13 C ATOM 2011 O LYS B 15 5.298 13.096 3.565 1.00 1.11 O ATOM 2012 CB LYS B 15 7.798 15.215 3.662 1.00 1.32 C ATOM 2013 CG LYS B 15 6.780 16.292 4.009 1.00 1.46 C ATOM 2014 CD LYS B 15 7.438 17.657 4.162 1.00 1.55 C ATOM 2015 CE LYS B 15 7.968 18.180 2.835 1.00 1.76 C ATOM 2016 NZ LYS B 15 8.836 19.375 3.019 1.00 1.80 N ATOM 0 H LYS B 15 9.539 13.529 4.111 1.00 1.15 H new ATOM 0 HA LYS B 15 6.971 13.978 5.220 1.00 1.18 H new ATOM 0 HB2 LYS B 15 8.781 15.530 4.012 1.00 1.32 H new ATOM 0 HB3 LYS B 15 7.861 15.122 2.578 1.00 1.32 H new ATOM 0 HG2 LYS B 15 6.020 16.339 3.230 1.00 1.46 H new ATOM 0 HG3 LYS B 15 6.271 16.027 4.936 1.00 1.46 H new ATOM 0 HD2 LYS B 15 6.716 18.365 4.570 1.00 1.55 H new ATOM 0 HD3 LYS B 15 8.256 17.588 4.879 1.00 1.55 H new ATOM 0 HE2 LYS B 15 8.533 17.394 2.334 1.00 1.76 H new ATOM 0 HE3 LYS B 15 7.131 18.435 2.185 1.00 1.76 H new ATOM 0 HZ1 LYS B 15 8.653 20.058 2.256 1.00 1.80 H new ATOM 0 HZ2 LYS B 15 8.628 19.817 3.937 1.00 1.80 H new ATOM 0 HZ3 LYS B 15 9.835 19.086 2.993 1.00 1.80 H new ATOM 2030 N LYS B 16 7.050 12.414 2.340 1.00 1.14 N ATOM 2031 CA LYS B 16 6.225 11.675 1.392 1.00 1.14 C ATOM 2032 C LYS B 16 5.550 10.469 2.042 1.00 1.03 C ATOM 2033 O LYS B 16 4.391 10.167 1.751 1.00 1.01 O ATOM 2034 CB LYS B 16 7.072 11.220 0.201 1.00 1.22 C ATOM 2035 CG LYS B 16 7.525 12.365 -0.694 1.00 1.31 C ATOM 2036 CD LYS B 16 6.436 12.776 -1.671 1.00 1.30 C ATOM 2037 CE LYS B 16 6.367 11.830 -2.862 1.00 1.45 C ATOM 2038 NZ LYS B 16 5.214 12.131 -3.745 1.00 1.65 N ATOM 0 H LYS B 16 8.052 12.363 2.158 1.00 1.14 H new ATOM 0 HA LYS B 16 5.440 12.347 1.047 1.00 1.14 H new ATOM 0 HB2 LYS B 16 7.949 10.689 0.571 1.00 1.22 H new ATOM 0 HB3 LYS B 16 6.497 10.510 -0.394 1.00 1.22 H new ATOM 0 HG2 LYS B 16 7.804 13.220 -0.078 1.00 1.31 H new ATOM 0 HG3 LYS B 16 8.416 12.065 -1.246 1.00 1.31 H new ATOM 0 HD2 LYS B 16 5.473 12.789 -1.160 1.00 1.30 H new ATOM 0 HD3 LYS B 16 6.625 13.791 -2.022 1.00 1.30 H new ATOM 0 HE2 LYS B 16 7.291 11.901 -3.436 1.00 1.45 H new ATOM 0 HE3 LYS B 16 6.292 10.803 -2.505 1.00 1.45 H new ATOM 0 HZ1 LYS B 16 5.204 11.464 -4.543 1.00 1.65 H new ATOM 0 HZ2 LYS B 16 4.330 12.038 -3.205 1.00 1.65 H new ATOM 0 HZ3 LYS B 16 5.298 13.102 -4.107 1.00 1.65 H new ATOM 2052 N ILE B 17 6.272 9.795 2.931 1.00 0.98 N ATOM 2053 CA ILE B 17 5.745 8.615 3.601 1.00 0.92 C ATOM 2054 C ILE B 17 4.822 8.987 4.761 1.00 0.89 C ATOM 2055 O ILE B 17 3.799 8.333 4.977 1.00 0.86 O ATOM 2056 CB ILE B 17 6.899 7.690 4.068 1.00 0.94 C ATOM 2057 CG1 ILE B 17 7.552 7.053 2.839 1.00 1.00 C ATOM 2058 CG2 ILE B 17 6.403 6.614 5.026 1.00 1.00 C ATOM 2059 CD1 ILE B 17 8.863 6.351 3.118 1.00 0.96 C ATOM 0 H ILE B 17 7.222 10.046 3.203 1.00 0.98 H new ATOM 0 HA ILE B 17 5.141 8.065 2.880 1.00 0.92 H new ATOM 0 HB ILE B 17 7.631 8.289 4.609 1.00 0.94 H new ATOM 0 HG12 ILE B 17 6.856 6.336 2.404 1.00 1.00 H new ATOM 0 HG13 ILE B 17 7.721 7.827 2.091 1.00 1.00 H new ATOM 0 HG21 ILE B 17 7.239 5.985 5.332 1.00 1.00 H new ATOM 0 HG22 ILE B 17 5.963 7.084 5.905 1.00 1.00 H new ATOM 0 HG23 ILE B 17 5.652 6.001 4.528 1.00 1.00 H new ATOM 0 HD11 ILE B 17 9.254 5.929 2.192 1.00 0.96 H new ATOM 0 HD12 ILE B 17 9.580 7.066 3.523 1.00 0.96 H new ATOM 0 HD13 ILE B 17 8.701 5.551 3.841 1.00 0.96 H new ATOM 2071 N ASP B 18 5.151 10.054 5.485 1.00 0.94 N ATOM 2072 CA ASP B 18 4.310 10.483 6.605 1.00 0.99 C ATOM 2073 C ASP B 18 2.938 10.921 6.106 1.00 0.96 C ATOM 2074 O ASP B 18 1.915 10.596 6.702 1.00 0.94 O ATOM 2075 CB ASP B 18 4.960 11.612 7.401 1.00 1.14 C ATOM 2076 CG ASP B 18 4.205 11.909 8.685 1.00 1.29 C ATOM 2077 OD1 ASP B 18 4.369 11.155 9.672 1.00 1.88 O ATOM 2078 OD2 ASP B 18 3.446 12.901 8.721 1.00 1.59 O ATOM 0 H ASP B 18 5.977 10.630 5.323 1.00 0.94 H new ATOM 0 HA ASP B 18 4.194 9.627 7.270 1.00 0.99 H new ATOM 0 HB2 ASP B 18 5.989 11.342 7.639 1.00 1.14 H new ATOM 0 HB3 ASP B 18 5.000 12.512 6.787 1.00 1.14 H new ATOM 2083 N SER B 19 2.920 11.654 4.999 1.00 0.98 N ATOM 2084 CA SER B 19 1.666 12.102 4.406 1.00 0.99 C ATOM 2085 C SER B 19 0.925 10.920 3.781 1.00 0.91 C ATOM 2086 O SER B 19 -0.303 10.925 3.686 1.00 0.90 O ATOM 2087 CB SER B 19 1.923 13.176 3.349 1.00 1.10 C ATOM 2088 OG SER B 19 2.514 14.340 3.917 1.00 1.21 O ATOM 0 H SER B 19 3.756 11.950 4.496 1.00 0.98 H new ATOM 0 HA SER B 19 1.048 12.532 5.194 1.00 0.99 H new ATOM 0 HB2 SER B 19 2.578 12.776 2.575 1.00 1.10 H new ATOM 0 HB3 SER B 19 0.984 13.443 2.865 1.00 1.10 H new ATOM 0 HG SER B 19 3.489 14.239 3.929 1.00 1.21 H new ATOM 2094 N LEU B 20 1.689 9.924 3.340 1.00 0.87 N ATOM 2095 CA LEU B 20 1.133 8.731 2.719 1.00 0.84 C ATOM 2096 C LEU B 20 0.127 8.047 3.643 1.00 0.80 C ATOM 2097 O LEU B 20 -1.010 7.779 3.249 1.00 0.79 O ATOM 2098 CB LEU B 20 2.266 7.769 2.368 1.00 0.86 C ATOM 2099 CG LEU B 20 1.914 6.653 1.388 1.00 0.91 C ATOM 2100 CD1 LEU B 20 1.831 7.209 -0.027 1.00 1.07 C ATOM 2101 CD2 LEU B 20 2.951 5.548 1.484 1.00 1.35 C ATOM 0 H LEU B 20 2.707 9.923 3.404 1.00 0.87 H new ATOM 0 HA LEU B 20 0.606 9.023 1.811 1.00 0.84 H new ATOM 0 HB2 LEU B 20 3.090 8.347 1.950 1.00 0.86 H new ATOM 0 HB3 LEU B 20 2.630 7.315 3.290 1.00 0.86 H new ATOM 0 HG LEU B 20 0.940 6.235 1.642 1.00 0.91 H new ATOM 0 HD11 LEU B 20 1.579 6.406 -0.719 1.00 1.07 H new ATOM 0 HD12 LEU B 20 1.062 7.980 -0.070 1.00 1.07 H new ATOM 0 HD13 LEU B 20 2.793 7.640 -0.306 1.00 1.07 H new ATOM 0 HD21 LEU B 20 2.699 4.751 0.784 1.00 1.35 H new ATOM 0 HD22 LEU B 20 3.934 5.949 1.239 1.00 1.35 H new ATOM 0 HD23 LEU B 20 2.965 5.149 2.498 1.00 1.35 H new ATOM 2113 N ILE B 21 0.535 7.795 4.884 1.00 0.81 N ATOM 2114 CA ILE B 21 -0.348 7.144 5.846 1.00 0.82 C ATOM 2115 C ILE B 21 -1.524 8.044 6.195 1.00 0.81 C ATOM 2116 O ILE B 21 -2.618 7.558 6.455 1.00 0.81 O ATOM 2117 CB ILE B 21 0.391 6.703 7.131 1.00 0.88 C ATOM 2118 CG1 ILE B 21 1.367 7.781 7.603 1.00 1.19 C ATOM 2119 CG2 ILE B 21 1.118 5.390 6.879 1.00 1.21 C ATOM 2120 CD1 ILE B 21 2.297 7.332 8.709 1.00 1.38 C ATOM 0 H ILE B 21 1.460 8.029 5.244 1.00 0.81 H new ATOM 0 HA ILE B 21 -0.720 6.240 5.364 1.00 0.82 H new ATOM 0 HB ILE B 21 -0.344 6.556 7.923 1.00 0.88 H new ATOM 0 HG12 ILE B 21 1.964 8.112 6.753 1.00 1.19 H new ATOM 0 HG13 ILE B 21 0.798 8.644 7.949 1.00 1.19 H new ATOM 0 HG21 ILE B 21 1.638 5.082 7.786 1.00 1.21 H new ATOM 0 HG22 ILE B 21 0.397 4.623 6.596 1.00 1.21 H new ATOM 0 HG23 ILE B 21 1.841 5.523 6.074 1.00 1.21 H new ATOM 0 HD11 ILE B 21 2.957 8.154 8.986 1.00 1.38 H new ATOM 0 HD12 ILE B 21 1.711 7.029 9.577 1.00 1.38 H new ATOM 0 HD13 ILE B 21 2.894 6.489 8.362 1.00 1.38 H new ATOM 2132 N GLU B 22 -1.305 9.357 6.166 1.00 0.83 N ATOM 2133 CA GLU B 22 -2.371 10.313 6.459 1.00 0.86 C ATOM 2134 C GLU B 22 -3.464 10.242 5.395 1.00 0.83 C ATOM 2135 O GLU B 22 -4.647 10.399 5.692 1.00 0.84 O ATOM 2136 CB GLU B 22 -1.829 11.740 6.521 1.00 0.94 C ATOM 2137 CG GLU B 22 -0.888 12.005 7.682 1.00 1.11 C ATOM 2138 CD GLU B 22 -0.801 13.479 8.018 1.00 1.55 C ATOM 2139 OE1 GLU B 22 -0.391 14.274 7.146 1.00 1.98 O ATOM 2140 OE2 GLU B 22 -1.149 13.855 9.157 1.00 1.95 O ATOM 0 H GLU B 22 -0.405 9.782 5.944 1.00 0.83 H new ATOM 0 HA GLU B 22 -2.789 10.048 7.430 1.00 0.86 H new ATOM 0 HB2 GLU B 22 -1.307 11.958 5.589 1.00 0.94 H new ATOM 0 HB3 GLU B 22 -2.669 12.432 6.585 1.00 0.94 H new ATOM 0 HG2 GLU B 22 -1.229 11.453 8.558 1.00 1.11 H new ATOM 0 HG3 GLU B 22 0.106 11.630 7.436 1.00 1.11 H new ATOM 2147 N ALA B 23 -3.050 10.015 4.152 1.00 0.82 N ATOM 2148 CA ALA B 23 -3.979 9.914 3.037 1.00 0.83 C ATOM 2149 C ALA B 23 -4.830 8.652 3.151 1.00 0.79 C ATOM 2150 O ALA B 23 -6.056 8.716 3.083 1.00 0.80 O ATOM 2151 CB ALA B 23 -3.225 9.931 1.716 1.00 0.86 C ATOM 0 H ALA B 23 -2.070 9.897 3.893 1.00 0.82 H new ATOM 0 HA ALA B 23 -4.645 10.776 3.069 1.00 0.83 H new ATOM 0 HB1 ALA B 23 -3.934 9.855 0.891 1.00 0.86 H new ATOM 0 HB2 ALA B 23 -2.665 10.862 1.628 1.00 0.86 H new ATOM 0 HB3 ALA B 23 -2.535 9.088 1.680 1.00 0.86 H new ATOM 2157 N ILE B 24 -4.174 7.511 3.343 1.00 0.78 N ATOM 2158 CA ILE B 24 -4.872 6.234 3.476 1.00 0.78 C ATOM 2159 C ILE B 24 -5.798 6.269 4.699 1.00 0.74 C ATOM 2160 O ILE B 24 -6.924 5.762 4.662 1.00 0.74 O ATOM 2161 CB ILE B 24 -3.872 5.047 3.577 1.00 