USER MOD reduce.3.24.130724 H: found=0, std=0, add=1344, rem=0, adj=43 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 Single : A 6 GLN : amide:sc= -0.279 K(o=-0.28,f=-1.2) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0178 USER MOD Single : A 9 ASN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 10 LYS NZ :NH3+ -172:sc= 1.22 (180deg=0.957) USER MOD Single : A 15 LYS NZ :NH3+ -146:sc= 1.24 (180deg=0.476) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot 74:sc= 1.23 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ -163:sc= 1.17 (180deg=1.1) USER MOD Single : A 35 LYS NZ :NH3+ 148:sc= 1.25 (180deg=1.16) USER MOD Single : A 37 SER OG : rot 74:sc= 0.663 USER MOD Single : A 39 ASN : amide:sc=-0.00519 K(o=-0.0052,f=-1.3) USER MOD Single : A 42 SER OG : rot 73:sc= 1.28 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 160:sc= 0.912 (180deg=0.108!) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc=-0.00646 X(o=-0.0065,f=-0.0065) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= 1.1 K(o=1.1,f=-0.094) USER MOD Single : A 57 LYS NZ :NH3+ -108:sc= 0.306 (180deg=-1.35) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 73:sc= 1.12 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 151:sc= 1.25 (180deg=1.01) USER MOD Single : A 71 TYR OH : rot -90:sc= -0.0423 USER MOD Single : A 73 SER OG : rot 75:sc= 0.605 USER MOD Single : A 76 SER OG : rot 180:sc= 0.00774 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 167:sc= -0.0965 (180deg=-0.343) USER MOD Single : A 84 THR OG1 : rot 69:sc= 1.18 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : B 10 LYS NZ :NH3+ 164:sc= 1.16 (180deg=1.07) USER MOD Single : B 15 LYS NZ :NH3+ 147:sc= 1.21 (180deg=1.13) USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 SER OG : rot 82:sc= 0.342 USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 LYS NZ :NH3+ 156:sc= 1.19 (180deg=-0.0244) USER MOD Single : B 35 LYS NZ :NH3+ 169:sc= -0.0344 (180deg=-0.198) USER MOD Single : B 37 SER OG : rot 69:sc= 0.167 USER MOD Single : B 39 ASN : amide:sc= 0.602 K(o=0.6,f=-0.43) USER MOD Single : B 42 SER OG : rot 180:sc= 0 USER MOD Single : B 44 LYS NZ :NH3+ -175:sc= 0.447 (180deg=0.401) USER MOD Single : B 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 47 THR OG1 : rot 85:sc= 0.354 USER MOD Single : B 50 GLN : amide:sc= -0.268! X(o=-0.27!,f=-0.23) USER MOD Single : B 54 LYS NZ :NH3+ 151:sc= -0.21 (180deg=-1.13) USER MOD Single : B 56 ASN : amide:sc= -0.56 X(o=-0.56,f=-0.22) USER MOD Single : B 57 LYS NZ :NH3+ 156:sc= 0.386 (180deg=0.0425) USER MOD Single : B 62 TYR OH : rot 180:sc= 0 USER MOD Single : B 63 THR OG1 : rot 70:sc= 0.833 USER MOD Single : B 64 TYR OH : rot 180:sc= 0 USER MOD Single : B 69 LYS NZ :NH3+ -151:sc= 0.988 (180deg=0.337) USER MOD Single : B 71 TYR OH : rot 180:sc=-0.000276 USER MOD Single : B 73 SER OG : rot 79:sc= 1.19 USER MOD Single : B 76 SER OG : rot 180:sc= 0 USER MOD Single : B 77 LYS NZ :NH3+ -138:sc= 0.0372 (180deg=0) USER MOD Single : B 80 LYS NZ :NH3+ 159:sc= -0.107 (180deg=-0.557) USER MOD Single : B 84 THR OG1 : rot 65:sc= 1.33 USER MOD Single : B 86 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 77 N GLN A 6 -20.280 15.128 -6.616 1.00 1.91 N ATOM 78 CA GLN A 6 -19.855 13.782 -6.961 1.00 1.87 C ATOM 79 C GLN A 6 -18.674 13.797 -7.932 1.00 1.83 C ATOM 80 O GLN A 6 -17.707 13.064 -7.746 1.00 1.77 O ATOM 81 CB GLN A 6 -21.030 13.001 -7.563 1.00 1.89 C ATOM 82 CG GLN A 6 -20.744 11.525 -7.782 1.00 1.95 C ATOM 83 CD GLN A 6 -20.319 11.213 -9.205 1.00 1.96 C ATOM 84 OE1 GLN A 6 -20.802 11.823 -10.162 1.00 2.22 O ATOM 85 NE2 GLN A 6 -19.397 10.272 -9.352 1.00 2.13 N ATOM 0 HA GLN A 6 -19.524 13.288 -6.047 1.00 1.87 H new ATOM 0 HB2 GLN A 6 -21.893 13.099 -6.905 1.00 1.89 H new ATOM 0 HB3 GLN A 6 -21.303 13.453 -8.517 1.00 1.89 H new ATOM 0 HG2 GLN A 6 -19.960 11.206 -7.095 1.00 1.95 H new ATOM 0 HG3 GLN A 6 -21.636 10.947 -7.539 1.00 1.95 H new ATOM 0 HE21 GLN A 6 -19.024 9.792 -8.533 1.00 2.13 H new ATOM 0 HE22 GLN A 6 -19.061 10.028 -10.284 1.00 2.13 H new ATOM 94 N THR A 7 -18.745 14.645 -8.949 1.00 1.86 N ATOM 95 CA THR A 7 -17.684 14.727 -9.947 1.00 1.83 C ATOM 96 C THR A 7 -16.374 15.256 -9.359 1.00 1.79 C ATOM 97 O THR A 7 -15.293 14.746 -9.671 1.00 1.71 O ATOM 98 CB THR A 7 -18.112 15.608 -11.131 1.00 1.88 C ATOM 99 OG1 THR A 7 -18.730 16.807 -10.649 1.00 2.15 O ATOM 100 CG2 THR A 7 -19.081 14.860 -12.031 1.00 1.95 C ATOM 0 H THR A 7 -19.524 15.285 -9.106 1.00 1.86 H new ATOM 0 HA THR A 7 -17.508 13.710 -10.298 1.00 1.83 H new ATOM 0 HB THR A 7 -17.224 15.865 -11.709 1.00 1.88 H new ATOM 0 HG1 THR A 7 -18.999 17.365 -11.409 1.00 2.15 H new ATOM 0 HG21 THR A 7 -19.373 15.500 -12.864 1.00 1.95 H new ATOM 0 HG22 THR A 7 -18.600 13.961 -12.416 1.00 1.95 H new ATOM 0 HG23 THR A 7 -19.967 14.581 -11.460 1.00 1.95 H new ATOM 108 N ARG A 8 -16.472 16.272 -8.505 1.00 1.84 N ATOM 109 CA ARG A 8 -15.295 16.861 -7.876 1.00 1.82 C ATOM 110 C ARG A 8 -14.643 15.851 -6.936 1.00 1.75 C ATOM 111 O ARG A 8 -13.422 15.709 -6.916 1.00 1.69 O ATOM 112 CB ARG A 8 -15.679 18.149 -7.127 1.00 1.94 C ATOM 113 CG ARG A 8 -14.536 18.814 -6.364 1.00 2.03 C ATOM 114 CD ARG A 8 -13.261 18.914 -7.194 1.00 2.06 C ATOM 115 NE ARG A 8 -13.491 19.483 -8.522 1.00 2.06 N ATOM 116 CZ ARG A 8 -12.931 19.013 -9.636 1.00 2.08 C ATOM 117 NH1 ARG A 8 -12.127 17.954 -9.581 1.00 2.10 N ATOM 118 NH2 ARG A 8 -13.180 19.597 -10.803 1.00 2.22 N ATOM 0 H ARG A 8 -17.355 16.704 -8.233 1.00 1.84 H new ATOM 0 HA ARG A 8 -14.572 17.124 -8.648 1.00 1.82 H new ATOM 0 HB2 ARG A 8 -16.081 18.863 -7.845 1.00 1.94 H new ATOM 0 HB3 ARG A 8 -16.480 17.918 -6.424 1.00 1.94 H new ATOM 0 HG2 ARG A 8 -14.843 19.813 -6.054 1.00 2.03 H new ATOM 0 HG3 ARG A 8 -14.331 18.247 -5.456 1.00 2.03 H new ATOM 0 HD2 ARG A 8 -12.534 19.528 -6.662 1.00 2.06 H new ATOM 0 HD3 ARG A 8 -12.823 17.921 -7.300 1.00 2.06 H new ATOM 0 HE ARG A 8 -14.116 20.285 -8.600 1.00 2.06 H new ATOM 0 HH11 ARG A 8 -11.939 17.502 -8.686 1.00 2.10 H new ATOM 0 HH12 ARG A 8 -11.698 17.594 -10.434 1.00 2.10 H new ATOM 0 HH21 ARG A 8 -13.800 20.406 -10.847 1.00 2.22 H new ATOM 0 HH22 ARG A 8 -12.751 19.237 -11.655 1.00 2.22 H new ATOM 132 N ASN A 9 -15.470 15.143 -6.177 1.00 1.76 N ATOM 133 CA ASN A 9 -14.984 14.135 -5.238 1.00 1.72 C ATOM 134 C ASN A 9 -14.318 12.975 -5.974 1.00 1.61 C ATOM 135 O ASN A 9 -13.253 12.507 -5.573 1.00 1.56 O ATOM 136 CB ASN A 9 -16.149 13.623 -4.380 1.00 1.78 C ATOM 137 CG ASN A 9 -15.877 12.278 -3.724 1.00 1.75 C ATOM 138 OD1 ASN A 9 -16.176 11.225 -4.289 1.00 1.75 O ATOM 139 ND2 ASN A 9 -15.324 12.308 -2.521 1.00 1.84 N ATOM 0 H ASN A 9 -16.485 15.248 -6.192 1.00 1.76 H new ATOM 0 HA ASN A 9 -14.236 14.595 -4.592 1.00 1.72 H new ATOM 0 HB2 ASN A 9 -16.369 14.358 -3.605 1.00 1.78 H new ATOM 0 HB3 ASN A 9 -17.039 13.540 -5.003 1.00 1.78 H new ATOM 0 HD21 ASN A 9 -15.130 11.437 -2.027 1.00 1.84 H new ATOM 0 HD22 ASN A 9 -15.092 13.202 -2.089 1.00 1.84 H new ATOM 146 N LYS A 10 -14.946 12.538 -7.060 1.00 1.60 N ATOM 147 CA LYS A 10 -14.451 11.426 -7.858 1.00 1.52 C ATOM 148 C LYS A 10 -13.028 11.675 -8.361 1.00 1.47 C ATOM 149 O LYS A 10 -12.142 10.857 -8.141 1.00 1.41 O ATOM 150 CB LYS A 10 -15.397 11.195 -9.044 1.00 1.53 C ATOM 151 CG LYS A 10 -14.862 10.230 -10.089 1.00 1.59 C ATOM 152 CD LYS A 10 -14.903 8.792 -9.605 1.00 1.70 C ATOM 153 CE LYS A 10 -14.733 7.817 -10.761 1.00 2.07 C ATOM 154 NZ LYS A 10 -15.945 7.765 -11.625 1.00 2.48 N ATOM 0 H LYS A 10 -15.813 12.946 -7.411 1.00 1.60 H new ATOM 0 HA LYS A 10 -14.421 10.539 -7.225 1.00 1.52 H new ATOM 0 HB2 LYS A 10 -16.347 10.815 -8.668 1.00 1.53 H new ATOM 0 HB3 LYS A 10 -15.603 12.153 -9.522 1.00 1.53 H new ATOM 0 HG2 LYS A 10 -15.449 10.322 -11.003 1.00 1.59 H new ATOM 0 HG3 LYS A 10 -13.836 10.499 -10.341 1.00 1.59 H new ATOM 0 HD2 LYS A 10 -14.114 8.630 -8.870 1.00 1.70 H new ATOM 0 HD3 LYS A 10 -15.851 8.602 -9.102 1.00 1.70 H new ATOM 0 HE2 LYS A 10 -13.872 8.111 -11.361 1.00 2.07 H new ATOM 0 HE3 LYS A 10 -14.523 6.822 -10.369 1.00 2.07 H new ATOM 0 HZ1 LYS A 10 -15.845 6.996 -12.318 1.00 2.48 H new ATOM 0 HZ2 LYS A 10 -16.784 7.593 -11.036 1.00 2.48 H new ATOM 0 HZ3 LYS A 10 -16.053 8.670 -12.126 1.00 2.48 H new ATOM 168 N GLU A 11 -12.809 12.821 -8.994 1.00 1.52 N ATOM 169 CA GLU A 11 -11.495 13.154 -9.536 1.00 1.50 C ATOM 170 C GLU A 11 -10.468 13.356 -8.424 1.00 1.45 C ATOM 171 O GLU A 11 -9.292 13.018 -8.588 1.00 1.38 O ATOM 172 CB GLU A 11 -11.575 14.421 -10.386 1.00 1.58 C ATOM 173 CG GLU A 11 -10.362 14.628 -11.283 1.00 1.63 C ATOM 174 CD GLU A 11 -10.089 16.085 -11.587 1.00 1.77 C ATOM 175 OE1 GLU A 11 -11.059 16.862 -11.728 1.00 1.96 O ATOM 176 OE2 GLU A 11 -8.901 16.464 -11.688 1.00 1.90 O ATOM 0 H GLU A 11 -13.522 13.535 -9.145 1.00 1.52 H new ATOM 0 HA GLU A 11 -11.175 12.317 -10.156 1.00 1.50 H new ATOM 0 HB2 GLU A 11 -12.471 14.378 -11.005 1.00 1.58 H new ATOM 0 HB3 GLU A 11 -11.682 15.284 -9.729 1.00 1.58 H new ATOM 0 HG2 GLU A 11 -9.485 14.193 -10.804 1.00 1.63 H new ATOM 0 HG3 GLU A 11 -10.514 14.090 -12.219 1.00 1.63 H new ATOM 183 N LEU A 12 -10.919 13.892 -7.294 1.00 1.51 N ATOM 184 CA LEU A 12 -10.042 14.166 -6.163 1.00 1.50 C ATOM 185 C LEU A 12 -9.330 12.902 -5.677 1.00 1.40 C ATOM 186 O LEU A 12 -8.102 12.818 -5.715 1.00 1.33 O ATOM 187 CB LEU A 12 -10.838 14.793 -5.008 1.00 1.62 C ATOM 188 CG LEU A 12 -10.004 15.347 -3.848 1.00 1.65 C ATOM 189 CD1 LEU A 12 -9.143 16.515 -4.316 1.00 1.69 C ATOM 190 CD2 LEU A 12 -10.916 15.775 -2.709 1.00 1.82 C ATOM 0 H LEU A 12 -11.894 14.146 -7.138 1.00 1.51 H new ATOM 0 HA LEU A 12 -9.282 14.870 -6.503 1.00 1.50 H new ATOM 0 HB2 LEU A 12 -11.450 15.601 -5.410 1.00 1.62 H new ATOM 0 HB3 LEU A 12 -11.522 14.042 -4.613 1.00 1.62 H new ATOM 0 HG LEU A 12 -9.340 14.561 -3.487 1.00 1.65 H new ATOM 0 HD11 LEU A 12 -8.558 16.895 -3.478 1.00 1.69 H new ATOM 0 HD12 LEU A 12 -8.470 16.178 -5.105 1.00 1.69 H new ATOM 0 HD13 LEU A 12 -9.784 17.309 -4.700 1.00 1.69 H new ATOM 0 HD21 LEU A 12 -10.314 16.167 -1.889 1.00 1.82 H new ATOM 0 HD22 LEU A 12 -11.599 16.548 -3.061 1.00 1.82 H new ATOM 0 HD23 LEU A 12 -11.489 14.916 -2.360 1.00 1.82 H new ATOM 202 N LEU A 13 -10.102 11.905 -5.255 1.00 1.41 N ATOM 203 CA LEU A 13 -9.522 10.675 -4.734 1.00 1.35 C ATOM 204 C LEU A 13 -8.965 9.785 -5.848 1.00 1.23 C ATOM 205 O LEU A 13 -7.945 9.126 -5.660 1.00 1.18 O ATOM 206 CB LEU A 13 -10.545 9.912 -3.877 1.00 1.43 C ATOM 207 CG LEU A 13 -11.843 9.519 -4.581 1.00 1.43 C ATOM 208 CD1 LEU A 13 -11.834 8.043 -4.933 1.00 1.81 C ATOM 209 CD2 LEU A 13 -13.041 9.844 -3.707 1.00 1.76 C ATOM 0 H LEU A 13 -11.122 11.925 -5.264 1.00 1.41 H new ATOM 0 HA LEU A 13 -8.681 10.955 -4.100 1.00 1.35 H new ATOM 0 HB2 LEU A 13 -10.070 9.006 -3.499 1.00 1.43 H new ATOM 0 HB3 LEU A 13 -10.795 10.526 -3.011 1.00 1.43 H new ATOM 0 HG LEU A 13 -11.919 10.094 -5.504 1.00 1.43 H new ATOM 0 HD11 LEU A 13 -12.767 7.783 -5.433 1.00 1.81 H new ATOM 0 HD12 LEU A 13 -10.995 7.832 -5.596 1.00 1.81 H new ATOM 0 HD13 LEU A 13 -11.734 7.452 -4.022 1.00 1.81 H new ATOM 0 HD21 LEU A 13 -13.957 9.558 -4.224 1.00 1.76 H new ATOM 0 HD22 LEU A 13 -12.967 9.294 -2.769 1.00 1.76 H new ATOM 0 HD23 LEU A 13 -13.061 10.914 -3.500 1.00 1.76 H new ATOM 221 N LEU A 14 -9.617 9.779 -7.004 1.00 1.21 N ATOM 222 CA LEU A 14 -9.174 8.958 -8.132 1.00 1.13 C ATOM 223 C LEU A 14 -7.737 9.291 -8.531 1.00 1.11 C ATOM 224 O LEU A 14 -6.915 8.400 -8.753 1.00 1.04 O ATOM 225 CB LEU A 14 -10.106 9.163 -9.330 1.00 1.16 C ATOM 226 CG LEU A 14 -9.765 8.359 -10.584 1.00 1.09 C ATOM 227 CD1 LEU A 14 -10.214 6.915 -10.430 1.00 1.11 C ATOM 228 CD2 LEU A 14 -10.412 8.989 -11.804 1.00 1.23 C ATOM 0 H LEU A 14 -10.454 10.332 -7.188 1.00 1.21 H new ATOM 0 HA LEU A 14 -9.207 7.914 -7.820 1.00 1.13 H new ATOM 0 HB2 LEU A 14 -11.121 8.910 -9.024 1.00 1.16 H new ATOM 0 HB3 LEU A 14 -10.106 10.222 -9.589 1.00 1.16 H new ATOM 0 HG LEU A 14 -8.683 8.369 -10.719 1.00 1.09 H new ATOM 0 HD11 LEU A 14 -9.963 6.358 -11.333 1.00 1.11 H new ATOM 0 HD12 LEU A 14 -9.709 6.466 -9.574 1.00 1.11 H new ATOM 0 HD13 LEU A 14 -11.292 6.884 -10.273 1.00 1.11 H new ATOM 0 HD21 LEU A 14 -10.161 8.407 -12.691 1.00 1.23 H new ATOM 0 HD22 LEU A 14 -11.494 9.005 -11.675 1.00 1.23 H new ATOM 0 HD23 LEU A 14 -10.046 10.009 -11.924 1.00 1.23 H new ATOM 240 N LYS A 15 -7.442 10.580 -8.608 1.00 1.19 N ATOM 241 CA LYS A 15 -6.120 11.041 -8.991 1.00 1.19 C ATOM 242 C LYS A 15 -5.106 10.816 -7.874 1.00 1.14 C ATOM 243 O LYS A 15 -3.965 10.422 -8.128 1.00 1.09 O ATOM 244 CB LYS A 15 -6.175 12.522 -9.364 1.00 1.32 C ATOM 245 CG LYS A 15 -4.912 13.031 -10.039 1.00 1.56 C ATOM 246 CD LYS A 15 -5.199 14.228 -10.930 1.00 1.68 C ATOM 247 CE LYS A 15 -5.764 15.394 -10.138 1.00 1.70 C ATOM 248 NZ LYS A 15 -6.189 16.517 -11.016 1.00 1.93 N ATOM 0 H LYS A 15 -8.106 11.328 -8.409 1.00 1.19 H new ATOM 0 HA LYS A 15 -5.796 10.462 -9.856 1.00 1.19 H new ATOM 0 HB2 LYS A 15 -7.023 12.689 -10.028 1.00 1.32 H new ATOM 0 HB3 LYS A 15 -6.356 13.108 -8.463 1.00 1.32 H new ATOM 0 HG2 LYS A 15 -4.180 13.308 -9.281 1.00 1.56 H new ATOM 0 HG3 LYS A 15 -4.469 12.232 -10.633 1.00 1.56 H new ATOM 0 HD2 LYS A 15 -4.281 14.538 -11.430 1.00 1.68 H new ATOM 0 HD3 LYS A 15 -5.905 13.941 -11.709 1.00 1.68 H new ATOM 0 HE2 LYS A 15 -6.616 15.053 -9.550 1.00 1.70 H new ATOM 0 HE3 LYS A 15 -5.013 15.750 -9.433 1.00 1.70 H new ATOM 0 HZ1 LYS A 15 -6.018 17.421 -10.531 1.00 1.93 H new ATOM 0 HZ2 LYS A 15 -5.644 16.491 -11.901 1.00 1.93 H new ATOM 0 HZ3 LYS A 15 -7.202 16.425 -11.231 1.00 1.93 H new ATOM 262 N LYS A 16 -5.530 11.050 -6.638 1.00 1.17 N ATOM 263 CA LYS A 16 -4.650 10.882 -5.485 1.00 1.16 C ATOM 264 C LYS A 16 -4.336 9.412 -5.227 1.00 1.04 C ATOM 265 O LYS A 16 -3.289 9.089 -4.670 1.00 1.05 O ATOM 266 CB LYS A 16 -5.274 11.499 -4.231 1.00 1.26 C ATOM 267 CG LYS A 16 -5.309 13.022 -4.239 1.00 1.32 C ATOM 268 CD LYS A 16 -3.921 13.630 -4.075 1.00 1.30 C ATOM 269 CE LYS A 16 -3.415 13.512 -2.645 1.00 1.50 C ATOM 270 NZ LYS A 16 -2.123 14.225 -2.455 1.00 1.62 N ATOM 0 H LYS A 16 -6.475 11.356 -6.407 1.00 1.17 H new ATOM 0 HA LYS A 16 -3.718 11.398 -5.715 1.00 1.16 H new ATOM 0 HB2 LYS A 16 -6.291 11.123 -4.122 1.00 1.26 H new ATOM 0 HB3 LYS A 16 -4.715 11.164 -3.357 1.00 1.26 H new ATOM 0 HG2 LYS A 16 -5.748 13.369 -5.175 1.00 1.32 H new ATOM 0 HG3 LYS A 16 -5.955 13.373 -3.435 1.00 1.32 H new ATOM 0 HD2 LYS A 16 -3.224 13.131 -4.749 1.00 1.30 H new ATOM 0 HD3 LYS A 16 -3.948 14.680 -4.365 1.00 1.30 H new ATOM 0 HE2 LYS A 16 -4.159 13.920 -1.961 1.00 1.50 H new ATOM 0 HE3 LYS A 16 -3.290 12.460 -2.389 1.00 1.50 H new ATOM 0 HZ1 LYS A 16 -1.811 14.121 -1.468 1.00 1.62 H new ATOM 0 HZ2 LYS A 16 -1.406 13.819 -3.089 1.00 1.62 H new ATOM 0 HZ3 LYS A 16 -2.248 15.234 -2.674 1.00 1.62 H new ATOM 284 N ILE A 17 -5.236 8.529 -5.643 1.00 0.96 N ATOM 285 CA ILE A 17 -5.051 7.096 -5.440 1.00 0.88 C ATOM 286 C ILE A 17 -4.043 6.509 -6.430 1.00 0.85 C ATOM 287 O ILE A 17 -3.164 5.739 -6.041 1.00 0.83 O ATOM 288 CB ILE A 17 -6.400 6.339 -5.532 1.00 0.85 C ATOM 289 CG1 ILE A 17 -7.130 6.406 -4.188 1.00 1.01 C ATOM 290 CG2 ILE A 17 -6.195 4.891 -5.953 1.00 0.89 C ATOM 291 CD1 ILE A 17 -8.482 5.727 -4.194 1.00 1.02 C ATOM 0 H ILE A 17 -6.101 8.779 -6.123 1.00 0.96 H new ATOM 0 HA ILE A 17 -4.649 6.965 -4.435 1.00 0.88 H new ATOM 0 HB ILE A 17 -7.010 6.823 -6.295 1.00 0.85 H new ATOM 0 HG12 ILE A 17 -6.506 5.945 -3.422 1.00 1.01 H new ATOM 0 HG13 ILE A 17 -7.260 7.451 -3.907 1.00 1.01 H new ATOM 0 HG21 ILE A 17 -7.160 4.388 -6.008 1.00 0.89 H new ATOM 0 HG22 ILE A 17 -5.714 4.861 -6.931 1.00 0.89 H new ATOM 0 HG23 ILE A 17 -5.564 4.386 -5.222 1.00 0.89 H new ATOM 0 HD11 ILE A 17 -8.938 5.816 -3.208 1.00 1.02 H new ATOM 0 HD12 ILE A 17 -9.125 6.202 -4.935 1.00 1.02 H new ATOM 0 HD13 ILE A 17 -8.359 4.673 -4.443 1.00 1.02 H new ATOM 303 N ASP A 18 -4.153 6.875 -7.703 1.00 0.90 N ATOM 304 CA ASP A 18 -3.227 6.351 -8.710 1.00 0.93 C ATOM 305 C ASP A 18 -1.818 6.887 -8.472 1.00 0.93 C ATOM 306 O ASP A 18 -0.831 6.178 -8.645 1.00 0.93 O ATOM 307 CB ASP A 18 -3.696 6.695 -10.123 1.00 1.04 C ATOM 308 CG ASP A 18 -3.210 5.683 -11.144 1.00 1.20 C ATOM 309 OD1 ASP A 18 -3.129 4.480 -10.813 1.00 1.66 O ATOM 310 OD2 ASP A 18 -2.921 6.076 -12.294 1.00 1.62 O ATOM 0 H ASP A 18 -4.858 7.519 -8.061 1.00 0.90 H new ATOM 0 HA ASP A 18 -3.209 5.265 -8.615 1.00 0.93 H new ATOM 0 HB2 ASP A 18 -4.785 6.737 -10.144 1.00 1.04 H new ATOM 0 HB3 ASP A 18 -3.334 7.687 -10.394 1.00 1.04 H new ATOM 315 N SER A 19 -1.740 8.145 -8.063 1.00 0.99 N ATOM 316 CA SER A 19 -0.460 8.782 -7.775 1.00 1.03 C ATOM 317 C SER A 19 0.163 8.178 -6.522 1.00 0.96 C ATOM 318 O SER A 19 1.384 8.165 -6.357 1.00 0.96 O ATOM 319 CB SER A 19 -0.640 10.288 -7.586 1.00 1.17 C ATOM 320 OG SER A 19 -1.320 10.869 -8.691 1.00 1.28 O ATOM 0 H SER A 19 -2.551 8.748 -7.922 1.00 0.99 H new ATOM 0 HA SER A 19 0.204 8.610 -8.622 1.00 1.03 H new ATOM 0 HB2 SER A 19 -1.201 10.477 -6.671 1.00 1.17 H new ATOM 0 HB3 SER A 19 0.335 10.761 -7.466 1.00 1.17 H new ATOM 0 HG SER A 19 -2.270 10.632 -8.652 1.00 1.28 H new ATOM 326 N LEU A 20 -0.702 7.702 -5.635 1.00 0.92 N ATOM 327 CA LEU A 20 -0.294 7.097 -4.376 1.00 0.90 C ATOM 328 C LEU A 20 0.660 5.925 -4.613 1.00 0.84 C ATOM 329 O LEU A 20 1.765 5.893 -4.073 1.00 0.86 O ATOM 330 CB