0.83 C ATOM 2162 CG1 ILE B 24 -3.389 4.623 2.182 1.00 0.99 C ATOM 2163 CG2 ILE B 24 -4.499 3.860 4.292 1.00 1.03 C ATOM 2164 CD1 ILE B 24 -2.398 5.579 1.547 1.00 0.89 C ATOM 0 H ILE B 24 -3.158 7.444 3.410 1.00 0.78 H new ATOM 0 HA ILE B 24 -5.473 6.079 2.580 1.00 0.78 H new ATOM 0 HB ILE B 24 -3.015 5.386 4.159 1.00 0.83 H new ATOM 0 HG12 ILE B 24 -2.930 3.637 2.254 1.00 0.99 H new ATOM 0 HG13 ILE B 24 -4.253 4.525 1.525 1.00 0.99 H new ATOM 0 HG21 ILE B 24 -3.777 3.046 4.348 1.00 1.03 H new ATOM 0 HG22 ILE B 24 -4.791 4.155 5.300 1.00 1.03 H new ATOM 0 HG23 ILE B 24 -5.379 3.527 3.742 1.00 1.03 H new ATOM 0 HD11 ILE B 24 -2.109 5.204 0.565 1.00 0.89 H new ATOM 0 HD12 ILE B 24 -2.858 6.561 1.440 1.00 0.89 H new ATOM 0 HD13 ILE B 24 -1.514 5.659 2.179 1.00 0.89 H new ATOM 2176 N LYS B 25 -5.318 6.903 5.764 1.00 0.74 N ATOM 2177 CA LYS B 25 -6.074 7.036 7.003 1.00 0.75 C ATOM 2178 C LYS B 25 -7.342 7.866 6.772 1.00 0.78 C ATOM 2179 O LYS B 25 -8.369 7.649 7.413 1.00 0.80 O ATOM 2180 CB LYS B 25 -5.197 7.694 8.074 1.00 0.79 C ATOM 2181 CG LYS B 25 -5.745 7.559 9.486 1.00 0.88 C ATOM 2182 CD LYS B 25 -5.088 6.416 10.248 1.00 1.17 C ATOM 2183 CE LYS B 25 -5.343 6.530 11.745 1.00 1.48 C ATOM 2184 NZ LYS B 25 -4.863 7.830 12.289 1.00 1.72 N ATOM 0 H LYS B 25 -4.396 7.338 5.792 1.00 0.74 H new ATOM 0 HA LYS B 25 -6.371 6.044 7.344 1.00 0.75 H new ATOM 0 HB2 LYS B 25 -4.202 7.251 8.037 1.00 0.79 H new ATOM 0 HB3 LYS B 25 -5.084 8.752 7.838 1.00 0.79 H new ATOM 0 HG2 LYS B 25 -5.587 8.492 10.026 1.00 0.88 H new ATOM 0 HG3 LYS B 25 -6.822 7.394 9.442 1.00 0.88 H new ATOM 0 HD2 LYS B 25 -5.473 5.464 9.883 1.00 1.17 H new ATOM 0 HD3 LYS B 25 -4.015 6.419 10.059 1.00 1.17 H new ATOM 0 HE2 LYS B 25 -6.410 6.425 11.941 1.00 1.48 H new ATOM 0 HE3 LYS B 25 -4.842 5.712 12.263 1.00 1.48 H new ATOM 0 HZ1 LYS B 25 -4.345 7.665 13.176 1.00 1.72 H new ATOM 0 HZ2 LYS B 25 -4.232 8.284 11.598 1.00 1.72 H new ATOM 0 HZ3 LYS B 25 -5.677 8.451 12.474 1.00 1.72 H new ATOM 2198 N LYS B 26 -7.258 8.810 5.847 1.00 0.80 N ATOM 2199 CA LYS B 26 -8.389 9.668 5.527 1.00 0.85 C ATOM 2200 C LYS B 26 -9.423 8.919 4.690 1.00 0.83 C ATOM 2201 O LYS B 26 -10.624 9.097 4.875 1.00 0.86 O ATOM 2202 CB LYS B 26 -7.917 10.920 4.783 1.00 0.91 C ATOM 2203 CG LYS B 26 -8.452 12.209 5.387 1.00 1.01 C ATOM 2204 CD LYS B 26 -9.921 12.428 5.052 1.00 1.13 C ATOM 2205 CE LYS B 26 -10.607 13.290 6.098 1.00 1.38 C ATOM 2206 NZ LYS B 26 -12.023 13.577 5.742 1.00 1.39 N ATOM 0 H LYS B 26 -6.416 9.002 5.304 1.00 0.80 H new ATOM 0 HA LYS B 26 -8.858 9.970 6.463 1.00 0.85 H new ATOM 0 HB2 LYS B 26 -6.827 10.949 4.787 1.00 0.91 H new ATOM 0 HB3 LYS B 26 -8.231 10.856 3.741 1.00 0.91 H new ATOM 0 HG2 LYS B 26 -8.327 12.182 6.469 1.00 1.01 H new ATOM 0 HG3 LYS B 26 -7.867 13.052 5.020 1.00 1.01 H new ATOM 0 HD2 LYS B 26 -10.006 12.903 4.075 1.00 1.13 H new ATOM 0 HD3 LYS B 26 -10.427 11.465 4.983 1.00 1.13 H new ATOM 0 HE2 LYS B 26 -10.571 12.786 7.064 1.00 1.38 H new ATOM 0 HE3 LYS B 26 -10.063 14.228 6.208 1.00 1.38 H new ATOM 0 HZ1 LYS B 26 -12.393 14.324 6.364 1.00 1.39 H new ATOM 0 HZ2 LYS B 26 -12.075 13.893 4.753 1.00 1.39 H new ATOM 0 HZ3 LYS B 26 -12.592 12.715 5.860 1.00 1.39 H new ATOM 2220 N ILE B 27 -8.950 8.067 3.786 1.00 0.80 N ATOM 2221 CA ILE B 27 -9.840 7.301 2.914 1.00 0.81 C ATOM 2222 C ILE B 27 -10.774 6.391 3.714 1.00 0.80 C ATOM 2223 O ILE B 27 -11.978 6.339 3.449 1.00 0.82 O ATOM 2224 CB ILE B 27 -9.045 6.461 1.883 1.00 0.81 C ATOM 2225 CG1 ILE B 27 -8.263 7.386 0.939 1.00 0.79 C ATOM 2226 CG2 ILE B 27 -9.979 5.553 1.090 1.00 0.90 C ATOM 2227 CD1 ILE B 27 -7.575 6.659 -0.199 1.00 1.04 C ATOM 0 H ILE B 27 -7.957 7.888 3.637 1.00 0.80 H new ATOM 0 HA ILE B 27 -10.447 8.029 2.375 1.00 0.81 H new ATOM 0 HB ILE B 27 -8.337 5.831 2.422 1.00 0.81 H new ATOM 0 HG12 ILE B 27 -8.946 8.127 0.524 1.00 0.79 H new ATOM 0 HG13 ILE B 27 -7.515 7.930 1.516 1.00 0.79 H new ATOM 0 HG21 ILE B 27 -9.399 4.973 0.372 1.00 0.90 H new ATOM 0 HG22 ILE B 27 -10.494 4.877 1.772 1.00 0.90 H new ATOM 0 HG23 ILE B 27 -10.712 6.160 0.558 1.00 0.90 H new ATOM 0 HD11 ILE B 27 -7.044 7.379 -0.822 1.00 1.04 H new ATOM 0 HD12 ILE B 27 -6.866 5.937 0.206 1.00 1.04 H new ATOM 0 HD13 ILE B 27 -8.320 6.138 -0.801 1.00 1.04 H new ATOM 2239 N ILE B 28 -10.225 5.686 4.705 1.00 0.78 N ATOM 2240 CA ILE B 28 -11.030 4.788 5.536 1.00 0.78 C ATOM 2241 C ILE B 28 -12.098 5.573 6.298 1.00 0.81 C ATOM 2242 O ILE B 28 -13.207 5.084 6.530 1.00 0.84 O ATOM 2243 CB ILE B 28 -10.160 3.962 6.522 1.00 0.77 C ATOM 2244 CG1 ILE B 28 -10.964 2.786 7.090 1.00 0.80 C ATOM 2245 CG2 ILE B 28 -9.617 4.828 7.656 1.00 0.82 C ATOM 2246 CD1 ILE B 28 -11.350 1.750 6.053 1.00 0.97 C ATOM 0 H ILE B 28 -9.236 5.718 4.951 1.00 0.78 H new ATOM 0 HA ILE B 28 -11.518 4.082 4.864 1.00 0.78 H new ATOM 0 HB ILE B 28 -9.308 3.574 5.963 1.00 0.77 H new ATOM 0 HG12 ILE B 28 -10.379 2.303 7.872 1.00 0.80 H new ATOM 0 HG13 ILE B 28 -11.869 3.170 7.560 1.00 0.80 H new ATOM 0 HG21 ILE B 28 -9.013 4.215 8.325 1.00 0.82 H new ATOM 0 HG22 ILE B 28 -9.002 5.626 7.241 1.00 0.82 H new ATOM 0 HG23 ILE B 28 -10.448 5.262 8.212 1.00 0.82 H new ATOM 0 HD11 ILE B 28 -11.916 0.950 6.531 1.00 0.97 H new ATOM 0 HD12 ILE B 28 -11.963 2.218 5.282 1.00 0.97 H new ATOM 0 HD13 ILE B 28 -10.449 1.336 5.599 1.00 0.97 H new ATOM 2258 N ALA B 29 -11.756 6.801 6.670 1.00 0.82 N ATOM 2259 CA ALA B 29 -12.667 7.663 7.403 1.00 0.87 C ATOM 2260 C ALA B 29 -13.891 7.998 6.560 1.00 0.90 C ATOM 2261 O ALA B 29 -15.027 7.925 7.039 1.00 0.93 O ATOM 2262 CB ALA B 29 -11.953 8.933 7.839 1.00 0.90 C ATOM 0 H ALA B 29 -10.848 7.221 6.473 1.00 0.82 H new ATOM 0 HA ALA B 29 -13.005 7.131 8.292 1.00 0.87 H new ATOM 0 HB1 ALA B 29 -12.647 9.570 8.387 1.00 0.90 H new ATOM 0 HB2 ALA B 29 -11.112 8.675 8.482 1.00 0.90 H new ATOM 0 HB3 ALA B 29 -11.588 9.465 6.960 1.00 0.90 H new ATOM 2268 N GLU B 30 -13.650 8.336 5.297 1.00 0.91 N ATOM 2269 CA GLU B 30 -14.725 8.686 4.374 1.00 0.95 C ATOM 2270 C GLU B 30 -15.654 7.499 4.157 1.00 0.95 C ATOM 2271 O GLU B 30 -16.868 7.659 4.073 1.00 0.96 O ATOM 2272 CB GLU B 30 -14.160 9.145 3.022 1.00 1.00 C ATOM 2273 CG GLU B 30 -12.944 10.054 3.122 1.00 1.02 C ATOM 2274 CD GLU B 30 -13.220 11.367 3.826 1.00 1.13 C ATOM 2275 OE1 GLU B 30 -13.332 11.373 5.070 1.00 1.18 O ATOM 2276 OE2 GLU B 30 -13.282 12.412 3.143 1.00 1.38 O ATOM 0 H GLU B 30 -12.716 8.375 4.888 1.00 0.91 H new ATOM 0 HA GLU B 30 -15.288 9.506 4.819 1.00 0.95 H new ATOM 0 HB2 GLU B 30 -13.893 8.265 2.437 1.00 1.00 H new ATOM 0 HB3 GLU B 30 -14.944 9.667 2.473 1.00 1.00 H new ATOM 0 HG2 GLU B 30 -12.151 9.527 3.653 1.00 1.02 H new ATOM 0 HG3 GLU B 30 -12.573 10.261 2.118 1.00 1.02 H new ATOM 2283 N PHE B 31 -15.073 6.305 4.082 1.00 0.96 N ATOM 2284 CA PHE B 31 -15.843 5.080 3.870 1.00 0.99 C ATOM 2285 C PHE B 31 -16.919 4.893 4.939 1.00 0.97 C ATOM 2286 O PHE B 31 -18.055 4.533 4.630 1.00 1.01 O ATOM 2287 CB PHE B 31 -14.924 3.859 3.849 1.00 1.01 C ATOM 2288 CG PHE B 31 -14.580 3.378 2.465 1.00 1.04 C ATOM 2289 CD1 PHE B 31 -13.509 3.923 1.773 1.00 1.50 C ATOM 2290 CD2 PHE B 31 -15.328 2.378 1.853 1.00 1.68 C ATOM 2291 CE1 PHE B 31 -13.189 3.485 0.501 1.00 1.59 C ATOM 2292 CE2 PHE B 31 -15.008 1.937 0.580 1.00 1.83 C ATOM 2293 CZ PHE B 31 -13.940 2.491 -0.096 1.00 1.37 C ATOM 0 H PHE B 31 -14.067 6.158 4.165 1.00 0.96 H new ATOM 0 HA PHE B 31 -16.336 5.177 2.903 1.00 0.99 H new ATOM 0 HB2 PHE B 31 -14.002 4.101 4.378 1.00 1.01 H new ATOM 0 HB3 PHE B 31 -15.402 3.047 4.397 1.00 1.01 H new ATOM 0 HD1 PHE B 31 -12.917 4.700 2.234 1.00 1.50 H new ATOM 0 HD2 PHE B 31 -16.166 1.941 2.375 1.00 1.68 H new ATOM 0 HE1 PHE B 31 -12.352 3.920 -0.026 1.00 1.59 H new ATOM 0 HE2 PHE B 31 -15.595 1.158 0.116 1.00 1.83 H new ATOM 0 HZ PHE B 31 -13.692 2.148 -1.090 1.00 1.37 H new ATOM 2303 N ASP B 32 -16.556 5.146 6.195 1.00 0.94 N ATOM 2304 CA ASP B 32 -17.488 5.004 7.315 1.00 0.93 C ATOM 2305 C ASP B 32 -18.608 6.037 7.217 1.00 0.93 C ATOM 2306 O ASP B 32 -19.785 5.728 7.441 1.00 0.96 O ATOM 2307 CB ASP B 32 -16.739 5.166 8.643 1.00 0.94 C ATOM 2308 CG ASP B 32 -17.585 4.803 9.850 1.00 1.20 C ATOM 2309 OD1 ASP B 32 -18.483 3.942 9.723 1.00 1.64 O ATOM 2310 OD2 ASP B 32 -17.340 5.361 10.942 1.00 1.54 O ATOM 0 H ASP B 32 -15.621 5.451 6.464 1.00 0.94 H new ATOM 0 HA ASP B 32 -17.931 4.009 7.273 1.00 0.93 H new ATOM 0 HB2 ASP B 32 -15.847 4.539 8.630 1.00 0.94 H new ATOM 0 HB3 ASP B 32 -16.402 6.198 8.740 1.00 0.94 H new ATOM 2315 N VAL B 33 -18.234 7.259 6.856 1.00 0.92 N ATOM 2316 CA VAL B 33 -19.190 8.348 6.717 1.00 0.93 C ATOM 2317 C VAL B 33 -20.137 8.091 5.543 1.00 0.94 C ATOM 2318 O VAL B 33 -21.351 8.249 5.669 1.00 0.95 O ATOM 2319 CB VAL B 33 -18.475 9.703 6.516 1.00 0.94 C ATOM 2320 CG1 VAL B 33 -19.484 10.838 6.468 1.00 1.00 C ATOM 2321 CG2 VAL B 33 -17.456 9.942 7.620 1.00 0.92 C ATOM 0 H VAL B 33 -17.269 7.520 6.653 1.00 0.92 H new ATOM 0 HA VAL B 33 -19.767 8.393 7.641 1.00 0.93 H new ATOM 0 HB VAL B 33 -17.947 9.672 5.563 1.00 0.94 H new ATOM 0 HG11 VAL B 33 -18.961 11.784 6.326 1.00 1.00 H new ATOM 0 HG12 VAL B 33 -20.174 10.677 5.640 1.00 1.00 H new ATOM 0 HG13 VAL B 33 -20.042 10.869 7.404 1.00 1.00 H new ATOM 0 HG21 VAL B 33 -16.964 10.901 7.460 1.00 0.92 H new ATOM 0 HG22 VAL B 33 -17.961 9.950 8.586 1.00 0.92 H new ATOM 0 HG23 VAL B 33 -16.712 9.146 7.607 1.00 0.92 H new ATOM 2331 N VAL B 34 -19.571 7.683 4.411 1.00 0.96 N ATOM 2332 CA VAL B 34 -20.355 7.392 3.212 1.00 0.99 C ATOM 2333 C VAL B 34 -21.351 6.264 3.474 1.00 1.00 C ATOM 2334 O VAL B 34 -22.475 6.286 2.967 1.00 1.02 O ATOM 2335 CB VAL B 34 -19.439 7.022 2.019 1.00 1.02 C ATOM 2336 CG1 VAL B 34 -20.251 6.449 0.865 1.00 1.21 C ATOM 2337 CG2 VAL B 34 -18.650 8.241 1.558 1.00 1.13 C ATOM 0 H VAL B 34 -18.567 7.545 4.298 1.00 0.96 H new ATOM 0 HA VAL B 34 -20.907 8.296 2.955 1.00 0.99 H new ATOM 0 HB VAL B 34 -18.739 6.257 2.354 1.00 1.02 H new ATOM 0 HG11 VAL B 34 -19.584 6.198 0.040 1.00 1.21 H new ATOM 0 HG12 VAL B 34 -20.772 5.551 1.197 1.00 1.21 H new ATOM 0 HG13 VAL B 34 -20.979 7.188 0.530 1.00 1.21 H new ATOM 0 HG21 VAL B 34 -18.011 7.965 0.719 1.00 1.13 H new ATOM 0 HG22 VAL B 34 -19.340 9.025 1.246 1.00 1.13 H new ATOM 0 HG23 VAL B 34 -18.033 8.607 2.379 1.00 1.13 H new ATOM 2347 N LYS B 35 -20.939 5.292 4.282 1.00 1.01 N ATOM 2348 CA LYS B 35 -21.790 4.158 4.624 1.00 1.05 C ATOM 2349 C LYS B 35 -23.088 4.635 5.274 1.00 1.03 C ATOM 2350 O LYS B 35 -24.181 4.224 4.877 1.00 1.05 O ATOM 2351 CB LYS B 35 -21.039 3.215 5.569 1.00 1.08 C ATOM 2352 CG LYS B 35 -21.840 1.999 6.011 1.00 1.13 C ATOM 2353 CD LYS B 35 -22.244 2.100 7.477 1.00 1.32 C ATOM 2354 CE LYS B 35 -22.695 0.756 8.025 1.00 1.51 C ATOM 2355 NZ LYS B 35 -21.573 -0.212 8.130 1.00 1.86 N ATOM 0 H LYS B 35 -20.015 5.268 4.714 1.00 1.01 H new ATOM 0 HA LYS B 35 -22.044 3.621 3.710 1.00 1.05 H new ATOM 0 HB2 LYS B 35 -20.128 2.875 5.076 1.00 1.08 H new ATOM 0 HB3 LYS B 35 -20.733 3.774 6.453 1.00 1.08 H new ATOM 0 HG2 LYS B 35 -22.732 1.905 5.392 1.00 1.13 H new ATOM 0 HG3 LYS B 35 -21.249 1.097 5.857 1.00 1.13 H new ATOM 0 HD2 LYS B 35 -21.402 2.469 8.063 1.00 1.32 H new ATOM 0 HD3 LYS B 35 -23.049 2.827 7.584 1.00 1.32 H new ATOM 0 HE2 LYS B 35 -23.143 0.898 9.008 1.00 1.51 H new ATOM 0 HE3 LYS B 35 -23.469 0.343 7.379 1.00 1.51 H new ATOM 0 HZ1 LYS B 35 -21.834 -0.976 8.786 1.00 1.86 H new ATOM 0 HZ2 LYS B 35 -21.372 -0.614 7.192 1.00 1.86 H new ATOM 0 HZ3 LYS B 35 -20.726 0.275 8.486 1.00 1.86 H new ATOM 2369 N GLU B 36 -22.963 5.508 6.264 1.00 1.00 N ATOM 2370 CA GLU B 36 -24.132 6.039 6.951 1.00 1.00 C ATOM 2371 C GLU B 36 -24.868 7.069 6.091 1.00 0.96 C ATOM 2372 O GLU B 36 -26.095 7.160 6.132 1.00 0.97 O ATOM 2373 CB GLU B 36 -23.740 6.653 8.294 1.00 1.01 C ATOM 2374 CG GLU B 36 -24.930 6.937 9.195 1.00 1.15 C ATOM 2375 CD GLU B 36 -25.615 5.674 9.682 1.00 1.29 C ATOM 2376 OE1 GLU B 36 -26.241 4.968 8.868 1.00 1.40 O ATOM 2377 OE2 GLU B 36 -25.538 5.382 10.893 1.00 1.57 O ATOM 0 H GLU B 36 -22.070 5.862 6.608 1.00 1.00 H new ATOM 0 HA GLU B 36 -24.811 5.206 7.133 1.00 1.00 H new ATOM 0 HB2 GLU B 36 -23.056 5.978 8.809 1.00 1.01 H new ATOM 0 HB3 GLU B 36 -23.198 7.582 8.117 1.00 1.01 H new ATOM 0 HG2 GLU B 36 -24.598 7.519 10.055 1.00 1.15 H new ATOM 0 HG3 GLU B 36 -25.651 7.550 8.654 1.00 1.15 H new ATOM 2384 N SER B 37 -24.128 7.820 5.304 1.00 0.00 N ATOM 2385 CA SER B 37 -24.661 8.863 4.432 1.00 0.00 C ATOM 2386 C SER B 37 -25.681 8.296 3.472 1.00 0.00 C ATOM 2387 O SER B 37 -26.795 8.817 3.343 1.00 0.00 O ATOM 2388 CB SER B 37 -23.518 9.592 3.682 1.00 0.00 C ATOM 2389 OG SER B 37 -22.671 10.345 4.557 1.00 0.00 O ATOM 0 H SER B 37 -23.114 7.726 5.246 1.00 0.00 H new ATOM 0 HA SER B 37 -25.170 9.600 5.054 1.00 0.00 H new ATOM 0 HB2 SER B 37 -22.917 8.859 3.144 1.00 0.00 H new ATOM 0 HB3 SER B 37 -23.948 10.260 2.936 1.00 0.00 H new ATOM 0 HG SER B 37 -22.121 9.732 5.088 1.00 0.00 H new ATOM 2395 N VAL B 38 -25.290 7.261 2.731 1.00 0.96 N ATOM 2396 CA VAL B 38 -26.167 6.650 1.736 1.00 1.00 C ATOM 2397 C VAL B 38 -27.377 5.993 2.392 1.00 1.02 C ATOM 2398 O VAL B 38 -28.450 5.908 1.790 1.00 1.04 O ATOM 2399 CB VAL B 38 -25.420 5.622 0.851 1.00 1.05 C ATOM 2400 CG1 VAL B 38 -24.335 6.317 0.038 1.00 1.05 C ATOM 2401 CG2 VAL B 38 -24.831 4.491 1.683 1.00 1.07 C ATOM 0 H VAL B 38 -24.369 6.828 2.802 1.00 0.96 H new ATOM 0 HA VAL B 38 -26.513 7.458 1.091 1.00 1.00 H new ATOM 0 HB VAL B 38 -26.143 5.180 0.166 1.00 1.05 H new ATOM 0 HG11 VAL B 38 -23.817 5.583 -0.580 1.00 1.05 H new ATOM 0 HG12 VAL B 38 -24.788 7.075 -0.601 1.00 1.05 H new ATOM 0 HG13 VAL B 38 -23.622 6.791 0.713 1.00 1.05 H new ATOM 0 HG21 VAL B 38 -24.314 3.789 1.029 1.00 1.07 H new ATOM 0 HG22 VAL B 38 -24.125 4.900 2.406 1.00 1.07 H new ATOM 0 HG23 VAL B 38 -25.631 3.973 2.211 1.00 1.07 H new ATOM 2411 N ASN B 39 -27.202 5.536 3.626 1.00 1.03 N ATOM 2412 CA ASN B 39 -28.283 4.905 4.372 1.00 1.07 C ATOM 2413 C ASN B 39 -29.397 5.917 4.659 1.00 1.05 C ATOM 2414 O ASN B 39 -30.562 5.688 4.328 1.00 1.08 O ATOM 2415 CB ASN B 39 -27.733 4.323 5.680 1.00 1.11 C ATOM 2416 CG ASN B 39 -28.816 3.812 6.615 1.00 1.20 C ATOM 2417 OD1 ASN B 39 -29.835 3.276 6.182 1.00 1.25 O ATOM 2418 ND2 ASN B 39 -28.599 3.981 7.909 1.00 1.25 N ATOM 0 H ASN B 39 -26.318 5.591 4.132 1.00 1.03 H new ATOM 0 HA ASN B 39 -28.705 4.097 3.774 1.00 1.07 H new ATOM 0 HB2 ASN B 39 -27.050 3.506 5.447 1.00 1.11 H new ATOM 0 HB3 ASN B 39 -27.151 5.089 6.194 1.00 1.11 H new ATOM 0 HD21 ASN B 39 -29.290 3.662 8.588 1.00 1.25 H new ATOM 0 HD22 ASN B 39 -27.741 4.430 8.228 1.00 1.25 H new ATOM 2425 N GLU B 40 -29.021 7.054 5.232 1.00 1.02 N ATOM 2426 CA GLU B 40 -29.974 8.106 5.565 1.00 1.02 C ATOM 2427 C GLU B 40 -30.546 8.760 4.310 1.00 0.98 C ATOM 2428 O GLU B 40 -31.686 9.224 4.306 1.00 1.01 O ATOM 2429 CB GLU B 40 -29.299 9.167 6.432 1.00 1.04 C ATOM 2430 CG GLU B 40 -29.473 8.944 7.922 1.00 1.24 C ATOM 2431 CD GLU B 40 -29.813 10.226 8.653 1.00 1.46 C ATOM 2432 OE1 GLU B 40 -30.660 10.996 8.148 1.00 1.92 O ATOM 2433 OE2 GLU B 40 -29.244 10.468 9.737 1.00 2.04 O ATOM 0 H GLU B 40 -28.055 7.272 5.477 1.00 1.02 H new ATOM 0 HA GLU B 40 -30.796 7.648 6.116 1.00 1.02 H new ATOM 0 HB2 GLU B 40 -28.234 9.189 6.200 1.00 1.04 H new ATOM 0 HB3 GLU B 40 -29.702 10.146 6.171 1.00 1.04 H new ATOM 0 HG2 GLU B 40 -30.263 8.211 8.089 1.00 1.24 H new ATOM 0 HG3 GLU B 40 -28.556 8.524 8.335 1.00 1.24 H new ATOM 2440 N LEU B 41 -29.744 8.799 3.251 1.00 0.95 N ATOM 2441 CA LEU B 41 -30.158 9.406 1.990 1.00 0.94 C ATOM 2442 C LEU B 41 -31.277 8.607 1.330 1.00 0.95 C ATOM 2443 O LEU B 41 -32.314 9.164 0.969 1.00 0.97 O ATOM 2444 CB LEU B 41 -28.966 9.521 1.037 1.00 0.92 C ATOM 2445 CG LEU B 41 -29.118 10.556 -0.079 1.00 0.97 C ATOM 2446 CD1 LEU B 41 -29.320 11.948 0.504 1.00 1.08 C ATOM 2447 CD2 LEU B 41 -27.903 10.534 -0.993 1.00 1.01 C ATOM 0 H LEU B 41 -28.799 8.415 3.241 1.00 0.95 H new ATOM 0 HA LEU B 41 -30.537 10.404 2.211 1.00 0.94 H new ATOM 0 HB2 LEU B 41 -28.079 9.767 1.620 1.00 0.92 H new ATOM 0 HB3 LEU B 41 -28.789 8.546 0.584 1.00 0.92 H new ATOM 0 HG LEU B 41 -29.999 10.299 -0.667 1.00 0.97 H new ATOM 0 HD11 LEU B 41 -29.426 12.670 -0.306 1.00 1.08 H new ATOM 0 HD12 LEU B 41 -30.220 11.958 1.119 1.00 1.08 H new ATOM 0 HD13 LEU B 41 -28.459 12.214 1.117 1.00 1.08 H new ATOM 0 HD21 LEU B 41 -28.027 11.276 -1.781 1.00 1.01 H new ATOM 0 HD22 LEU B 