LEU A 20 -1.548 6.627 -3.640 1.00 0.92 C ATOM 331 CG LEU A 20 -1.347 6.083 -2.232 1.00 1.01 C ATOM 332 CD1 LEU A 20 -1.733 7.140 -1.210 1.00 1.37 C ATOM 333 CD2 LEU A 20 -2.172 4.816 -2.058 1.00 1.14 C ATOM 0 H LEU A 20 -1.713 7.726 -5.771 1.00 0.92 H new ATOM 0 HA LEU A 20 0.240 7.833 -3.774 1.00 0.90 H new ATOM 0 HB2 LEU A 20 -2.245 7.463 -3.586 1.00 0.92 H new ATOM 0 HB3 LEU A 20 -2.025 5.852 -4.240 1.00 0.92 H new ATOM 0 HG LEU A 20 -0.297 5.834 -2.076 1.00 1.01 H new ATOM 0 HD11 LEU A 20 -1.587 6.745 -0.205 1.00 1.37 H new ATOM 0 HD12 LEU A 20 -1.109 8.023 -1.347 1.00 1.37 H new ATOM 0 HD13 LEU A 20 -2.780 7.411 -1.345 1.00 1.37 H new ATOM 0 HD21 LEU A 20 -2.030 4.425 -1.051 1.00 1.14 H new ATOM 0 HD22 LEU A 20 -3.226 5.044 -2.213 1.00 1.14 H new ATOM 0 HD23 LEU A 20 -1.851 4.070 -2.786 1.00 1.14 H new ATOM 345 N ILE A 21 0.251 4.987 -5.460 1.00 0.80 N ATOM 346 CA ILE A 21 1.081 3.821 -5.755 1.00 0.79 C ATOM 347 C ILE A 21 2.317 4.209 -6.567 1.00 0.81 C ATOM 348 O ILE A 21 3.355 3.558 -6.479 1.00 0.83 O ATOM 349 CB ILE A 21 0.287 2.717 -6.494 1.00 0.81 C ATOM 350 CG1 ILE A 21 -0.318 3.247 -7.800 1.00 1.06 C ATOM 351 CG2 ILE A 21 -0.807 2.163 -5.592 1.00 1.04 C ATOM 352 CD1 ILE A 21 0.231 2.572 -9.038 1.00 1.23 C ATOM 0 H ILE A 21 -0.642 5.009 -5.952 1.00 0.80 H new ATOM 0 HA ILE A 21 1.405 3.418 -4.795 1.00 0.79 H new ATOM 0 HB ILE A 21 0.980 1.914 -6.746 1.00 0.81 H new ATOM 0 HG12 ILE A 21 -1.399 3.112 -7.771 1.00 1.06 H new ATOM 0 HG13 ILE A 21 -0.133 4.319 -7.868 1.00 1.06 H new ATOM 0 HG21 ILE A 21 -1.358 1.387 -6.123 1.00 1.04 H new ATOM 0 HG22 ILE A 21 -0.358 1.739 -4.694 1.00 1.04 H new ATOM 0 HG23 ILE A 21 -1.489 2.966 -5.312 1.00 1.04 H new ATOM 0 HD11 ILE A 21 -0.241 2.997 -9.924 1.00 1.23 H new ATOM 0 HD12 ILE A 21 1.308 2.729 -9.091 1.00 1.23 H new ATOM 0 HD13 ILE A 21 0.022 1.503 -8.993 1.00 1.23 H new ATOM 364 N GLU A 22 2.206 5.283 -7.339 1.00 0.84 N ATOM 365 CA GLU A 22 3.320 5.761 -8.150 1.00 0.90 C ATOM 366 C GLU A 22 4.462 6.247 -7.264 1.00 0.90 C ATOM 367 O GLU A 22 5.633 6.024 -7.568 1.00 0.93 O ATOM 368 CB GLU A 22 2.861 6.882 -9.080 1.00 0.98 C ATOM 369 CG GLU A 22 2.101 6.386 -10.302 1.00 1.29 C ATOM 370 CD GLU A 22 1.771 7.502 -11.276 1.00 1.78 C ATOM 371 OE1 GLU A 22 2.711 8.164 -11.766 1.00 2.22 O ATOM 372 OE2 GLU A 22 0.575 7.728 -11.554 1.00 2.29 O ATOM 0 H GLU A 22 1.356 5.840 -7.421 1.00 0.84 H new ATOM 0 HA GLU A 22 3.682 4.930 -8.755 1.00 0.90 H new ATOM 0 HB2 GLU A 22 2.226 7.569 -8.521 1.00 0.98 H new ATOM 0 HB3 GLU A 22 3.732 7.449 -9.409 1.00 0.98 H new ATOM 0 HG2 GLU A 22 2.695 5.628 -10.812 1.00 1.29 H new ATOM 0 HG3 GLU A 22 1.178 5.904 -9.980 1.00 1.29 H new ATOM 379 N ALA A 23 4.111 6.908 -6.170 1.00 0.89 N ATOM 380 CA ALA A 23 5.100 7.419 -5.236 1.00 0.92 C ATOM 381 C ALA A 23 5.834 6.270 -4.563 1.00 0.88 C ATOM 382 O ALA A 23 7.059 6.282 -4.456 1.00 0.89 O ATOM 383 CB ALA A 23 4.438 8.305 -4.194 1.00 0.94 C ATOM 0 H ALA A 23 3.145 7.103 -5.908 1.00 0.89 H new ATOM 0 HA ALA A 23 5.823 8.017 -5.790 1.00 0.92 H new ATOM 0 HB1 ALA A 23 5.193 8.679 -3.502 1.00 0.94 H new ATOM 0 HB2 ALA A 23 3.950 9.145 -4.688 1.00 0.94 H new ATOM 0 HB3 ALA A 23 3.696 7.727 -3.643 1.00 0.94 H new ATOM 389 N ILE A 24 5.070 5.270 -4.128 1.00 0.86 N ATOM 390 CA ILE A 24 5.632 4.097 -3.465 1.00 0.85 C ATOM 391 C ILE A 24 6.580 3.357 -4.405 1.00 0.83 C ATOM 392 O ILE A 24 7.615 2.837 -3.984 1.00 0.83 O ATOM 393 CB ILE A 24 4.514 3.146 -2.970 1.00 0.87 C ATOM 394 CG1 ILE A 24 3.689 3.837 -1.880 1.00 1.12 C ATOM 395 CG2 ILE A 24 5.106 1.848 -2.434 1.00 1.03 C ATOM 396 CD1 ILE A 24 2.215 3.489 -1.901 1.00 1.05 C ATOM 0 H ILE A 24 4.055 5.250 -4.224 1.00 0.86 H new ATOM 0 HA ILE A 24 6.194 4.439 -2.596 1.00 0.85 H new ATOM 0 HB ILE A 24 3.866 2.904 -3.813 1.00 0.87 H new ATOM 0 HG12 ILE A 24 4.100 3.571 -0.906 1.00 1.12 H new ATOM 0 HG13 ILE A 24 3.797 4.916 -1.988 1.00 1.12 H new ATOM 0 HG21 ILE A 24 4.303 1.196 -2.092 1.00 1.03 H new ATOM 0 HG22 ILE A 24 5.666 1.350 -3.225 1.00 1.03 H new ATOM 0 HG23 ILE A 24 5.773 2.069 -1.601 1.00 1.03 H new ATOM 0 HD11 ILE A 24 1.704 4.020 -1.098 1.00 1.05 H new ATOM 0 HD12 ILE A 24 1.786 3.781 -2.859 1.00 1.05 H new ATOM 0 HD13 ILE A 24 2.093 2.415 -1.761 1.00 1.05 H new ATOM 408 N LYS A 25 6.235 3.343 -5.689 1.00 0.83 N ATOM 409 CA LYS A 25 7.055 2.687 -6.700 1.00 0.84 C ATOM 410 C LYS A 25 8.416 3.378 -6.813 1.00 0.86 C ATOM 411 O LYS A 25 9.442 2.729 -7.000 1.00 0.86 O ATOM 412 CB LYS A 25 6.336 2.699 -8.052 1.00 0.88 C ATOM 413 CG LYS A 25 7.110 2.017 -9.170 1.00 0.96 C ATOM 414 CD LYS A 25 7.241 0.522 -8.930 1.00 1.13 C ATOM 415 CE LYS A 25 7.865 -0.176 -10.128 1.00 1.39 C ATOM 416 NZ LYS A 25 7.952 -1.645 -9.928 1.00 1.61 N ATOM 0 H LYS A 25 5.389 3.781 -6.054 1.00 0.83 H new ATOM 0 HA LYS A 25 7.218 1.652 -6.400 1.00 0.84 H new ATOM 0 HB2 LYS A 25 5.369 2.209 -7.942 1.00 0.88 H new ATOM 0 HB3 LYS A 25 6.139 3.732 -8.338 1.00 0.88 H new ATOM 0 HG2 LYS A 25 6.606 2.190 -10.121 1.00 0.96 H new ATOM 0 HG3 LYS A 25 8.102 2.461 -9.250 1.00 0.96 H new ATOM 0 HD2 LYS A 25 7.852 0.346 -8.045 1.00 1.13 H new ATOM 0 HD3 LYS A 25 6.258 0.096 -8.729 1.00 1.13 H new ATOM 0 HE2 LYS A 25 7.274 0.035 -11.020 1.00 1.39 H new ATOM 0 HE3 LYS A 25 8.863 0.226 -10.304 1.00 1.39 H new ATOM 0 HZ1 LYS A 25 8.383 -2.085 -10.766 1.00 1.61 H new ATOM 0 HZ2 LYS A 25 8.536 -1.848 -9.092 1.00 1.61 H new ATOM 0 HZ3 LYS A 25 6.998 -2.033 -9.785 1.00 1.61 H new ATOM 430 N LYS A 26 8.412 4.695 -6.676 1.00 0.87 N ATOM 431 CA LYS A 26 9.636 5.477 -6.756 1.00 0.91 C ATOM 432 C LYS A 26 10.488 5.263 -5.509 1.00 0.90 C ATOM 433 O LYS A 26 11.714 5.228 -5.586 1.00 0.91 O ATOM 434 CB LYS A 26 9.318 6.965 -6.927 1.00 0.97 C ATOM 435 CG LYS A 26 9.979 7.589 -8.147 1.00 1.07 C ATOM 436 CD LYS A 26 11.489 7.437 -8.097 1.00 1.21 C ATOM 437 CE LYS A 26 12.146 7.920 -9.378 1.00 1.35 C ATOM 438 NZ LYS A 26 13.502 7.338 -9.558 1.00 1.42 N ATOM 0 H LYS A 26 7.571 5.247 -6.508 1.00 0.87 H new ATOM 0 HA LYS A 26 10.198 5.140 -7.627 1.00 0.91 H new ATOM 0 HB2 LYS A 26 8.238 7.091 -7.004 1.00 0.97 H new ATOM 0 HB3 LYS A 26 9.639 7.502 -6.035 1.00 0.97 H new ATOM 0 HG2 LYS A 26 9.594 7.119 -9.052 1.00 1.07 H new ATOM 0 HG3 LYS A 26 9.720 8.646 -8.202 1.00 1.07 H new ATOM 0 HD2 LYS A 26 11.883 8.000 -7.251 1.00 1.21 H new ATOM 0 HD3 LYS A 26 11.744 6.390 -7.930 1.00 1.21 H new ATOM 0 HE2 LYS A 26 11.520 7.654 -10.230 1.00 1.35 H new ATOM 0 HE3 LYS A 26 12.217 9.008 -9.362 1.00 1.35 H new ATOM 0 HZ1 LYS A 26 14.027 7.892 -10.265 1.00 1.42 H new ATOM 0 HZ2 LYS A 26 14.012 7.360 -8.652 1.00 1.42 H new ATOM 0 HZ3 LYS A 26 13.417 6.354 -9.883 1.00 1.42 H new ATOM 452 N ILE A 27 9.827 5.108 -4.367 1.00 0.88 N ATOM 453 CA ILE A 27 10.509 4.901 -3.088 1.00 0.89 C ATOM 454 C ILE A 27 11.463 3.708 -3.152 1.00 0.87 C ATOM 455 O ILE A 27 12.635 3.816 -2.789 1.00 0.90 O ATOM 456 CB ILE A 27 9.497 4.667 -1.944 1.00 0.90 C ATOM 457 CG1 ILE A 27 8.554 5.862 -1.789 1.00 0.90 C ATOM 458 CG2 ILE A 27 10.215 4.386 -0.633 1.00 0.93 C ATOM 459 CD1 ILE A 27 9.253 7.179 -1.528 1.00 1.31 C ATOM 0 H ILE A 27 8.809 5.122 -4.298 1.00 0.88 H new ATOM 0 HA ILE A 27 11.079 5.808 -2.887 1.00 0.89 H new ATOM 0 HB ILE A 27 8.900 3.793 -2.205 1.00 0.90 H new ATOM 0 HG12 ILE A 27 7.954 5.956 -2.694 1.00 0.90 H new ATOM 0 HG13 ILE A 27 7.864 5.662 -0.969 1.00 0.90 H new ATOM 0 HG21 ILE A 27 9.481 4.225 0.157 1.00 0.93 H new ATOM 0 HG22 ILE A 27 10.834 3.495 -0.741 1.00 0.93 H new ATOM 0 HG23 ILE A 27 10.846 5.237 -0.374 1.00 0.93 H new ATOM 0 HD11 ILE A 27 8.511 7.972 -1.431 1.00 1.31 H new ATOM 0 HD12 ILE A 27 9.831 7.108 -0.606 1.00 1.31 H new ATOM 0 HD13 ILE A 27 9.921 7.407 -2.358 1.00 1.31 H new ATOM 471 N ILE A 28 10.946 2.576 -3.618 1.00 0.83 N ATOM 472 CA ILE A 28 11.739 1.354 -3.726 1.00 0.82 C ATOM 473 C ILE A 28 12.915 1.536 -4.688 1.00 0.83 C ATOM 474 O ILE A 28 13.978 0.947 -4.495 1.00 0.84 O ATOM 475 CB ILE A 28 10.869 0.141 -4.152 1.00 0.82 C ATOM 476 CG1 ILE A 28 11.537 -1.167 -3.732 1.00 0.88 C ATOM 477 CG2 ILE A 28 10.599 0.139 -5.652 1.00 0.88 C ATOM 478 CD1 ILE A 28 10.567 -2.320 -3.592 1.00 1.05 C ATOM 0 H ILE A 28 9.979 2.478 -3.928 1.00 0.83 H new ATOM 0 HA ILE A 28 12.140 1.146 -2.734 1.00 0.82 H new ATOM 0 HB ILE A 28 9.909 0.230 -3.643 1.00 0.82 H new ATOM 0 HG12 ILE A 28 12.298 -1.430 -4.467 1.00 0.88 H new ATOM 0 HG13 ILE A 28 12.049 -1.016 -2.782 1.00 0.88 H new ATOM 0 HG21 ILE A 28 9.987 -0.725 -5.910 1.00 0.88 H new ATOM 0 HG22 ILE A 28 10.072 1.052 -5.928 1.00 0.88 H new ATOM 0 HG23 ILE A 28 11.545 0.089 -6.192 1.00 0.88 H new ATOM 0 HD11 ILE A 28 11.109 -3.217 -3.292 1.00 1.05 H new ATOM 0 HD12 ILE A 28 9.820 -2.077 -2.836 1.00 1.05 H new ATOM 0 HD13 ILE A 28 10.073 -2.498 -4.547 1.00 1.05 H new ATOM 490 N ALA A 29 12.715 2.353 -5.712 1.00 0.84 N ATOM 491 CA ALA A 29 13.752 2.611 -6.697 1.00 0.87 C ATOM 492 C ALA A 29 14.909 3.379 -6.068 1.00 0.90 C ATOM 493 O ALA A 29 16.065 2.978 -6.184 1.00 0.93 O ATOM 494 CB ALA A 29 13.181 3.376 -7.880 1.00 0.90 C ATOM 0 H ALA A 29 11.840 2.850 -5.882 1.00 0.84 H new ATOM 0 HA ALA A 29 14.133 1.655 -7.057 1.00 0.87 H new ATOM 0 HB1 ALA A 29 13.970 3.561 -8.609 1.00 0.90 H new ATOM 0 HB2 ALA A 29 12.389 2.789 -8.345 1.00 0.90 H new ATOM 0 HB3 ALA A 29 12.774 4.327 -7.536 1.00 0.90 H new ATOM 500 N GLU A 30 14.585 4.470 -5.380 1.00 0.93 N ATOM 501 CA GLU A 30 15.598 5.301 -4.731 1.00 0.99 C ATOM 502 C GLU A 30 16.359 4.500 -3.675 1.00 0.99 C ATOM 503 O GLU A 30 17.574 4.646 -3.530 1.00 1.01 O ATOM 504 CB GLU A 30 14.958 6.532 -4.083 1.00 1.06 C ATOM 505 CG GLU A 30 14.063 7.327 -5.022 1.00 1.10 C ATOM 506 CD GLU A 30 14.809 7.903 -6.208 1.00 1.18 C ATOM 507 OE1 GLU A 30 15.384 9.003 -6.081 1.00 1.46 O ATOM 508 OE2 GLU A 30 14.805 7.269 -7.283 1.00 1.25 O ATOM 0 H GLU A 30 13.628 4.801 -5.257 1.00 0.93 H new ATOM 0 HA GLU A 30 16.299 5.631 -5.498 1.00 0.99 H new ATOM 0 HB2 GLU A 30 14.372 6.213 -3.221 1.00 1.06 H new ATOM 0 HB3 GLU A 30 15.746 7.185 -3.709 1.00 1.06 H new ATOM 0 HG2 GLU A 30 13.261 6.682 -5.383 1.00 1.10 H new ATOM 0 HG3 GLU A 30 13.594 8.139 -4.466 1.00 1.10 H new ATOM 515 N PHE A 31 15.634 3.657 -2.944 1.00 0.97 N ATOM 516 CA PHE A 31 16.230 2.813 -1.908 1.00 1.00 C ATOM 517 C PHE A 31 17.349 1.953 -2.492 1.00 0.97 C ATOM 518 O PHE A 31 18.435 1.839 -1.917 1.00 1.00 O ATOM 519 CB PHE A 31 15.159 1.911 -1.284 1.00 1.02 C ATOM 520 CG PHE A 31 14.702 2.352 0.077 1.00 1.10 C ATOM 521 CD1 PHE A 31 13.883 3.461 0.226 1.00 1.79 C ATOM 522 CD2 PHE A 31 15.086 1.650 1.208 1.00 1.42 C ATOM 523 CE1 PHE A 31 13.456 3.861 1.477 1.00 1.98 C ATOM 524 CE2 PHE A 31 14.664 2.045 2.460 1.00 1.58 C ATOM 525 CZ PHE A 31 13.849 3.153 2.597 1.00 1.54 C ATOM 0 H PHE A 31 14.626 3.539 -3.050 1.00 0.97 H new ATOM 0 HA PHE A 31 16.650 3.460 -1.138 1.00 1.00 H new ATOM 0 HB2 PHE A 31 14.297 1.874 -1.950 1.00 1.02 H new ATOM 0 HB3 PHE A 31 15.551 0.896 -1.213 1.00 1.02 H new ATOM 0 HD1 PHE A 31 13.575 4.018 -0.646 1.00 1.79 H new ATOM 0 HD2 PHE A 31 15.723 0.784 1.108 1.00 1.42 H new ATOM 0 HE1 PHE A 31 12.816 4.725 1.580 1.00 1.98 H new ATOM 0 HE2 PHE A 31 14.970 1.489 3.334 1.00 1.58 H new ATOM 0 HZ PHE A 31 13.520 3.465 3.577 1.00 1.54 H new ATOM 535 N ASP A 32 17.076 1.369 -3.652 1.00 0.93 N ATOM 536 CA ASP A 32 18.037 0.509 -4.336 1.00 0.92 C ATOM 537 C ASP A 32 19.260 1.314 -4.769 1.00 0.92 C ATOM 538 O ASP A 32 20.402 0.857 -4.650 1.00 0.93 O ATOM 539 CB ASP A 32 17.380 -0.135 -5.559 1.00 0.94 C ATOM 540 CG ASP A 32 18.221 -1.244 -6.166 1.00 1.15 C ATOM 541 OD1 ASP A 32 19.073 -0.960 -7.035 1.00 1.45 O ATOM 542 OD2 ASP A 32 18.024 -2.413 -5.783 1.00 1.54 O ATOM 0 H ASP A 32 16.189 1.476 -4.144 1.00 0.93 H new ATOM 0 HA ASP A 32 18.359 -0.272 -3.647 1.00 0.92 H new ATOM 0 HB2 ASP A 32 16.408 -0.538 -5.273 1.00 0.94 H new ATOM 0 HB3 ASP A 32 17.198 0.631 -6.313 1.00 0.94 H new ATOM 547 N VAL A 33 19.003 2.519 -5.265 1.00 0.93 N ATOM 548 CA VAL A 33 20.058 3.416 -5.720 1.00 0.95 C ATOM 549 C VAL A 33 21.008 3.775 -4.575 1.00 0.96 C ATOM 550 O VAL A 33 22.229 3.686 -4.721 1.00 0.97 O ATOM 551 CB VAL A 33 19.465 4.713 -6.317 1.00 0.99 C ATOM 552 CG1 VAL A 33 20.566 5.689 -6.695 1.00 1.06 C ATOM 553 CG2 VAL A 33 18.588 4.404 -7.519 1.00 0.98 C ATOM 0 H VAL A 33 18.062 2.900 -5.363 1.00 0.93 H new ATOM 0 HA VAL A 33 20.617 2.890 -6.494 1.00 0.95 H new ATOM 0 HB VAL A 33 18.844 5.180 -5.553 1.00 0.99 H new ATOM 0 HG11 VAL A 33 20.123 6.593 -7.113 1.00 1.06 H new ATOM 0 HG12 VAL A 33 21.146 5.945 -5.808 1.00 1.06 H new ATOM 0 HG13 VAL A 33 21.220 5.230 -7.436 1.00 1.06 H new ATOM 0 HG21 VAL A 33 18.182 5.332 -7.922 1.00 0.98 H new ATOM 0 HG22 VAL A 33 19.183 3.906 -8.285 1.00 0.98 H new ATOM 0 HG23 VAL A 33 17.769 3.752 -7.214 1.00 0.98 H new ATOM 563 N VAL A 34 20.437 4.171 -3.440 1.00 0.98 N ATOM 564 CA VAL A 34 21.221 4.542 -2.265 1.00 1.02 C ATOM 565 C VAL A 34 22.125 3.394 -1.826 1.00 1.02 C ATOM 566 O VAL A 34 23.295 3.607 -1.510 1.00 1.04 O ATOM 567 CB VAL A 34 20.314 4.983 -1.092 1.00 1.07 C ATOM 568 CG1 VAL A 34 21.125 5.156 0.184 1.00 1.14 C ATOM 569 CG2 VAL A 34 19.598 6.282 -1.441 1.00 1.08 C ATOM 0 H VAL A 34 19.428 4.243 -3.309 1.00 0.98 H new ATOM 0 HA VAL A 34 21.845 5.390 -2.549 1.00 1.02 H new ATOM 0 HB VAL A 34 19.571 4.204 -0.922 1.00 1.07 H new ATOM 0 HG11 VAL A 34 20.466 5.466 0.995 1.00 1.14 H new ATOM 0 HG12 VAL A 34 21.600 4.210 0.444 1.00 1.14 H new ATOM 0 HG13 VAL A 34 21.891 5.916 0.028 1.00 1.14 H new ATOM 0 HG21 VAL A 34 18.963 6.582 -0.608 1.00 1.08 H new ATOM 0 HG22 VAL A 34 20.334 7.062 -1.636 1.00 1.08 H new ATOM 0 HG23 VAL A 34 18.985 6.132 -2.329 1.00 1.08 H new ATOM 579 N LYS A 35 21.586 2.181 -1.844 1.00 1.00 N ATOM 580 CA LYS A 35 22.341 0.993 -1.452 1.00 1.02 C ATOM 581 C LYS A 35 23.581 0.809 -2.333 1.00 1.01 C ATOM 582 O LYS A 35 24.669 0.508 -1.838 1.00 1.04 O ATOM 583 CB LYS A 35 21.436 -0.245 -1.525 1.00 1.02 C ATOM 584 CG LYS A 35 22.157 -1.560 -1.267 1.00 1.06 C ATOM 585 CD LYS A 35 22.507 -2.266 -2.568 1.00 1.23 C ATOM 586 CE LYS A 35 23.378 -3.487 -2.332 1.00 1.45 C ATOM 587 NZ LYS A 35 23.865 -4.078 -3.607 1.00 1.92 N ATOM 0 H LYS A 35 20.624 1.992 -2.127 1.00 1.00 H new ATOM 0 HA LYS A 35 22.683 1.124 -0.425 1.00 1.02 H new ATOM 0 HB2 LYS A 35 20.631 -0.136 -0.798 1.00 1.02 H new ATOM 0 HB3 LYS A 35 20.972 -0.285 -2.511 1.00 1.02 H new ATOM 0 HG2 LYS A 35 23.067 -1.372 -0.697 1.00 1.06 H new ATOM 0 HG3 LYS A 35 21.527 -2.208 -0.657 1.00 1.06 H new ATOM 0 HD2 LYS A 35 21.591 -2.566 -3.076 1.00 1.23 H new ATOM 0 HD3 LYS A 35 23.026 -1.572 -3.230 1.00 1.23 H new ATOM 0 HE2 LYS A 35 24.230 -3.210 -1.712 1.00 1.45 H new ATOM 0 HE3 LYS A 35 22.811 -4.236 -1.779 1.00 1.45 H new ATOM 0 HZ1 LYS A 35 24.804 -4.500 -3.458 1.00 1.92 H new ATOM 0 HZ2 LYS A 35 23.202 -4.813 -3.924 1.00 1.92 H new ATOM 0 HZ3 LYS A 35 23.930 -3.335 -4.331 1.00 1.92 H new ATOM 601 N GLU A 36 23.414 0.991 -3.632 1.00 0.99 N ATOM 602 CA GLU A 36 24.520 0.844 -4.568 1.00 1.00 C ATOM 603 C GLU A 36 25.485 2.022 -4.461 1.00 0.99 C ATOM 604 O GLU A 36 26.695 1.864 -4.617 1.00 1.01 O ATOM 605 CB GLU A 36 23.990 0.724 -5.998 1.00 1.03 C ATOM 606 CG GLU A 36 23.108 -0.492 -6.226 1.00 1.31 C ATOM 607 CD GLU A 36 23.896 -1.789 -6.276 1.00 1.41 C ATOM 608 OE1 GLU A 36 24.578 -2.122 -5.282 1.00 1.44 O ATOM 609 OE2 GLU A 36 23.819 -2.492 -7.302 1.00 1.71 O ATOM 0 H GLU A 36 22.524 1.241 -4.064 1.00 0.99 H new ATOM 0 HA GLU A 36 25.063 -0.066 -4.314 1.00 1.00 H new ATOM 0 HB2 GLU A 36 23.424 1.623 -6.242 1.00 1.03 H new ATOM 0 HB3 GLU A 36 24.834 0.683 -6.686 1.00 1.03 H new ATOM 0 HG2 GLU A 36 22.367 -0.553 -5.429 1.00 1.31 H new ATOM 0 HG3 GLU A 36 22.561 -0.368 -7.161 1.00 1.31 H new ATOM 616 N SER A 37 24.952 3.191 -4.182 1.00 0.00 N ATOM 617 CA SER A 37 25.739 4.414 -4.061 1.00 0.00 C ATOM 618 C SER A 37 26.731 4.310 -2.926 1.00 0.00 C ATOM 619 O SER A 37 27.915 4.634 -3.091 1.00 0.00 O ATOM 620 CB SER A 37 24.817 5.649 -3.899 1.00 0.00 C ATOM 621 OG SER A 37 24.036 5.917 -5.069 1.00 0.00 O ATOM 0 H SER A 37 23.953 3.328 -4.030 1.00 0.00 H new ATOM 0 HA SER A 37 26.308 4.545 -4.981 1.00 0.00 H new ATOM 0 HB2 SER A 37 24.150 5.490 -3.051 1.00 0.00 H new ATOM 0 HB3 SER A 37 25.426 6.523 -3.666 1.00 0.00 H new ATOM 0 HG SER A 37 23.319 5.254 -5.142 1.00 0.00 H new ATOM 627 N VAL A 38 26.281 3.874 -1.753 1.00 1.03 N ATOM 628 CA VAL A 38 27.163 3.757 -0.598 1.00 1.06 C ATOM 629 C VAL A 38 28.248 2.708 -0.839 1.00 1.07 C ATOM 630 O VAL A 38 29.353 2.821 -0.319 1.00 1.09 O ATOM 631 CB VAL A 38 26.391 3.424 0.701 1.00 1.10 C ATOM 632 CG1 VAL A 38 25.362 4.503 1.004 1.00 1.12 C ATOM 633 CG2 VAL A 38 25.718 2.066 0.620 1.00 1.10 C ATOM 0 H VAL A 38 25.315 3.597 -1.578 1.00 1.03 H new ATOM 0 HA VAL A 38 27.631 4.733 -0.467 1.00 1.06 H new ATOM 0 HB VAL A 38 27.118 3.389 1.513 1.00 1.10 H new ATOM 0 HG11 VAL A 38 24.830 4.251 1.921 1.00 1.12 H new ATOM 0 HG12 VAL A 38 25.866 5.461 1.129 1.00 1.12 H new ATOM 0 HG13 VAL A 38 24.652 4.571 0.179 1.00 1.12 H new ATOM 0 HG21 VAL A 38 25.186 1.867 1.550 1.00 1.10 H new ATOM 0 HG22 VAL A 38 25.012 2.059 -0.210 1.00 1.10 H new ATOM 0 HG23 VAL A 38 26.472 1.295 0.462 1.00 1.10 H new ATOM 643 N ASN A 39 27.932 1.704 -1.647 1.00 1.05 N ATOM 644 CA ASN A 39 28.878 0.640 -1.958 1.00 1.08 C ATOM 645 C ASN A 39 30.030 1.193 -2.795 1.00 1.07 C ATOM 646 O ASN A 39 31.206 1.039 -2.449 1.00 1.10 O ATOM 647 CB ASN A 39 28.168 -0.492 -2.709 1.00 1.10 C ATOM 648 CG ASN A 39 28.906 -1.816 -2.615 1.00 1.41 C ATOM 649 OD1 ASN A 39 30.118 -1.851 -2.422 1.00 1.68 O ATOM 650 ND2 ASN A 39 28.178 -2.916 -2.752 1.00 1.72 N ATOM 0 H ASN A 39 27.024 1.604 -2.101 1.00 1.05 H new ATOM 0 HA ASN A 39 29.282 0.241 -1.028 1.00 1.08 H new ATOM 0 HB2 ASN A 39 27.162 -0.613 -2.307 1.00 1.10 H new ATOM 0 HB3 ASN A 39 28.061 -0.215 -3.758 1.00 1.10 H new ATOM 0 HD21 ASN A 39 28.623 -3.832 -2.698 1.00 1.72 H new ATOM 0 HD22 ASN A 39 27.173 -2.846 -2.911 1.00 1.72 H new ATOM 657 N GLU A 40 29.670 1.874 -3.878 1.00 1.06 N ATOM 658 CA GLU A 40 30.643 2.470 -4.791 1.00 1.08 C ATOM 659 C GLU A 40 31.497 3.525 -4.085 1.00 1.06 C ATOM 660 O GLU A 40 32.717 3.575 -4.254 1.00 1.09 O ATOM 661 CB GLU A 40 29.909 3.115 -5.972 1.00 1.11 C ATOM 662 CG GLU A 40 30.221 2.484 -7.320 1.00 1.33 C ATOM 663 CD GLU A 40 31.640 2.751 -7.777 1.00 1.77 C ATOM 664 OE1 GLU A 40 32.156 3.858 -7.518 1.00 2.13 O ATOM 665 OE2 GLU A 40 32.250 1.855 -8.398 1.00 2.31 O ATOM 0 H GLU A 40 28.699 2.029 -4.148 1.00 1.06 H new ATOM 0 HA GLU A 40 31.303 1.679 -5.147 1.00 1.08 H new ATOM 0 HB2 GLU A 40 28.835 3.054 -5.795 1.00 1.11 H new ATOM 0 HB3 GLU A 40 30.166 4.174 -6.011 1.00 1.11 H new ATOM 0 HG2 GLU A 40 30.060 1.408 -7.258 1.00 1.33 H new ATOM 0 HG3 GLU A 40 29.525 2.868 -8.066 1.00 1.33 H new ATOM 672 N LEU A 41 30.842 4.358 -3.284 1.00 1.04 N ATOM 673 CA LEU A 41 31.513 5.428 -2.559 1.00 1.05 C ATOM 674 C LEU A 41 32.531 4.879 -1.561 1.00 1.08 C ATOM 675 O LEU A 41 33.638 5.404 -1.446 1.00 1.12 O ATOM 676 CB LEU A 41 30.484 6.297 -1.836 1.00 1.04 C ATOM 677 CG LEU A 41 30.897 7.756 -1.621 1.00 1.04 C ATOM 678 CD1 LEU A 41 30.939 8.504 -2.947 1.00 1.19 C ATOM 679 CD2 LEU A 41 29.944 8.446 -0.656 1.00 1.07 C ATOM 0 H LEU A 41 29.836 4.310 -3.120 1.00 1.04 H new ATOM 0 HA LEU A 41 32.053 6.035 -3.285 1.00 1.05 H new ATOM 0 HB2 LEU A 41 29.554 6.280 -2.404 1.00 1.04 H new ATOM 0 HB3 LEU A 41 30.272 5.849 -0.865 1.00 1.04 H new ATOM 0 HG LEU A 41 31.897 7.765 -1.187 1.00 1.04 H new ATOM 0 HD11 LEU A 41 31.234 9.538 -2.772 1.00 1.19 H new ATOM 0 HD12 LEU A 41 31.661 8.028 -3.611 1.00 1.19 H new ATOM 0 HD13 LEU A 41 29.952 8.482 -3.409 1.00 1.19 H new ATOM 0 HD21 LEU A 41 30.254 9.482 -0.516 1.00 1.07 H new ATOM 0 HD22 LEU A 41 28.933 8.422 -1.063 1.00 1.07 H new ATOM 0 HD23 LEU A 41 29.961 7.930 0.304 1.00 1.07 H new ATOM 691 N SER A 42 32.160 3.815 -0.856 1.00 1.07 N ATOM 692 CA SER A 42 33.043 3.209 0.133 1.00 1.12 C ATOM 693 C SER A 42 34.311 2.645 -0.519 1.00 1.16 C ATOM 694 O SER A 42 35.411 2.790 0.019 1.00 1.20 O ATOM 695 CB SER A 42 32.308 2.110 0.905 1.00 1.13 C ATOM 696 OG SER A 42 31.173 2.631 1.572 1.00 1.47 O ATOM 0 H SER A 42 31.255 3.355 -0.951 1.00 1.07 H new ATOM 0 HA SER A 42 33.345 3.990 0.831 1.00 1.12 H new ATOM 0 HB2 SER A 42 32.000 1.322 0.218 1.00 1.13 H new ATOM 0 HB3 SER A 42 32.984 1.656 1.630 1.00 1.13 H new ATOM 0 HG SER A 42 30.470 2.827 0.918 1.00 1.47 H new ATOM 702 N GLU A 43 34.159 2.028 -1.685 1.00 1.16 N ATOM 703 CA GLU A 43 35.296 1.449 -2.399 1.00 1.22 C ATOM 704 C GLU A 43 36.240 2.546 -2.899 1.00 1.21 C ATOM 705 O GLU A 43 37.463 2.381 -2.893 1.00 1.25 O ATOM 706 CB GLU A 43 34.799 0.588 -3.563 1.00 1.27 C ATOM 707 CG GLU A 43 35.873 -0.282 -4.202 1.00 1.60 C ATOM 708 CD GLU A 43 36.469 -1.292 -3.241 1.00 1.71 C ATOM 709 OE1 GLU A 43 35.820 -1.641 -2.234 1.00 1.94 O ATOM 710 OE2 GLU A 43 37.597 -1.756 -3.493 1.00 1.98 O ATOM 0 H GLU A 43 33.262 1.915 -2.157 1.00 1.16 H new ATOM 0 HA GLU A 43 35.855 0.816 -1.710 1.00 1.22 H new ATOM 0 HB2 GLU A 43 33.993 -0.053 -3.207 1.00 1.27 H new ATOM 0 HB3 GLU A 43 34.374 1.240 -4.326 1.00 1.27 H new ATOM 0 HG2 GLU A 43 35.445 -0.809 -5.055 1.00 1.60 H new ATOM 0 HG3 GLU A 43 36.668 0.357 -4.588 1.00 1.60 H new ATOM 717 N LYS A 44 35.668 3.675 -3.307 1.00 1.18 N ATOM 718 CA LYS A 44 36.456 4.800 -3.804 1.00 1.20 C ATOM 719 C LYS A 44 37.196 5.497 -2.669 1.00 1.20 C ATOM 720 O LYS A 44 38.247 6.101 -2.878 1.00 1.25 O ATOM 721 CB LYS A 44 35.560 5.799 -4.539 1.00 1.22 C ATOM 722 CG LYS A 44 35.533 5.590 -6.047 1.00 1.25 C ATOM 723 CD LYS A 44 36.848 5.994 -6.689 1.00 1.46 C ATOM 724 CE LYS A 44 36.849 5.719 -8.186 1.00 1.75 C ATOM 725 NZ LYS A 44 38.185 5.954 -8.788 1.00 2.12 N ATOM 0 H LYS A 44 34.661 3.836 -3.303 1.00 1.18 H new ATOM 0 HA LYS A 44 37.195 4.407 -4.503 1.00 1.20 H new ATOM 0 HB2 LYS A 44 34.545 5.720 -4.150 1.00 1.22 H new ATOM 0 HB3 LYS A 44 35.905 6.811 -4.326 1.00 1.22 H new ATOM 0 HG2 LYS A 44 35.327 4.542 -6.266 1.00 1.25 H new ATOM 0 HG3 LYS A 44 34.721 6.173 -6.482 1.00 1.25 H new ATOM 0 HD2 LYS A 44 37.029 7.054 -6.513 1.00 1.46 H new ATOM 0 HD3 LYS A 44 37.666 5.449 -6.218 1.00 1.46 H new ATOM 0 HE2 LYS A 44 36.545 4.688 -8.366 1.00 1.75 H new ATOM 0 HE3 LYS A 44 36.113 6.358 -8.674 1.00 1.75 H new ATOM 0 HZ1 LYS A 44 38.146 5.756 -9.808 1.00 2.12 H new ATOM 0 HZ2 LYS A 44 38.464 6.945 -8.638 1.00 2.12 H new ATOM 0 HZ3 LYS A 44 38.883 5.326 -8.340 1.00 2.12 H new ATOM 739 N ALA A 45 36.642 5.407 -1.471 1.00 1.17 N ATOM 740 CA ALA A 45 37.242 6.029 -0.301 1.00 1.18 C ATOM 741 C ALA A 45 38.352 5.162 0.275 1.00 1.18 C ATOM 742 O ALA A 45 39.212 5.640 1.007 1.00 1.19 O ATOM 743 CB ALA A 45 36.180 6.301 0.751 1.00 1.21 C ATOM 0 H ALA A 45 35.773 4.907 -1.282 1.00 1.17 H new ATOM 0 HA ALA A 45 37.684 6.976 -0.610 1.00 1.18 H new ATOM 0 HB1 ALA A 45 36.641 6.767 1.622 1.00 1.21 H new ATOM 0 HB2 ALA A 45 35.424 6.970 0.340 1.00 1.21 H new ATOM 0 HB3 ALA A 45 35.712 5.362 1.047 1.00 1.21 H new ATOM 749 N LYS A 46 38.343 3.888 -0.090 1.00 1.21 N ATOM 750 CA LYS A 46 39.340 2.934 0.388 1.00 1.24 C ATOM 751 C LYS A 46 40.724 3.231 -0.182 1.00 1.24 C ATOM 752 O LYS A 46 41.730 2.717 0.311 1.00 1.27 O ATOM 753 CB LYS A 46 38.918 1.516 0.001 1.00 1.32 C ATOM 754 CG LYS A 46 38.817 0.553 1.179 1.00 1.61 C ATOM 755 CD LYS A 46 38.032 -0.700 0.807 1.00 2.02 C ATOM 756 CE LYS A 46 38.810 -1.570 -0.166 1.00 2.38 C ATOM 757 NZ LYS A 46 37.960 -2.628 -0.772 1.00 2.75 N ATOM 0 H LYS A 46 37.650 3.486 -0.722 1.00 1.21 H new ATOM 0 HA LYS A 46 39.399 3.024 1.473 1.00 1.24 H new ATOM 0 HB2 LYS A 46 37.952 1.560 -0.502 1.00 1.32 H new ATOM 0 HB3 LYS A 46 39.634 1.119 -0.719 1.00 1.32 H new ATOM 0 HG2 LYS A 46 39.817 0.273 1.509 1.00 1.61 H new ATOM 0 HG3 LYS A 46 38.333 1.052 2.018 1.00 1.61 H new ATOM 0 HD2 LYS A 46 37.806 -1.271 1.708 1.00 2.02 H new ATOM 0 HD3 LYS A 46 37.079 -0.416 0.362 1.00 2.02 H new ATOM 0 HE2 LYS A 46 39.229 -0.946 -0.955 1.00 2.38 H new ATOM 0 HE3 LYS A 46 39.649 -2.033 0.353 1.00 2.38 H new ATOM 0 HZ1 LYS A 46 38.404 -2.970 -1.648 1.00 2.75 H new ATOM 0 HZ2 LYS A 46 37.860 -3.418 -0.103 1.00 2.75 H new ATOM 0 HZ3 LYS A 46 37.021 -2.237 -0.989 1.00 2.75 H new ATOM 771 N THR A 47 40.776 4.062 -1.211 1.00 1.23 N ATOM 772 CA THR A 47 42.039 4.399 -1.848 1.00 1.26 C ATOM 773 C THR A 47 42.683 5.647 -1.231 1.00 1.21 C ATOM 774 O THR A 47 43.723 6.117 -1.702 1.00 1.30 O ATOM 775 CB THR A 47 41.830 4.632 -3.353 1.00 1.39 C ATOM 776 OG1 THR A 47 40.712 3.854 -3.809 1.00 1.54 O ATOM 777 CG2 THR A 47 43.074 4.247 -4.140 1.00 1.62 C ATOM 0 H THR A 47 39.960 4.515 -1.622 1.00 1.23 H new ATOM 0 HA THR A 47 42.711 3.556 -1.688 1.00 1.26 H new ATOM 0 HB THR A 47 41.634 5.692 -3.515 1.00 1.39 H new ATOM 0 HG1 THR A 47 40.578 4.004 -4.768 1.00 1.54 H new ATOM 0 HG21 THR A 47 42.901 4.421 -5.202 1.00 1.62 H new ATOM 0 HG22 THR A 47 43.917 4.851 -3.806 1.00 1.62 H new ATOM 0 HG23 THR A 47 43.296 3.192 -3.977 1.00 1.62 H new ATOM 785 N ASP A 48 42.069 6.188 -0.185 1.00 1.15 N ATOM 786 CA ASP A 48 42.606 7.379 0.472 1.00 1.15 C ATOM 787 C ASP A 48 42.296 7.373 1.970 1.00 1.09 C ATOM 788 O ASP A 48 41.152 7.186 2.365 1.00 1.06 O ATOM 789 CB ASP A 48 42.040 8.643 -0.179 1.00 1.24 C ATOM 790 CG ASP A 48 42.528 9.912 0.494 1.00 1.32 C ATOM 791 OD1 ASP A 48 43.675 10.330 0.230 1.00 1.50 O ATOM 792 OD2 ASP A 48 41.767 10.495 1.290 1.00 1.41 O ATOM 0 H ASP A 48 41.207 5.827 0.225 1.00 1.15 H new ATOM 0 HA ASP A 48 43.689 7.370 0.351 1.00 1.15 H new ATOM 0 HB2 ASP A 48 42.322 8.663 -1.232 1.00 1.24 H new ATOM 0 HB3 ASP A 48 40.951 8.611 -0.141 1.00 1.24 H new ATOM 797 N PRO A 49 43.318 7.587 2.819 1.00 1.12 N ATOM 798 CA PRO A 49 43.163 7.593 4.284 1.00 1.13 C ATOM 799 C PRO A 49 42.159 8.635 4.786 1.00 1.17 C ATOM 800 O PRO A 49 41.396 8.373 5.720 1.00 1.18 O ATOM 801 CB PRO A 49 44.568 7.925 4.801 1.00 1.22 C ATOM 802 CG PRO A 49 45.299 8.495 3.635 1.00 1.25 C ATOM 803 CD PRO A 49 44.711 7.842 2.420 1.00 1.19 C ATOM 0 HA PRO A 49 42.772 6.639 4.636 1.00 1.13 H new ATOM 0 HB2 PRO A 49 44.525 8.639 5.624 1.00 1.22 H new ATOM 0 HB3 PRO A 49 45.068 7.033 5.179 1.00 1.22 H new ATOM 0 HG2 PRO A 49 45.181 9.578 3.592 1.00 1.25 H new ATOM 0 HG3 PRO A 49 46.368 8.293 3.708 1.00 1.25 H new ATOM 0 HD2 PRO A 49 44.768 8.491 1.546 1.00 1.19 H new ATOM 0 HD3 PRO A 49 45.233 6.919 2.166 1.00 1.19 H new ATOM 811 N GLN A 50 42.159 9.809 4.163 1.00 1.23 N ATOM 812 CA GLN A 50 41.248 10.882 4.546 1.00 1.30 C ATOM 813 C GLN A 50 39.817 10.511 4.161 1.00 1.21 C ATOM 814 O GLN A 50 38.897 10.589 4.980 1.00 1.22 O ATOM 815 CB GLN A 50 41.661 12.196 3.871 1.00 1.43 C ATOM 816 CG GLN A 50 40.750 13.371 4.184 1.00 1.59 C ATOM 817 CD GLN A 50 40.821 13.792 5.638 1.00 1.77 C ATOM 818 OE1 GLN A 50 40.032 13.344 6.471 1.00 2.00 O ATOM 819 NE2 GLN A 50 41.774 14.647 5.960 1.00 1.96 N ATOM 0 H GLN A 50 42.781 10.042 3.389 1.00 1.23 H new ATOM 0 HA GLN A 50 41.297 11.020 5.626 1.00 1.30 H new ATOM 0 HB2 GLN A 50 42.676 12.446 4.179 1.00 1.43 H new ATOM 0 HB3 GLN A 50 41.683 12.046 2.792 1.00 1.43 H new ATOM 0 HG2 GLN A 50 41.022 14.216 3.551 1.00 1.59 H new ATOM 0 HG3 GLN A 50 39.722 13.105 3.936 1.00 1.59 H new ATOM 0 HE21 GLN A 50 42.409 14.997 5.243 1.00 1.96 H new ATOM 0 HE22 GLN A 50 41.875 14.958 6.926 1.00 1.96 H new ATOM 828 N ALA A 51 39.640 10.086 2.916 1.00 1.16 N ATOM 829 CA ALA A 51 38.329 9.689 2.418 1.00 1.11 C ATOM 830 C ALA A 51 37.821 8.462 3.163 1.00 1.02 C ATOM 831 O ALA A 51 36.621 8.293 3.345 1.00 1.00 O ATOM 832 CB ALA A 51 38.386 9.414 0.925 1.00 1.15 C ATOM 0 H ALA A 51 40.391 10.007 2.230 1.00 1.16 H new ATOM 0 HA ALA A 51 37.635 10.511 2.593 1.00 1.11 H new ATOM 0 HB1 ALA A 51 37.398 9.119 0.571 1.00 1.15 H new ATOM 0 HB2 ALA A 51 38.705 10.315 0.401 1.00 1.15 H new ATOM 0 HB3 ALA A 51 39.096 8.610 0.730 1.00 1.15 H new ATOM 838 N ALA A 52 38.745 7.605 3.585 1.00 1.01 N ATOM 839 CA ALA A 52 38.400 6.393 4.317 1.00 1.01 C ATOM 840 C ALA A 52 37.741 6.726 5.651 1.00 1.04 C ATOM 841 O ALA A 52 36.803 6.057 6.073 1.00 1.05 O ATOM 842 CB ALA A 52 39.636 5.533 4.538 1.00 1.07 C ATOM 0 H ALA A 52 39.746 7.730 3.431 1.00 1.01 H new ATOM 0 HA ALA A 52 37.685 5.831 3.717 1.00 1.01 H new ATOM 0 HB1 ALA A 52 39.359 4.632 5.086 1.00 1.07 H new ATOM 0 HB2 ALA A 52 40.063 5.255 3.574 1.00 1.07 H new ATOM 0 HB3 ALA A 52 40.373 6.095 5.112 1.00 1.07 H new ATOM 848 N GLU A 53 38.235 7.770 6.309 1.00 1.10 N ATOM 849 CA GLU A 53 37.682 8.192 7.591 1.00 1.20 C ATOM 850 C GLU A 53 36.331 8.879 7.389 1.00 1.18 C ATOM 851 O GLU A 53 35.410 8.717 8.191 1.00 1.23 O ATOM 852 CB GLU A 53 38.661 9.125 8.308 1.00 1.32 C ATOM 853 CG GLU A 53 38.197 9.568 9.687 1.00 1.52 C ATOM 854 CD GLU A 53 37.769 8.408 10.566 1.00 1.64 C ATOM 855 OE1 GLU A 53 38.653 7.708 11.101 1.00 1.87 O ATOM 856 OE2 GLU A 53 36.548 8.207 10.741 1.00 1.65 O ATOM 0 H GLU A 53 39.015 8.338 5.977 1.00 1.10 H new ATOM 0 HA GLU A 53 37.527 7.310 8.213 1.00 1.20 H new ATOM 0 HB2 GLU A 53 39.623 8.621 8.404 1.00 1.32 H new ATOM 0 HB3 GLU A 53 38.824 10.008 7.690 1.00 1.32 H new ATOM 0 HG2 GLU A 53 39.003 10.112 10.179 1.00 1.52 H new ATOM 0 HG3 GLU A 53 37.364 10.262 9.579 1.00 1.52 H new ATOM 863 N LYS A 54 36.212 9.636 6.310 1.00 1.14 N ATOM 864 CA LYS A 54 34.969 10.327 6.006 1.00 1.15 C ATOM 865 C LYS A 54 33.871 9.313 5.712 1.00 1.06 C ATOM 866 O LYS A 54 32.739 9.451 6.173 1.00 1.08 O ATOM 867 CB LYS A 54 35.154 11.262 4.810 1.00 1.20 C ATOM 868 CG LYS A 54 36.119 12.412 5.073 1.00 1.43 C ATOM 869 CD LYS A 54 36.477 13.149 3.791 1.00 1.56 C ATOM 870 CE LYS A 54 35.309 13.972 3.270 1.00 1.86 C ATOM 871 NZ LYS A 54 35.275 15.334 3.862 1.00 2.25 N ATOM 0 H LYS A 54 36.959 9.787 5.632 1.00 1.14 H new ATOM 0 HA LYS A 54 34.681 10.925 6.871 1.00 1.15 H new ATOM 0 HB2 LYS A 54 35.516 10.683 3.960 1.00 1.20 H new ATOM 0 HB3 LYS A 54 34.184 11.671 4.527 1.00 1.20 H new ATOM 0 HG2 LYS A 54 35.670 13.109 5.781 1.00 1.43 H new ATOM 0 HG3 LYS A 54 37.027 12.027 5.537 1.00 1.43 H new ATOM 0 HD2 LYS A 54 37.330 13.803 3.973 1.00 1.56 H new ATOM 0 HD3 LYS A 54 36.783 12.430 3.031 1.00 1.56 H new ATOM 0 HE2 LYS A 54 35.377 14.051 2.185 1.00 1.86 H new ATOM 0 HE3 LYS A 54 34.375 13.457 3.494 1.00 1.86 H new ATOM 0 HZ1 LYS A 54 34.463 15.859 3.479 1.00 2.25 H new ATOM 0 HZ2 LYS A 54 35.183 15.261 4.895 1.00 2.25 H new ATOM 0 HZ3 LYS A 54 36.155 15.837 3.627 1.00 2.25 H new ATOM 885 N LEU A 55 34.226 8.279 4.963 1.00 0.98 N ATOM 886 CA LEU A 55 33.283 7.230 4.603 1.00 0.95 C ATOM 887 C LEU A 55 33.027 6.307 5.785 1.00 0.98 C ATOM 888 O LEU A 55 32.012 5.620 5.831 1.00 1.00 O ATOM 889 CB LEU A 55 33.796 6.424 3.408 1.00 0.93 C ATOM 890 CG LEU A 55 33.013 6.626 2.107 1.00 1.05 C ATOM 891 CD1 LEU A 55 31.579 6.139 2.260 1.00 1.34 C ATOM 892 CD2 LEU A 55 33.038 8.089 1.690 1.00 1.22 C ATOM 0 H LEU A 55 35.166 8.144 4.591 1.00 0.98 H new ATOM 0 HA LEU A 55 32.343 7.706 4.323 1.00 0.95 H new ATOM 0 HB2 LEU A 55 34.839 6.688 3.232 1.00 0.93 H new ATOM 0 HB3 LEU A 55 33.775 5.365 3.667 1.00 0.93 H new ATOM 0 HG LEU A 55 33.492 6.036 1.325 1.00 1.05 H new ATOM 0 HD11 LEU A 55 31.041 6.292 1.324 1.00 1.34 H new ATOM 0 HD12 LEU A 55 31.580 5.078 2.509 1.00 1.34 H new ATOM 0 HD13 LEU A 55 31.088 6.698 3.056 1.00 1.34 H new ATOM 0 HD21 LEU A 55 32.477 8.213 0.764 1.00 1.22 H new ATOM 0 HD22 LEU A 55 32.586 8.698 2.473 1.00 1.22 H new ATOM 0 HD23 LEU A 55 34.069 8.405 1.534 1.00 1.22 H new ATOM 904 N ASN A 56 33.952 6.296 6.735 1.00 1.04 N ATOM 905 CA ASN A 56 33.825 5.468 7.930 1.00 1.14 C ATOM 906 C ASN A 56 32.582 5.875 8.713 1.00 1.19 C ATOM 907 O ASN A 56 31.744 5.044 9.061 1.00 1.25 O ATOM 908 CB ASN A 56 35.076 5.611 8.807 1.00 1.25 C ATOM 909 CG ASN A 56 34.902 5.029 10.196 1.00 1.42 C ATOM 910 OD1 ASN A 56 34.338 3.950 10.371 1.00 1.48 O ATOM 911 ND2 ASN A 56 35.386 5.753 11.197 1.00 1.57 N ATOM 0 H ASN A 56 34.805 6.855 6.702 1.00 1.04 H new ATOM 0 HA ASN A 56 33.727 4.425 7.630 1.00 1.14 H new ATOM 0 HB2 ASN A 56 35.914 5.117 8.316 1.00 1.25 H new ATOM 0 HB3 ASN A 56 35.333 6.667 8.892 1.00 1.25 H new ATOM 0 HD21 ASN A 56 35.297 5.420 12.157 1.00 1.57 H new ATOM 0 HD22 ASN A 56 35.847 6.643 11.007 1.00 1.57 H new ATOM 918 N LYS A 57 32.464 7.168 8.967 1.00 1.20 N ATOM 919 CA LYS A 57 31.329 7.707 9.704 1.00 1.28 C ATOM 920 C LYS A 57 30.093 7.804 8.812 1.00 1.22 C ATOM 921 O LYS A 57 28.961 7.687 9.286 1.00 1.27 O ATOM 922 CB LYS A 57 31.672 9.076 10.297 1.00 1.39 C ATOM 923 CG LYS A 57 32.536 9.952 9.401 1.00 1.52 C ATOM 924 CD LYS A 57 32.920 11.244 10.096 1.00 1.63 C ATOM 925 CE LYS A 57 33.927 11.004 11.212 1.00 1.74 C ATOM 926 NZ LYS A 57 35.249 10.553 10.691 1.00 1.86 N ATOM 0 H LYS A 57 33.144 7.869 8.672 1.00 1.20 H new ATOM 0 HA LYS A 57 31.103 7.023 10.522 1.00 1.28 H new ATOM 0 HB2 LYS A 57 30.745 9.605 10.517 1.00 1.39 H new ATOM 0 HB3 LYS A 57 32.188 8.928 11.246 1.00 1.39 H new ATOM 0 HG2 LYS A 57 33.437 9.408 9.117 1.00 1.52 H new ATOM 0 HG3 LYS A 57 31.997 10.178 8.481 1.00 1.52 H new ATOM 0 HD2 LYS A 57 33.341 11.938 9.368 1.00 1.63 H new ATOM 0 HD3 LYS A 57 32.027 11.716 10.506 1.00 1.63 H new ATOM 0 HE2 LYS A 57 34.058 11.922 11.784 1.00 1.74 H new ATOM 0 HE3 LYS A 57 33.534 10.254 11.898 1.00 1.74 H new ATOM 0 HZ1 LYS A 57 35.385 9.546 10.914 1.00 1.86 H new ATOM 0 HZ2 LYS A 57 35.280 10.687 9.660 1.00 1.86 H new ATOM 0 HZ3 LYS A 57 36.006 11.111 11.135 1.00 1.86 H new ATOM 940 N LEU A 58 30.317 8.023 7.520 1.00 1.12 N ATOM 941 CA LEU A 58 29.223 8.132 6.556 1.00 1.10 C ATOM 942 C LEU A 58 28.425 6.830 6.482 1.00 1.08 C ATOM 943 O LEU A 58 27.200 6.837 6.601 1.00 1.11 O ATOM 944 CB LEU A 58 29.773 8.494 5.171 1.00 1.06 C ATOM 945 CG LEU A 58 29.387 9.882 4.646 1.00 1.22 C ATOM 946 CD1 LEU A 58 27.888 9.972 4.416 1.00 1.35 C ATOM 947 CD2 LEU A 58 29.851 10.975 5.603 1.00 1.39 C ATOM 0 H LEU A 58 31.247 8.129 7.114 1.00 1.12 H new ATOM 0 HA LEU A 58 28.552 8.923 6.891 1.00 1.10 H new ATOM 0 HB2 LEU A 58 30.860 8.427 5.203 1.00 1.06 H new ATOM 0 HB3 LEU A 58 29.429 7.746 4.456 1.00 1.06 H new ATOM 0 HG LEU A 58 29.890 10.033 3.691 1.00 1.22 H new ATOM 0 HD11 LEU A 58 27.636 10.965 4.044 1.00 1.35 H new ATOM 0 HD12 LEU A 58 27.587 9.223 3.684 1.00 1.35 H new ATOM 0 HD13 LEU A 58 27.364 9.793 5.355 1.00 1.35 H new ATOM 0 HD21 LEU A 58 29.565 11.950 5.208 1.00 1.39 H new ATOM 0 HD22 LEU A 58 29.385 10.827 6.577 1.00 1.39 H new ATOM 0 HD23 LEU A 58 30.935 10.930 5.709 1.00 1.39 H new ATOM 959 N ILE A 59 29.128 5.717 6.295 1.00 1.07 N ATOM 960 CA ILE A 59 28.490 4.409 6.215 1.00 1.12 C ATOM 961 C ILE A 59 27.840 4.057 7.547 1.00 1.22 C ATOM 962 O ILE A 59 26.789 3.414 7.587 1.00 1.28 O ATOM 963 CB ILE A 59 29.488 3.301 5.787 1.00 1.15 C ATOM 964 CG1 ILE A 59 28.732 