41 -27.008 10.765 -0.415 1.00 1.01 H new ATOM 0 HD23 LEU B 41 -27.801 9.545 -1.439 1.00 1.01 H new ATOM 2459 N SER B 42 -31.063 7.300 1.181 1.00 0.97 N ATOM 2460 CA SER B 42 -32.058 6.425 0.566 1.00 1.01 C ATOM 2461 C SER B 42 -33.364 6.466 1.356 1.00 1.02 C ATOM 2462 O SER B 42 -34.452 6.357 0.794 1.00 1.03 O ATOM 2463 CB SER B 42 -31.525 4.991 0.497 1.00 1.07 C ATOM 2464 OG SER B 42 -30.205 4.967 -0.025 1.00 1.56 O ATOM 0 H SER B 42 -30.210 6.825 1.478 1.00 0.97 H new ATOM 0 HA SER B 42 -32.255 6.777 -0.447 1.00 1.01 H new ATOM 0 HB2 SER B 42 -31.535 4.546 1.492 1.00 1.07 H new ATOM 0 HB3 SER B 42 -32.179 4.385 -0.130 1.00 1.07 H new ATOM 0 HG SER B 42 -29.561 5.016 0.712 1.00 1.56 H new ATOM 2470 N GLU B 43 -33.233 6.646 2.664 1.00 1.04 N ATOM 2471 CA GLU B 43 -34.376 6.714 3.561 1.00 1.07 C ATOM 2472 C GLU B 43 -35.255 7.930 3.248 1.00 1.05 C ATOM 2473 O GLU B 43 -36.482 7.829 3.220 1.00 1.10 O ATOM 2474 CB GLU B 43 -33.877 6.768 5.004 1.00 1.12 C ATOM 2475 CG GLU B 43 -34.967 7.013 6.032 1.00 1.24 C ATOM 2476 CD GLU B 43 -34.407 7.422 7.372 1.00 1.41 C ATOM 2477 OE1 GLU B 43 -33.936 6.544 8.120 1.00 1.92 O ATOM 2478 OE2 GLU B 43 -34.427 8.631 7.683 1.00 1.56 O ATOM 0 H GLU B 43 -32.332 6.749 3.131 1.00 1.04 H new ATOM 0 HA GLU B 43 -34.989 5.824 3.420 1.00 1.07 H new ATOM 0 HB2 GLU B 43 -33.377 5.828 5.239 1.00 1.12 H new ATOM 0 HB3 GLU B 43 -33.130 7.557 5.089 1.00 1.12 H new ATOM 0 HG2 GLU B 43 -35.638 7.791 5.668 1.00 1.24 H new ATOM 0 HG3 GLU B 43 -35.562 6.108 6.150 1.00 1.24 H new ATOM 2485 N LYS B 44 -34.624 9.077 3.004 1.00 1.00 N ATOM 2486 CA LYS B 44 -35.357 10.307 2.700 1.00 1.00 C ATOM 2487 C LYS B 44 -35.935 10.265 1.290 1.00 0.98 C ATOM 2488 O LYS B 44 -37.012 10.797 1.030 1.00 1.03 O ATOM 2489 CB LYS B 44 -34.437 11.527 2.833 1.00 1.01 C ATOM 2490 CG LYS B 44 -33.660 11.581 4.138 1.00 1.06 C ATOM 2491 CD LYS B 44 -34.573 11.740 5.343 1.00 1.17 C ATOM 2492 CE LYS B 44 -33.775 11.827 6.634 1.00 1.32 C ATOM 2493 NZ LYS B 44 -32.921 10.629 6.844 1.00 1.35 N ATOM 0 H LYS B 44 -33.609 9.182 3.011 1.00 1.00 H new ATOM 0 HA LYS B 44 -36.175 10.389 3.415 1.00 1.00 H new ATOM 0 HB2 LYS B 44 -33.731 11.528 2.002 1.00 1.01 H new ATOM 0 HB3 LYS B 44 -35.037 12.432 2.743 1.00 1.01 H new ATOM 0 HG2 LYS B 44 -33.072 10.669 4.247 1.00 1.06 H new ATOM 0 HG3 LYS B 44 -32.956 12.412 4.106 1.00 1.06 H new ATOM 0 HD2 LYS B 44 -35.179 12.638 5.227 1.00 1.17 H new ATOM 0 HD3 LYS B 44 -35.261 10.896 5.394 1.00 1.17 H new ATOM 0 HE2 LYS B 44 -33.149 12.719 6.614 1.00 1.32 H new ATOM 0 HE3 LYS B 44 -34.459 11.937 7.476 1.00 1.32 H new ATOM 0 HZ1 LYS B 44 -32.308 10.780 7.670 1.00 1.35 H new ATOM 0 HZ2 LYS B 44 -33.524 9.797 7.008 1.00 1.35 H new ATOM 0 HZ3 LYS B 44 -32.333 10.470 6.001 1.00 1.35 H new ATOM 2507 N ALA B 45 -35.209 9.619 0.387 1.00 0.98 N ATOM 2508 CA ALA B 45 -35.622 9.509 -1.006 1.00 0.99 C ATOM 2509 C ALA B 45 -36.783 8.535 -1.178 1.00 1.01 C ATOM 2510 O ALA B 45 -37.512 8.597 -2.166 1.00 1.03 O ATOM 2511 CB ALA B 45 -34.444 9.077 -1.862 1.00 1.01 C ATOM 0 H ALA B 45 -34.323 9.159 0.597 1.00 0.98 H new ATOM 0 HA ALA B 45 -35.967 10.491 -1.330 1.00 0.99 H new ATOM 0 HB1 ALA B 45 -34.760 8.997 -2.902 1.00 1.01 H new ATOM 0 HB2 ALA B 45 -33.646 9.815 -1.781 1.00 1.01 H new ATOM 0 HB3 ALA B 45 -34.080 8.109 -1.518 1.00 1.01 H new ATOM 2517 N LYS B 46 -36.969 7.658 -0.199 1.00 1.04 N ATOM 2518 CA LYS B 46 -38.028 6.654 -0.246 1.00 1.10 C ATOM 2519 C LYS B 46 -39.416 7.294 -0.194 1.00 1.12 C ATOM 2520 O LYS B 46 -40.424 6.646 -0.489 1.00 1.18 O ATOM 2521 CB LYS B 46 -37.854 5.669 0.912 1.00 1.18 C ATOM 2522 CG LYS B 46 -38.542 4.333 0.686 1.00 1.46 C ATOM 2523 CD LYS B 46 -38.158 3.319 1.754 1.00 1.98 C ATOM 2524 CE LYS B 46 -39.354 2.489 2.190 1.00 2.66 C ATOM 2525 NZ LYS B 46 -40.427 3.326 2.788 1.00 3.40 N ATOM 0 H LYS B 46 -36.396 7.621 0.644 1.00 1.04 H new ATOM 0 HA LYS B 46 -37.949 6.121 -1.194 1.00 1.10 H new ATOM 0 HB2 LYS B 46 -36.790 5.497 1.074 1.00 1.18 H new ATOM 0 HB3 LYS B 46 -38.246 6.120 1.823 1.00 1.18 H new ATOM 0 HG2 LYS B 46 -39.623 4.474 0.689 1.00 1.46 H new ATOM 0 HG3 LYS B 46 -38.274 3.946 -0.297 1.00 1.46 H new ATOM 0 HD2 LYS B 46 -37.378 2.661 1.369 1.00 1.98 H new ATOM 0 HD3 LYS B 46 -37.740 3.838 2.617 1.00 1.98 H new ATOM 0 HE2 LYS B 46 -39.752 1.949 1.331 1.00 2.66 H new ATOM 0 HE3 LYS B 46 -39.031 1.742 2.915 1.00 2.66 H new ATOM 0 HZ1 LYS B 46 -40.948 2.769 3.495 1.00 3.40 H new ATOM 0 HZ2 LYS B 46 -40.004 4.158 3.246 1.00 3.40 H new ATOM 0 HZ3 LYS B 46 -41.081 3.637 2.042 1.00 3.40 H new ATOM 2539 N THR B 47 -39.471 8.560 0.188 1.00 1.10 N ATOM 2540 CA THR B 47 -40.734 9.274 0.266 1.00 1.16 C ATOM 2541 C THR B 47 -41.232 9.675 -1.129 1.00 1.17 C ATOM 2542 O THR B 47 -42.417 9.968 -1.319 1.00 1.27 O ATOM 2543 CB THR B 47 -40.592 10.531 1.146 1.00 1.24 C ATOM 2544 OG1 THR B 47 -39.495 10.354 2.054 1.00 1.54 O ATOM 2545 CG2 THR B 47 -41.868 10.787 1.935 1.00 1.41 C ATOM 0 H THR B 47 -38.655 9.114 0.449 1.00 1.10 H new ATOM 0 HA THR B 47 -41.465 8.602 0.716 1.00 1.16 H new ATOM 0 HB THR B 47 -40.407 11.389 0.500 1.00 1.24 H new ATOM 0 HG1 THR B 47 -38.666 10.657 1.628 1.00 1.54 H new ATOM 0 HG21 THR B 47 -41.744 11.679 2.549 1.00 1.41 H new ATOM 0 HG22 THR B 47 -42.699 10.934 1.245 1.00 1.41 H new ATOM 0 HG23 THR B 47 -42.077 9.931 2.577 1.00 1.41 H new ATOM 2553 N ASP B 48 -40.334 9.651 -2.106 1.00 1.14 N ATOM 2554 CA ASP B 48 -40.676 10.032 -3.468 1.00 1.18 C ATOM 2555 C ASP B 48 -40.291 8.927 -4.449 1.00 1.14 C ATOM 2556 O ASP B 48 -39.169 8.437 -4.418 1.00 1.10 O ATOM 2557 CB ASP B 48 -39.961 11.328 -3.833 1.00 1.23 C ATOM 2558 CG ASP B 48 -40.307 11.801 -5.225 1.00 1.28 C ATOM 2559 OD1 ASP B 48 -41.420 12.328 -5.419 1.00 1.39 O ATOM 2560 OD2 ASP B 48 -39.467 11.644 -6.130 1.00 1.43 O ATOM 0 H ASP B 48 -39.362 9.371 -1.979 1.00 1.14 H new ATOM 0 HA ASP B 48 -41.754 10.185 -3.529 1.00 1.18 H new ATOM 0 HB2 ASP B 48 -40.226 12.102 -3.112 1.00 1.23 H new ATOM 0 HB3 ASP B 48 -38.884 11.179 -3.760 1.00 1.23 H new ATOM 2565 N PRO B 49 -41.209 8.534 -5.343 1.00 1.20 N ATOM 2566 CA PRO B 49 -40.963 7.460 -6.321 1.00 1.22 C ATOM 2567 C PRO B 49 -39.836 7.775 -7.303 1.00 1.24 C ATOM 2568 O PRO B 49 -39.121 6.873 -7.749 1.00 1.24 O ATOM 2569 CB PRO B 49 -42.298 7.336 -7.063 1.00 1.33 C ATOM 2570 CG PRO B 49 -42.992 8.633 -6.835 1.00 1.36 C ATOM 2571 CD PRO B 49 -42.560 9.097 -5.476 1.00 1.29 C ATOM 0 HA PRO B 49 -40.641 6.545 -5.825 1.00 1.22 H new ATOM 0 HB2 PRO B 49 -42.142 7.154 -8.126 1.00 1.33 H new ATOM 0 HB3 PRO B 49 -42.886 6.502 -6.680 1.00 1.33 H new ATOM 0 HG2 PRO B 49 -42.722 9.360 -7.600 1.00 1.36 H new ATOM 0 HG3 PRO B 49 -44.074 8.510 -6.880 1.00 1.36 H new ATOM 0 HD2 PRO B 49 -42.552 10.185 -5.406 1.00 1.29 H new ATOM 0 HD3 PRO B 49 -43.227 8.732 -4.695 1.00 1.29 H new ATOM 2579 N GLN B 50 -39.665 9.052 -7.624 1.00 1.28 N ATOM 2580 CA GLN B 50 -38.632 9.463 -8.565 1.00 1.33 C ATOM 2581 C GLN B 50 -37.269 9.423 -7.883 1.00 1.22 C ATOM 2582 O GLN B 50 -36.318 8.834 -8.401 1.00 1.22 O ATOM 2583 CB GLN B 50 -38.900 10.874 -9.103 1.00 1.45 C ATOM 2584 CG GLN B 50 -40.381 11.223 -9.233 1.00 1.58 C ATOM 2585 CD GLN B 50 -40.610 12.718 -9.328 1.00 1.65 C ATOM 2586 OE1 GLN B 50 -40.803 13.266 -10.412 1.00 1.81 O ATOM 2587 NE2 GLN B 50 -40.594 13.385 -8.186 1.00 1.66 N ATOM 0 H GLN B 50 -40.226 9.817 -7.248 1.00 1.28 H new ATOM 0 HA GLN B 50 -38.643 8.770 -9.406 1.00 1.33 H new ATOM 0 HB2 GLN B 50 -38.424 11.599 -8.443 1.00 1.45 H new ATOM 0 HB3 GLN B 50 -38.427 10.974 -10.080 1.00 1.45 H new ATOM 0 HG2 GLN B 50 -40.791 10.737 -10.119 1.00 1.58 H new ATOM 0 HG3 GLN B 50 -40.923 10.828 -8.373 1.00 1.58 H new ATOM 0 HE21 GLN B 50 -40.430 12.891 -7.309 1.00 1.66 H new ATOM 0 HE22 GLN B 50 -40.746 14.394 -8.182 1.00 1.66 H new ATOM 2596 N ALA B 51 -37.192 10.048 -6.714 1.00 1.15 N ATOM 2597 CA ALA B 51 -35.956 10.087 -5.941 1.00 1.08 C ATOM 2598 C ALA B 51 -35.546 8.685 -5.508 1.00 1.00 C ATOM 2599 O ALA B 51 -34.362 8.349 -5.503 1.00 0.98 O ATOM 2600 CB ALA B 51 -36.117 10.994 -4.729 1.00 1.09 C ATOM 0 H ALA B 51 -37.974 10.537 -6.279 1.00 1.15 H new ATOM 0 HA ALA B 51 -35.167 10.492 -6.575 1.00 1.08 H new ATOM 0 HB1 ALA B 51 -35.186 