2.054 5.317 1.00 1.28 C ATOM 965 CG2 ILE A 59 30.449 2.940 6.915 1.00 1.26 C ATOM 966 CD1 ILE A 59 28.023 2.232 3.991 1.00 1.39 C ATOM 0 H ILE A 59 30.143 5.696 6.196 1.00 1.07 H new ATOM 0 HA ILE A 59 27.720 4.465 5.446 1.00 1.12 H new ATOM 0 HB ILE A 59 30.079 3.694 4.960 1.00 1.15 H new ATOM 0 HG12 ILE A 59 29.434 1.225 5.234 1.00 1.28 H new ATOM 0 HG13 ILE A 59 28.000 1.777 6.075 1.00 1.28 H new ATOM 0 HG21 ILE A 59 31.132 2.161 6.576 1.00 1.26 H new ATOM 0 HG22 ILE A 59 31.020 3.823 7.203 1.00 1.26 H new ATOM 0 HG23 ILE A 59 29.883 2.578 7.773 1.00 1.26 H new ATOM 0 HD11 ILE A 59 27.511 1.307 3.725 1.00 1.39 H new ATOM 0 HD12 ILE A 59 27.295 3.039 4.073 1.00 1.39 H new ATOM 0 HD13 ILE A 59 28.752 2.478 3.219 1.00 1.39 H new ATOM 978 N GLU A 60 28.468 4.493 8.636 1.00 1.27 N ATOM 979 CA GLU A 60 27.945 4.255 9.972 1.00 1.41 C ATOM 980 C GLU A 60 26.554 4.877 10.085 1.00 1.39 C ATOM 981 O GLU A 60 25.607 4.236 10.535 1.00 1.49 O ATOM 982 CB GLU A 60 28.884 4.858 11.018 1.00 1.52 C ATOM 983 CG GLU A 60 28.681 4.315 12.422 1.00 1.73 C ATOM 984 CD GLU A 60 28.223 5.384 13.390 1.00 2.09 C ATOM 985 OE1 GLU A 60 27.006 5.640 13.468 1.00 2.28 O ATOM 986 OE2 GLU A 60 29.079 5.966 14.092 1.00 2.61 O ATOM 0 H GLU A 60 29.344 5.015 8.615 1.00 1.27 H new ATOM 0 HA GLU A 60 27.875 3.182 10.151 1.00 1.41 H new ATOM 0 HB2 GLU A 60 29.915 4.674 10.714 1.00 1.52 H new ATOM 0 HB3 GLU A 60 28.745 5.939 11.035 1.00 1.52 H new ATOM 0 HG2 GLU A 60 27.944 3.512 12.396 1.00 1.73 H new ATOM 0 HG3 GLU A 60 29.614 3.880 12.779 1.00 1.73 H new ATOM 993 N GLY A 61 26.441 6.121 9.625 1.00 1.30 N ATOM 994 CA GLY A 61 25.175 6.829 9.663 1.00 1.30 C ATOM 995 C GLY A 61 24.119 6.175 8.800 1.00 1.26 C ATOM 996 O GLY A 61 22.944 6.175 9.145 1.00 1.27 O ATOM 0 H GLY A 61 27.212 6.654 9.223 1.00 1.30 H new ATOM 0 HA2 GLY A 61 24.820 6.877 10.692 1.00 1.30 H new ATOM 0 HA3 GLY A 61 25.327 7.856 9.330 1.00 1.30 H new ATOM 1000 N TYR A 62 24.541 5.616 7.669 1.00 1.25 N ATOM 1001 CA TYR A 62 23.618 4.944 6.761 1.00 1.31 C ATOM 1002 C TYR A 62 23.124 3.640 7.372 1.00 1.43 C ATOM 1003 O TYR A 62 21.954 3.296 7.249 1.00 1.47 O ATOM 1004 CB TYR A 62 24.293 4.659 5.420 1.00 1.39 C ATOM 1005 CG TYR A 62 24.178 5.790 4.431 1.00 1.59 C ATOM 1006 CD1 TYR A 62 22.957 6.102 3.850 1.00 2.03 C ATOM 1007 CD2 TYR A 62 25.288 6.538 4.071 1.00 2.27 C ATOM 1008 CE1 TYR A 62 22.844 7.135 2.941 1.00 2.60 C ATOM 1009 CE2 TYR A 62 25.186 7.572 3.160 1.00 2.80 C ATOM 1010 CZ TYR A 62 23.963 7.866 2.597 1.00 2.80 C ATOM 1011 OH TYR A 62 23.852 8.897 1.692 1.00 3.54 O ATOM 0 H TYR A 62 25.513 5.615 7.361 1.00 1.25 H new ATOM 0 HA TYR A 62 22.767 5.605 6.595 1.00 1.31 H new ATOM 0 HB2 TYR A 62 25.348 4.445 5.593 1.00 1.39 H new ATOM 0 HB3 TYR A 62 23.853 3.762 4.985 1.00 1.39 H new ATOM 0 HD1 TYR A 62 22.081 5.528 4.113 1.00 2.03 H new ATOM 0 HD2 TYR A 62 26.248 6.309 4.510 1.00 2.27 H new ATOM 0 HE1 TYR A 62 21.886 7.370 2.502 1.00 2.60 H new ATOM 0 HE2 TYR A 62 26.060 8.147 2.891 1.00 2.80 H new ATOM 0 HH TYR A 62 24.730 9.312 1.559 1.00 3.54 H new ATOM 1021 N THR A 63 24.025 2.921 8.036 1.00 1.55 N ATOM 1022 CA THR A 63 23.671 1.660 8.672 1.00 1.74 C ATOM 1023 C THR A 63 22.670 1.906 9.794 1.00 1.68 C ATOM 1024 O THR A 63 21.708 1.159 9.971 1.00 1.81 O ATOM 1025 CB THR A 63 24.911 0.944 9.236 1.00 1.96 C ATOM 1026 OG1 THR A 63 25.946 0.910 8.240 1.00 2.00 O ATOM 1027 CG2 THR A 63 24.573 -0.475 9.669 1.00 2.37 C ATOM 0 H THR A 63 25.002 3.191 8.146 1.00 1.55 H new ATOM 0 HA THR A 63 23.224 1.019 7.912 1.00 1.74 H new ATOM 0 HB THR A 63 25.257 1.497 10.109 1.00 1.96 H new ATOM 0 HG1 THR A 63 26.325 1.807 8.131 1.00 2.00 H new ATOM 0 HG21 THR A 63 25.467 -0.958 10.063 1.00 2.37 H new ATOM 0 HG22 THR A 63 23.805 -0.446 10.442 1.00 2.37 H new ATOM 0 HG23 THR A 63 24.204 -1.039 8.812 1.00 2.37 H new ATOM 1035 N TYR A 64 22.894 2.984 10.529 1.00 1.56 N ATOM 1036 CA TYR A 64 22.025 3.364 11.629 1.00 1.61 C ATOM 1037 C TYR A 64 21.080 4.463 11.177 1.00 1.32 C ATOM 1038 O TYR A 64 20.716 5.348 11.954 1.00 1.40 O ATOM 1039 CB TYR A 64 22.858 3.819 12.832 1.00 1.89 C ATOM 1040 CG TYR A 64 23.693 2.708 13.428 1.00 2.36 C ATOM 1041 CD1 TYR A 64 23.121 1.756 14.262 1.00 2.88 C ATOM 1042 CD2 TYR A 64 25.048 2.602 13.145 1.00 2.94 C ATOM 1043 CE1 TYR A 64 23.877 0.732 14.801 1.00 3.56 C ATOM 1044 CE2 TYR A 64 25.810 1.581 13.676 1.00 3.61 C ATOM 1045 CZ TYR A 64 25.220 0.650 14.503 1.00 3.79 C ATOM 1046 OH TYR A 64 25.975 -0.375 15.029 1.00 4.61 O ATOM 0 H TYR A 64 23.680 3.617 10.380 1.00 1.56 H new ATOM 0 HA TYR A 64 21.434 2.501 11.936 1.00 1.61 H new ATOM 0 HB2 TYR A 64 23.514 4.634 12.525 1.00 1.89 H new ATOM 0 HB3 TYR A 64 22.192 4.216 13.598 1.00 1.89 H new ATOM 0 HD1 TYR A 64 22.068 1.817 14.493 1.00 2.88 H new ATOM 0 HD2 TYR A 64 25.514 3.331 12.498 1.00 2.94 H new ATOM 0 HE1 TYR A 64 23.419 0.001 15.451 1.00 3.56 H new ATOM 0 HE2 TYR A 64 26.863 1.512 13.445 1.00 3.61 H new ATOM 0 HH TYR A 64 26.902 -0.290 14.722 1.00 4.61 H new ATOM 1056 N GLY A 65 20.707 4.404 9.900 1.00 1.16 N ATOM 1057 CA GLY A 65 19.811 5.386 9.331 1.00 1.08 C ATOM 1058 C GLY A 65 18.423 5.301 9.927 1.00 1.03 C ATOM 1059 O GLY A 65 17.591 4.505 9.478 1.00 1.02 O ATOM 0 H GLY A 65 21.016 3.684 9.247 1.00 1.16 H new ATOM 0 HA2 GLY A 65 20.216 6.385 9.496 1.00 1.08 H new ATOM 0 HA3 GLY A 65 19.752 5.240 8.252 1.00 1.08 H new ATOM 1063 N GLU A 66 18.170 6.124 10.939 1.00 1.04 N ATOM 1064 CA GLU A 66 16.883 6.152 11.607 1.00 1.03 C ATOM 1065 C GLU A 66 15.788 6.562 10.632 1.00 0.98 C ATOM 1066 O GLU A 66 14.629 6.176 10.788 1.00 0.98 O ATOM 1067 CB GLU A 66 16.933 7.108 12.800 1.00 1.10 C ATOM 1068 CG GLU A 66 17.781 6.590 13.950 1.00 1.55 C ATOM 1069 CD GLU A 66 17.182 5.362 14.608 1.00 1.48 C ATOM 1070 OE1 GLU A 66 16.010 5.420 15.027 1.00 1.79 O ATOM 1071 OE2 GLU A 66 17.879 4.332 14.718 1.00 1.73 O ATOM 0 H GLU A 66 18.850 6.785 11.314 1.00 1.04 H new ATOM 0 HA GLU A 66 16.653 5.152 11.974 1.00 1.03 H new ATOM 0 HB2 GLU A 66 17.328 8.069 12.470 1.00 1.10 H new ATOM 0 HB3 GLU A 66 15.919 7.286 13.157 1.00 1.10 H new ATOM 0 HG2 GLU A 66 18.779 6.351 13.582 1.00 1.55 H new ATOM 0 HG3 GLU A 66 17.897 7.377 14.695 1.00 1.55 H new ATOM 1078 N GLU A 67 16.159 7.346 9.626 1.00 0.98 N ATOM 1079 CA GLU A 67 15.214 7.780 8.609 1.00 0.98 C ATOM 1080 C GLU A 67 14.806 6.600 7.734 1.00 0.95 C ATOM 1081 O GLU A 67 13.638 6.448 7.386 1.00 0.93 O ATOM 1082 CB GLU A 67 15.813 8.894 7.750 1.00 1.05 C ATOM 1083 CG GLU A 67 16.336 10.064 8.568 1.00 1.33 C ATOM 1084 CD GLU A 67 17.836 10.011 8.762 1.00 1.79 C ATOM 1085 OE1 GLU A 67 18.327 9.007 9.316 1.00 2.37 O ATOM 1086 OE2 GLU A 67 18.523 10.972 8.348 1.00 2.46 O ATOM 0 H GLU A 67 17.109 7.693 9.495 1.00 0.98 H new ATOM 0 HA GLU A 67 14.329 8.173 9.108 1.00 0.98 H new ATOM 0 HB2 GLU A 67 16.627 8.485 7.151 1.00 1.05 H new ATOM 0 HB3 GLU A 67 15.056 9.255 7.054 1.00 1.05 H new ATOM 0 HG2 GLU A 67 16.070 10.998 8.072 1.00 1.33 H new ATOM 0 HG3 GLU A 67 15.847 10.070 9.542 1.00 1.33 H new ATOM 1093 N ARG A 68 15.776 5.751 7.407 1.00 0.97 N ATOM 1094 CA ARG A 68 15.523 4.571 6.586 1.00 0.99 C ATOM 1095 C ARG A 68 14.590 3.622 7.330 1.00 0.96 C ATOM 1096 O ARG A 68 13.726 2.980 6.735 1.00 0.97 O ATOM 1097 CB ARG A 68 16.850 3.872 6.244 1.00 1.06 C ATOM 1098 CG ARG A 68 16.721 2.745 5.225 1.00 1.17 C ATOM 1099 CD ARG A 68 16.670 1.382 5.899 1.00 1.27 C ATOM 1100 NE ARG A 68 16.340 0.314 4.955 1.00 1.43 N ATOM 1101 CZ ARG A 68 15.327 -0.539 5.115 1.00 1.40 C ATOM 1102 NH1 ARG A 68 14.535 -0.447 6.178 1.00 1.41 N ATOM 1103 NH2 ARG A 68 15.103 -1.478 4.204 1.00 1.70 N ATOM 0 H ARG A 68 16.747 5.859 7.699 1.00 0.97 H new ATOM 0 HA ARG A 68 15.046 4.873 5.654 1.00 0.99 H new ATOM 0 HB2 ARG A 68 17.550 4.614 5.861 1.00 1.06 H new ATOM 0 HB3 ARG A 68 17.282 3.470 7.160 1.00 1.06 H new ATOM 0 HG2 ARG A 68 15.818 2.892 4.632 1.00 1.17 H new ATOM 0 HG3 ARG A 68 17.565 2.779 4.536 1.00 1.17 H new ATOM 0 HD2 ARG A 68 17.634 1.171 6.362 1.00 1.27 H new ATOM 0 HD3 ARG A 68 15.929 1.401 6.698 1.00 1.27 H new ATOM 0 HE ARG A 68 16.921 0.216 4.122 1.00 1.43 H new ATOM 0 HH11 ARG A 68 14.700 0.278 6.876 1.00 1.41 H new ATOM 0 HH12 ARG A 68 13.762 -1.102 6.296 1.00 1.41 H new ATOM 0 HH21 ARG A 68 15.705 -1.546 3.383 1.00 1.70 H new ATOM 0 HH22 ARG A 68 14.329 -2.131 4.325 1.00 1.70 H new ATOM 1117 N LYS A 69 14.770 3.557 8.643 1.00 0.95 N ATOM 1118 CA LYS A 69 13.945 2.710 9.494 1.00 0.97 C ATOM 1119 C LYS A 69 12.534 3.284 9.598 1.00 0.91 C ATOM 1120 O LYS A 69 11.554 2.543 9.699 1.00 0.92 O ATOM 1121 CB LYS A 69 14.573 2.585 10.884 1.00 1.04 C ATOM 1122 CG LYS A 69 15.859 1.773 10.898 1.00 1.31 C ATOM 1123 CD LYS A 69 16.666 2.026 12.161 1.00 1.43 C ATOM 1124 CE LYS A 69 15.848 1.778 13.419 1.00 1.48 C ATOM 1125 NZ LYS A 69 16.657 1.967 14.649 1.00 1.54 N ATOM 0 H LYS A 69 15.485 4.085 9.144 1.00 0.95 H new ATOM 0 HA LYS A 69 13.885 1.717 9.049 1.00 0.97 H new ATOM 0 HB2 LYS A 69 14.778 3.583 11.272 1.00 1.04 H new ATOM 0 HB3 LYS A 69 13.853 2.122 11.559 1.00 1.04 H new ATOM 0 HG2 LYS A 69 15.621 0.712 10.824 1.00 1.31 H new ATOM 0 HG3 LYS A 69 16.460 2.027 10.025 1.00 1.31 H new ATOM 0 HD2 LYS A 69 17.544 1.380 12.166 1.00 1.43 H new ATOM 0 HD3 LYS A 69 17.027 3.054 12.160 1.00 1.43 H new ATOM 0 HE2 LYS A 69 14.995 2.456 13.437 1.00 1.48 H new ATOM 0 HE3 LYS A 69 15.449 0.764 13.399 1.00 1.48 H new ATOM 0 HZ1 LYS A 69 16.039 2.276 15.427 1.00 1.54 H new ATOM 0 HZ2 LYS A 69 17.114 1.069 14.906 1.00 1.54 H new ATOM 0 HZ3 LYS A 69 17.385 2.689 14.478 1.00 1.54 H new ATOM 1139 N LEU A 70 12.445 4.610 9.548 1.00 0.90 N ATOM 1140 CA LEU A 70 11.166 5.306 9.620 1.00 0.88 C ATOM 1141 C LEU A 70 10.320 4.993 8.391 1.00 0.85 C ATOM 1142 O LEU A 70 9.131 4.731 8.504 1.00 0.85 O ATOM 1143 CB LEU A 70 11.387 6.819 9.729 1.00 0.93 C ATOM 1144 CG LEU A 70 10.125 7.677 9.605 1.00 1.01 C ATOM 1145 CD1 LEU A 70 9.255 7.548 10.848 1.00 1.14 C ATOM 1146 CD2 LEU A 70 10.491 9.134 9.361 1.00 1.15 C ATOM 0 H LEU A 70 13.252 5.228 9.457 1.00 0.90 H new ATOM 0 HA LEU A 70 10.637 4.961 10.509 1.00 0.88 H new ATOM 0 HB2 LEU A 70 11.858 7.032 10.689 1.00 0.93 H new ATOM 0 HB3 LEU A 70 12.090 7.123 8.954 1.00 0.93 H new ATOM 0 HG LEU A 70 9.553 7.315 8.751 1.00 1.01 H new ATOM 0 HD11 LEU A 70 8.365 8.167 10.735 1.00 1.14 H new ATOM 0 HD12 LEU A 70 8.959 6.507 10.978 1.00 1.14 H new ATOM 0 HD13 LEU A 70 9.817 7.877 11.722 1.00 1.14 H new ATOM 0 HD21 LEU A 70 9.581 9.728 9.276 1.00 1.15 H new ATOM 0 HD22 LEU A 70 11.089 9.503 10.194 1.00 1.15 H new ATOM 0 HD23 LEU A 70 11.065 9.215 8.438 1.00 1.15 H new ATOM 1158 N TYR A 71 10.947 5.014 7.215 1.00 0.84 N ATOM 1159 CA TYR A 71 10.243 4.738 5.966 1.00 0.86 C ATOM 1160 C TYR A 71 9.762 3.293 5.928 1.00 0.85 C ATOM 1161 O TYR A 71 8.697 2.997 5.392 1.00 0.85 O ATOM 1162 CB TYR A 71 11.149 5.045 4.771 1.00 0.91 C ATOM 1163 CG TYR A 71 11.624 6.482 4.729 1.00 0.92 C ATOM 1164 CD1 TYR A 71 10.765 7.528 5.042 1.00 0.94 C ATOM 1165 CD2 TYR A 71 12.935 6.793 4.383 1.00 0.99 C ATOM 1166 CE1 TYR A 71 11.195 8.837 5.011 1.00 1.01 C ATOM 1167 CE2 TYR A 71 13.373 8.106 4.349 1.00 1.05 C ATOM 1168 CZ TYR A 71 12.499 9.123 4.665 1.00 1.05 C ATOM 1169 OH TYR A 71 12.925 10.430 4.632 1.00 1.16 O ATOM 0 H TYR A 71 11.940 5.219 7.103 1.00 0.84 H new ATOM 0 HA TYR A 71 9.367 5.384 5.908 1.00 0.86 H new ATOM 0 HB2 TYR A 71 12.016 4.385 4.803 1.00 0.91 H new ATOM 0 HB3 TYR A 71 10.611 4.821 3.850 1.00 0.91 H new ATOM 0 HD1 TYR A 71 9.743 7.312 5.314 1.00 0.94 H new ATOM 0 HD2 TYR A 71 13.622 5.997 4.137 1.00 0.99 H new ATOM 0 HE1 TYR A 71 10.512 9.637 5.257 1.00 1.01 H new ATOM 0 HE2 TYR A 71 14.393 8.332 4.076 1.00 1.05 H new ATOM 0 HH TYR A 71 12.784 10.797 3.734 1.00 1.16 H new ATOM 1179 N ASP A 72 10.545 2.406 6.525 1.00 0.86 N ATOM 1180 CA ASP A 72 10.210 0.987 6.591 1.00 0.90 C ATOM 1181 C ASP A 72 8.953 0.786 7.438 1.00 0.87 C ATOM 1182 O ASP A 72 7.998 0.122 7.025 1.00 0.87 O ATOM 1183 CB ASP A 72 11.389 0.215 7.199 1.00 0.98 C ATOM 1184 CG ASP A 72 11.306 -1.289 7.003 1.00 1.21 C ATOM 1185 OD1 ASP A 72 10.335 -1.911 7.480 1.00 1.47 O ATOM 1186 OD2 ASP A 72 12.245 -1.861 6.401 1.00 1.48 O ATOM 0 H ASP A 72 11.428 2.646 6.976 1.00 0.86 H new ATOM 0 HA ASP A 72 10.015 0.612 5.586 1.00 0.90 H new ATOM 0 HB2 ASP A 72 12.316 0.579 6.756 1.00 0.98 H new ATOM 0 HB3 ASP A 72 11.440 0.430 8.266 1.00 0.98 H new ATOM 1191 N SER A 73 8.948 1.407 8.614 1.00 0.85 N ATOM 1192 CA SER A 73 7.823 1.313 9.536 1.00 0.85 C ATOM 1193 C SER A 73 6.576 1.984 8.959 1.00 0.81 C ATOM 1194 O SER A 73 5.447 1.636 9.315 1.00 0.80 O ATOM 1195 CB SER A 73 8.195 1.955 10.875 1.00 0.90 C ATOM 1196 OG SER A 73 9.412 1.422 11.381 1.00 0.96 O ATOM 0 H SER A 73 9.718 1.985 8.952 1.00 0.85 H new ATOM 0 HA SER A 73 7.595 0.258 9.691 1.00 0.85 H new ATOM 0 HB2 SER A 73 8.292 3.033 10.750 1.00 0.90 H new ATOM 0 HB3 SER A 73 7.395 1.788 11.596 1.00 0.90 H new ATOM 0 HG SER A 73 10.166 1.788 10.873 1.00 0.96 H new ATOM 1202 N ALA A 74 6.789 2.943 8.068 1.00 0.80 N ATOM 1203 CA ALA A 74 5.695 3.656 7.433 1.00 0.79 C ATOM 1204 C ALA A 74 4.897 2.709 6.549 1.00 0.76 C ATOM 1205 O ALA A 74 3.669 2.777 6.498 1.00 0.75 O ATOM 1206 CB ALA A 74 6.224 4.834 6.630 1.00 0.82 C ATOM 0 H ALA A 74 7.716 3.245 7.769 1.00 0.80 H new ATOM 0 HA ALA A 74 5.032 4.045 8.205 1.00 0.79 H new ATOM 0 HB1 ALA A 74 5.391 5.358 6.161 1.00 0.82 H new ATOM 0 HB2 ALA A 74 6.755 5.517 7.293 1.00 0.82 H new ATOM 0 HB3 ALA A 74 6.906 4.473 5.860 1.00 0.82 H new ATOM 1212 N LEU A 75 5.603 1.812 5.869 1.00 0.77 N ATOM 1213 CA LEU A 75 4.962 0.835 5.002 1.00 0.78 C ATOM 1214 C LEU A 75 4.133 -0.134 5.842 1.00 0.77 C ATOM 1215 O LEU A 75 3.090 -0.619 5.405 1.00 0.77 O ATOM 1216 CB LEU A 75 6.011 0.075 4.181 1.00 0.83 C ATOM 1217 CG LEU A 75 5.711 -0.055 2.682 1.00 0.92 C ATOM 1218 CD1 LEU A 75 4.436 -0.848 2.451 1.00 1.13 C ATOM 1219 CD2 LEU A 75 5.604 1.318 2.035 1.00 1.15 C ATOM 0 H LEU A 75 6.620 1.743 5.903 1.00 0.77 H new ATOM 0 HA LEU A 75 4.302 1.356 4.309 1.00 0.78 H new ATOM 0 HB2 LEU A 75 6.972 0.576 4.299 1.00 0.83 H new ATOM 0 HB3 LEU A 75 6.120 -0.925 4.600 1.00 0.83 H new ATOM 0 HG LEU A 75 6.538 -0.594 2.219 1.00 0.92 H new ATOM 0 HD11 LEU A 75 4.245 -0.926 1.381 1.00 1.13 H new ATOM 0 HD12 LEU A 75 4.547 -1.847 2.874 1.00 1.13 H new ATOM 0 HD13 LEU A 75 3.600 -0.341 2.933 1.00 1.13 H new ATOM 0 HD21 LEU A 75 5.391 1.204 0.972 1.00 1.15 H new ATOM 0 HD22 LEU A 75 4.800 1.881 2.508 1.00 1.15 H new ATOM 0 HD23 LEU A 75 6.545 1.854 2.161 1.00 1.15 H new ATOM 1231 N SER A 76 4.599 -0.398 7.057 1.00 0.78 N ATOM 1232 CA SER A 76 3.899 -1.290 7.970 1.00 0.80 C ATOM 1233 C SER A 76 2.528 -0.719 8.341 1.00 0.76 C ATOM 1234 O SER A 76 1.565 -1.462 8.544 1.00 0.77 O ATOM 1235 CB SER A 76 4.746 -1.516 9.222 1.00 0.85 C ATOM 1236 OG SER A 76 6.117 -1.674 8.883 1.00 0.88 O ATOM 0 H SER A 76 5.462 -0.005 7.433 1.00 0.78 H new ATOM 0 HA SER A 76 3.740 -2.247 7.474 1.00 0.80 H new ATOM 0 HB2 SER A 76 4.630 -0.672 9.902 1.00 0.85 H new ATOM 0 HB3 SER A 76 4.393 -2.402 9.750 1.00 0.85 H new ATOM 0 HG SER A 76 6.641 -1.816 9.699 1.00 0.88 H new ATOM 1242 N LYS A 77 2.445 0.608 8.407 1.00 0.75 N ATOM 1243 CA LYS A 77 1.188 1.281 8.727 1.00 0.74 C ATOM 1244 C LYS A 77 0.194 1.065 7.594 1.00 0.71 C ATOM 1245 O LYS A 77 -1.012 0.966 7.817 1.00 0.70 O ATOM 1246 CB LYS A 77 1.408 2.785 8.955 1.00 0.76 C ATOM 1247 CG LYS A 77 2.209 3.112 10.207 1.00 0.90 C ATOM 1248 CD LYS A 77 2.333 4.618 10.414 1.00 0.98 C ATOM 1249 CE LYS A 77 0.996 5.250 10.778 1.00 1.35 C ATOM 1250 NZ LYS A 77 1.128 6.704 11.081 1.00 1.61 N ATOM 0 H LYS A 77 3.231 1.237 8.244 1.00 0.75 H new ATOM 0 HA LYS A 77 0.791 0.855 9.649 1.00 0.74 H new ATOM 0 HB2 LYS A 77 1.922 3.202 8.089 1.00 0.76 H new ATOM 0 HB3 LYS A 77 0.438 3.278 9.018 1.00 0.76 H new ATOM 0 HG2 LYS A 77 1.728 2.663 11.076 1.00 0.90 H new ATOM 0 HG3 LYS A 77 3.203 2.671 10.130 1.00 0.90 H new ATOM 0 HD2 LYS A 77 3.057 4.818 11.204 1.00 0.98 H new ATOM 0 HD3 LYS A 77 2.718 5.080 9.505 1.00 0.98 H new ATOM 0 HE2 LYS A 77 0.295 5.114 9.955 1.00 1.35 H new ATOM 0 HE3 LYS A 77 0.576 4.736 11.643 1.00 1.35 H new ATOM 0 HZ1 LYS A 77 0.195 7.094 11.324 1.00 1.61 H new ATOM 0 HZ2 LYS A 77 1.777 6.834 11.883 1.00 1.61 H new ATOM 0 HZ3 LYS A 77 1.504 7.200 10.248 1.00 1.61 H new ATOM 1264 N ILE A 78 0.723 0.980 6.379 1.00 0.71 N ATOM 1265 CA ILE A 78 -0.093 0.754 5.193 1.00 0.71 C ATOM 1266 C ILE A 78 -0.711 -0.641 5.244 1.00 0.70 C ATOM 1267 O ILE A 78 -1.900 -0.810 4.973 1.00 0.69 O ATOM 1268 CB ILE A 78 0.737 0.900 3.895 1.00 0.77 C ATOM 1269 CG1 ILE A 78 1.251 2.338 3.745 1.00 1.04 C ATOM 1270 CG2 ILE A 78 -0.085 0.499 2.672 1.00 0.84 C ATOM 1271 CD1 ILE A 78 0.149 3.375 3.711 1.00 1.33 C ATOM 0 H ILE A 78 1.722 1.065 6.189 1.00 0.71 H new ATOM 0 HA ILE A 78 -0.879 1.509 5.183 1.00 0.71 H new ATOM 0 HB ILE A 78 1.593 0.229 3.964 1.00 0.77 H new ATOM 0 HG12 ILE A 78 1.924 2.562 4.572 1.00 1.04 H new ATOM 0 HG13 ILE A 78 1.836 2.412 2.829 1.00 1.04 H new ATOM 0 HG21 ILE A 78 0.522 0.611 1.773 1.00 0.84 H new ATOM 0 HG22 ILE A 78 -0.400 -0.540 2.770 1.00 0.84 H new ATOM 0 HG23 ILE A 78 -0.964 1.139 2.598 1.00 0.84 H new ATOM 0 HD11 ILE A 78 0.587 4.368 3.603 1.00 1.33 H new ATOM 0 HD12 ILE A 78 -0.512 3.176 2.867 1.00 1.33 H new ATOM 0 HD13 ILE A 78 -0.423 3.329 4.638 1.00 1.33 