11.013 -4.162 1.00 1.09 H new ATOM 0 HB2 ALA B 51 -36.361 12.004 -5.060 1.00 1.09 H new ATOM 0 HB3 ALA B 51 -36.920 10.616 -4.096 1.00 1.09 H new ATOM 2606 N ALA B 52 -36.536 7.868 -5.160 1.00 0.99 N ATOM 2607 CA ALA B 52 -36.289 6.493 -4.741 1.00 0.98 C ATOM 2608 C ALA B 52 -35.675 5.688 -5.876 1.00 1.02 C ATOM 2609 O ALA B 52 -34.878 4.783 -5.643 1.00 1.03 O ATOM 2610 CB ALA B 52 -37.573 5.833 -4.268 1.00 1.03 C ATOM 0 H ALA B 52 -37.520 8.136 -5.160 1.00 0.99 H new ATOM 0 HA ALA B 52 -35.585 6.517 -3.909 1.00 0.98 H new ATOM 0 HB1 ALA B 52 -37.364 4.808 -3.961 1.00 1.03 H new ATOM 0 HB2 ALA B 52 -37.978 6.390 -3.423 1.00 1.03 H new ATOM 0 HB3 ALA B 52 -38.300 5.827 -5.080 1.00 1.03 H new ATOM 2616 N GLU B 53 -36.041 6.029 -7.106 1.00 1.09 N ATOM 2617 CA GLU B 53 -35.507 5.341 -8.271 1.00 1.18 C ATOM 2618 C GLU B 53 -34.068 5.780 -8.516 1.00 1.17 C ATOM 2619 O GLU B 53 -33.221 4.983 -8.927 1.00 1.23 O ATOM 2620 CB GLU B 53 -36.363 5.616 -9.508 1.00 1.28 C ATOM 2621 CG GLU B 53 -36.127 4.625 -10.639 1.00 1.45 C ATOM 2622 CD GLU B 53 -36.044 3.193 -10.154 1.00 1.51 C ATOM 2623 OE1 GLU B 53 -36.909 2.781 -9.351 1.00 1.66 O ATOM 2624 OE2 GLU B 53 -35.112 2.471 -10.568 1.00 1.58 O ATOM 0 H GLU B 53 -36.703 6.775 -7.320 1.00 1.09 H new ATOM 0 HA GLU B 53 -35.527 4.268 -8.079 1.00 1.18 H new ATOM 0 HB2 GLU B 53 -37.415 5.590 -9.226 1.00 1.28 H new ATOM 0 HB3 GLU B 53 -36.155 6.623 -9.868 1.00 1.28 H new ATOM 0 HG2 GLU B 53 -36.934 4.712 -11.367 1.00 1.45 H new ATOM 0 HG3 GLU B 53 -35.203 4.883 -11.156 1.00 1.45 H new ATOM 2631 N LYS B 54 -33.799 7.054 -8.250 1.00 1.13 N ATOM 2632 CA LYS B 54 -32.462 7.608 -8.417 1.00 1.14 C ATOM 2633 C LYS B 54 -31.495 6.924 -7.464 1.00 1.05 C ATOM 2634 O LYS B 54 -30.414 6.488 -7.861 1.00 1.09 O ATOM 2635 CB LYS B 54 -32.467 9.118 -8.154 1.00 1.16 C ATOM 2636 CG LYS B 54 -33.280 9.914 -9.164 1.00 1.32 C ATOM 2637 CD LYS B 54 -33.313 11.400 -8.822 1.00 1.48 C ATOM 2638 CE LYS B 54 -31.949 12.059 -8.998 1.00 1.68 C ATOM 2639 NZ LYS B 54 -31.495 12.033 -10.415 1.00 2.09 N ATOM 0 H LYS B 54 -34.493 7.724 -7.917 1.00 1.13 H new ATOM 0 HA LYS B 54 -32.141 7.434 -9.444 1.00 1.14 H new ATOM 0 HB2 LYS B 54 -32.864 9.302 -7.156 1.00 1.16 H new ATOM 0 HB3 LYS B 54 -31.440 9.482 -8.161 1.00 1.16 H new ATOM 0 HG2 LYS B 54 -32.855 9.780 -10.159 1.00 1.32 H new ATOM 0 HG3 LYS B 54 -34.298 9.526 -9.197 1.00 1.32 H new ATOM 0 HD2 LYS B 54 -34.042 11.902 -9.458 1.00 1.48 H new ATOM 0 HD3 LYS B 54 -33.647 11.527 -7.792 1.00 1.48 H new ATOM 0 HE2 LYS B 54 -31.998 13.091 -8.652 1.00 1.68 H new ATOM 0 HE3 LYS B 54 -31.216 11.548 -8.373 1.00 1.68 H new ATOM 0 HZ1 LYS B 54 -30.695 12.686 -10.535 1.00 2.09 H new ATOM 0 HZ2 LYS B 54 -31.196 11.069 -10.666 1.00 2.09 H new ATOM 0 HZ3 LYS B 54 -32.277 12.326 -11.035 1.00 2.09 H new ATOM 2653 N LEU B 55 -31.904 6.807 -6.204 1.00 0.98 N ATOM 2654 CA LEU B 55 -31.077 6.170 -5.186 1.00 0.95 C ATOM 2655 C LEU B 55 -31.003 4.669 -5.411 1.00 0.99 C ATOM 2656 O LEU B 55 -30.037 4.024 -5.024 1.00 0.99 O ATOM 2657 CB LEU B 55 -31.619 6.471 -3.786 1.00 0.94 C ATOM 2658 CG LEU B 55 -30.850 7.544 -3.006 1.00 1.02 C ATOM 2659 CD1 LEU B 55 -29.424 7.090 -2.735 1.00 1.13 C ATOM 2660 CD2 LEU B 55 -30.854 8.864 -3.761 1.00 1.09 C ATOM 0 H LEU B 55 -32.804 7.146 -5.864 1.00 0.98 H new ATOM 0 HA LEU B 55 -30.070 6.579 -5.265 1.00 0.95 H new ATOM 0 HB2 LEU B 55 -32.659 6.785 -3.876 1.00 0.94 H new ATOM 0 HB3 LEU B 55 -31.614 5.548 -3.205 1.00 0.94 H new ATOM 0 HG LEU B 55 -31.351 7.695 -2.050 1.00 1.02 H new ATOM 0 HD11 LEU B 55 -28.895 7.865 -2.181 1.00 1.13 H new ATOM 0 HD12 LEU B 55 -29.440 6.171 -2.149 1.00 1.13 H new ATOM 0 HD13 LEU B 55 -28.914 6.908 -3.681 1.00 1.13 H new ATOM 0 HD21 LEU B 55 -30.303 9.611 -3.190 1.00 1.09 H new ATOM 0 HD22 LEU B 55 -30.380 8.728 -4.733 1.00 1.09 H new ATOM 0 HD23 LEU B 55 -31.881 9.200 -3.902 1.00 1.09 H new ATOM 2672 N ASN B 56 -32.031 4.123 -6.044 1.00 1.06 N ATOM 2673 CA ASN B 56 -32.091 2.693 -6.350 1.00 1.16 C ATOM 2674 C ASN B 56 -30.967 2.306 -7.303 1.00 1.20 C ATOM 2675 O ASN B 56 -30.254 1.330 -7.084 1.00 1.26 O ATOM 2676 CB ASN B 56 -33.444 2.351 -6.983 1.00 1.26 C ATOM 2677 CG ASN B 56 -33.551 0.896 -7.397 1.00 1.44 C ATOM 2678 OD1 ASN B 56 -33.068 0.000 -6.702 1.00 1.49 O ATOM 2679 ND2 ASN B 56 -34.173 0.655 -8.540 1.00 1.58 N ATOM 0 H ASN B 56 -32.844 4.651 -6.360 1.00 1.06 H new ATOM 0 HA ASN B 56 -31.974 2.134 -5.422 1.00 1.16 H new ATOM 0 HB2 ASN B 56 -34.240 2.581 -6.274 1.00 1.26 H new ATOM 0 HB3 ASN B 56 -33.602 2.984 -7.856 1.00 1.26 H new ATOM 0 HD21 ASN B 56 -34.267 -0.303 -8.877 1.00 1.58 H new ATOM 0 HD22 ASN B 56 -34.558 1.427 -9.084 1.00 1.58 H new ATOM 2686 N LYS B 57 -30.814 3.093 -8.357 1.00 1.21 N ATOM 2687 CA LYS B 57 -29.778 2.845 -9.347 1.00 1.29 C ATOM 2688 C LYS B 57 -28.407 3.246 -8.812 1.00 1.21 C ATOM 2689 O LYS B 57 -27.398 2.639 -9.158 1.00 1.26 O ATOM 2690 CB LYS B 57 -30.091 3.605 -10.635 1.00 1.39 C ATOM 2691 CG LYS B 57 -31.239 2.998 -11.431 1.00 1.52 C ATOM 2692 CD LYS B 57 -31.794 3.977 -12.451 1.00 1.62 C ATOM 2693 CE LYS B 57 -32.622 3.268 -13.513 1.00 1.73 C ATOM 2694 NZ LYS B 57 -33.699 2.424 -12.925 1.00 1.81 N ATOM 0 H LYS B 57 -31.395 3.909 -8.549 1.00 1.21 H new ATOM 0 HA LYS B 57 -29.757 1.777 -9.563 1.00 1.29 H new ATOM 0 HB2 LYS B 57 -30.336 4.638 -10.388 1.00 1.39 H new ATOM 0 HB3 LYS B 57 -29.198 3.630 -11.260 1.00 1.39 H new ATOM 0 HG2 LYS B 57 -30.893 2.099 -11.940 1.00 1.52 H new ATOM 0 HG3 LYS B 57 -32.033 2.693 -10.750 1.00 1.52 H new ATOM 0 HD2 LYS B 57 -32.410 4.721 -11.945 1.00 1.62 H new ATOM 0 HD3 LYS B 57 -30.973 4.513 -12.927 1.00 1.62 H new ATOM 0 HE2 LYS B 57 -33.067 4.009 -14.177 1.00 1.73 H new ATOM 0 HE3 LYS B 57 -31.968 2.645 -14.123 1.00 1.73 H new ATOM 0 HZ1 LYS B 57 -34.529 2.435 -13.551 1.00 1.81 H new ATOM 0 HZ2 LYS B 57 -33.357 1.448 -12.820 1.00 1.81 H new ATOM 0 HZ3 LYS B 57 -33.964 2.800 -11.992 1.00 1.81 H new ATOM 2708 N LEU B 58 -28.380 4.267 -7.962 1.00 1.12 N ATOM 2709 CA LEU B 58 -27.129 4.757 -7.388 1.00 1.09 C ATOM 2710 C LEU B 58 -26.495 3.731 -6.450 1.00 1.08 C ATOM 2711 O LEU B 58 -25.312 3.412 -6.578 1.00 1.11 O ATOM 2712 CB LEU B 58 -27.371 6.075 -6.640 1.00 1.06 C ATOM 2713 CG LEU B 58 -26.757 7.323 -7.279 1.00 1.21 C ATOM 2714 CD1 LEU B 58 -25.238 7.248 -7.262 1.00 1.37 C ATOM 2715 CD2 LEU B 58 -27.264 7.510 -8.701 1.00 1.40 C ATOM 0 H LEU B 58 -29.211 4.773 -7.654 1.00 1.12 H new ATOM 0 HA LEU B 58 -26.434 4.929 -8.210 1.00 1.09 H new ATOM 0 HB2 LEU B 58 -28.446 6.228 -6.549 1.00 1.06 H new ATOM 0 HB3 LEU B 58 -26.976 5.975 -5.629 1.00 1.06 H new ATOM 0 HG LEU B 58 -27.065 8.187 -6.690 1.00 1.21 H new ATOM 0 HD11 LEU B 58 -24.824 8.146 -7.721 1.00 1.37 H new ATOM 0 HD12 LEU B 58 -24.889 7.173 -6.232 1.00 1.37 H new ATOM 0 HD13 LEU B 58 -24.911 6.371 -7.820 1.00 1.37 H new ATOM 0 HD21 LEU B 58 -26.813 8.403 -9.133 1.00 1.40 H new ATOM 0 HD22 LEU B 58 -26.994 6.641 -9.301 1.00 1.40 H new ATOM 0 HD23 LEU B 58 -28.348 7.620 -8.689 1.00 1.40 H new ATOM 2727 N ILE B 59 -27.285 3.204 -5.525 1.00 1.08 N ATOM 2728 CA ILE B 59 -26.785 2.233 -4.556 1.00 1.15 C ATOM 2729 C ILE B 59 -26.385 0.929 -5.247 1.00 1.25 C ATOM 2730 O ILE B 59 -25.382 0.308 -4.884 1.00 1.32 O ATOM 2731 CB ILE B 59 -27.810 1.955 -3.422 1.00 1.20 C ATOM 2732 CG1 ILE B 59 -27.172 1.115 -2.312 1.00 1.33 C ATOM 2733 CG2 ILE B 59 -29.053 1.259 -3.955 1.00 1.22 C ATOM 2734 CD1 ILE B 59 -26.024 1.802 -1.611 1.00 1.37 C ATOM 0 H ILE B 59 -28.274 3.431 -5.423 1.00 1.08 H new ATOM 0 HA ILE B 59 -25.900 2.671 -4.095 1.00 1.15 H new ATOM 0 HB ILE B 59 -28.112 2.917 -3.009 1.00 1.20 H new ATOM 0 HG12 ILE B 59 -27.935 0.862 -1.576 1.00 1.33 H new ATOM 0 HG13 ILE B 59 -26.816 0.177 -2.738 1.00 1.33 H new ATOM 0 HG21 ILE B 59 -29.749 1.079 -3.136 1.00 1.22 H new ATOM 0 HG22 ILE B 59 -29.530 1.890 -4.705 1.00 1.22 H new ATOM 0 HG23 ILE B 59 -28.772 0.308 -4.407 1.00 1.22 H new ATOM 0 HD11 ILE B 59 -25.624 1.145 -0.838 1.00 1.37 H new ATOM 0 HD12 ILE B 59 -25.241 2.031 -2.334 1.00 1.37 H new ATOM 0 HD13 ILE B 59 -26.377 2.726 -1.154 1.00 1.37 H new ATOM 2746 N GLU B 60 -27.151 0.530 -6.252 1.00 1.29 N ATOM 2747 CA GLU B 60 -26.859 -0.685 -6.992 