H new ATOM 1283 N GLU A 79 0.105 -1.631 5.618 1.00 0.72 N ATOM 1284 CA GLU A 79 -0.349 -3.016 5.719 1.00 0.74 C ATOM 1285 C GLU A 79 -1.512 -3.119 6.703 1.00 0.73 C ATOM 1286 O GLU A 79 -2.431 -3.918 6.518 1.00 0.74 O ATOM 1287 CB GLU A 79 0.808 -3.920 6.155 1.00 0.79 C ATOM 1288 CG GLU A 79 0.632 -5.377 5.760 1.00 1.00 C ATOM 1289 CD GLU A 79 0.126 -6.246 6.896 1.00 1.32 C ATOM 1290 OE1 GLU A 79 0.381 -5.919 8.074 1.00 1.93 O ATOM 1291 OE2 GLU A 79 -0.520 -7.278 6.615 1.00 1.95 O ATOM 0 H GLU A 79 1.087 -1.495 5.856 1.00 0.72 H new ATOM 0 HA GLU A 79 -0.696 -3.347 4.740 1.00 0.74 H new ATOM 0 HB2 GLU A 79 1.734 -3.545 5.719 1.00 0.79 H new ATOM 0 HB3 GLU A 79 0.917 -3.858 7.238 1.00 0.79 H new ATOM 0 HG2 GLU A 79 -0.066 -5.439 4.925 1.00 1.00 H new ATOM 0 HG3 GLU A 79 1.586 -5.769 5.408 1.00 1.00 H new ATOM 1298 N LYS A 80 -1.466 -2.297 7.745 1.00 0.72 N ATOM 1299 CA LYS A 80 -2.522 -2.273 8.742 1.00 0.73 C ATOM 1300 C LYS A 80 -3.831 -1.829 8.107 1.00 0.72 C ATOM 1301 O LYS A 80 -4.876 -2.438 8.325 1.00 0.75 O ATOM 1302 CB LYS A 80 -2.162 -1.324 9.882 1.00 0.74 C ATOM 1303 CG LYS A 80 -1.184 -1.903 10.891 1.00 0.81 C ATOM 1304 CD LYS A 80 -1.147 -1.077 12.167 1.00 0.96 C ATOM 1305 CE LYS A 80 -2.491 -1.081 12.878 1.00 1.35 C ATOM 1306 NZ LYS A 80 -2.984 -2.464 13.136 1.00 1.71 N ATOM 0 H LYS A 80 -0.706 -1.639 7.919 1.00 0.72 H new ATOM 0 HA LYS A 80 -2.637 -3.280 9.143 1.00 0.73 H new ATOM 0 HB2 LYS A 80 -1.735 -0.414 9.461 1.00 0.74 H new ATOM 0 HB3 LYS A 80 -3.076 -1.037 10.402 1.00 0.74 H new ATOM 0 HG2 LYS A 80 -1.468 -2.928 11.128 1.00 0.81 H new ATOM 0 HG3 LYS A 80 -0.187 -1.942 10.452 1.00 0.81 H new ATOM 0 HD2 LYS A 80 -0.381 -1.472 12.834 1.00 0.96 H new ATOM 0 HD3 LYS A 80 -0.864 -0.052 11.929 1.00 0.96 H new ATOM 0 HE2 LYS A 80 -2.402 -0.546 13.823 1.00 1.35 H new ATOM 0 HE3 LYS A 80 -3.222 -0.543 12.274 1.00 1.35 H new ATOM 0 HZ1 LYS A 80 -3.779 -2.430 13.806 1.00 1.71 H new ATOM 0 HZ2 LYS A 80 -3.302 -2.891 12.243 1.00 1.71 H new ATOM 0 HZ3 LYS A 80 -2.215 -3.037 13.539 1.00 1.71 H new ATOM 1320 N LEU A 81 -3.759 -0.772 7.302 1.00 0.69 N ATOM 1321 CA LEU A 81 -4.934 -0.231 6.623 1.00 0.71 C ATOM 1322 C LEU A 81 -5.586 -1.287 5.745 1.00 0.72 C ATOM 1323 O LEU A 81 -6.809 -1.352 5.643 1.00 0.76 O ATOM 1324 CB LEU A 81 -4.552 0.988 5.776 1.00 0.71 C ATOM 1325 CG LEU A 81 -4.985 2.343 6.345 1.00 0.78 C ATOM 1326 CD1 LEU A 81 -6.504 2.454 6.375 1.00 1.00 C ATOM 1327 CD2 LEU A 81 -4.401 2.553 7.738 1.00 0.94 C ATOM 0 H LEU A 81 -2.894 -0.270 7.103 1.00 0.69 H new ATOM 0 HA LEU A 81 -5.649 0.078 7.385 1.00 0.71 H new ATOM 0 HB2 LEU A 81 -3.470 0.996 5.648 1.00 0.71 H new ATOM 0 HB3 LEU A 81 -4.990 0.872 4.784 1.00 0.71 H new ATOM 0 HG LEU A 81 -4.600 3.126 5.692 1.00 0.78 H new ATOM 0 HD11 LEU A 81 -6.790 3.424 6.782 1.00 1.00 H new ATOM 0 HD12 LEU A 81 -6.896 2.356 5.363 1.00 1.00 H new ATOM 0 HD13 LEU A 81 -6.914 1.662 7.001 1.00 1.00 H new ATOM 0 HD21 LEU A 81 -4.720 3.521 8.124 1.00 0.94 H new ATOM 0 HD22 LEU A 81 -4.752 1.763 8.402 1.00 0.94 H new ATOM 0 HD23 LEU A 81 -3.313 2.525 7.684 1.00 0.94 H new ATOM 1339 N ILE A 82 -4.761 -2.125 5.133 1.00 0.72 N ATOM 1340 CA ILE A 82 -5.254 -3.190 4.269 1.00 0.76 C ATOM 1341 C ILE A 82 -6.146 -4.147 5.059 1.00 0.80 C ATOM 1342 O ILE A 82 -7.273 -4.436 4.657 1.00 0.84 O ATOM 1343 CB ILE A 82 -4.095 -3.986 3.630 1.00 0.75 C ATOM 1344 CG1 ILE A 82 -3.038 -3.023 3.078 1.00 0.74 C ATOM 1345 CG2 ILE A 82 -4.618 -4.904 2.526 1.00 0.80 C ATOM 1346 CD1 ILE A 82 -1.951 -3.692 2.266 1.00 0.77 C ATOM 0 H ILE A 82 -3.745 -2.088 5.219 1.00 0.72 H new ATOM 0 HA ILE A 82 -5.832 -2.720 3.473 1.00 0.76 H new ATOM 0 HB ILE A 82 -3.633 -4.608 4.397 1.00 0.75 H new ATOM 0 HG12 ILE A 82 -3.533 -2.277 2.456 1.00 0.74 H new ATOM 0 HG13 ILE A 82 -2.578 -2.491 3.911 1.00 0.74 H new ATOM 0 HG21 ILE A 82 -3.787 -5.456 2.088 1.00 0.80 H new ATOM 0 HG22 ILE A 82 -5.338 -5.606 2.947 1.00 0.80 H new ATOM 0 HG23 ILE A 82 -5.103 -4.306 1.755 1.00 0.80 H new ATOM 0 HD11 ILE A 82 -1.245 -2.940 1.913 1.00 0.77 H new ATOM 0 HD12 ILE A 82 -1.427 -4.418 2.888 1.00 0.77 H new ATOM 0 HD13 ILE A 82 -2.396 -4.201 1.411 1.00 0.77 H new ATOM 1358 N GLU A 83 -5.639 -4.601 6.200 1.00 0.80 N ATOM 1359 CA GLU A 83 -6.378 -5.518 7.061 1.00 0.86 C ATOM 1360 C GLU A 83 -7.591 -4.822 7.679 1.00 0.85 C ATOM 1361 O GLU A 83 -8.575 -5.464 8.051 1.00 0.90 O ATOM 1362 CB GLU A 83 -5.467 -6.053 8.170 1.00 0.90 C ATOM 1363 CG GLU A 83 -6.106 -7.155 9.006 1.00 1.24 C ATOM 1364 CD GLU A 83 -5.144 -7.794 9.987 1.00 1.70 C ATOM 1365 OE1 GLU A 83 -4.456 -7.054 10.720 1.00 2.18 O ATOM 1366 OE2 GLU A 83 -5.063 -9.042 10.027 1.00 2.36 O ATOM 0 H GLU A 83 -4.716 -4.348 6.551 1.00 0.80 H new ATOM 0 HA GLU A 83 -6.727 -6.351 6.451 1.00 0.86 H new ATOM 0 HB2 GLU A 83 -4.549 -6.434 7.722 1.00 0.90 H new ATOM 0 HB3 GLU A 83 -5.184 -5.229 8.825 1.00 0.90 H new ATOM 0 HG2 GLU A 83 -6.953 -6.742 9.554 1.00 1.24 H new ATOM 0 HG3 GLU A 83 -6.501 -7.923 8.342 1.00 1.24 H new ATOM 1373 N THR A 84 -7.511 -3.507 7.794 1.00 0.82 N ATOM 1374 CA THR A 84 -8.602 -2.735 8.359 1.00 0.84 C ATOM 1375 C THR A 84 -9.743 -2.610 7.349 1.00 0.89 C ATOM 1376 O THR A 84 -10.921 -2.636 7.712 1.00 0.92 O ATOM 1377 CB THR A 84 -8.129 -1.330 8.782 1.00 0.83 C ATOM 1378 OG1 THR A 84 -6.926 -1.436 9.557 1.00 0.84 O ATOM 1379 CG2 THR A 84 -9.195 -0.619 9.600 1.00 0.85 C ATOM 0 H THR A 84 -6.704 -2.954 7.504 1.00 0.82 H new ATOM 0 HA THR A 84 -8.959 -3.261 9.244 1.00 0.84 H new ATOM 0 HB THR A 84 -7.939 -0.749 7.880 1.00 0.83 H new ATOM 0 HG1 THR A 84 -6.191 -1.735 8.981 1.00 0.84 H new ATOM 0 HG21 THR A 84 -8.835 0.370 9.885 1.00 0.85 H new ATOM 0 HG22 THR A 84 -10.103 -0.517 9.005 1.00 0.85 H new ATOM 0 HG23 THR A 84 -9.412 -1.199 10.497 1.00 0.85 H new ATOM 1387 N LEU A 85 -9.382 -2.482 6.078 1.00 0.93 N ATOM 1388 CA LEU A 85 -10.366 -2.351 5.014 1.00 1.01 C ATOM 1389 C LEU A 85 -10.931 -3.712 4.632 1.00 1.08 C ATOM 1390 O LEU A 85 -12.121 -3.850 4.371 1.00 1.17 O ATOM 1391 CB LEU A 85 -9.738 -1.674 3.791 1.00 1.04 C ATOM 1392 CG LEU A 85 -10.717 -0.919 2.894 1.00 1.05 C ATOM 1393 CD1 LEU A 85 -10.284 0.530 2.736 1.00 1.22 C ATOM 1394 CD2 LEU A 85 -10.827 -1.597 1.536 1.00 1.13 C ATOM 0 H LEU A 85 -8.413 -2.466 5.760 1.00 0.93 H new ATOM 0 HA LEU A 85 -11.185 -1.730 5.378 1.00 1.01 H new ATOM 0 HB2 LEU A 85 -8.972 -0.978 4.134 1.00 1.04 H new ATOM 0 HB3 LEU A 85 -9.234 -2.434 3.194 1.00 1.04 H new ATOM 0 HG LEU A 85 -11.700 -0.934 3.365 1.00 1.05 H new ATOM 0 HD11 LEU A 85 -10.992 1.053 2.094 1.00 1.22 H new ATOM 0 HD12 LEU A 85 -10.257 1.010 3.714 1.00 1.22 H new ATOM 0 HD13 LEU A 85 -9.292 0.566 2.287 1.00 1.22 H new ATOM 0 HD21 LEU A 85 -11.529 -1.046 0.910 1.00 1.13 H new ATOM 0 HD22 LEU A 85 -9.848 -1.613 1.057 1.00 1.13 H new ATOM 0 HD23 LEU A 85 -11.183 -2.619 1.667 1.00 1.13 H new ATOM 1406 N SER A 86 -10.069 -4.714 4.586 1.00 1.18 N ATOM 1407 CA SER A 86 -10.483 -6.067 4.243 1.00 1.31 C ATOM 1408 C SER A 86 -9.679 -7.087 5.046 1.00 1.73 C ATOM 1409 O SER A 86 -8.592 -7.493 4.641 1.00 2.31 O ATOM 1410 CB SER A 86 -10.313 -6.305 2.740 1.00 1.71 C ATOM 1411 OG SER A 86 -11.076 -5.371 1.991 1.00 1.97 O ATOM 0 H SER A 86 -9.073 -4.616 4.783 1.00 1.18 H new ATOM 0 HA SER A 86 -11.537 -6.188 4.495 1.00 1.31 H new ATOM 0 HB2 SER A 86 -9.260 -6.220 2.471 1.00 1.71 H new ATOM 0 HB3 SER A 86 -10.625 -7.319 2.490 1.00 1.71 H new ATOM 0 HG SER A 86 -10.952 -5.540 1.034 1.00 1.97 H new ATOM 1914 N LYS B 10 15.852 13.128 0.506 1.00 1.52 N ATOM 1915 CA LYS B 10 15.267 12.619 1.743 1.00 1.44 C ATOM 1916 C LYS B 10 13.943 13.306 2.077 1.00 1.38 C ATOM 1917 O LYS B 10 12.954 12.639 2.376 1.00 1.32 O ATOM 1918 CB LYS B 10 16.252 12.805 2.902 1.00 1.48 C ATOM 1919 CG LYS B 10 15.929 11.963 4.130 1.00 1.54 C ATOM 1920 CD LYS B 10 16.889 12.248 5.276 1.00 1.71 C ATOM 1921 CE LYS B 10 18.321 11.872 4.924 1.00 2.08 C ATOM 1922 NZ LYS B 10 19.247 12.060 6.074 1.00 2.41 N ATOM 0 HA LYS B 10 15.062 11.559 1.596 1.00 1.44 H new ATOM 0 HB2 LYS B 10 17.255 12.555 2.556 1.00 1.48 H new ATOM 0 HB3 LYS B 10 16.266 13.857 3.188 1.00 1.48 H new ATOM 0 HG2 LYS B 10 14.908 12.166 4.452 1.00 1.54 H new ATOM 0 HG3 LYS B 10 15.977 10.906 3.869 1.00 1.54 H new ATOM 0 HD2 LYS B 10 16.844 13.306 5.532 1.00 1.71 H new ATOM 0 HD3 LYS B 10 16.575 11.693 6.160 1.00 1.71 H new ATOM 0 HE2 LYS B 10 18.353 10.832 4.599 1.00 2.08 H new ATOM 0 HE3 LYS B 10 18.659 12.479 4.084 1.00 2.08 H new ATOM 0 HZ1 LYS B 10 20.135 11.550 5.892 1.00 2.41 H new ATOM 0 HZ2 LYS B 10 19.448 13.073 6.196 1.00 2.41 H new ATOM 0 HZ3 LYS B 10 18.806 11.688 6.939 1.00 2.41 H new ATOM 1936 N GLU B 11 13.933 14.636 2.016 1.00 1.42 N ATOM 1937 CA GLU B 11 12.736 15.413 2.325 1.00 1.39 C ATOM 1938 C GLU B 11 11.624 15.137 1.314 1.00 1.36 C ATOM 1939 O GLU B 11 10.446 15.083 1.671 1.00 1.30 O ATOM 1940 CB GLU B 11 13.065 16.910 2.334 1.00 1.47 C ATOM 1941 CG GLU B 11 11.947 17.772 2.898 1.00 1.48 C ATOM 1942 CD GLU B 11 11.725 19.043 2.105 1.00 1.62 C ATOM 1943 OE1 GLU B 11 11.113 18.975 1.020 1.00 1.90 O ATOM 1944 OE2 GLU B 11 12.167 20.120 2.558 1.00 1.72 O ATOM 0 H GLU B 11 14.743 15.199 1.755 1.00 1.42 H new ATOM 0 HA GLU B 11 12.387 15.112 3.313 1.00 1.39 H new ATOM 0 HB2 GLU B 11 13.969 17.072 2.921 1.00 1.47 H new ATOM 0 HB3 GLU B 11 13.284 17.232 1.316 1.00 1.47 H new ATOM 0 HG2 GLU B 11 11.023 17.194 2.915 1.00 1.48 H new ATOM 0 HG3 GLU B 11 12.180 18.030 3.931 1.00 1.48 H new ATOM 1951 N LEU B 12 12.014 14.954 0.059 1.00 1.43 N ATOM 1952 CA LEU B 12 11.067 14.689 -1.016 1.00 1.45 C ATOM 1953 C LEU B 12 10.258 13.428 -0.739 1.00 1.36 C ATOM 1954 O LEU B 12 9.028 13.472 -0.670 1.00 1.32 O ATOM 1955 CB LEU B 12 11.815 14.548 -2.346 1.00 1.57 C ATOM 1956 CG LEU B 12 11.004 13.956 -3.505 1.00 1.73 C ATOM 1957 CD1 LEU B 12 9.966 14.953 -3.998 1.00 1.89 C ATOM 1958 CD2 LEU B 12 11.926 13.536 -4.639 1.00 1.89 C ATOM 0 H LEU B 12 12.988 14.985 -0.241 1.00 1.43 H new ATOM 0 HA LEU B 12 10.375 15.529 -1.075 1.00 1.45 H new ATOM 0 HB2 LEU B 12 12.176 15.532 -2.645 1.00 1.57 H new ATOM 0 HB3 LEU B 12 12.693 13.922 -2.184 1.00 1.57 H new ATOM 0 HG LEU B 12 10.480 13.072 -3.142 1.00 1.73 H new ATOM 0 HD11 LEU B 12 9.401 14.514 -4.820 1.00 1.89 H new ATOM 0 HD12 LEU B 12 9.286 15.203 -3.184 1.00 1.89 H new ATOM 0 HD13 LEU B 12 10.466 15.858 -4.344 1.00 1.89 H new ATOM 0 HD21 LEU B 12 11.334 13.118 -5.453 1.00 1.89 H new ATOM 0 HD22 LEU B 12 12.478 14.404 -5.000 1.00 1.89 H new ATOM 0 HD23 LEU B 12 12.628 12.784 -4.278 1.00 1.89 H new ATOM 1970 N LEU B 13 10.951 12.311 -0.567 1.00 1.35 N ATOM 1971 CA LEU B 13 10.280 11.047 -0.317 1.00 1.30 C ATOM 1972 C LEU B 13 9.603 11.044 1.056 1.00 1.18 C ATOM 1973 O LEU B 13 8.590 10.377 1.249 1.00 1.15 O ATOM 1974 CB LEU B 13 11.260 9.875 -0.458 1.00 1.35 C ATOM 1975 CG LEU B 13 12.089 9.531 0.781 1.00 1.32 C ATOM 1976 CD1 LEU B 13 11.830 8.094 1.201 1.00 1.48 C ATOM 1977 CD2 LEU B 13 13.573 9.738 0.505 1.00 1.50 C ATOM 0 H LEU B 13 11.969 12.256 -0.596 1.00 1.35 H new ATOM 0 HA LEU B 13 9.499 10.923 -1.068 1.00 1.30 H new ATOM 0 HB2 LEU B 13 10.695 8.989 -0.748 1.00 1.35 H new ATOM 0 HB3 LEU B 13 11.945 10.098 -1.276 1.00 1.35 H new ATOM 0 HG LEU B 13 11.792 10.195 1.592 1.00 1.32 H new ATOM 0 HD11 LEU B 13 12.425 7.860 2.084 1.00 1.48 H new ATOM 0 HD12 LEU B 13 10.772 7.968 1.432 1.00 1.48 H new ATOM 0 HD13 LEU B 13 12.106 7.422 0.389 1.00 1.48 H new ATOM 0 HD21 LEU B 13 14.147 9.489 1.397 1.00 1.50 H new ATOM 0 HD22 LEU B 13 13.883 9.094 -0.318 1.00 1.50 H new ATOM 0 HD23 LEU B 13 13.752 10.780 0.238 1.00 1.50 H new ATOM 1989 N LEU B 14 10.159 11.806 1.997 1.00 1.15 N ATOM 1990 CA LEU B 14 9.598 11.899 3.343 1.00 1.07 C ATOM 1991 C LEU B 14 8.167 12.422 3.289 1.00 1.07 C ATOM 1992 O LEU B 14 7.244 11.799 3.817 1.00 1.02 O ATOM 1993 CB LEU B 14 10.444 12.833 4.215 1.00 1.08 C ATOM 1994 CG LEU B 14 9.860 13.148 5.596 1.00 1.04 C ATOM 1995 CD1 LEU B 14 10.133 12.008 6.566 1.00 1.06 C ATOM 1996 CD2 LEU B 14 10.427 14.458 6.122 1.00 1.14 C ATOM 0 H LEU B 14 10.998 12.368 1.851 1.00 1.15 H new ATOM 0 HA LEU B 14 9.601 10.900 3.779 1.00 1.07 H new ATOM 0 HB2 LEU B 14 11.429 12.385 4.349 1.00 1.08 H new ATOM 0 HB3 LEU B 14 10.590 13.770 3.678 1.00 1.08 H new ATOM 0 HG LEU B 14 8.780 13.256 5.501 1.00 1.04 H new ATOM 0 HD11 LEU B 14 9.710 12.251 7.541 1.00 1.06 H new ATOM 0 HD12 LEU B 14 9.676 11.093 6.190 1.00 1.06 H new ATOM 0 HD13 LEU B 14 11.209 11.862 6.663 1.00 1.06 H new ATOM 0 HD21 LEU B 14 10.004 14.670 7.104 1.00 1.14 H new ATOM 0 HD22 LEU B 14 11.511 14.378 6.204 1.00 1.14 H new ATOM 0 HD23 LEU B 14 10.173 15.266 5.436 1.00 1.14 H new ATOM 2008 N LYS B 15 7.990 13.556 2.622 1.00 1.15 N ATOM 2009 CA LYS B 15 6.679 14.176 2.494 1.00 1.18 C ATOM 2010 C LYS B 15 5.736 13.309 1.664 1.00 1.13 C ATOM 2011 O LYS B 15 4.530 13.273 1.913 1.00 1.11 O ATOM 2012 CB LYS B 15 6.813 15.562 1.863 1.00 1.32 C ATOM 2013 CG LYS B 15 7.103 16.663 2.871 1.00 1.46 C ATOM 2014 CD LYS B 15 8.133 17.652 2.349 1.00 1.55 C ATOM 2015 CE LYS B 15 7.713 18.262 1.024 1.00 1.76 C ATOM 2016 NZ LYS B 15 8.508 19.472 0.700 1.00 1.80 N ATOM 0 H LYS B 15 8.743 14.066 2.160 1.00 1.15 H new ATOM 0 HA LYS B 15 6.253 14.276 3.492 1.00 1.18 H new ATOM 0 HB2 LYS B 15 7.612 15.539 1.122 1.00 1.32 H new ATOM 0 HB3 LYS B 15 5.892 15.801 1.331 1.00 1.32 H new ATOM 0 HG2 LYS B 15 6.179 17.191 3.107 1.00 1.46 H new ATOM 0 HG3 LYS B 15 7.463 16.220 3.799 1.00 1.46 H new ATOM 0 HD2 LYS B 15 8.280 18.444 3.083 1.00 1.55 H new ATOM 0 HD3 LYS B 15 9.092 17.148 2.229 1.00 1.55 H new ATOM 0 HE2 LYS B 15 7.832 17.525 0.230 1.00 1.76 H new ATOM 0 HE3 LYS B 15 6.655 18.521 1.062 1.00 1.76 H new ATOM 0 HZ1 LYS B 15 8.632 19.540 -0.330 1.00 1.80 H new ATOM 0 HZ2 LYS B 15 8.010 20.317 1.045 1.00 1.80 H new ATOM 0 HZ3 LYS B 15 9.440 19.408 1.158 1.00 1.80 H new ATOM 2030 N LYS B 16 6.289 12.612 0.683 1.00 1.14 N ATOM 2031 CA LYS B 16 5.490 11.755 -0.180 1.00 1.14 C ATOM 2032 C LYS B 16 4.896 10.592 0.605 1.00 1.03 C ATOM 2033 O LYS B 16 3.737 10.233 0.409 1.00 1.01 O ATOM 2034 CB LYS B 16 6.323 11.224 -1.352 1.00 1.22 C ATOM 2035 CG LYS B 16 6.732 12.290 -2.364 1.00 1.31 C ATOM 2036 CD LYS B 16 5.534 13.059 -2.912 1.00 1.30 C ATOM 2037 CE LYS B 16 4.476 12.126 -3.484 1.00 1.45 C ATOM 2038 NZ LYS B 16 3.432 12.866 -4.237 1.00 1.65 N ATOM 0 H LYS B 16 7.285 12.623 0.465 1.00 1.14 H new ATOM 0 HA LYS B 16 4.675 12.359 -0.579 1.00 1.14 H new ATOM 0 HB2 LYS B 16 7.222 10.749 -0.958 1.00 1.22 H new ATOM 0 HB3 LYS B 16 5.753 10.450 -1.867 1.00 1.22 H new ATOM 0 HG2 LYS B 16 7.424 12.988 -1.893 1.00 1.31 H new ATOM 0 HG3 LYS B 16 7.266 11.819 -3.189 1.00 1.31 H new ATOM 0 HD2 LYS B 16 5.095 13.662 -2.117 1.00 1.30 H new ATOM 0 HD3 LYS B 16 5.868 13.748 -3.688 1.00 1.30 H new ATOM 0 HE2 LYS B 16 4.951 11.399 -4.142 1.00 1.45 H new ATOM 0 HE3 LYS B 16 4.010 11.566 -2.673 1.00 1.45 H new ATOM 0 HZ1 LYS B 16 2.731 12.194 -4.610 1.00 1.65 H new ATOM 0 HZ2 LYS B 16 2.960 13.542 -3.603 1.00 1.65 H new ATOM 0 HZ3 LYS B 16 3.872 13.381 -5.026 1.00 1.65 H new ATOM 2052 N ILE B 17 5.686 10.015 1.501 1.00 0.98 N ATOM 2053 CA ILE B 17 5.229 8.887 2.302 1.00 0.92 C ATOM 2054 C ILE B 17 4.324 9.350 3.447 1.00 0.89 C ATOM 2055 O ILE B 17 3.331 8.693 3.762 1.00 0.86 O ATOM 2056 CB ILE B 17 6.412 8.068 2.866 1.00 0.94 C ATOM 2057 CG1 ILE B 17 7.299 7.570 1.719 1.00 1.00 C ATOM 2058 CG2 ILE B 17 5.903 6.893 3.691 1.00 1.00 C ATOM 2059 CD1 ILE B 17 8.452 6.697 2.168 1.00 0.96 C ATOM 0 H ILE B 17 6.644 10.309 1.691 1.00 0.98 H new ATOM 0 HA ILE B 17 4.653 8.242 1.638 1.00 0.92 H new ATOM 0 HB ILE B 17 7.005 8.712 3.516 1.00 0.94 H new ATOM 0 HG12 ILE B 17 6.684 7.009 1.015 1.00 1.00 H new ATOM 0 HG13 ILE B 17 7.696 8.430 1.180 1.00 1.00 H new ATOM 0 HG21 ILE B 17 6.750 6.328 4.080 1.00 1.00 H new ATOM 0 HG22 ILE B 17 5.302 7.264 4.521 1.00 1.00 H new ATOM 0 HG23 ILE B 17 5.292 6.245 3.063 1.00 1.00 H new ATOM 0 HD11 ILE B 17 9.032 6.385 1.299 1.00 0.96 H new ATOM 0 HD12 ILE B 17 9.091 7.260 2.848 1.00 0.96 H new ATOM 0 HD13 ILE B 17 8.064 5.817 2.680 1.00 0.96 H new ATOM 2071 N ASP B 18 4.656 10.486 4.055 1.00 0.94 N ATOM 2072 CA ASP B 18 3.857 11.019 5.159 1.00 0.99 C ATOM 2073 C ASP B 18 2.417 11.273 4.722 1.00 0.96 C ATOM 2074 O ASP B 18 1.468 10.802 5.350 1.00 0.94 O ATOM 2075 CB ASP B 18 4.474 12.313 5.695 1.00 1.14 C ATOM 2076 CG ASP B 18 3.566 13.022 6.680 1.00 1.29 C ATOM 2077 OD1 ASP B 18 3.188 12.405 7.702 1.00 1.88 O ATOM 2078 OD2 ASP B 18 3.234 14.203 6.445 1.00 1.59 O ATOM 0 H ASP B 18 5.466 11.053 3.806 1.00 0.94 H new ATOM 0 HA ASP B 18 3.851 10.273 5.954 1.00 0.99 H new ATOM 0 HB2 ASP B 18 5.424 12.086 6.179 1.00 1.14 H new ATOM 0 HB3 ASP B 18 4.693 12.980 4.861 1.00 1.14 H new ATOM 2083 N SER B 19 2.270 11.996 3.622 1.00 0.98 N ATOM 2084 CA SER B 19 0.958 12.318 3.082 1.00 0.99 C ATOM 2085 C SER B 19 0.283 11.073 2.511 1.00 0.91 C ATOM 2086 O SER B 19 -0.944 10.997 2.450 1.00 0.90 O ATOM 2087 CB SER B 19 1.082 13.384 1.999 1.00 1.10 C ATOM 2088 OG SER B 19 1.828 14.503 2.459 1.00 1.21 O ATOM 0 H SER B 19 3.049 12.373 3.083 1.00 0.98 H new ATOM 0 HA SER B 19 0.341 12.703 3.894 1.00 0.99 H new ATOM 0 HB2 SER B 19 1.566 12.958 1.120 1.00 1.10 H new ATOM 0 HB3 SER B 19 0.088 13.709 1.690 1.00 1.10 H new ATOM 0 HG SER B 19 2.786 14.310 2.386 1.00 1.21 H new ATOM 2094 N LEU B 20 1.099 