1.00 1.44 C ATOM 2748 C GLU B 60 -25.540 -0.524 -7.734 1.00 1.40 C ATOM 2749 O GLU B 60 -24.673 -1.398 -7.687 1.00 1.51 O ATOM 2750 CB GLU B 60 -27.985 -0.993 -7.972 1.00 1.54 C ATOM 2751 CG GLU B 60 -27.818 -2.322 -8.679 1.00 1.75 C ATOM 2752 CD GLU B 60 -28.926 -2.591 -9.662 1.00 1.96 C ATOM 2753 OE1 GLU B 60 -29.039 -1.842 -10.656 1.00 2.17 O ATOM 2754 OE2 GLU B 60 -29.694 -3.544 -9.446 1.00 2.28 O ATOM 0 H GLU B 60 -27.979 1.031 -6.572 1.00 1.29 H new ATOM 0 HA GLU B 60 -26.777 -1.518 -6.294 1.00 1.44 H new ATOM 0 HB2 GLU B 60 -28.934 -0.991 -7.436 1.00 1.54 H new ATOM 0 HB3 GLU B 60 -28.037 -0.198 -8.716 1.00 1.54 H new ATOM 0 HG2 GLU B 60 -26.861 -2.335 -9.201 1.00 1.75 H new ATOM 0 HG3 GLU B 60 -27.789 -3.123 -7.940 1.00 1.75 H new ATOM 2761 N GLY B 61 -25.391 0.623 -8.388 1.00 1.29 N ATOM 2762 CA GLY B 61 -24.184 0.914 -9.130 1.00 1.28 C ATOM 2763 C GLY B 61 -22.951 0.917 -8.250 1.00 1.21 C ATOM 2764 O GLY B 61 -21.872 0.542 -8.697 1.00 1.23 O ATOM 0 H GLY B 61 -26.094 1.361 -8.415 1.00 1.29 H new ATOM 0 HA2 GLY B 61 -24.060 0.175 -9.921 1.00 1.28 H new ATOM 0 HA3 GLY B 61 -24.284 1.885 -9.614 1.00 1.28 H new ATOM 2768 N TYR B 62 -23.103 1.371 -7.007 1.00 1.19 N ATOM 2769 CA TYR B 62 -21.990 1.395 -6.068 1.00 1.23 C ATOM 2770 C TYR B 62 -21.638 -0.014 -5.610 1.00 1.35 C ATOM 2771 O TYR B 62 -20.467 -0.399 -5.597 1.00 1.37 O ATOM 2772 CB TYR B 62 -22.312 2.260 -4.847 1.00 1.28 C ATOM 2773 CG TYR B 62 -21.245 2.180 -3.772 1.00 1.60 C ATOM 2774 CD1 TYR B 62 -19.978 2.714 -3.990 1.00 2.11 C ATOM 2775 CD2 TYR B 62 -21.491 1.550 -2.554 1.00 2.25 C ATOM 2776 CE1 TYR B 62 -18.988 2.620 -3.031 1.00 2.72 C ATOM 2777 CE2 TYR B 62 -20.505 1.459 -1.586 1.00 2.90 C ATOM 2778 CZ TYR B 62 -19.256 1.994 -1.832 1.00 2.96 C ATOM 2779 OH TYR B 62 -18.268 1.893 -0.876 1.00 3.75 O ATOM 0 H TYR B 62 -23.983 1.725 -6.631 1.00 1.19 H new ATOM 0 HA TYR B 62 -21.136 1.828 -6.589 1.00 1.23 H new ATOM 0 HB2 TYR B 62 -22.427 3.297 -5.162 1.00 1.28 H new ATOM 0 HB3 TYR B 62 -23.268 1.947 -4.428 1.00 1.28 H new ATOM 0 HD1 TYR B 62 -19.765 3.210 -4.925 1.00 2.11 H new ATOM 0 HD2 TYR B 62 -22.466 1.126 -2.362 1.00 2.25 H new ATOM 0 HE1 TYR B 62 -18.009 3.035 -3.220 1.00 2.72 H new ATOM 0 HE2 TYR B 62 -20.712 0.972 -0.644 1.00 2.90 H new ATOM 0 HH TYR B 62 -18.620 1.425 -0.090 1.00 3.75 H new ATOM 2789 N THR B 63 -22.664 -0.777 -5.239 1.00 1.51 N ATOM 2790 CA THR B 63 -22.479 -2.146 -4.767 1.00 1.71 C ATOM 2791 C THR B 63 -21.769 -3.001 -5.820 1.00 1.67 C ATOM 2792 O THR B 63 -20.974 -3.883 -5.490 1.00 1.80 O ATOM 2793 CB THR B 63 -23.831 -2.795 -4.394 1.00 1.94 C ATOM 2794 OG1 THR B 63 -24.595 -1.895 -3.576 1.00 2.00 O ATOM 2795 CG2 THR B 63 -23.624 -4.113 -3.653 1.00 2.31 C ATOM 0 H THR B 63 -23.636 -0.468 -5.257 1.00 1.51 H new ATOM 0 HA THR B 63 -21.855 -2.099 -3.874 1.00 1.71 H new ATOM 0 HB THR B 63 -24.373 -3.002 -5.316 1.00 1.94 H new ATOM 0 HG1 THR B 63 -25.051 -1.241 -4.146 1.00 2.00 H new ATOM 0 HG21 THR B 63 -24.593 -4.546 -3.404 1.00 2.31 H new ATOM 0 HG22 THR B 63 -23.070 -4.804 -4.288 1.00 2.31 H new ATOM 0 HG23 THR B 63 -23.061 -3.931 -2.737 1.00 2.31 H new ATOM 2803 N TYR B 64 -22.047 -2.720 -7.083 1.00 1.57 N ATOM 2804 CA TYR B 64 -21.427 -3.446 -8.184 1.00 1.63 C ATOM 2805 C TYR B 64 -20.489 -2.520 -8.937 1.00 1.37 C ATOM 2806 O TYR B 64 -20.246 -2.693 -10.132 1.00 1.46 O ATOM 2807 CB TYR B 64 -22.502 -3.980 -9.133 1.00 1.90 C ATOM 2808 CG TYR B 64 -23.501 -4.905 -8.466 1.00 2.42 C ATOM 2809 CD1 TYR B 64 -23.111 -6.149 -7.991 1.00 3.10 C ATOM 2810 CD2 TYR B 64 -24.832 -4.529 -8.305 1.00 2.81 C ATOM 2811 CE1 TYR B 64 -24.013 -6.992 -7.375 1.00 3.76 C ATOM 2812 CE2 TYR B 64 -25.739 -5.367 -7.685 1.00 3.50 C ATOM 2813 CZ TYR B 64 -25.322 -6.598 -7.223 1.00 3.84 C ATOM 2814 OH TYR B 64 -26.215 -7.434 -6.596 1.00 4.62 O ATOM 0 H TYR B 64 -22.700 -1.992 -7.374 1.00 1.57 H new ATOM 0 HA TYR B 64 -20.862 -4.288 -7.784 1.00 1.63 H new ATOM 0 HB2 TYR B 64 -23.037 -3.138 -9.572 1.00 1.90 H new ATOM 0 HB3 TYR B 64 -22.019 -4.512 -9.952 1.00 1.90 H new ATOM 0 HD1 TYR B 64 -22.084 -6.463 -8.105 1.00 3.10 H new ATOM 0 HD2 TYR B 64 -25.161 -3.567 -8.670 1.00 2.81 H new ATOM 0 HE1 TYR B 64 -23.692 -7.958 -7.013 1.00 3.76 H new ATOM 0 HE2 TYR B 64 -26.767 -5.060 -7.563 1.00 3.50 H new ATOM 0 HH TYR B 64 -27.097 -7.008 -6.568 1.00 4.62 H new ATOM 2824 N GLY B 65 -19.968 -1.540 -8.216 1.00 1.20 N ATOM 2825 CA GLY B 65 -19.081 -0.561 -8.803 1.00 1.11 C ATOM 2826 C GLY B 65 -17.764 -1.137 -9.268 1.00 1.04 C ATOM 2827 O GLY B 65 -17.013 -1.715 -8.480 1.00 1.03 O ATOM 0 H GLY B 65 -20.148 -1.405 -7.221 1.00 1.20 H new ATOM 0 HA2 GLY B 65 -19.582 -0.092 -9.650 1.00 1.11 H new ATOM 0 HA3 GLY B 65 -18.886 0.224 -8.073 1.00 1.11 H new ATOM 2831 N GLU B 66 -17.480 -0.958 -10.549 1.00 1.04 N ATOM 2832 CA GLU B 66 -16.244 -1.442 -11.135 1.00 1.02 C ATOM 2833 C GLU B 66 -15.056 -0.698 -10.533 1.00 0.98 C ATOM 2834 O GLU B 66 -14.041 -1.303 -10.170 1.00 0.95 O ATOM 2835 CB GLU B 66 -16.272 -1.255 -12.651 1.00 1.10 C ATOM 2836 CG GLU B 66 -16.861 -2.436 -13.401 1.00 1.36 C ATOM 2837 CD GLU B 66 -15.840 -3.519 -13.667 1.00 1.66 C ATOM 2838 OE1 GLU B 66 -14.887 -3.267 -14.430 1.00 2.08 O ATOM 2839 OE2 GLU B 66 -15.982 -4.633 -13.122 1.00 2.08 O ATOM 0 H GLU B 66 -18.095 -0.477 -11.205 1.00 1.04 H new ATOM 0 HA GLU B 66 -16.141 -2.505 -10.917 1.00 1.02 H new ATOM 0 HB2 GLU B 66 -16.850 -0.361 -12.887 1.00 1.10 H new ATOM 0 HB3 GLU B 66 -15.256 -1.081 -13.006 1.00 1.10 H new ATOM 0 HG2 GLU B 66 -17.687 -2.853 -12.825 1.00 1.36 H new ATOM 0 HG3 GLU B 66 -17.275 -2.091 -14.348 1.00 1.36 H new ATOM 2846 N GLU B 67 -15.208 0.616 -10.396 1.00 1.00 N ATOM 2847 CA GLU B 67 -14.160 1.463 -9.839 1.00 1.01 C ATOM 2848 C GLU B 67 -13.863 1.091 -8.394 1.00 0.97 C ATOM 2849 O GLU B 67 -12.714 1.157 -7.955 1.00 0.95 O ATOM 2850 CB GLU B 67 -14.562 2.931 -9.931 1.00 1.10 C ATOM 2851 CG GLU B 67 -14.552 3.464 -11.346 1.00 1.53 C ATOM 2852 CD GLU B 67 -14.016 4.873 -11.406 1.00 1.81 C ATOM 2853 OE1 GLU B 67 -12.859 5.091 -10.989 1.00 2.44 O ATOM 2854 OE2 GLU B 67 -14.747 5.775 -11.861 1.00 2.28 O ATOM 0 H GLU B 67 -16.053 1.119 -10.665 1.00 1.00 H new ATOM 0 HA GLU B 67 -13.254 1.305 -10.423 1.00 1.01 H new ATOM 0 HB2 GLU B 67 -15.560 3.055 -9.510 1.00 1.10 H new ATOM 0 HB3 GLU B 67 -13.883 3.526 -9.321 1.00 1.10 H new ATOM 0 HG2 GLU B 67 -13.943 2.815 -11.975 1.00 1.53 H new ATOM 0 HG3 GLU B 67 -15.564 3.442 -11.751 1.00 1.53 H new ATOM 2861 N ARG B 68 -14.897 0.689 -7.661 1.00 0.98 N ATOM 2862 CA ARG B 68 -14.734 0.288 -6.269 1.00 0.99 C ATOM 2863 C ARG B 68 -13.764 -0.887 -6.180 1.00 0.95 C ATOM 2864 O ARG B 68 -12.891 -0.929 -5.316 1.00 0.95 O ATOM 2865 CB ARG B 68 -16.087 -0.092 -5.665 1.00 1.04 C ATOM 2866 CG ARG B 68 -16.036 -0.393 -4.177 1.00 1.10 C ATOM 2867 CD ARG B 68 -17.408 -0.783 -3.653 1.00 1.41 C ATOM 2868 NE ARG B 68 -17.411 -0.936 -2.200 1.00 1.59 N ATOM 2869 CZ ARG B 68 -17.109 -2.075 -1.575 1.00 1.88 C ATOM 2870 NH1 ARG B 68 -16.780 -3.160 -2.274 1.00 2.30 N ATOM 2871 NH2 ARG B 68 -17.148 -2.141 -0.253 1.00 2.17 N ATOM 0 H ARG B 68 -15.855 0.633 -8.008 1.00 0.98 H new ATOM 0 HA ARG B 68 -14.327 1.126 -5.703 1.00 0.99 H new ATOM 0 HB2 ARG B 68 -16.792 0.722 -5.837 1.00 1.04 H new ATOM 0 HB3 ARG B 68 -16.475 -0.966 -6.189 1.00 1.04 H new ATOM 0 HG2 ARG B 68 -15.328 -1.201 -3.990 1.00 1.10 H new ATOM 0 HG3 ARG B 68 -15.672 0.481 -3.638 1.00 1.10 H new ATOM 0 HD2 ARG B 68 -18.136 -0.024 -3.940 1.00 1.41 H new ATOM 0 HD3 ARG B 68 -17.722 -1.718 -4.117 1.00 1.41 H new ATOM 0 HE ARG B 68 -17.658 -0.126 -1.631 1.00 1.59 H new ATOM 0 HH11 ARG B 68 -16.758 -3.123 -3.293 1.00 2.30 H new ATOM 0 HH12 ARG B 68 -16.550 -4.028 -1.790 1.00 2.30 H new ATOM 0 HH21 ARG B 68 -17.410 -1.319 0.291 1.00 2.17 H new ATOM 0 HH22 ARG B 68 -16.916 -3.014 0.221 1.00 2.17 H new ATOM 2885 N LYS B 69 -13.917 -1.825 -7.105 1.00 0.94 N ATOM 2886 CA LYS B 69 -13.056 -2.996 -7.168 1.00 0.94 C ATOM 2887 C LYS B 69 -11.630 -2.582 -7.537 1.00 0.89 C ATOM 2888 O LYS B 69 -10.657 -3.167 -7.062 1.00 0.88 O ATOM 2889 CB LYS B 69 -13.604 -3.983 -8.201 1.00 1.00 C ATOM 2890 CG LYS B 69 -12.692 -5.170 -8.489 1.00 1.28 C ATOM 2891 CD LYS B 69 -13.324 -6.132 -9.485 1.00 1.46 C ATOM 2892 CE LYS B 69 -13.810 -5.411 -10.736 1.00 1.55 C ATOM 2893 NZ LYS B 69 -14.585 -6.311 -11.627 1.00 1.70 N ATOM 0 H LYS B 69 -14.636 -1.796 -7.828 1.00 0.94 H new ATOM 0 HA LYS B 69 -13.036 -3.478 -6.191 1.00 0.94 H new ATOM 0 HB2 LYS B 69 -14.567 -4.357 -7.852 1.00 1.00 H new ATOM 0 HB3 LYS B 69 -13.789 -3.449 -9.133 1.00 1.00 H new ATOM 0 HG2 LYS B 69 -11.740 -4.812 -8.882 1.00 1.28 H new ATOM 0 HG3 LYS B 69 -12.475 -5.697 -7.560 1.00 1.28 H new ATOM 0 HD2 LYS B 69 -12.598 -6.895 -9.764 1.00 1.46 H new ATOM 0 HD3 LYS B 69 -14.161 -6.646 -9.013 1.00 1.46 H new ATOM 0 HE2 LYS B 69 -14.431 -4.562 -10.448 1.00 1.55 H new ATOM 0 HE3 LYS B 69 -12.954 -5.010 -11.280 1.00 1.55 H new ATOM 0 HZ1 LYS B 69 -14.955 -5.767 -12.433 1.00 1.70 H new ATOM 0 HZ2 LYS B 69 -13.966 -7.070 -11.977 1.00 1.70 H new ATOM 0 HZ3 LYS B 69 -15.377 -6.727 -11.097 1.00 1.70 H new ATOM 2907 N LEU B 70 -11.523 -1.561 -8.386 1.00 0.89 N ATOM 2908 CA LEU B 70 -10.231 -1.046 -8.823 1.00 0.87 C ATOM 2909 C LEU B 70 -9.443 -0.492 -7.639 1.00 0.83 C ATOM 2910 O LEU B 70 -8.225 -0.670 -7.551 1.00 0.82 O ATOM 2911 CB LEU B 70 -10.422 0.045 -9.885 1.00 0.91 C ATOM 2912 CG LEU B 70 -9.149 0.806 -10.279 1.00 0.96 C ATOM 2913 CD1 LEU B 70 -8.286 -0.028 -11.213 1.00 1.04 C ATOM 2914 CD2 LEU B 70 -9.501 2.146 -10.913 1.00 1.04 C ATOM 0 H LEU B 70 -12.324 -1.072 -8.786 1.00 0.89 H new ATOM 0 HA LEU B 70 -9.666 -1.869 -9.261 1.00 0.87 H new ATOM 0 HB2 LEU B 70 -10.844 -0.412 -10.780 1.00 0.91 H new ATOM 0 HB3 LEU B 70 -11.155 0.763 -9.517 1.00 0.91 H new ATOM 0 HG LEU B 70 -8.572 0.999 -9.374 1.00 0.96 H new ATOM 0 HD11 LEU B 70 -7.390 0.533 -11.478 1.00 1.04 H new ATOM 0 HD12 LEU B 70 -8.000 -0.954 -10.714 1.00 1.04 H new ATOM 0 HD13 LEU B 70 -8.849 -0.261 -12.117 1.00 1.04 H new ATOM 0 HD21 LEU B 70 -8.586 2.671 -11.186 1.00 1.04 H new ATOM 0 HD22 LEU B 70 -10.103 1.979 -11.806 1.00 1.04 H new ATOM 0 HD23 LEU B 70 -10.066 2.748 -10.201 1.00 1.04 H new ATOM 2926 N TYR B 71 -10.145 0.164 -6.727 1.00 0.84 N ATOM 2927 CA TYR B 71 -9.513 0.742 -5.550 1.00 0.84 C ATOM 2928 C TYR B 71 -9.025 -0.360 -4.612 1.00 0.83 C ATOM 2929 O TYR B 71 -7.952 -0.256 -4.013 1.00 0.82 O ATOM 2930 CB TYR B 71 -10.477 1.699 -4.839 1.00 0.91 C ATOM 2931 CG TYR B 71 -11.053 2.767 -5.753 1.00 0.92 C ATOM 2932 CD1 TYR B 71 -10.315 3.263 -6.824 1.00 0.93 C ATOM 2933 CD2 TYR B 71 -12.335 3.272 -5.555 1.00 1.01 C ATOM 2934 CE1 TYR B 71 -10.836 4.223 -7.669 1.00 1.00 C ATOM 2935 CE2 TYR B 71 -12.861 4.237 -6.397 1.00 1.09 C ATOM 2936 CZ TYR B 71 -12.106 4.706 -7.452 1.00 1.07 C ATOM 2937 OH TYR B 71 -12.626 5.657 -8.301 1.00 1.19 O ATOM 0 H TYR B 71 -11.153 0.310 -6.779 1.00 0.84 H new ATOM 0 HA TYR B 71 -8.644 1.320 -5.865 1.00 0.84 H new ATOM 0 HB2 TYR B 71 -11.295 1.123 -4.406 1.00 0.91 H new ATOM 0 HB3 TYR B 71 -9.954 2.182 -4.013 1.00 0.91 H new ATOM 0 HD1 TYR B 71 -9.316 2.890 -6.997 1.00 0.93 H new ATOM 0 HD2 TYR B 71 -12.929 2.905 -4.731 1.00 1.01 H new ATOM 0 HE1 TYR B 71 -10.249 4.593 -8.497 1.00 1.00 H new ATOM 0 HE2 TYR B 71 -13.857 4.620 -6.229 1.00 1.09 H new ATOM 0 HH TYR B 71 -12.627 5.312 -9.218 1.00 1.19 H new ATOM 2947 N ASP B 72 -9.805 -1.431 -4.496 1.00 0.86 N ATOM 2948 CA ASP B 72 -9.412 -2.561 -3.653 1.00 0.88 C ATOM 2949 C ASP B 72 -8.173 -3.217 -4.261 1.00 0.85 C ATOM 2950 O ASP B 72 -7.294 -3.707 -3.554 1.00 0.85 O ATOM 2951 CB ASP B 72 -10.554 -3.576 -3.540 1.00 0.95 C ATOM 2952 CG ASP B 72 -10.182 -4.800 -2.717 1.00 1.07 C ATOM 2953 OD1 ASP B 72 -10.380 -4.783 -1.482 1.00 1.31 O ATOM 2954 OD2 ASP B 72 -9.722 -5.798 -3.307 1.00 1.32 O ATOM 0 H ASP B 72 -10.702 -1.542 -4.968 1.00 0.86 H new ATOM 0 HA ASP B 72 -9.185 -2.204 -2.648 1.00 0.88 H new ATOM 0 HB2 ASP B 72 -11.420 -3.091 -3.089 1.00 0.95 H new ATOM 0 HB3 ASP B 72 -10.851 -3.894 -4.540 1.00 0.95 H new ATOM 2959 N SER B 73 -8.104 -3.178 -5.587 1.00 0.84 N ATOM 2960 CA SER B 73 -6.978 -3.736 -6.319 1.00 0.83 C ATOM 2961 C SER B 73 -5.726 -2.889 -6.084 1.00 0.79 C ATOM 2962 O SER B 73 -4.600 -3.364 -6.249 1.00 0.78 O ATOM 2963 CB SER B 73 -7.312 -3.816 -7.808 1.00 0.86 C ATOM 2964 OG SER B 73 -8.537 -4.509 -8.016 1.00 0.91 O ATOM 0 H SER B 73 -8.822 -2.761 -6.179 1.00 0.84 H new ATOM 0 HA SER B 73 -6.779 -4.745 -5.957 1.00 0.83 H new ATOM 0 HB2 SER B 73 -7.383 -2.811 -8.224 1.00 0.86 H new ATOM 0 HB3 SER B 73 -6.507 -4.324 -8.339 1.00 0.86 H new ATOM 0 HG SER B 73 -9.288 -3.891 -7.891 1.00 0.91 H new ATOM 2970 N ALA B 74 -5.927 -1.631 -5.691 1.00 0.79 N ATOM 2971 CA ALA B 74 -4.816 -0.735 -5.396 1.00 0.78 C ATOM 2972 C ALA B 74 -4.146 -1.198 -4.114 1.00 0.74 C ATOM 2973 O ALA B 74 -2.934 -1.063 -3.945 1.00 0.72 O ATOM 2974 CB ALA B 74 -5.290 0.705 -5.269 1.00 0.81 C ATOM 0 H ALA B 74 -6.849 -1.212 -5.571 1.00 0.79 H new ATOM 0 HA ALA B 74 -4.100 -0.765 -6.217 1.00 0.78 H new ATOM 0 HB1 ALA B 74 -4.439 1.350 -5.049 1.00 0.81 H new ATOM 0 HB2 ALA B 74 -5.752 1.020 -6.205 1.00 0.81 H new ATOM 0 HB3 ALA B 74 -6.019 0.778 -4.462 1.00 0.81 H new ATOM 2980 N LEU B 75 -4.952 -1.753 -3.208 1.00 0.76 N ATOM 2981 CA LEU B 75 -4.435 -2.284 -1.954 1.00 0.76 C ATOM 2982 C LEU B 75 -3.548 -3.488 -2.259 1.00 0.73 C ATOM 2983 O LEU B 75 -2.534 -3.711 -1.598 1.00 0.71 O ATOM 2984 CB LEU B 75 -5.585 -2.685 -1.017 1.00 0.81 C ATOM 2985 CG LEU B 75 -5.240 -2.826 0.481 1.00 0.89 C ATOM 2986 CD1 LEU B 75 -4.622 -4.189 0.780 1.00 1.13 C ATOM 2987 CD2 LEU B 75 -4.309 -1.706 0.936 1.00 1.14 C ATOM 0 H LEU B 75 -5.961 -1.845 -3.322 1.00 0.76 H new ATOM 0 HA LEU B 75 -3.850 -1.516 -1.449 1.00 0.76 H new ATOM 0 HB2 LEU B 75 -6.378 -1.944 -1.115 1.00 0.81 H new ATOM 0 HB3 LEU B 75 -5.991 -3.635 -1.364 1.00 0.81 H new ATOM 0 HG LEU B 75 -6.171 -2.746 1.041 1.00 0.89 H new ATOM 0 HD11 LEU B 75 -4.390 -4.258 1.843 1.00 1.13 H new ATOM 0 HD12 LEU B 75 -5.327 -4.975 0.511 1.00 1.13 H new ATOM 0 HD13 LEU B 75 -3.707 -4.309 0.200 1.00 1.13 H new ATOM 0 HD21 LEU B 75 -4.082 -1.829 1.995 1.00 1.14 H new ATOM 0 HD22 LEU B 75 -3.385 -1.745 0.360 1.00 1.14 H new ATOM 0 HD23 LEU B 75 -4.795 -0.743 0.779 1.00 1.14 H new ATOM 2999 N SER B 76 -3.933 -4.249 -3.282 1.00 0.75 N ATOM 3000 CA SER B 76 -3.171 -5.418 -3.704 1.00 0.75 C ATOM 3001 C SER B 76 -1.793 -5.000 -4.214 1.00 0.72 C ATOM 3002 O SER B 76 -0.812 -5.725 -4.055 1.00 0.72 O ATOM 3003 CB SER B 76 -3.927 -6.168 -4.802 1.00 0.81 C ATOM 3004 OG SER B 76 -5.325 -6.153 -4.559 1.00 0.91 O ATOM 0 H SER B 76 -4.772 -4.074 -3.835 1.00 0.75 H new ATOM 0 HA SER B 76 -3.042 -6.077 -2.846 1.00 0.75 H new ATOM 0 HB2 SER B 76 -3.718 -5.711 -5.769 1.00 0.81 H new ATOM 0 HB3 SER B 76 -3.574 -7.198 -4.853 1.00 0.81 H new ATOM 0 HG SER B 76 -5.787 -6.637 -5.275 1.00 0.91 H new ATOM 3010 N LYS B 77 -1.727 -3.822 -4.822 1.00 0.72 N ATOM 3011 CA LYS B 77 -0.469 -3.309 -5.342 1.00 0.71 C ATOM 3012 C LYS B 77 0.450 -2.929 -4.184 1.00 0.67 C ATOM 3013 O LYS B 77 1.661 -3.138 -4.238 1.00 0.66 O ATOM 3014 CB LYS B 77 -0.715 -2.102 -6.250 1.00 0.75 C ATOM 3015 CG LYS B 77 0.404 -1.840 -7.248 1.00 0.93 C ATOM 3016 CD LYS B 77 -0.055 -0.907 -8.353 1.00 1.09 C ATOM 3017 CE LYS B 77 0.807 -1.060 -9.593 1.00 1.34 C ATOM 3018 NZ LYS B 77 0.118 -0.568 -10.813 1.00 1.68 N ATOM 0 H LYS B 77 -2.528 -3.207 -4.966 1.00 0.72 H new ATOM 0 HA LYS B 77 0.012 -4.087 -5.935 1.00 0.71 H new ATOM 0 HB2 LYS B 77 -1.646 -2.255 -6.796 1.00 0.75 H new ATOM 0 HB3 LYS B 77 -0.850 -1.216 -5.630 1.00 0.75 H new ATOM 0 HG2 LYS B 77 1.260 -1.404 -6.733 1.00 0.93 H new ATOM 0 HG3 LYS B 77 0.738 -2.783 -7.680 1.00 0.93 H new ATOM 0 HD2 LYS B 77 -1.095 -1.117 -8.602 1.00 1.09 H new ATOM 0 HD3 LYS B 77 -0.013 0.124 -8.003 1.00 1.09 H new ATOM 0 HE2 LYS B 77 1.739 -0.511 -9.457 1.00 1.34 H new ATOM 0 HE3 LYS B 77 1.071 -2.109 -9.724 1.00 1.34 H new ATOM 0 HZ1 LYS B 77 0.741 -0.691 -11.637 1.00 1.68 H new ATOM 0 HZ2 LYS B 77 -0.759 -1.108 -10.958 1.00 1.68 H new ATOM 0 HZ3 LYS B 77 -0.111 0.440 -10.699 1.00 1.68 H new ATOM 3032 N ILE B 78 -0.145 -2.375 -3.130 1.00 0.66 N ATOM 3033 CA ILE B 78 0.602 -1.983 -1.945 1.00 0.64 C ATOM 3034 C ILE B 78 1.149 -3.227 -1.248 1.00 0.63 C ATOM 3035 O ILE B 78 2.230 -3.197 -0.662 1.00 0.64 O ATOM 3036 CB ILE B 78 -0.271 -1.127 -0.979 1.00 