10.124 2.062 1.00 0.87 N ATOM 2095 CA LEU B 20 0.609 8.876 1.488 1.00 0.84 C ATOM 2096 C LEU B 20 -0.319 8.155 2.464 1.00 0.80 C ATOM 2097 O LEU B 20 -1.454 7.821 2.127 1.00 0.79 O ATOM 2098 CB LEU B 20 1.801 7.981 1.133 1.00 0.86 C ATOM 2099 CG LEU B 20 1.483 6.725 0.330 1.00 0.91 C ATOM 2100 CD1 LEU B 20 1.988 6.888 -1.090 1.00 1.07 C ATOM 2101 CD2 LEU B 20 2.099 5.508 0.998 1.00 1.35 C ATOM 0 H LEU B 20 2.116 10.198 2.086 1.00 0.87 H new ATOM 0 HA LEU B 20 0.039 9.102 0.587 1.00 0.84 H new ATOM 0 HB2 LEU B 20 2.520 8.575 0.569 1.00 0.86 H new ATOM 0 HB3 LEU B 20 2.292 7.681 2.059 1.00 0.86 H new ATOM 0 HG LEU B 20 0.404 6.577 0.296 1.00 0.91 H new ATOM 0 HD11 LEU B 20 1.760 5.989 -1.663 1.00 1.07 H new ATOM 0 HD12 LEU B 20 1.501 7.746 -1.553 1.00 1.07 H new ATOM 0 HD13 LEU B 20 3.066 7.046 -1.077 1.00 1.07 H new ATOM 0 HD21 LEU B 20 1.866 4.616 0.416 1.00 1.35 H new ATOM 0 HD22 LEU B 20 3.180 5.632 1.054 1.00 1.35 H new ATOM 0 HD23 LEU B 20 1.694 5.401 2.004 1.00 1.35 H new ATOM 2113 N ILE B 21 0.158 7.957 3.688 1.00 0.81 N ATOM 2114 CA ILE B 21 -0.623 7.279 4.714 1.00 0.82 C ATOM 2115 C ILE B 21 -1.835 8.116 5.111 1.00 0.81 C ATOM 2116 O ILE B 21 -2.926 7.589 5.322 1.00 0.81 O ATOM 2117 CB ILE B 21 0.229 6.993 5.968 1.00 0.88 C ATOM 2118 CG1 ILE B 21 1.576 6.375 5.569 1.00 1.19 C ATOM 2119 CG2 ILE B 21 -0.525 6.069 6.916 1.00 1.21 C ATOM 2120 CD1 ILE B 21 2.564 6.280 6.710 1.00 1.38 C ATOM 0 H ILE B 21 1.084 8.257 3.993 1.00 0.81 H new ATOM 0 HA ILE B 21 -0.959 6.332 4.292 1.00 0.82 H new ATOM 0 HB ILE B 21 0.423 7.934 6.483 1.00 0.88 H new ATOM 0 HG12 ILE B 21 1.403 5.377 5.166 1.00 1.19 H new ATOM 0 HG13 ILE B 21 2.015 6.970 4.768 1.00 1.19 H new ATOM 0 HG21 ILE B 21 0.086 5.874 7.797 1.00 1.21 H new ATOM 0 HG22 ILE B 21 -1.459 6.542 7.219 1.00 1.21 H new ATOM 0 HG23 ILE B 21 -0.743 5.128 6.411 1.00 1.21 H new ATOM 0 HD11 ILE B 21 3.492 5.834 6.352 1.00 1.38 H new ATOM 0 HD12 ILE B 21 2.768 7.278 7.099 1.00 1.38 H new ATOM 0 HD13 ILE B 21 2.146 5.660 7.503 1.00 1.38 H new ATOM 2132 N GLU B 22 -1.630 9.423 5.186 1.00 0.83 N ATOM 2133 CA GLU B 22 -2.688 10.356 5.558 1.00 0.86 C ATOM 2134 C GLU B 22 -3.873 10.271 4.600 1.00 0.83 C ATOM 2135 O GLU B 22 -5.028 10.237 5.030 1.00 0.84 O ATOM 2136 CB GLU B 22 -2.141 11.778 5.571 1.00 0.94 C ATOM 2137 CG GLU B 22 -1.169 12.043 6.706 1.00 1.11 C ATOM 2138 CD GLU B 22 -1.854 12.081 8.051 1.00 1.55 C ATOM 2139 OE1 GLU B 22 -2.406 13.148 8.402 1.00 1.98 O ATOM 2140 OE2 GLU B 22 -1.851 11.054 8.758 1.00 1.95 O ATOM 0 H GLU B 22 -0.732 9.866 4.992 1.00 0.83 H new ATOM 0 HA GLU B 22 -3.039 10.085 6.554 1.00 0.86 H new ATOM 0 HB2 GLU B 22 -1.642 11.975 4.622 1.00 0.94 H new ATOM 0 HB3 GLU B 22 -2.973 12.478 5.645 1.00 0.94 H new ATOM 0 HG2 GLU B 22 -0.402 11.268 6.713 1.00 1.11 H new ATOM 0 HG3 GLU B 22 -0.661 12.992 6.532 1.00 1.11 H new ATOM 2147 N ALA B 23 -3.577 10.230 3.305 1.00 0.82 N ATOM 2148 CA ALA B 23 -4.609 10.158 2.280 1.00 0.83 C ATOM 2149 C ALA B 23 -5.407 8.859 2.387 1.00 0.79 C ATOM 2150 O ALA B 23 -6.640 8.874 2.382 1.00 0.80 O ATOM 2151 CB ALA B 23 -3.990 10.287 0.897 1.00 0.86 C ATOM 0 H ALA B 23 -2.625 10.246 2.940 1.00 0.82 H new ATOM 0 HA ALA B 23 -5.298 10.988 2.437 1.00 0.83 H new ATOM 0 HB1 ALA B 23 -4.773 10.231 0.141 1.00 0.86 H new ATOM 0 HB2 ALA B 23 -3.475 11.245 0.817 1.00 0.86 H new ATOM 0 HB3 ALA B 23 -3.277 9.478 0.741 1.00 0.86 H new ATOM 2157 N ILE B 24 -4.695 7.743 2.510 1.00 0.78 N ATOM 2158 CA ILE B 24 -5.326 6.429 2.605 1.00 0.78 C ATOM 2159 C ILE B 24 -6.187 6.315 3.863 1.00 0.74 C ATOM 2160 O ILE B 24 -7.304 5.780 3.821 1.00 0.74 O ATOM 2161 CB ILE B 24 -4.270 5.304 2.590 1.00 0.83 C ATOM 2162 CG1 ILE B 24 -3.397 5.430 1.333 1.00 0.99 C ATOM 2163 CG2 ILE B 24 -4.942 3.935 2.643 1.00 1.03 C ATOM 2164 CD1 ILE B 24 -2.156 4.566 1.359 1.00 0.89 C ATOM 0 H ILE B 24 -3.676 7.722 2.546 1.00 0.78 H new ATOM 0 HA ILE B 24 -5.971 6.317 1.733 1.00 0.78 H new ATOM 0 HB ILE B 24 -3.637 5.402 3.472 1.00 0.83 H new ATOM 0 HG12 ILE B 24 -3.994 5.165 0.460 1.00 0.99 H new ATOM 0 HG13 ILE B 24 -3.100 6.472 1.212 1.00 0.99 H new ATOM 0 HG21 ILE B 24 -4.181 3.155 2.632 1.00 1.03 H new ATOM 0 HG22 ILE B 24 -5.531 3.854 3.557 1.00 1.03 H new ATOM 0 HG23 ILE B 24 -5.595 3.817 1.779 1.00 1.03 H new ATOM 0 HD11 ILE B 24 -1.592 4.711 0.437 1.00 0.89 H new ATOM 0 HD12 ILE B 24 -1.536 4.845 2.211 1.00 0.89 H new ATOM 0 HD13 ILE B 24 -2.444 3.518 1.448 1.00 0.89 H new ATOM 2176 N LYS B 25 -5.674 6.836 4.973 1.00 0.74 N ATOM 2177 CA LYS B 25 -6.396 6.803 6.238 1.00 0.75 C ATOM 2178 C LYS B 25 -7.686 7.608 6.132 1.00 0.78 C ATOM 2179 O LYS B 25 -8.685 7.293 6.776 1.00 0.80 O ATOM 2180 CB LYS B 25 -5.521 7.348 7.371 1.00 0.79 C ATOM 2181 CG LYS B 25 -6.090 7.075 8.754 1.00 0.88 C ATOM 2182 CD LYS B 25 -6.006 5.600 9.111 1.00 1.17 C ATOM 2183 CE LYS B 25 -7.073 5.201 10.120 1.00 1.48 C ATOM 2184 NZ LYS B 25 -6.834 5.798 11.461 1.00 1.72 N ATOM 0 H LYS B 25 -4.760 7.286 5.021 1.00 0.74 H new ATOM 0 HA LYS B 25 -6.648 5.767 6.464 1.00 0.75 H new ATOM 0 HB2 LYS B 25 -4.528 6.904 7.300 1.00 0.79 H new ATOM 0 HB3 LYS B 25 -5.399 8.423 7.242 1.00 0.79 H new ATOM 0 HG2 LYS B 25 -5.546 7.661 9.494 1.00 0.88 H new ATOM 0 HG3 LYS B 25 -7.130 7.401 8.791 1.00 0.88 H new ATOM 0 HD2 LYS B 25 -6.118 5.000 8.208 1.00 1.17 H new ATOM 0 HD3 LYS B 25 -5.019 5.380 9.519 1.00 1.17 H new ATOM 0 HE2 LYS B 25 -8.051 5.514 9.754 1.00 1.48 H new ATOM 0 HE3 LYS B 25 -7.099 4.115 10.208 1.00 1.48 H new ATOM 0 HZ1 LYS B 25 -7.586 5.498 12.114 1.00 1.72 H new ATOM 0 HZ2 LYS B 25 -5.913 5.479 11.824 1.00 1.72 H new ATOM 0 HZ3 LYS B 25 -6.836 6.835 11.385 1.00 1.72 H new ATOM 2198 N LYS B 26 -7.659 8.648 5.316 1.00 0.80 N ATOM 2199 CA LYS B 26 -8.829 9.487 5.120 1.00 0.85 C ATOM 2200 C LYS B 26 -9.881 8.755 4.289 1.00 0.83 C ATOM 2201 O LYS B 26 -11.075 8.865 4.555 1.00 0.86 O ATOM 2202 CB LYS B 26 -8.440 10.800 4.433 1.00 0.91 C ATOM 2203 CG LYS B 26 -8.810 12.045 5.225 1.00 1.01 C ATOM 2204 CD LYS B 26 -10.317 12.208 5.323 1.00 1.13 C ATOM 2205 CE LYS B 26 -10.703 13.223 6.385 1.00 1.38 C ATOM 2206 NZ LYS B 26 -12.167 13.487 6.396 1.00 1.39 N ATOM 0 H LYS B 26 -6.840 8.932 4.779 1.00 0.80 H new ATOM 0 HA LYS B 26 -9.252 9.715 6.099 1.00 0.85 H new ATOM 0 HB2 LYS B 26 -7.365 10.801 4.256 1.00 0.91 H new ATOM 0 HB3 LYS B 26 -8.924 10.845 3.457 1.00 0.91 H new ATOM 0 HG2 LYS B 26 -8.383 11.982 6.226 1.00 1.01 H new ATOM 0 HG3 LYS B 26 -8.377 12.924 4.748 1.00 1.01 H new ATOM 0 HD2 LYS B 26 -10.713 12.523 4.357 1.00 1.13 H new ATOM 0 HD3 LYS B 26 -10.773 11.246 5.556 1.00 1.13 H new ATOM 0 HE2 LYS B 26 -10.393 12.859 7.364 1.00 1.38 H new ATOM 0 HE3 LYS B 26 -10.168 14.156 6.207 1.00 1.38 H new ATOM 0 HZ1 LYS B 26 -12.450 13.835 7.334 1.00 1.39 H new ATOM 0 HZ2 LYS B 26 -12.396 14.203 5.678 1.00 1.39 H new ATOM 0 HZ3 LYS B 26 -12.680 12.608 6.184 1.00 1.39 H new ATOM 2220 N ILE B 27 -9.423 7.991 3.300 1.00 0.80 N ATOM 2221 CA ILE B 27 -10.318 7.241 2.413 1.00 0.81 C ATOM 2222 C ILE B 27 -11.255 6.320 3.197 1.00 0.80 C ATOM 2223 O ILE B 27 -12.473 6.344 3.000 1.00 0.82 O ATOM 2224 CB ILE B 27 -9.515 6.398 1.390 1.00 0.81 C ATOM 2225 CG1 ILE B 27 -8.665 7.303 0.485 1.00 0.79 C ATOM 2226 CG2 ILE B 27 -10.452 5.540 0.551 1.00 0.90 C ATOM 2227 CD1 ILE B 27 -7.800 6.543 -0.503 1.00 1.04 C ATOM 0 H ILE B 27 -8.432 7.873 3.090 1.00 0.80 H new ATOM 0 HA ILE B 27 -10.918 7.979 1.881 1.00 0.81 H new ATOM 0 HB ILE B 27 -8.845 5.741 1.944 1.00 0.81 H new ATOM 0 HG12 ILE B 27 -9.325 7.974 -0.065 1.00 0.79 H new ATOM 0 HG13 ILE B 27 -8.025 7.927 1.109 1.00 0.79 H new ATOM 0 HG21 ILE B 27 -9.870 4.955 -0.161 1.00 0.90 H new ATOM 0 HG22 ILE B 27 -11.010 4.867 1.202 1.00 0.90 H new ATOM 0 HG23 ILE B 27 -11.148 6.182 0.011 1.00 0.90 H new ATOM 0 HD11 ILE B 27 -7.230 7.250 -1.106 1.00 1.04 H new ATOM 0 HD12 ILE B 27 -7.114 5.893 0.039 1.00 1.04 H new ATOM 0 HD13 ILE B 27 -8.434 5.940 -1.153 1.00 1.04 H new ATOM 2239 N ILE B 28 -10.684 5.521 4.089 1.00 0.78 N ATOM 2240 CA ILE B 28 -11.471 4.591 4.892 1.00 0.78 C ATOM 2241 C ILE B 28 -12.498 5.325 5.760 1.00 0.81 C ATOM 2242 O ILE B 28 -13.601 4.824 5.991 1.00 0.84 O ATOM 2243 CB ILE B 28 -10.576 3.678 5.766 1.00 0.77 C ATOM 2244 CG1 ILE B 28 -11.354 2.431 6.191 1.00 0.80 C ATOM 2245 CG2 ILE B 28 -10.035 4.419 6.982 1.00 0.82 C ATOM 2246 CD1 ILE B 28 -10.485 1.349 6.797 1.00 0.97 C ATOM 0 H ILE B 28 -9.681 5.497 4.275 1.00 0.78 H new ATOM 0 HA ILE B 28 -12.011 3.955 4.191 1.00 0.78 H new ATOM 0 HB ILE B 28 -9.719 3.372 5.166 1.00 0.77 H new ATOM 0 HG12 ILE B 28 -12.118 2.719 6.914 1.00 0.80 H new ATOM 0 HG13 ILE B 28 -11.873 2.024 5.323 1.00 0.80 H new ATOM 0 HG21 ILE B 28 -9.412 3.746 7.571 1.00 0.82 H new ATOM 0 HG22 ILE B 28 -9.439 5.271 6.654 1.00 0.82 H new ATOM 0 HG23 ILE B 28 -10.866 4.771 7.593 1.00 0.82 H new ATOM 0 HD11 ILE B 28 -11.105 0.497 7.074 1.00 0.97 H new ATOM 0 HD12 ILE B 28 -9.738 1.033 6.069 1.00 0.97 H new ATOM 0 HD13 ILE B 28 -9.986 1.738 7.684 1.00 0.97 H new ATOM 2258 N ALA B 29 -12.141 6.517 6.219 1.00 0.82 N ATOM 2259 CA ALA B 29 -13.029 7.305 7.058 1.00 0.87 C ATOM 2260 C ALA B 29 -14.205 7.845 6.251 1.00 0.90 C ATOM 2261 O ALA B 29 -15.355 7.769 6.687 1.00 0.93 O ATOM 2262 CB ALA B 29 -12.254 8.440 7.708 1.00 0.90 C ATOM 0 H ALA B 29 -11.242 6.958 6.024 1.00 0.82 H new ATOM 0 HA ALA B 29 -13.432 6.661 7.840 1.00 0.87 H new ATOM 0 HB1 ALA B 29 -12.925 9.027 8.335 1.00 0.90 H new ATOM 0 HB2 ALA B 29 -11.452 8.029 8.321 1.00 0.90 H new ATOM 0 HB3 ALA B 29 -11.829 9.080 6.935 1.00 0.90 H new ATOM 2268 N GLU B 30 -13.907 8.372 5.068 1.00 0.91 N ATOM 2269 CA GLU B 30 -14.928 8.931 4.189 1.00 0.95 C ATOM 2270 C GLU B 30 -15.921 7.858 3.749 1.00 0.95 C ATOM 2271 O GLU B 30 -17.131 8.086 3.749 1.00 0.96 O ATOM 2272 CB GLU B 30 -14.287 9.561 2.949 1.00 1.00 C ATOM 2273 CG GLU B 30 -13.215 10.590 3.261 1.00 1.02 C ATOM 2274 CD GLU B 30 -13.751 11.810 3.980 1.00 1.13 C ATOM 2275 OE1 GLU B 30 -13.803 11.804 5.227 1.00 1.18 O ATOM 2276 OE2 GLU B 30 -14.093 12.799 3.302 1.00 1.38 O ATOM 0 H GLU B 30 -12.960 8.424 4.694 1.00 0.91 H new ATOM 0 HA GLU B 30 -15.460 9.698 4.752 1.00 0.95 H new ATOM 0 HB2 GLU B 30 -13.851 8.771 2.338 1.00 1.00 H new ATOM 0 HB3 GLU B 30 -15.066 10.033 2.351 1.00 1.00 H new ATOM 0 HG2 GLU B 30 -12.442 10.126 3.873 1.00 1.02 H new ATOM 0 HG3 GLU B 30 -12.740 10.904 2.331 1.00 1.02 H new ATOM 2283 N PHE B 31 -15.400 6.686 3.387 1.00 0.96 N ATOM 2284 CA PHE B 31 -16.234 5.574 2.936 1.00 0.99 C ATOM 2285 C PHE B 31 -17.281 5.203 3.981 1.00 0.97 C ATOM 2286 O PHE B 31 -18.441 4.956 3.647 1.00 1.01 O ATOM 2287 CB PHE B 31 -15.368 4.353 2.608 1.00 1.01 C ATOM 2288 CG PHE B 31 -14.828 4.346 1.202 1.00 1.04 C ATOM 2289 CD1 PHE B 31 -14.436 5.525 0.583 1.00 1.68 C ATOM 2290 CD2 PHE B 31 -14.721 3.157 0.498 1.00 1.50 C ATOM 2291 CE1 PHE B 31 -13.943 5.517 -0.708 1.00 1.83 C ATOM 2292 CE2 PHE B 31 -14.227 3.144 -0.792 1.00 1.59 C ATOM 2293 CZ PHE B 31 -13.842 4.324 -1.398 1.00 1.37 C ATOM 0 H PHE B 31 -14.401 6.482 3.398 1.00 0.96 H new ATOM 0 HA PHE B 31 -16.754 5.897 2.034 1.00 0.99 H new ATOM 0 HB2 PHE B 31 -14.533 4.314 3.307 1.00 1.01 H new ATOM 0 HB3 PHE B 31 -15.957 3.450 2.765 1.00 1.01 H new ATOM 0 HD1 PHE B 31 -14.517 6.460 1.117 1.00 1.68 H new ATOM 0 HD2 PHE B 31 -15.027 2.231 0.963 1.00 1.50 H new ATOM 0 HE1 PHE B 31 -13.637 6.441 -1.176 1.00 1.83 H new ATOM 0 HE2 PHE B 31 -14.142 2.210 -1.327 1.00 1.59 H new ATOM 0 HZ PHE B 31 -13.463 4.314 -2.409 1.00 1.37 H new ATOM 2303 N ASP B 32 -16.864 5.185 5.244 1.00 0.94 N ATOM 2304 CA ASP B 32 -17.759 4.849 6.348 1.00 0.93 C ATOM 2305 C ASP B 32 -18.896 5.868 6.469 1.00 0.93 C ATOM 2306 O ASP B 32 -20.058 5.501 6.672 1.00 0.96 O ATOM 2307 CB ASP B 32 -16.967 4.771 7.657 1.00 0.94 C ATOM 2308 CG ASP B 32 -17.860 4.632 8.875 1.00 1.20 C ATOM 2309 OD1 ASP B 32 -18.459 3.551 9.059 1.00 1.64 O ATOM 2310 OD2 ASP B 32 -17.969 5.607 9.648 1.00 1.54 O ATOM 0 H ASP B 32 -15.909 5.400 5.529 1.00 0.94 H new ATOM 0 HA ASP B 32 -18.205 3.876 6.143 1.00 0.93 H new ATOM 0 HB2 ASP B 32 -16.284 3.922 7.614 1.00 0.94 H new ATOM 0 HB3 ASP B 32 -16.355 5.667 7.761 1.00 0.94 H new ATOM 2315 N VAL B 33 -18.556 7.142 6.310 1.00 0.92 N ATOM 2316 CA VAL B 33 -19.534 8.220 6.403 1.00 0.93 C ATOM 2317 C VAL B 33 -20.524 8.162 5.247 1.00 0.94 C ATOM 2318 O VAL B 33 -21.732 8.271 5.451 1.00 0.95 O ATOM 2319 CB VAL B 33 -18.857 9.609 6.419 1.00 0.94 C ATOM 2320 CG1 VAL B 33 -19.892 10.711 6.591 1.00 1.00 C ATOM 2321 CG2 VAL B 33 -17.814 9.682 7.523 1.00 0.92 C ATOM 0 H VAL B 33 -17.605 7.455 6.115 1.00 0.92 H new ATOM 0 HA VAL B 33 -20.065 8.079 7.344 1.00 0.93 H new ATOM 0 HB VAL B 33 -18.357 9.755 5.461 1.00 0.94 H new ATOM 0 HG11 VAL B 33 -19.393 11.680 6.600 1.00 1.00 H new ATOM 0 HG12 VAL B 33 -20.602 10.675 5.765 1.00 1.00 H new ATOM 0 HG13 VAL B 33 -20.423 10.568 7.532 1.00 1.00 H new ATOM 0 HG21 VAL B 33 -17.348 10.667 7.519 1.00 0.92 H new ATOM 0 HG22 VAL B 33 -18.292 9.511 8.487 1.00 0.92 H new ATOM 0 HG23 VAL B 33 -17.053 8.920 7.355 1.00 0.92 H new ATOM 2331 N VAL B 34 -20.007 7.986 4.036 1.00 0.96 N ATOM 2332 CA VAL B 34 -20.853 7.912 2.850 1.00 0.99 C ATOM 2333 C VAL B 34 -21.879 6.786 2.982 1.00 1.00 C ATOM 2334 O VAL B 34 -23.064 6.971 2.688 1.00 1.02 O ATOM 2335 CB VAL B 34 -20.014 7.695 1.567 1.00 1.02 C ATOM 2336 CG1 VAL B 34 -20.909 7.458 0.355 1.00 1.21 C ATOM 2337 CG2 VAL B 34 -19.102 8.886 1.318 1.00 1.13 C ATOM 0 H VAL B 34 -19.009 7.892 3.850 1.00 0.96 H new ATOM 0 HA VAL B 34 -21.374 8.866 2.768 1.00 0.99 H new ATOM 0 HB VAL B 34 -19.402 6.806 1.717 1.00 1.02 H new ATOM 0 HG11 VAL B 34 -20.291 7.309 -0.530 1.00 1.21 H new ATOM 0 HG12 VAL B 34 -21.522 6.572 0.523 1.00 1.21 H new ATOM 0 HG13 VAL B 34 -21.555 8.323 0.205 1.00 1.21 H new ATOM 0 HG21 VAL B 34 -18.520 8.716 0.412 1.00 1.13 H new ATOM 0 HG22 VAL B 34 -19.704 9.787 1.198 1.00 1.13 H new ATOM 0 HG23 VAL B 34 -18.427 9.011 2.165 1.00 1.13 H new ATOM 2347 N LYS B 35 -21.423 5.630 3.453 1.00 1.01 N ATOM 2348 CA LYS B 35 -22.288 4.472 3.625 1.00 1.05 C ATOM 2349 C LYS B 35 -23.407 4.764 4.624 1.00 1.03 C ATOM 2350 O LYS B 35 -24.525 4.259 4.490 1.00 1.05 O ATOM 2351 CB LYS B 35 -21.476 3.262 4.088 1.00 1.08 C ATOM 2352 CG LYS B 35 -22.263 1.956 4.064 1.00 1.13 C ATOM 2353 CD LYS B 35 -21.348 0.739 4.048 1.00 1.32 C ATOM 2354 CE LYS B 35 -20.474 0.675 5.288 1.00 1.51 C ATOM 2355 NZ LYS B 35 -21.280 0.603 6.535 1.00 1.86 N ATOM 0 H LYS B 35 -20.452 5.471 3.724 1.00 1.01 H new ATOM 0 HA LYS B 35 -22.741 4.247 2.659 1.00 1.05 H new ATOM 0 HB2 LYS B 35 -20.597 3.159 3.451 1.00 1.08 H new ATOM 0 HB3 LYS B 35 -21.117 3.442 5.101 1.00 1.08 H new ATOM 0 HG2 LYS B 35 -22.914 1.909 4.937 1.00 1.13 H new ATOM 0 HG3 LYS B 35 -22.907 1.937 3.185 1.00 1.13 H new ATOM 0 HD2 LYS B 35 -21.950 -0.167 3.980 1.00 1.32 H new ATOM 0 HD3 LYS B 35 -20.717 0.770 3.160 1.00 1.32 H new ATOM 0 HE2 LYS B 35 -19.822 -0.196 5.227 1.00 1.51 H new ATOM 0 HE3 LYS B 35 -19.830 1.554 5.323 1.00 1.51 H new ATOM 0 HZ1 LYS B 35 -20.659 0.375 7.337 1.00 1.86 H new ATOM 0 HZ2 LYS B 35 -21.741 1.520 6.704 1.00 1.86 H new ATOM 0 HZ3 LYS B 35 -22.005 -0.136 6.437 1.00 1.86 H new ATOM 2369 N GLU B 36 -23.104 5.565 5.631 1.00 1.00 N ATOM 2370 CA GLU B 36 -24.092 5.924 6.640 1.00 1.00 C ATOM 2371 C GLU B 36 -25.086 6.946 6.086 1.00 0.96 C ATOM 2372 O GLU B 36 -26.277 6.915 6.408 1.00 0.97 O ATOM 2373 CB GLU B 36 -23.398 6.468 7.890 1.00 1.01 C ATOM 2374 CG GLU B 36 -24.151 6.168 9.180 1.00 1.15 C ATOM 2375 CD GLU B 36 -24.715 4.757 9.211 1.00 1.29 C ATOM 2376 OE1 GLU B 36 -23.946 3.792 9.010 1.00 1.57 O ATOM 2377 OE2 GLU B 36 -25.936 4.604 9.428 1.00 1.40 O ATOM 0 H GLU B 36 -22.183 5.980 5.774 1.00 1.00 H new ATOM 0 HA GLU B 36 -24.648 5.027 6.914 1.00 1.00 H new ATOM 0 HB2 GLU B 36 -22.397 6.042 7.955 1.00 1.01 H new ATOM 0 HB3 GLU B 36 -23.279 7.547 7.790 1.00 1.01 H new ATOM 0 HG2 GLU B 36 -23.481 6.307 10.028 1.00 1.15 H new ATOM 0 HG3 GLU B 36 -24.965 6.884 9.296 1.00 1.15 H new ATOM 2384 N SER B 37 -24.597 7.829 5.232 1.00 0.00 N ATOM 2385 CA SER B 37 -25.399 8.875 4.604 1.00 0.00 C ATOM 2386 C SER B 37 -26.479 8.280 3.731 1.00 0.00 C ATOM 2387 O SER B 37 -27.653 8.644 3.844 1.00 0.00 O ATOM 2388 CB SER B 37 -24.501 9.856 3.810 1.00 0.00 C ATOM 2389 OG SER B 37 -23.629 10.619 4.651 1.00 0.00 O ATOM 0 H SER B 37 -23.617 7.843 4.949 1.00 0.00 H new ATOM 0 HA SER B 37 -25.893 9.444 5.392 1.00 0.00 H new ATOM 0 HB2 SER B 37 -23.904 9.294 3.092 1.00 0.00 H new ATOM 0 HB3 SER B 37 -25.132 10.536 3.238 1.00 0.00 H new ATOM 0 HG SER B 37 -22.953 10.028 5.043 1.00 0.00 H new ATOM 2395 N VAL B 38 -26.095 7.381 2.818 1.00 0.96 N ATOM 2396 CA VAL B 38 -27.054 6.758 1.903 1.00 1.00 C ATOM 2397 C VAL B 38 -28.106 5.949 2.662 1.00 1.02 C ATOM 2398 O VAL B 38 -29.243 5.818 2.211 1.00 1.04 O ATOM 2399 CB VAL B 38 -26.366 5.857 0.848 1.00 1.05 C ATOM 2400 CG1 VAL B 38 -25.546 6.697 -0.120 1.00 1.05 C ATOM 2401 CG2 VAL B 38 -25.489 4.797 1.499 1.00 1.07 C ATOM 0 H VAL B 38 -25.131 7.071 2.694 1.00 0.96 H new ATOM 0 HA VAL B 38 -27.545 7.577 1.377 1.00 1.00 H new ATOM 0 HB VAL B 38 -27.152 5.344 0.294 1.00 1.05 H new ATOM 0 HG11 VAL B 38 -25.070 6.046 -0.854 1.00 1.05 H new ATOM 0 HG12 VAL B 38 -26.199 7.404 -0.632 1.00 1.05 H new ATOM 0 HG13 VAL B 38 -24.780 7.243 0.431 1.00 1.05 H new ATOM 0 HG21 VAL B 38 -25.024 4.185 0.726 1.00 1.07 H new ATOM 0 HG22 VAL B 38 -24.714 5.281 2.094 1.00 1.07 H new ATOM 0 HG23 VAL B 38 -26.100 4.165 2.144 1.00 1.07 H new ATOM 2411 N ASN B 39 -27.720 5.429 3.821 1.00 1.03 N ATOM 2412 CA ASN B 39 -28.621 4.644 4.656 1.00 1.07 C ATOM 2413 C ASN B 39 -29.779 5.509 5.143 1.00 1.05 C ATOM 2414 O ASN B 39 -30.950 5.166 4.961 1.00 1.08 O ATOM 2415 CB ASN B 39 -27.848 4.068 5.853 1.00 1.11 C ATOM 2416 CG ASN B 39 -28.749 3.412 6.886 1.00 1.20 C ATOM 2417 OD1 ASN B 39 -29.783 2.831 6.550 1.00 1.25 O ATOM 2418 ND2 ASN B 39 -28.365 3.503 8.154 1.00 1.25 N ATOM 0 H ASN B 39 -26.782 5.538 4.206 1.00 1.03 H new ATOM 0 HA ASN B 39 -29.028 3.823 4.066 1.00 1.07 H new ATOM 0 HB2 ASN B 39 -27.126 3.336 5.493 1.00 1.11 H new ATOM 0 HB3 ASN B 39 -27.281 4.867 6.330 1.00 1.11 H new ATOM 0 HD21 ASN B 39 -28.933 3.083 8.890 1.00 1.25 H new ATOM 0 HD22 ASN B 39 -27.502 3.992 8.392 1.00 1.25 H new ATOM 2425 N GLU B 40 -29.441 6.651 5.732 1.00 1.02 N ATOM 2426 CA GLU B 40 -30.442 7.574 6.255 1.00 1.02 C ATOM 2427 C GLU B 40 -31.267 8.189 5.127 1.00 0.98 C ATOM 2428 O GLU B 40 -32.470 8.415 5.273 1.00 1.01 O ATOM 2429 CB GLU B 40 -29.763 8.682 7.056 1.00 1.04 C ATOM 2430 CG GLU B 40 -30.371 8.901 8.430 1.00 1.24 C ATOM 2431 CD GLU B 40 -29.854 10.161 9.087 1.00 1.46 C ATOM 2432 OE1 GLU B 40 -28.675 10.182 9.492 1.00 2.04 O ATOM 2433 OE2 GLU B 40 -30.618 11.144 9.186 1.00 1.92 O ATOM 0 H GLU B 40 -28.478 6.961 5.860 1.00 1.02 H new ATOM 0 HA GLU B 40 -31.112 7.011 6.905 1.00 1.02 H new ATOM 0 HB2 GLU B 40 -28.706 8.441 7.170 1.00 1.04 H new ATOM 0 HB3 GLU B 40 -29.818 9.613 6.491 1.00 1.04 H new ATOM 0 HG2 GLU B 40 -31.456 8.958 8.341 1.00 1.24 H new ATOM 0 HG3 GLU B 40 -30.148 8.044 9.065 1.00 1.24 H new ATOM 2440 N LEU B 41 -30.607 8.460 4.006 1.00 0.95 N ATOM 2441 CA LEU B 41 -31.260 9.052 2.845 1.00 0.94 C ATOM 2442 C LEU B 41 -32.335 8.124 2.286 1.00 0.95 C ATOM 2443 O LEU B 41 -33.420 8.574 1.935 1.00 0.97 O ATOM 2444 CB LEU B 41 -30.223 9.376 1.763 1.00 0.92 C ATOM 2445 CG LEU B 41 -30.776 10.073 0.518 1.00 0.97 C ATOM 2446 CD1 LEU B 41 -31.169 11.507 0.837 1.00 1.08 C ATOM 2447 CD2 LEU B 41 -29.757 10.035 -0.611 1.00 1.01 C ATOM 0 H LEU B 41 -29.612 8.277 3.877 1.00 0.95 H new ATOM 0 HA LEU B 41 -31.743 9.976 3.162 1.00 0.94 H new ATOM 0 HB2 LEU B 41 -29.450 10.008 2.201 1.00 0.92 H new ATOM 0 HB3 LEU B 41 -29.740 8.448 1.456 1.00 0.92 H new ATOM 0 HG LEU B 41 -31.669 9.539 0.193 1.00 0.97 H new ATOM 0 HD11 LEU B 41 -31.560 11.986 -0.061 1.00 1.08 H new ATOM 0 HD12 LEU B 41 -31.935 11.510 1.613 1.00 1.08 H new ATOM 0 HD13 LEU B 41 -30.294 12.054 1.188 1.00 1.08 H new ATOM 0 HD21 LEU B 41 -30.167 10.535 -1.488 1.00 1.01 H new ATOM 0 HD22 LEU B 41 -28.846 10.544 -0.296 1.00 1.01 H new ATOM 0 HD23 LEU B 41 -29.527 8.999 -0.859 1.00 1.01 H new ATOM 2459 N SER B 42 -32.033 6.830 2.212 1.00 0.97 N ATOM 2460 CA SER B 42 -32.984 5.847 1.704 1.00 1.01 C ATOM 2461 C SER B 42 -34.249 5.836 2.555 1.00 1.02 C ATOM 2462 O SER B 42 -35.359 5.718 2.034 1.00 1.03 O ATOM 2463 CB SER B 42 -32.347 4.452 1.690 1.00 1.07 C ATOM 2464 OG SER B 42 -33.190 3.507 1.049 1.00 1.56 O ATOM 0 H SER B 42 -31.136 6.438 2.498 1.00 0.97 H new ATOM 0 HA SER B 42 -33.254 6.123 0.685 1.00 1.01 H new ATOM 0 HB2 SER B 42 -31.387 4.493 1.176 1.00 1.07 H new ATOM 0 HB3 SER B 42 -32.148 4.130 2.712 1.00 1.07 H new ATOM 0 HG SER B 42 -32.758 2.627 1.053 1.00 1.56 H new ATOM 2470 N GLU B 43 -34.071 5.989 3.861 1.00 1.04 N ATOM 2471 CA GLU B 43 -35.184 5.993 4.799 1.00 1.07 C ATOM 2472 C GLU B 43 -36.119 7.182 4.550 1.00 1.05 C ATOM 2473 O GLU B 43 -37.328 7.091 4.766 1.00 1.10 O ATOM 2474 CB GLU B 43 -34.648 6.033 6.230 1.00 1.12 C ATOM 2475 CG GLU B 43 -35.719 5.878 7.299 1.00 1.24 C ATOM 2476 CD GLU B 43 -35.646 6.979 8.333 1.00 1.41 C ATOM 2477 OE1 GLU B 43 -34.523 7.412 8.660 1.00 1.56 O ATOM 2478 OE2 GLU B 43 -36.708 7.429 8.809 1.00 1.92 O ATOM 0 H GLU B 43 -33.157 6.113 4.297 1.00 1.04 H new ATOM 0 HA GLU B 43 -35.761 5.080 4.651 1.00 1.07 H new ATOM 0 HB2 GLU B 43 -33.910 5.240 6.352 1.00 1.12 H new ATOM 0 HB3 GLU B 43 -34.129 6.979 6.386 1.00 1.12 H new ATOM 0 HG2 GLU B 43 -36.703 5.884 6.831 1.00 1.24 H new ATOM 0 HG3 GLU B 43 -35.606 4.911 7.789 1.00 1.24 H new ATOM 2485 N LYS B 44 -35.562 8.293 4.085 1.00 1.00 N ATOM 2486 CA LYS B 44 -36.358 9.490 3.820 1.00 1.00 C ATOM 2487 C LYS B 44 -36.996 9.435 2.433 1.00 0.98 C ATOM 2488 O LYS B 44 -38.121 9.897 2.233 1.00 1.03 O ATOM 2489 CB LYS B 44 -35.489 10.744 3.939 1.00 1.01 C ATOM 2490 CG LYS B 44 -34.730 10.848 5.254 1.00 1.06 C ATOM 2491 CD LYS B 44 -35.639 10.650 6.459 1.00 1.17 C ATOM 2492 CE LYS B 44 -34.871 10.787 7.764 1.00 1.32 C ATOM 2493 NZ LYS B 44 -33.761 9.807 7.859 1.00 1.35 N ATOM 0 H LYS B 44 -34.567 8.393 3.884 1.00 1.00 H new ATOM 0 HA LYS B 44 -37.154 9.531 4.563 1.00 1.00 H new ATOM 0 HB2 LYS B 44 -34.774 10.758 3.116 1.00 1.01 H new ATOM 0 HB3 LYS B 44 -36.122 11.624 3.826 1.00 1.01 H new ATOM 0 HG2 LYS B 44 -33.936 10.102 5.273 1.00 1.06 H new ATOM 0 HG3 LYS B 44 -34.251 11.825 5.319 1.00 1.06 H new ATOM 0 HD2 LYS B 44 -36.446 11.382 6.432 1.00 1.17 H new ATOM 0 HD3 LYS B 44 -36.101 9.664 6.409 1.00 1.17 H new ATOM 0 HE2 LYS B 44 -34.471 11.798 7.845 1.00 1.32 H new ATOM 0 HE3 LYS B 44 -35.553 10.646 8.603 1.00 1.32 H new ATOM 0 HZ1 LYS B 44 -33.316 9.876 8.797 1.00 1.35 H new ATOM 0 HZ2 LYS B 44 -34.134 8.846 7.722 1.00 1.35 H new ATOM 0 HZ3 LYS B 44 -33.054 10.011 7.125 1.00 1.35 H new ATOM 2507 N ALA B 45 -36.274 8.860 1.482 1.00 0.98 N ATOM 2508 CA ALA B 45 -36.751 8.746 0.108 1.00 0.99 C ATOM 2509 C ALA B 45 -37.885 7.737 -0.007 1.00 1.01 C ATOM 2510 O ALA B 45 -38.684 7.791 -0.938 1.00 1.03 O ATOM 2511 CB ALA B 45 -35.605 8.349 -0.807 1.00 1.01 C ATOM 0 H ALA B 45 -35.348 8.462 1.637 1.00 0.98 H new ATOM 0 HA ALA B 45 -37.138 9.719 -0.196 1.00 0.99 H new ATOM 0 HB1 ALA B 45 -35.969 8.266 -1.831 1.00 1.01 H new ATOM 0 HB2 ALA B 45 -34.823 9.107 -0.760 1.00 1.01 H new ATOM 0 HB3 ALA B 45 -35.200 7.389 -0.487 1.00 1.01 H new ATOM 2517 N LYS B 46 -37.959 6.820 0.945 1.00 1.04 N ATOM 2518 CA LYS B 46 -39.001 5.801 0.943 1.00 1.10 C ATOM 2519 C LYS B 46 -40.391 6.415 1.132 1.00 1.12 C ATOM 2520 O LYS B 46 -41.404 5.766 0.874 1.00 1.18 O ATOM 2521 CB LYS B 46 -38.743 4.762 2.034 1.00 1.18 C ATOM 2522 CG LYS B 46 -37.825 3.628 1.597 1.00 1.46 C ATOM 2523 CD LYS B 46 -37.850 2.471 2.586 1.00 1.98 C ATOM 2524 CE LYS B 46 -39.181 1.738 2.554 1.00 2.66 C ATOM 2525 NZ LYS B 46 -39.306 0.747 3.650 1.00 3.40 N ATOM 0 H LYS B 46 -37.310 6.759 1.730 1.00 1.04 H new ATOM 0 HA LYS B 46 -38.973 5.313 -0.031 1.00 1.10 H new ATOM 0 HB2 LYS B 46 -38.305 5.259 2.900 1.00 1.18 H new ATOM 0 HB3 LYS B 46 -39.696 4.342 2.356 1.00 1.18 H new ATOM 0 HG2 LYS B 46 -38.129 3.272 0.613 1.00 1.46 H new ATOM 0 HG3 LYS B 46 -36.806 4.002 1.500 1.00 1.46 H new ATOM 0 HD2 LYS B 46 -37.045 1.775 2.353 1.00 1.98 H new ATOM 0 HD3 LYS B 46 -37.665 2.847 3.592 1.00 1.98 H new ATOM 0 HE2 LYS B 46 -39.993 2.461 2.627 1.00 2.66 H new ATOM 0 HE3 LYS B 46 -39.291 1.231 1.595 1.00 2.66 H new ATOM 0 HZ1 LYS B 46 -40.230 0.273 3.586 1.00 3.40 H new ATOM 0 HZ2 LYS B 46 -38.548 0.040 3.567 1.00 3.40 H new ATOM 0 HZ3 LYS B 46 -39.228 1.232 4.567 1.00 3.40 H new ATOM 2539 N THR B 47 -40.434 7.664 1.567 1.00 1.10 N ATOM 2540 CA THR B 47 -41.693 8.354 1.794 1.00 1.16 C ATOM 2541 C THR B 47 -42.190 9.072 0.529 1.00 1.17 C ATOM 2542 O THR B 47 -43.104 9.896 0.586 1.00 1.27 O ATOM 2543 CB THR B 47 -41.533 9.370 2.940 1.00 1.24 C ATOM 2544 OG1 THR B 47 -40.493 8.930 3.834 1.00 1.54 O ATOM 2545 CG2 THR B 47 -42.835 9.530 3.710 1.00 1.41 C ATOM 0 H THR B 47 -39.606 8.223 1.771 1.00 1.10 H new ATOM 0 HA THR B 47 -42.437 7.604 2.064 1.00 1.16 H new ATOM 0 HB THR B 47 -41.266 10.336 2.510 1.00 1.24 H new ATOM 0 HG1 THR B 47 -39.622 9.223 3.493 1.00 1.54 H new ATOM 0 HG21 THR B 47 -42.696 10.253 4.514 1.00 1.41 H new ATOM 0 HG22 THR B 47 -43.615 9.883 3.036 1.00 1.41 H new ATOM 0 HG23 THR B 47 -43.128 8.569 4.133 1.00 1.41 H new ATOM 2553 N ASP B 48 -41.584 8.763 -0.609 1.00 1.14 N ATOM 2554 CA ASP B 48 -41.972 9.376 -1.877 1.00 1.18 C ATOM 2555 C ASP B 48 -41.688 8.427 -3.037 1.00 1.14 C ATOM 2556 O ASP B 48 -40.598 7.870 -3.127 1.00 1.10 O ATOM 2557 CB ASP B 48 -41.218 10.688 -2.083 1.00 1.23 C ATOM 2558 CG ASP B 48 -41.608 11.380 -3.369 1.00 1.28 C ATOM 2559 OD1 ASP B 48 -42.747 11.882 -3.455 1.00 1.39 O ATOM 2560 OD2 ASP B 48 -40.776 11.434 -4.296 1.00 1.43 O ATOM 0 H ASP B 48 -40.820 8.091 -0.683 1.00 1.14 H new ATOM 0 HA ASP B 48 -43.042 9.583 -1.846 1.00 1.18 H new ATOM 0 HB2 ASP B 48 -41.414 11.353 -1.242 1.00 1.23 H new ATOM 0 HB3 ASP B 48 -40.146 10.491 -2.090 1.00 1.23 H new ATOM 2565 N PRO B 49 -42.660 8.238 -3.946 1.00 1.20 N ATOM 2566 CA PRO B 49 -42.505 7.340 -5.099 1.00 1.22 C ATOM 2567 C PRO B 49 -41.380 7.770 -6.042 1.00 1.24 C ATOM 2568 O PRO B 49 -40.652 6.929 -6.580 1.00 1.24 O ATOM 2569 CB PRO B 49 -43.860 7.425 -5.810 1.00 1.33 C ATOM 2570 CG PRO B 49 -44.470 8.698 -5.334 1.00 1.36 C ATOM 2571 CD PRO B 49 -43.987 8.880 -3.924 1.00 1.29 C ATOM 0 HA PRO B 49 -42.235 6.332 -4.784 1.00 1.22 H new ATOM 0 HB2 PRO B 49 -43.737 7.428 -6.893 1.00 1.33 H new ATOM 0 HB3 PRO B 49 -44.489 6.570 -5.563 1.00 1.33 H new ATOM 0 HG2 PRO B 49 -44.167 9.536 -5.962 1.00 1.36 H new ATOM 0 HG3 PRO B 49 -45.558 8.648 -5.371 1.00 1.36 H new ATOM 0 HD2 PRO B 49 -43.922 9.933 -3.652 1.00 1.29 H new ATOM 0 HD3 PRO B 49 -44.654 8.405 -3.204 1.00 1.29 H new ATOM 2579 N GLN B 50 -41.239 9.077 -6.232 1.00 1.28 N ATOM 2580 CA GLN B 50 -40.207 9.614 -7.107 1.00 1.33 C ATOM 2581 C GLN B 50 -38.837 9.427 -6.477 1.00 1.22 C ATOM 2582 O GLN B 50 -37.895 8.967 -7.126 1.00 1.22 O ATOM 2583 CB GLN B 50 -40.447 11.097 -7.381 1.00 1.45 C ATOM 2584 CG GLN B 50 -41.835 11.410 -7.915 1.00 1.58 C ATOM 2585 CD GLN B 50 -42.331 12.773 -7.476 1.00 1.65 C ATOM 2586 OE1 GLN B 50 -42.972 13.489 -8.244 1.00 1.81 O ATOM 2587 NE2 GLN B 50 -42.065 13.131 -6.227 1.00 1.66 N ATOM 0 H GLN B 50 -41.828 9.784 -5.791 1.00 1.28 H new ATOM 0 HA GLN B 50 -40.247 9.072 -8.052 1.00 1.33 H new ATOM 0 HB2 GLN B 50 -40.289 11.657 -6.459 1.00 1.45 H new ATOM 0 HB3 GLN B 50 -39.705 11.448 -8.098 1.00 1.45 H new ATOM 0 HG2 GLN B 50 -41.821 11.365 -9.004 1.00 1.58 H new ATOM 0 HG3 GLN B 50 -42.533 10.646 -7.574 1.00 1.58 H new ATOM 0 HE21 GLN B 50 -41.530 12.509 -5.621 1.00 1.66 H new ATOM 0 HE22 GLN B 50 -42.395 14.028 -5.872 1.00 1.66 H new ATOM 2596 N ALA B 51 -38.746 9.785 -5.202 1.00 1.15 N ATOM 2597 CA ALA B 51 -37.508 9.659 -4.449 1.00 1.08 C ATOM 2598 C ALA B 51 -37.074 8.203 -4.365 1.00 1.00 C ATOM 2599 O ALA B 51 -35.878 7.899 -4.384 1.00 0.98 O ATOM 2600 CB ALA B 51 -37.667 10.249 -3.059 1.00 1.09 C ATOM 0 H ALA B 51 -39.524 10.168 -4.665 1.00 1.15 H new ATOM 0 HA ALA B 51 -36.732 10.216 -4.973 1.00 1.08 H new ATOM 0 HB1 ALA B 51 -36.731 10.146 -2.511 1.00 1.09 H new ATOM 0 HB2 ALA B 51 -37.926 11.305 -3.139 1.00 1.09 H new ATOM 0 HB3 ALA B 51 -38.459 9.721 -2.528 1.00 1.09 H new ATOM 2606 N ALA B 52 -38.052 7.309 -4.266 1.00 0.99 N ATOM 2607 CA ALA B 52 -37.782 5.883 -4.201 1.00 0.98 C ATOM 2608 C ALA B 52 -37.005 5.437 -5.433 1.00 1.02 C ATOM 2609 O ALA B 52 -36.089 4.622 -5.338 1.00 1.03 O ATOM 2610 CB ALA B 52 -39.083 5.100 -4.071 1.00 1.03 C ATOM 0 H ALA B 52 -39.042 7.551 -4.229 1.00 0.99 H new ATOM 0 HA ALA B 52 -37.174 5.682 -3.319 1.00 0.98 H new ATOM 0 HB1 ALA B 52 -38.863 4.034 -4.024 1.00 1.03 H new ATOM 0 HB2 ALA B 52 -39.601 5.404 -3.162 1.00 1.03 H new ATOM 0 HB3 ALA B 52 -39.717 5.301 -4.935 1.00 1.03 H new ATOM 2616 N GLU B 53 -37.364 5.997 -6.584 1.00 1.09 N ATOM 2617 CA GLU B 53 -36.694 5.667 -7.836 1.00 1.18 C ATOM 2618 C GLU B 53 -35.282 6.262 -7.862 1.00 1.17 C ATOM 2619 O GLU B 53 -34.357 5.665 -8.413 1.00 1.23 O ATOM 2620 CB GLU B 53 -37.516 6.174 -9.029 1.00 1.28 C ATOM 2621 CG GLU B 53 -36.911 5.850 -10.390 1.00 1.45 C ATOM 2622 CD GLU B 53 -36.496 4.396 -10.524 1.00 1.51 C ATOM 2623 OE1 GLU B 53 -37.366 3.510 -10.418 1.00 1.66 O ATOM 2624 OE2 GLU B 53 -35.293 4.136 -10.747 1.00 1.58 O ATOM 0 H GLU B 53 -38.115 6.681 -6.675 1.00 1.09 H new ATOM 0 HA GLU B 53 -36.609 4.583 -7.910 1.00 1.18 H new ATOM 0 HB2 GLU B 53 -38.515 5.742 -8.977 1.00 1.28 H new ATOM 0 HB3 GLU B 53 -37.631 7.255 -8.943 1.00 1.28 H new ATOM 0 HG2 GLU B 53 -37.635 6.089 -11.169 1.00 1.45 H new ATOM 0 HG3 GLU B 53 -36.042 6.487 -10.556 1.00 1.45 H new ATOM 2631 N LYS B 54 -35.119 7.433 -7.251 1.00 1.13 N ATOM 2632 CA LYS B 54 -33.819 8.101 -7.198 1.00 1.14 C ATOM 2633 C LYS B 54 -32.803 7.223 -6.481 1.00 1.05 C ATOM 2634 O LYS B 54 -31.679 7.035 -6.950 1.00 1.09 O ATOM 2635 CB LYS B 54 -33.927 9.450 -6.477 1.00 1.16 C ATOM 2636 CG LYS B 54 -34.995 10.368 -7.044 1.00 1.32 C ATOM 2637 CD LYS B 54 -35.109 11.656 -6.247 1.00 1.48 C ATOM 2638 CE LYS B 54 -34.217 12.750 -6.808 1.00 1.68 C ATOM 2639 NZ LYS B 54 -34.509 13.029 -8.238 1.00 2.09 N ATOM 0 H LYS B 54 -35.871 7.940 -6.785 1.00 1.13 H new ATOM 0 HA LYS B 54 -33.489 8.275 -8.222 1.00 1.14 H new ATOM 0 HB2 LYS B 54 -34.138 9.271 -5.423 1.00 1.16 H new ATOM 0 HB3 LYS B 54 -32.963 9.956 -6.528 1.00 1.16 H new ATOM 0 HG2 LYS B 54 -34.760 10.602 -8.082 1.00 1.32 H new ATOM 0 HG3 LYS B 54 -35.956 9.853 -7.043 1.00 1.32 H new ATOM 0 HD2 LYS B 54 -36.145 11.995 -6.251 1.00 1.48 H new ATOM 0 HD3 LYS B 54 -34.840 11.465 -5.208 1.00 1.48 H new ATOM 0 HE2 LYS B 54 -34.352 13.662 -6.226 1.00 1.68 H new ATOM 0 HE3 LYS B 54 -33.173 12.456 -6.702 1.00 1.68 H new ATOM 0 HZ1 LYS B 54 -34.286 14.022 -8.451 1.00 2.09 H new ATOM 0 HZ2 LYS B 54 -33.930 12.408 -8.838 1.00 2.09 H new ATOM 0 HZ3 LYS B 54 -35.516 12.853 -8.427 1.00 2.09 H new ATOM 2653 N LEU B 55 -33.221 6.666 -5.355 1.00 0.98 N ATOM 2654 CA LEU B 55 -32.354 5.805 -4.561 1.00 0.95 C ATOM 2655 C LEU B 55 -32.248 4.420 -5.185 1.00 0.99 C ATOM 2656 O LEU B 55 -31.266 3.711 -4.975 1.00 0.99 O ATOM 2657 CB LEU B 55 -32.875 5.705 -3.124 1.00 0.94 C ATOM 2658 CG LEU B 55 -32.270 6.708 -2.137 1.00 1.02 C ATOM 2659 CD1 LEU B 55 -30.775 6.478 -2.000 1.00 1.13 C ATOM 2660 CD2 LEU B 55 -32.548 8.138 -2.580 1.00 1.09 C ATOM 0 H LEU B 55 -34.156 6.794 -4.969 1.00 0.98 H new ATOM 0 HA LEU B 55 -31.358 6.247 -4.542 1.00 0.95 H new ATOM 0 HB2 LEU B 55 -33.956 5.840 -3.137 1.00 0.94 H new ATOM 0 HB3 LEU B 55 -32.684 4.697 -2.755 1.00 0.94 H new ATOM 0 HG LEU B 55 -32.738 6.555 -1.165 1.00 1.02 H new ATOM 0 HD11 LEU B 55 -30.359 7.198 -1.295 1.00 1.13 H new ATOM 0 HD12 LEU B 55 -30.594 5.467 -1.635 1.00 1.13 H new ATOM 0 HD13 LEU B 55 -30.297 6.603 -2.972 1.00 1.13 H new ATOM 0 HD21 LEU B 55 -32.109 8.833 -1.864 1.00 1.09 H new ATOM 0 HD22 LEU B 55 -32.110 8.306 -3.564 1.00 1.09 H new ATOM 0 HD23 LEU B 55 -33.625 8.301 -2.630 1.00 1.09 H new ATOM 2672 N ASN B 56 -33.260 4.048 -5.959 1.00 1.06 N ATOM 2673 CA ASN B 56 -33.296 2.753 -6.634 1.00 1.16 C ATOM 2674 C ASN B 56 -32.112 2.624 -7.589 1.00 1.20 C ATOM 2675 O ASN B 56 -31.385 1.626 -7.581 1.00 1.26 O ATOM 2676 CB ASN B 56 -34.620 2.597 -7.395 1.00 1.26 C ATOM 2677 CG ASN B 56 -34.682 1.350 -8.258 1.00 1.44 C ATOM 2678 OD1 ASN B 56 -34.139 0.303 -7.907 1.00 1.49 O ATOM 2679 ND2 ASN B 56 -35.352 1.452 -9.397 1.00 1.58 N ATOM 0 H ASN B 56 -34.077 4.632 -6.137 1.00 1.06 H new ATOM 0 HA ASN B 56 -33.226 1.961 -5.888 1.00 1.16 H new ATOM 0 HB2 ASN B 56 -35.441 2.574 -6.678 1.00 1.26 H new ATOM 0 HB3 ASN B 56 -34.772 3.473 -8.026 1.00 1.26 H new ATOM 0 HD21 ASN B 56 -35.431 0.645 -10.016 1.00 1.58 H new ATOM 0 HD22 ASN B 56 -35.789 2.337 -9.654 1.00 1.58 H new ATOM 2686 N LYS B 57 -31.903 3.651 -8.398 1.00 1.21 N ATOM 2687 CA LYS B 57 -30.804 3.651 -9.353 1.00 1.29 C ATOM 2688 C LYS B 57 -29.480 3.960 -8.664 1.00 1.21 C ATOM 2689 O LYS B 57 -28.428 3.487 -9.090 1.00 1.26 O ATOM 2690 CB LYS B 57 -31.058 4.651 -10.482 1.00 1.39 C ATOM 2691 CG LYS B 57 -31.587 5.998 -10.018 1.00 1.52 C ATOM 2692 CD LYS B 57 -31.679 6.991 -11.169 1.00 1.62 C ATOM 2693 CE LYS B 57 -32.528 6.455 -12.318 1.00 1.73 C ATOM 2694 NZ LYS B 57 -33.933 6.194 -11.902 1.00 1.81 N ATOM 0 H LYS B 57 -32.478 4.493 -8.413 1.00 1.21 H new ATOM 0 HA LYS B 57 -30.743 2.652 -9.784 1.00 1.29 H new ATOM 0 HB2 LYS B 57 -30.128 4.808 -11.028 1.00 1.39 H new ATOM 0 HB3 LYS B 57 -31.770 4.216 -11.183 1.00 1.39 H new ATOM 0 HG2 LYS B 57 -32.572 5.868 -9.569 1.00 1.52 H new ATOM 0 HG3 LYS B 57 -30.934 6.398 -9.243 1.00 1.52 H new ATOM 0 HD2 LYS B 57 -32.106 7.926 -10.808 1.00 1.62 H new ATOM 0 HD3 LYS B 57 -30.677 7.218 -11.533 1.00 1.62 H new ATOM 0 HE2 LYS B 57 -32.521 7.172 -13.139 1.00 1.73 H new ATOM 0 HE3 LYS B 57 -32.085 5.534 -12.696 1.00 1.73 H new ATOM 0 HZ1 LYS B 57 -34.554 6.230 -12.735 1.00 1.81 H new ATOM 0 HZ2 LYS B 57 -33.996 5.253 -11.464 1.00 1.81 H new ATOM 0 HZ3 LYS B 57 -34.232 6.916 -11.216 1.00 1.81 H new ATOM 2708 N LEU B 58 -29.537 4.759 -7.605 1.00 1.12 N ATOM 2709 CA LEU B 58 -28.337 5.135 -6.863 1.00 1.09 C ATOM 2710 C LEU B 58 -27.660 3.903 -6.259 1.00 1.08 C ATOM 2711 O LEU B 58 -26.452 3.709 -6.416 1.00 1.11 O ATOM 2712 CB LEU B 58 -28.683 6.144 -5.759 1.00 1.06 C ATOM 2713 CG LEU B 58 -27.960 7.495 -5.848 1.00 1.21 C ATOM 2714 CD1 LEU B 58 -26.457 7.317 -5.710 1.00 1.37 C ATOM 2715 CD2 LEU B 58 -28.298 8.201 -7.156 1.00 1.40 C ATOM 0 H LEU B 58 -30.401 5.160 -7.240 1.00 1.12 H new ATOM 0 