0.67 C ATOM 3037 CG1 ILE B 78 0.420 0.212 -0.676 1.00 0.90 C ATOM 3038 CG2 ILE B 78 -0.581 -1.868 0.318 1.00 0.79 C ATOM 3039 CD1 ILE B 78 1.688 0.076 0.146 1.00 1.15 C ATOM 0 H ILE B 78 -1.146 -2.188 -3.076 1.00 0.66 H new ATOM 0 HA ILE B 78 1.440 -1.357 -2.251 1.00 0.64 H new ATOM 0 HB ILE B 78 -1.219 -0.934 -1.481 1.00 0.67 H new ATOM 0 HG12 ILE B 78 0.660 0.707 -1.617 1.00 0.90 H new ATOM 0 HG13 ILE B 78 -0.279 0.858 -0.145 1.00 0.90 H new ATOM 0 HG21 ILE B 78 -1.191 -1.235 0.962 1.00 0.79 H new ATOM 0 HG22 ILE B 78 -1.124 -2.786 0.092 1.00 0.79 H new ATOM 0 HG23 ILE B 78 0.350 -2.114 0.828 1.00 0.79 H new ATOM 0 HD11 ILE B 78 2.117 1.063 0.318 1.00 1.15 H new ATOM 0 HD12 ILE B 78 1.453 -0.390 1.103 1.00 1.15 H new ATOM 0 HD13 ILE B 78 2.406 -0.543 -0.392 1.00 1.15 H new ATOM 3051 N GLU B 79 0.395 -4.322 -1.333 1.00 0.65 N ATOM 3052 CA GLU B 79 0.797 -5.586 -0.734 1.00 0.67 C ATOM 3053 C GLU B 79 2.113 -6.052 -1.337 1.00 0.67 C ATOM 3054 O GLU B 79 2.995 -6.529 -0.628 1.00 0.70 O ATOM 3055 CB GLU B 79 -0.287 -6.647 -0.945 1.00 0.71 C ATOM 3056 CG GLU B 79 0.103 -8.029 -0.446 1.00 0.77 C ATOM 3057 CD GLU B 79 0.130 -9.061 -1.559 1.00 1.10 C ATOM 3058 OE1 GLU B 79 0.834 -8.842 -2.567 1.00 1.59 O ATOM 3059 OE2 GLU B 79 -0.543 -10.106 -1.421 1.00 1.74 O ATOM 0 H GLU B 79 -0.503 -4.355 -1.815 1.00 0.65 H new ATOM 0 HA GLU B 79 0.931 -5.438 0.337 1.00 0.67 H new ATOM 0 HB2 GLU B 79 -1.197 -6.330 -0.435 1.00 0.71 H new ATOM 0 HB3 GLU B 79 -0.522 -6.707 -2.008 1.00 0.71 H new ATOM 0 HG2 GLU B 79 1.086 -7.979 0.023 1.00 0.77 H new ATOM 0 HG3 GLU B 79 -0.601 -8.347 0.323 1.00 0.77 H new ATOM 3066 N LYS B 80 2.241 -5.890 -2.652 1.00 0.67 N ATOM 3067 CA LYS B 80 3.453 -6.281 -3.354 1.00 0.69 C ATOM 3068 C LYS B 80 4.623 -5.423 -2.892 1.00 0.68 C ATOM 3069 O LYS B 80 5.759 -5.889 -2.837 1.00 0.72 O ATOM 3070 CB LYS B 80 3.260 -6.167 -4.865 1.00 0.72 C ATOM 3071 CG LYS B 80 2.296 -7.201 -5.436 1.00 0.79 C ATOM 3072 CD LYS B 80 3.030 -8.402 -6.027 1.00 1.18 C ATOM 3073 CE LYS B 80 3.679 -9.266 -4.950 1.00 1.78 C ATOM 3074 NZ LYS B 80 2.679 -9.954 -4.083 1.00 2.05 N ATOM 0 H LYS B 80 1.518 -5.490 -3.250 1.00 0.67 H new ATOM 0 HA LYS B 80 3.673 -7.323 -3.121 1.00 0.69 H new ATOM 0 HB2 LYS B 80 2.891 -5.169 -5.102 1.00 0.72 H new ATOM 0 HB3 LYS B 80 4.227 -6.274 -5.356 1.00 0.72 H new ATOM 0 HG2 LYS B 80 1.620 -7.540 -4.650 1.00 0.79 H new ATOM 0 HG3 LYS B 80 1.681 -6.737 -6.207 1.00 0.79 H new ATOM 0 HD2 LYS B 80 2.329 -9.007 -6.603 1.00 1.18 H new ATOM 0 HD3 LYS B 80 3.795 -8.053 -6.721 1.00 1.18 H new ATOM 0 HE2 LYS B 80 4.317 -10.012 -5.424 1.00 1.78 H new ATOM 0 HE3 LYS B 80 4.324 -8.643 -4.330 1.00 1.78 H new ATOM 0 HZ1 LYS B 80 3.160 -10.665 -3.496 1.00 2.05 H new ATOM 0 HZ2 LYS B 80 2.213 -9.256 -3.469 1.00 2.05 H new ATOM 0 HZ3 LYS B 80 1.966 -10.421 -4.679 1.00 2.05 H new ATOM 3088 N LEU B 81 4.337 -4.171 -2.548 1.00 0.65 N ATOM 3089 CA LEU B 81 5.365 -3.258 -2.056 1.00 0.67 C ATOM 3090 C LEU B 81 5.867 -3.745 -0.700 1.00 0.68 C ATOM 3091 O LEU B 81 7.072 -3.761 -0.441 1.00 0.72 O ATOM 3092 CB LEU B 81 4.821 -1.828 -1.933 1.00 0.67 C ATOM 3093 CG LEU B 81 5.252 -0.848 -3.035 1.00 0.78 C ATOM 3094 CD1 LEU B 81 6.753 -0.598 -2.972 1.00 1.02 C ATOM 3095 CD2 LEU B 81 4.851 -1.368 -4.405 1.00 0.97 C ATOM 0 H LEU B 81 3.403 -3.765 -2.601 1.00 0.65 H new ATOM 0 HA LEU B 81 6.189 -3.244 -2.770 1.00 0.67 H new ATOM 0 HB2 LEU B 81 3.732 -1.874 -1.921 1.00 0.67 H new ATOM 0 HB3 LEU B 81 5.134 -1.423 -0.971 1.00 0.67 H new ATOM 0 HG LEU B 81 4.740 0.100 -2.869 1.00 0.78 H new ATOM 0 HD11 LEU B 81 7.039 0.098 -3.760 1.00 1.02 H new ATOM 0 HD12 LEU B 81 7.011 -0.174 -2.002 1.00 1.02 H new ATOM 0 HD13 LEU B 81 7.285 -1.540 -3.109 1.00 1.02 H new ATOM 0 HD21 LEU B 81 5.166 -0.658 -5.170 1.00 0.97 H new ATOM 0 HD22 LEU B 81 5.330 -2.331 -4.583 1.00 0.97 H new ATOM 0 HD23 LEU B 81 3.768 -1.489 -4.446 1.00 0.97 H new ATOM 3107 N ILE B 82 4.929 -4.164 0.148 1.00 0.68 N ATOM 3108 CA ILE B 82 5.252 -4.683 1.473 1.00 0.72 C ATOM 3109 C ILE B 82 6.100 -5.950 1.332 1.00 0.77 C ATOM 3110 O ILE B 82 7.087 -6.138 2.045 1.00 0.81 O ATOM 3111 CB ILE B 82 3.966 -5.012 2.285 1.00 0.72 C ATOM 3112 CG1 ILE B 82 3.035 -3.793 2.360 1.00 0.70 C ATOM 3113 CG2 ILE B 82 4.325 -5.491 3.684 1.00 0.78 C ATOM 3114 CD1 ILE B 82 1.716 -4.048 3.080 1.00 0.72 C ATOM 0 H ILE B 82 3.931 -4.153 -0.063 1.00 0.68 H new ATOM 0 HA ILE B 82 5.807 -3.915 2.011 1.00 0.72 H new ATOM 0 HB ILE B 82 3.437 -5.812 1.767 1.00 0.72 H new ATOM 0 HG12 ILE B 82 3.559 -2.982 2.865 1.00 0.70 H new ATOM 0 HG13 ILE B 82 2.821 -3.452 1.347 1.00 0.70 H new ATOM 0 HG21 ILE B 82 3.413 -5.716 4.237 1.00 0.78 H new ATOM 0 HG22 ILE B 82 4.938 -6.389 3.615 1.00 0.78 H new ATOM 0 HG23 ILE B 82 4.881 -4.711 4.204 1.00 0.78 H new ATOM 0 HD11 ILE B 82 1.122 -3.134 3.086 1.00 0.72 H new ATOM 0 HD12 ILE B 82 1.166 -4.835 2.564 1.00 0.72 H new ATOM 0 HD13 ILE B 82 1.915 -4.358 4.106 1.00 0.72 H new ATOM 3126 N GLU B 83 5.707 -6.796 0.382 1.00 0.78 N ATOM 3127 CA GLU B 83 6.402 -8.054 0.102 1.00 0.85 C ATOM 3128 C GLU B 83 7.812 -7.798 -0.429 1.00 0.87 C ATOM 3129 O GLU B 83 8.733 -8.574 -0.183 1.00 0.94 O ATOM 3130 CB GLU B 83 5.599 -8.870 -0.913 1.00 0.88 C ATOM 3131 CG GLU B 83 5.751 -10.376 -0.768 1.00 1.11 C ATOM 3132 CD GLU B 83 4.963 -11.138 -1.816 1.00 1.73 C ATOM 3133 OE1 GLU B 83 3.721 -11.009 -1.845 1.00 2.25 O ATOM 3134 OE2 GLU B 83 5.575 -11.864 -2.625 1.00 2.41 O ATOM 0 H GLU B 83 4.898 -6.630 -0.216 1.00 0.78 H new ATOM 0 HA GLU B 83 6.489 -8.614 1.033 1.00 0.85 H new ATOM 0 HB2 GLU B 83 4.544 -8.612 -0.816 1.00 0.88 H new ATOM 0 HB3 GLU B 83 5.906 -8.581 -1.918 1.00 0.88 H new ATOM 0 HG2 GLU B 83 6.805 -10.642 -0.845 1.00 1.11 H new ATOM 0 HG3 GLU B 83 5.418 -10.679 0.225 1.00 1.11 H new ATOM 3141 N THR B 84 7.968 -6.711 -1.172 1.00 0.83 N ATOM 3142 CA THR B 84 9.260 -6.341 -1.729 1.00 0.87 C ATOM 3143 C THR B 84 10.202 -5.890 -0.613 1.00 0.91 C ATOM 3144 O THR B 84 11.411 -6.129 -0.668 1.00 0.98 O ATOM 3145 CB THR B 84 9.109 -5.220 -2.782 1.00 0.84 C ATOM 3146 OG1 THR B 84 8.238 -5.661 -3.832 1.00 0.84 O ATOM 3147 CG2 THR B 84 10.458 -4.820 -3.375 1.00 0.87 C ATOM 0 H THR B 84 7.211 -6.068 -1.403 1.00 0.83 H new ATOM 0 HA THR B 84 9.682 -7.216 -2.222 1.00 0.87 H new ATOM 0 HB THR B 84 8.686 -4.347 -2.285 1.00 0.84 H new ATOM 0 HG1 THR B 84 7.306 -5.554 -3.550 1.00 0.84 H new ATOM 0 HG21 THR B 84 10.312 -4.030 -4.111 1.00 0.87 H new ATOM 0 HG22 THR B 84 11.112 -4.460 -2.581 1.00 0.87 H new ATOM 0 HG23 THR B 84 10.914 -5.685 -3.857 1.00 0.87 H new ATOM 3155 N LEU B 85 9.637 -5.242 0.403 1.00 0.90 N ATOM 3156 CA LEU B 85 10.414 -4.773 1.544 1.00 0.98 C ATOM 3157 C LEU B 85 10.770 -5.948 2.448 1.00 1.07 C ATOM 3158 O LEU B 85 11.923 -6.125 2.839 1.00 1.22 O ATOM 3159 CB LEU B 85 9.630 -3.719 2.333 1.00 0.97 C ATOM 3160 CG LEU B 85 9.443 -2.383 1.615 1.00 0.91 C ATOM 3161 CD1 LEU B 85 8.442 -1.523 2.366 1.00 1.03 C ATOM 3162 CD2 LEU B 85 10.777 -1.654 1.472 1.00 1.01 C ATOM 0 H LEU B 85 8.641 -5.030 0.458 1.00 0.90 H new ATOM 0 HA LEU B 85 11.332 -4.315 1.176 1.00 0.98 H new ATOM 0 HB2 LEU B 85 8.648 -4.125 2.576 1.00 0.97 H new ATOM 0 HB3 LEU B 85 10.143 -3.538 3.278 1.00 0.97 H new ATOM 0 HG LEU B 85 9.056 -2.578 0.615 1.00 0.91 H new ATOM 0 HD11 LEU B 85 8.316 -0.573 1.846 1.00 1.03 H new ATOM 0 HD12 LEU B 85 7.483 -2.040 2.416 1.00 1.03 H new ATOM 0 HD13 LEU B 85 8.807 -1.338 3.376 1.00 1.03 H new ATOM 0 HD21 LEU B 85 10.620 -0.706 0.958 1.00 1.01 H new ATOM 0 HD22 LEU B 85 11.197 -1.466 2.460 1.00 1.01 H new ATOM 0 HD23 LEU B 85 11.468 -2.269 0.895 1.00 1.01 H new ATOM 3174 N SER B 86 9.768 -6.752 2.766 1.00 1.08 N ATOM 3175 CA SER B 86 9.962 -7.916 3.613 1.00 1.20 C ATOM 3176 C SER B 86 9.481 -9.179 2.901 1.00 1.59 C ATOM 3177 O SER B 86 8.311 -9.554 3.000 1.00 2.11 O ATOM 3178 CB SER B 86 9.221 -7.738 4.946 1.00 1.48 C ATOM 3179 OG SER B 86 9.775 -6.672 5.704 1.00 1.78 O ATOM 0 H SER B 86 8.808 -6.618 2.448 1.00 1.08 H new ATOM 0 HA SER B 86 11.027 -8.019 3.820 1.00 1.20 H new ATOM 0 HB2 SER B 86 8.166 -7.542 4.755 1.00 1.48 H new ATOM 0 HB3 SER B 86 9.274 -8.663 5.521 1.00 1.48 H new ATOM 0 HG SER B 86 9.283 -6.580 6.547 1.00 1.78 H new