HA LEU B 58 -27.641 5.602 -7.560 1.00 1.09 H new ATOM 0 HB2 LEU B 58 -29.758 6.325 -5.780 1.00 1.06 H new ATOM 0 HB3 LEU B 58 -28.455 5.692 -4.794 1.00 1.06 H new ATOM 0 HG LEU B 58 -28.305 8.117 -5.022 1.00 1.21 H new ATOM 0 HD11 LEU B 58 -25.968 8.289 -5.776 1.00 1.37 H new ATOM 0 HD12 LEU B 58 -26.231 6.863 -4.745 1.00 1.37 H new ATOM 0 HD13 LEU B 58 -26.092 6.672 -6.509 1.00 1.37 H new ATOM 0 HD21 LEU B 58 -27.775 9.157 -7.199 1.00 1.40 H new ATOM 0 HD22 LEU B 58 -27.988 7.579 -7.996 1.00 1.40 H new ATOM 0 HD23 LEU B 58 -29.373 8.373 -7.210 1.00 1.40 H new ATOM 2727 N ILE B 59 -28.443 3.067 -5.582 1.00 1.08 N ATOM 2728 CA ILE B 59 -27.913 1.854 -4.967 1.00 1.15 C ATOM 2729 C ILE B 59 -27.407 0.889 -6.042 1.00 1.25 C ATOM 2730 O ILE B 59 -26.417 0.178 -5.843 1.00 1.32 O ATOM 2731 CB ILE B 59 -28.957 1.158 -4.052 1.00 1.20 C ATOM 2732 CG1 ILE B 59 -28.288 0.077 -3.199 1.00 1.33 C ATOM 2733 CG2 ILE B 59 -30.096 0.560 -4.863 1.00 1.22 C ATOM 2734 CD1 ILE B 59 -27.315 0.629 -2.180 1.00 1.37 C ATOM 0 H ILE B 59 -29.444 3.207 -5.446 1.00 1.08 H new ATOM 0 HA ILE B 59 -27.077 2.148 -4.333 1.00 1.15 H new ATOM 0 HB ILE B 59 -29.377 1.917 -3.393 1.00 1.20 H new ATOM 0 HG12 ILE B 59 -29.058 -0.495 -2.682 1.00 1.33 H new ATOM 0 HG13 ILE B 59 -27.761 -0.617 -3.854 1.00 1.33 H new ATOM 0 HG21 ILE B 59 -30.808 0.081 -4.191 1.00 1.22 H new ATOM 0 HG22 ILE B 59 -30.599 1.350 -5.422 1.00 1.22 H new ATOM 0 HG23 ILE B 59 -29.699 -0.180 -5.558 1.00 1.22 H new ATOM 0 HD11 ILE B 59 -26.879 -0.192 -1.611 1.00 1.37 H new ATOM 0 HD12 ILE B 59 -26.524 1.177 -2.692 1.00 1.37 H new ATOM 0 HD13 ILE B 59 -27.841 1.301 -1.502 1.00 1.37 H new ATOM 2746 N GLU B 60 -28.084 0.881 -7.189 1.00 1.29 N ATOM 2747 CA GLU B 60 -27.699 0.026 -8.303 1.00 1.44 C ATOM 2748 C GLU B 60 -26.310 0.411 -8.801 1.00 1.40 C ATOM 2749 O GLU B 60 -25.456 -0.449 -9.034 1.00 1.51 O ATOM 2750 CB GLU B 60 -28.719 0.151 -9.437 1.00 1.54 C ATOM 2751 CG GLU B 60 -28.613 -0.959 -10.464 1.00 1.75 C ATOM 2752 CD GLU B 60 -29.276 -0.609 -11.779 1.00 1.96 C ATOM 2753 OE1 GLU B 60 -29.059 0.517 -12.279 1.00 2.17 O ATOM 2754 OE2 GLU B 60 -30.010 -1.463 -12.324 1.00 2.28 O ATOM 0 H GLU B 60 -28.904 1.460 -7.368 1.00 1.29 H new ATOM 0 HA GLU B 60 -27.676 -1.009 -7.963 1.00 1.44 H new ATOM 0 HB2 GLU B 60 -29.724 0.151 -9.014 1.00 1.54 H new ATOM 0 HB3 GLU B 60 -28.583 1.111 -9.935 1.00 1.54 H new ATOM 0 HG2 GLU B 60 -27.561 -1.184 -10.641 1.00 1.75 H new ATOM 0 HG3 GLU B 60 -29.069 -1.864 -10.062 1.00 1.75 H new ATOM 2761 N GLY B 61 -26.092 1.714 -8.946 1.00 1.29 N ATOM 2762 CA GLY B 61 -24.809 2.213 -9.395 1.00 1.28 C ATOM 2763 C GLY B 61 -23.706 1.862 -8.424 1.00 1.21 C ATOM 2764 O GLY B 61 -22.579 1.583 -8.829 1.00 1.23 O ATOM 0 H GLY B 61 -26.787 2.436 -8.759 1.00 1.29 H new ATOM 0 HA2 GLY B 61 -24.578 1.796 -10.375 1.00 1.28 H new ATOM 0 HA3 GLY B 61 -24.860 3.295 -9.513 1.00 1.28 H new ATOM 2768 N TYR B 62 -24.041 1.877 -7.137 1.00 1.19 N ATOM 2769 CA TYR B 62 -23.091 1.537 -6.087 1.00 1.23 C ATOM 2770 C TYR B 62 -22.686 0.069 -6.205 1.00 1.35 C ATOM 2771 O TYR B 62 -21.526 -0.292 -5.998 1.00 1.37 O ATOM 2772 CB TYR B 62 -23.708 1.816 -4.710 1.00 1.28 C ATOM 2773 CG TYR B 62 -22.921 1.243 -3.546 1.00 1.60 C ATOM 2774 CD1 TYR B 62 -21.702 1.792 -3.163 1.00 2.25 C ATOM 2775 CD2 TYR B 62 -23.398 0.151 -2.832 1.00 2.11 C ATOM 2776 CE1 TYR B 62 -20.981 1.268 -2.104 1.00 2.90 C ATOM 2777 CE2 TYR B 62 -22.682 -0.380 -1.771 1.00 2.72 C ATOM 2778 CZ TYR B 62 -21.473 0.183 -1.410 1.00 2.96 C ATOM 2779 OH TYR B 62 -20.754 -0.346 -0.359 1.00 3.75 O ATOM 0 H TYR B 62 -24.970 2.123 -6.796 1.00 1.19 H new ATOM 0 HA TYR B 62 -22.199 2.154 -6.199 1.00 1.23 H new ATOM 0 HB2 TYR B 62 -23.798 2.894 -4.577 1.00 1.28 H new ATOM 0 HB3 TYR B 62 -24.718 1.406 -4.687 1.00 1.28 H new ATOM 0 HD1 TYR B 62 -21.311 2.643 -3.702 1.00 2.25 H new ATOM 0 HD2 TYR B 62 -24.343 -0.292 -3.109 1.00 2.11 H new ATOM 0 HE1 TYR B 62 -20.036 1.708 -1.822 1.00 2.90 H new ATOM 0 HE2 TYR B 62 -23.067 -1.231 -1.228 1.00 2.72 H new ATOM 0 HH TYR B 62 -21.242 -1.106 0.022 1.00 3.75 H new ATOM 2789 N THR B 63 -23.653 -0.763 -6.564 1.00 1.51 N ATOM 2790 CA THR B 63 -23.419 -2.187 -6.723 1.00 1.71 C ATOM 2791 C THR B 63 -22.474 -2.448 -7.895 1.00 1.67 C ATOM 2792 O THR B 63 -21.473 -3.155 -7.759 1.00 1.80 O ATOM 2793 CB THR B 63 -24.745 -2.938 -6.951 1.00 1.94 C ATOM 2794 OG1 THR B 63 -25.703 -2.554 -5.955 1.00 2.00 O ATOM 2795 CG2 THR B 63 -24.535 -4.443 -6.897 1.00 2.31 C ATOM 0 H THR B 63 -24.612 -0.472 -6.751 1.00 1.51 H new ATOM 0 HA THR B 63 -22.960 -2.555 -5.805 1.00 1.71 H new ATOM 0 HB THR B 63 -25.118 -2.673 -7.941 1.00 1.94 H new ATOM 0 HG1 THR B 63 -25.987 -1.629 -6.113 1.00 2.00 H new ATOM 0 HG21 THR B 63 -25.486 -4.949 -7.061 1.00 2.31 H new ATOM 0 HG22 THR B 63 -23.828 -4.740 -7.672 1.00 2.31 H new ATOM 0 HG23 THR B 63 -24.140 -4.720 -5.920 1.00 2.31 H new ATOM 2803 N TYR B 64 -22.773 -1.838 -9.038 1.00 1.57 N ATOM 2804 CA TYR B 64 -21.955 -2.003 -10.235 1.00 1.63 C ATOM 2805 C TYR B 64 -20.859 -0.951 -10.261 1.00 1.37 C ATOM 2806 O TYR B 64 -20.440 -0.499 -11.328 1.00 1.46 O ATOM 2807 CB TYR B 64 -22.807 -1.892 -11.504 1.00 1.90 C ATOM 2808 CG TYR B 64 -24.057 -2.741 -11.483 1.00 2.42 C ATOM 2809 CD1 TYR B 64 -24.039 -4.039 -10.987 1.00 3.10 C ATOM 2810 CD2 TYR B 64 -25.256 -2.239 -11.958 1.00 2.81 C ATOM 2811 CE1 TYR B 64 -25.185 -4.808 -10.967 1.00 3.76 C ATOM 2812 CE2 TYR B 64 -26.404 -3.002 -11.939 1.00 3.50 C ATOM 2813 CZ TYR B 64 -26.364 -4.285 -11.443 1.00 3.84 C ATOM 2814 OH TYR B 64 -27.511 -5.043 -11.426 1.00 4.62 O ATOM 0 H TYR B 64 -23.578 -1.223 -9.161 1.00 1.57 H new ATOM 0 HA TYR B 64 -21.508 -2.997 -10.207 1.00 1.63 H new ATOM 0 HB2 TYR B 64 -23.091 -0.850 -11.648 1.00 1.90 H new ATOM 0 HB3 TYR B 64 -22.200 -2.179 -12.363 1.00 1.90 H new ATOM 0 HD1 TYR B 64 -23.114 -4.452 -10.612 1.00 3.10 H new ATOM 0 HD2 TYR B 64 -25.293 -1.233 -12.350 1.00 2.81 H new ATOM 0 HE1 TYR B 64 -25.156 -5.816 -10.579 1.00 3.76 H new ATOM 0 HE2 TYR B 64 -27.332 -2.594 -12.312 1.00 3.50 H new ATOM 0 HH TYR B 64 -28.253 -4.522 -11.797 1.00 4.62 H new ATOM 2824 N GLY B 65 -20.399 -0.564 -9.081 1.00 1.20 N ATOM 2825 CA GLY B 65 -19.372 0.447 -8.975 1.00 1.11 C ATOM 2826 C GLY B 65 -18.018 -0.008 -9.482 1.00 1.04 C ATOM 2827 O GLY B 65 -17.209 -0.537 -8.717 1.00 1.03 O ATOM 0 H GLY B 65 -20.723 -0.937 -8.189 1.00 1.20 H new ATOM 0 HA2 GLY B 65 -19.683 1.329 -9.535 1.00 1.11 H new ATOM 0 HA3 GLY B 65 -19.277 0.749 -7.932 1.00 1.11 H new ATOM 2831 N GLU B 66 -17.768 0.205 -10.768 1.00 1.04 N ATOM 2832 CA GLU B 66 -16.493 -0.156 -11.373 1.00 1.02 C ATOM 2833 C GLU B 66 -15.399 0.709 -10.773 1.00 0.98 C ATOM 2834 O GLU B 66 -14.271 0.265 -10.569 1.00 0.95 O ATOM 2835 CB GLU B 66 -16.537 0.035 -12.889 1.00 1.10 C ATOM 2836 CG GLU B 66 -17.320 -1.042 -13.616 1.00 1.36 C ATOM 2837 CD GLU B 66 -16.718 -2.418 -13.417 1.00 1.66 C ATOM 2838 OE1 GLU B 66 -15.713 -2.741 -14.087 1.00 2.08 O ATOM 2839 OE2 GLU B 66 -17.238 -3.183 -12.585 1.00 2.08 O ATOM 0 H GLU B 66 -18.435 0.628 -11.414 1.00 1.04 H new ATOM 0 HA GLU B 66 -16.288 -1.207 -11.171 1.00 1.02 H new ATOM 0 HB2 GLU B 66 -16.979 1.006 -13.111 1.00 1.10 H new ATOM 0 HB3 GLU B 66 -15.517 0.053 -13.274 1.00 1.10 H new ATOM 0 HG2 GLU B 66 -18.350 -1.043 -13.260 1.00 1.36 H new ATOM 0 HG3 GLU B 66 -17.351 -0.811 -14.681 1.00 1.36 H new ATOM 2846 N GLU B 67 -15.753 1.955 -10.494 1.00 1.00 N ATOM 2847 CA GLU B 67 -14.832 2.897 -9.884 1.00 1.01 C ATOM 2848 C GLU B 67 -14.483 2.429 -8.475 1.00 0.97 C ATOM 2849 O GLU B 67 -13.329 2.484 -8.061 1.00 0.95 O ATOM 2850 CB GLU B 67 -15.455 4.295 -9.861 1.00 1.10 C ATOM 2851 CG GLU B 67 -16.871 4.327 -9.304 1.00 1.53 C ATOM 2852 CD GLU B 67 -17.745 5.355 -9.987 1.00 1.81 C ATOM 2853 OE1 GLU B 67 -17.488 6.564 -9.823 1.00 2.28 O ATOM 2854 OE2 GLU B 67 -18.687 4.959 -10.705 1.00 2.44 O ATOM 0 H GLU B 67 -16.680 2.337 -10.683 1.00 1.00 H new ATOM 0 HA GLU B 67 -13.914 2.945 -10.470 1.00 1.01 H new ATOM 0 HB2 GLU B 67 -14.825 4.954 -9.264 1.00 1.10 H new ATOM 0 HB3 GLU B 67 -15.464 4.695 -10.875 1.00 1.10 H new ATOM 0 HG2 GLU B 67 -17.323 3.341 -9.415 1.00 1.53 H new ATOM 0 HG3 GLU B 67 -16.832 4.542 -8.236 1.00 1.53 H new ATOM 2861 N ARG B 68 -15.491 1.931 -7.756 1.00 0.98 N ATOM 2862 CA ARG B 68 -15.302 1.423 -6.402 1.00 0.99 C ATOM 2863 C ARG B 68 -14.338 0.242 -6.431 1.00 0.95 C ATOM 2864 O ARG B 68 -13.446 0.122 -5.589 1.00 0.95 O ATOM 2865 CB ARG B 68 -16.647 0.997 -5.801 1.00 1.04 C ATOM 2866 CG ARG B 68 -16.537 0.438 -4.393 1.00 1.10 C ATOM 2867 CD ARG B 68 -17.833 -0.225 -3.952 1.00 1.41 C ATOM 2868 NE ARG B 68 -17.670 -0.936 -2.686 1.00 1.59 N ATOM 2869 CZ ARG B 68 -17.755 -2.263 -2.545 1.00 1.88 C ATOM 2870 NH1 ARG B 68 -18.058 -3.038 -3.586 1.00 2.30 N ATOM 2871 NH2 ARG B 68 -17.539 -2.808 -1.354 1.00 2.17 N ATOM 0 H ARG B 68 -16.451 1.870 -8.095 1.00 0.98 H new ATOM 0 HA ARG B 68 -14.882 2.213 -5.779 1.00 0.99 H new ATOM 0 HB2 ARG B 68 -17.318 1.856 -5.790 1.00 1.04 H new ATOM 0 HB3 ARG B 68 -17.102 0.245 -6.446 1.00 1.04 H new ATOM 0 HG2 ARG B 68 -15.724 -0.287 -4.351 1.00 1.10 H new ATOM 0 HG3 ARG B 68 -16.284 1.241 -3.701 1.00 1.10 H new ATOM 0 HD2 ARG B 68 -18.612 0.531 -3.848 1.00 1.41 H new ATOM 0 HD3 ARG B 68 -18.166 -0.922 -4.721 1.00 1.41 H new ATOM 0 HE ARG B 68 -17.478 -0.382 -1.852 1.00 1.59 H new ATOM 0 HH11 ARG B 68 -18.228 -2.620 -4.501 1.00 2.30 H new ATOM 0 HH12 ARG B 68 -18.120 -4.049 -3.468 1.00 2.30 H new ATOM 0 HH21 ARG B 68 -17.310 -2.215 -0.556 1.00 2.17 H new ATOM 0 HH22 ARG B 68 -17.602 -3.819 -1.237 1.00 2.17 H new ATOM 2885 N LYS B 69 -14.518 -0.611 -7.430 1.00 0.94 N ATOM 2886 CA LYS B 69 -13.671 -1.778 -7.614 1.00 0.94 C ATOM 2887 C LYS B 69 -12.241 -1.350 -7.932 1.00 0.89 C ATOM 2888 O LYS B 69 -11.285 -2.046 -7.595 1.00 0.88 O ATOM 2889 CB LYS B 69 -14.234 -2.646 -8.745 1.00 1.00 C ATOM 2890 CG LYS B 69 -13.584 -4.016 -8.879 1.00 1.28 C ATOM 2891 CD LYS B 69 -14.293 -4.867 -9.926 1.00 1.46 C ATOM 2892 CE LYS B 69 -14.224 -4.230 -11.306 1.00 1.55 C ATOM 2893 NZ LYS B 69 -15.083 -4.936 -12.289 1.00 1.70 N ATOM 0 H LYS B 69 -15.252 -0.513 -8.132 1.00 0.94 H new ATOM 0 HA LYS B 69 -13.656 -2.359 -6.692 1.00 0.94 H new ATOM 0 HB2 LYS B 69 -15.304 -2.781 -8.583 1.00 1.00 H new ATOM 0 HB3 LYS B 69 -14.119 -2.111 -9.687 1.00 1.00 H new ATOM 0 HG2 LYS B 69 -12.536 -3.898 -9.153 1.00 1.28 H new ATOM 0 HG3 LYS B 69 -13.606 -4.527 -7.916 1.00 1.28 H new ATOM 0 HD2 LYS B 69 -13.839 -5.857 -9.959 1.00 1.46 H new ATOM 0 HD3 LYS B 69 -15.336 -5.004 -9.639 1.00 1.46 H new ATOM 0 HE2 LYS B 69 -14.532 -3.187 -11.239 1.00 1.55 H new ATOM 0 HE3 LYS B 69 -13.192 -4.236 -11.657 1.00 1.55 H new ATOM 0 HZ1 LYS B 69 -14.678 -4.833 -13.241 1.00 1.70 H new ATOM 0 HZ2 LYS B 69 -15.136 -5.945 -12.042 1.00 1.70 H new ATOM 0 HZ3 LYS B 69 -16.038 -4.525 -12.273 1.00 1.70 H new ATOM 2907 N LEU B 70 -12.104 -0.196 -8.574 1.00 0.89 N ATOM 2908 CA LEU B 70 -10.796 0.332 -8.935 1.00 0.87 C ATOM 2909 C LEU B 70 -10.021 0.735 -7.688 1.00 0.83 C ATOM 2910 O LEU B 70 -8.799 0.612 -7.645 1.00 0.82 O ATOM 2911 CB LEU B 70 -10.946 1.528 -9.883 1.00 0.91 C ATOM 2912 CG LEU B 70 -9.633 2.155 -10.362 1.00 0.96 C ATOM 2913 CD1 LEU B 70 -8.869 1.187 -11.248 1.00 1.04 C ATOM 2914 CD2 LEU B 70 -9.894 3.460 -11.099 1.00 1.04 C ATOM 0 H LEU B 70 -12.887 0.394 -8.856 1.00 0.89 H new ATOM 0 HA LEU B 70 -10.237 -0.450 -9.450 1.00 0.87 H new ATOM 0 HB2 LEU B 70 -11.516 1.209 -10.755 1.00 0.91 H new ATOM 0 HB3 LEU B 70 -11.534 2.296 -9.381 1.00 0.91 H new ATOM 0 HG LEU B 70 -9.023 2.374 -9.486 1.00 0.96 H new ATOM 0 HD11 LEU B 70 -7.940 1.651 -11.578 1.00 1.04 H new ATOM 0 HD12 LEU B 70 -8.642 0.281 -10.686 1.00 1.04 H new ATOM 0 HD13 LEU B 70 -9.476 0.933 -12.117 1.00 1.04 H new ATOM 0 HD21 LEU B 70 -8.947 3.887 -11.430 1.00 1.04 H new ATOM 0 HD22 LEU B 70 -10.528 3.268 -11.965 1.00 1.04 H new ATOM 0 HD23 LEU B 70 -10.394 4.161 -10.431 1.00 1.04 H new ATOM 2926 N TYR B 71 -10.738 1.208 -6.673 1.00 0.84 N ATOM 2927 CA TYR B 71 -10.105 1.611 -5.422 1.00 0.84 C ATOM 2928 C TYR B 71 -9.583 0.377 -4.691 1.00 0.83 C ATOM 2929 O TYR B 71 -8.501 0.398 -4.105 1.00 0.82 O ATOM 2930 CB TYR B 71 -11.090 2.372 -4.527 1.00 0.91 C ATOM 2931 CG TYR B 71 -11.889 3.445 -5.247 1.00 0.92 C ATOM 2932 CD1 TYR B 71 -11.302 4.252 -6.220 1.00 0.93 C ATOM 2933 CD2 TYR B 71 -13.237 3.643 -4.963 1.00 1.01 C ATOM 2934 CE1 TYR B 71 -12.035 5.219 -6.883 1.00 1.00 C ATOM 2935 CE2 TYR B 71 -13.974 4.611 -5.621 1.00 1.09 C ATOM 2936 CZ TYR B 71 -13.370 5.393 -6.580 1.00 1.07 C ATOM 2937 OH TYR B 71 -14.107 6.348 -7.242 1.00 1.19 O ATOM 0 H TYR B 71 -11.752 1.321 -6.692 1.00 0.84 H new ATOM 0 HA TYR B 71 -9.274 2.277 -5.654 1.00 0.84 H new ATOM 0 HB2 TYR B 71 -11.782 1.659 -4.080 1.00 0.91 H new ATOM 0 HB3 TYR B 71 -10.537 2.835 -3.709 1.00 0.91 H new ATOM 0 HD1 TYR B 71 -10.257 4.120 -6.460 1.00 0.93 H new ATOM 0 HD2 TYR B 71 -13.717 3.029 -4.215 1.00 1.01 H new ATOM 0 HE1 TYR B 71 -11.565 5.835 -7.635 1.00 1.00 H new ATOM 0 HE2 TYR B 71 -15.018 4.753 -5.384 1.00 1.09 H new ATOM 0 HH TYR B 71 -15.029 6.339 -6.909 1.00 1.19 H new ATOM 2947 N ASP B 72 -10.367 -0.697 -4.736 1.00 0.86 N ATOM 2948 CA ASP B 72 -9.984 -1.958 -4.109 1.00 0.88 C ATOM 2949 C ASP B 72 -8.747 -2.514 -4.808 1.00 0.85 C ATOM 2950 O ASP B 72 -7.803 -2.982 -4.164 1.00 0.85 O ATOM 2951 CB ASP B 72 -11.135 -2.968 -4.193 1.00 0.95 C ATOM 2952 CG ASP B 72 -10.819 -4.296 -3.525 1.00 1.07 C ATOM 2953 OD1 ASP B 72 -10.143 -5.141 -4.152 1.00 1.32 O ATOM 2954 OD2 ASP B 72 -11.276 -4.514 -2.383 1.00 1.31 O ATOM 0 H ASP B 72 -11.274 -0.719 -5.202 1.00 0.86 H new ATOM 0 HA ASP B 72 -9.758 -1.781 -3.057 1.00 0.88 H new ATOM 0 HB2 ASP B 72 -12.022 -2.537 -3.728 1.00 0.95 H new ATOM 0 HB3 ASP B 72 -11.378 -3.145 -5.241 1.00 0.95 H new ATOM 2959 N SER B 73 -8.754 -2.425 -6.138 1.00 0.84 N ATOM 2960 CA SER B 73 -7.646 -2.900 -6.952 1.00 0.83 C ATOM 2961 C SER B 73 -6.395 -2.054 -6.709 1.00 0.79 C ATOM 2962 O SER B 73 -5.274 -2.495 -6.960 1.00 0.78 O ATOM 2963 CB SER B 73 -8.029 -2.867 -8.432 1.00 0.86 C ATOM 2964 OG SER B 73 -9.271 -3.522 -8.657 1.00 0.91 O ATOM 0 H SER B 73 -9.524 -2.024 -6.674 1.00 0.84 H new ATOM 0 HA SER B 73 -7.424 -3.929 -6.667 1.00 0.83 H new ATOM 0 HB2 SER B 73 -8.094 -1.833 -8.771 1.00 0.86 H new ATOM 0 HB3 SER B 73 -7.249 -3.348 -9.023 1.00 0.86 H new ATOM 0 HG SER B 73 -10.006 -2.926 -8.402 1.00 0.91 H new ATOM 2970 N ALA B 74 -6.600 -0.834 -6.215 1.00 0.79 N ATOM 2971 CA ALA B 74 -5.498 0.071 -5.923 1.00 0.78 C ATOM 2972 C ALA B 74 -4.736 -0.421 -4.710 1.00 0.74 C ATOM 2973 O ALA B 74 -3.507 -0.341 -4.653 1.00 0.72 O ATOM 2974 CB ALA B 74 -6.008 1.481 -5.692 1.00 0.81 C ATOM 0 H ALA B 74 -7.523 -0.452 -6.009 1.00 0.79 H new ATOM 0 HA ALA B 74 -4.825 0.091 -6.781 1.00 0.78 H new ATOM 0 HB1 ALA B 74 -5.168 2.141 -5.475 1.00 0.81 H new ATOM 0 HB2 ALA B 74 -6.524 1.832 -6.585 1.00 0.81 H new ATOM 0 HB3 ALA B 74 -6.699 1.484 -4.849 1.00 0.81 H new ATOM 2980 N LEU B 75 -5.473 -0.948 -3.745 1.00 0.76 N ATOM 2981 CA LEU B 75 -4.869 -1.482 -2.536 1.00 0.76 C ATOM 2982 C LEU B 75 -4.100 -2.754 -2.873 1.00 0.73 C ATOM 2983 O LEU B 75 -3.105 -3.084 -2.232 1.00 0.71 O ATOM 2984 CB LEU B 75 -5.935 -1.763 -1.473 1.00 0.81 C ATOM 2985 CG LEU B 75 -5.794 -0.954 -0.180 1.00 0.89 C ATOM 2986 CD1 LEU B 75 -4.462 -1.254 0.493 1.00 1.13 C ATOM 2987 CD2 LEU B 75 -5.932 0.538 -0.459 1.00 1.14 C ATOM 0 H LEU B 75 -6.490 -1.017 -3.776 1.00 0.76 H new ATOM 0 HA LEU B 75 -4.179 -0.743 -2.128 1.00 0.76 H new ATOM 0 HB2 LEU B 75 -6.916 -1.563 -1.903 1.00 0.81 H new ATOM 0 HB3 LEU B 75 -5.907 -2.824 -1.224 1.00 0.81 H new ATOM 0 HG LEU B 75 -6.596 -1.248 0.497 1.00 0.89 H new ATOM 0 HD11 LEU B 75 -4.378 -0.671 1.410 1.00 1.13 H new ATOM 0 HD12 LEU B 75 -4.406 -2.316 0.732 1.00 1.13 H new ATOM 0 HD13 LEU B 75 -3.647 -0.990 -0.180 1.00 1.13 H new ATOM 0 HD21 LEU B 75 -5.829 1.094 0.473 1.00 1.14 H new ATOM 0 HD22 LEU B 75 -5.155 0.851 -1.156 1.00 1.14 H new ATOM 0 HD23 LEU B 75 -6.911 0.738 -0.894 1.00 1.14 H new ATOM 2999 N SER B 76 -4.568 -3.462 -3.895 1.00 0.75 N ATOM 3000 CA SER B 76 -3.910 -4.676 -4.341 1.00 0.75 C ATOM 3001 C SER B 76 -2.550 -4.338 -4.944 1.00 0.72 C ATOM 3002 O SER B 76 -1.596 -5.107 -4.821 1.00 0.72 O ATOM 3003 CB SER B 76 -4.788 -5.406 -5.358 1.00 0.81 C ATOM 3004 OG SER B 76 -6.140 -5.437 -4.925 1.00 0.91 O ATOM 0 H SER B 76 -5.401 -3.213 -4.428 1.00 0.75 H new ATOM 0 HA SER B 76 -3.755 -5.335 -3.487 1.00 0.75 H new ATOM 0 HB2 SER B 76 -4.722 -4.908 -6.326 1.00 0.81 H new ATOM 0 HB3 SER B 76 -4.422 -6.423 -5.497 1.00 0.81 H new ATOM 0 HG SER B 76 -6.686 -5.907 -5.590 1.00 0.91 H new ATOM 3010 N LYS B 77 -2.462 -3.173 -5.577 1.00 0.72 N ATOM 3011 CA LYS B 77 -1.218 -2.722 -6.179 1.00 0.71 C ATOM 3012 C LYS B 77 -0.158 -2.545 -5.101 1.00 0.67 C ATOM 3013 O LYS B 77 0.999 -2.925 -5.278 1.00 0.66 O ATOM 3014 CB LYS B 77 -1.426 -1.393 -6.909 1.00 0.75 C ATOM 3015 CG LYS B 77 -2.246 -1.494 -8.187 1.00 0.93 C ATOM 3016 CD LYS B 77 -2.858 -0.149 -8.552 1.00 1.09 C ATOM 3017 CE LYS B 77 -2.561 0.246 -9.989 1.00 1.34 C ATOM 3018 NZ LYS B 77 -3.257 1.509 -10.368 1.00 1.68 N ATOM 0 H LYS B 77 -3.241 -2.524 -5.685 1.00 0.72 H new ATOM 0 HA LYS B 77 -0.889 -3.473 -6.898 1.00 0.71 H new ATOM 0 HB2 LYS B 77 -1.917 -0.695 -6.232 1.00 0.75 H new ATOM 0 HB3 LYS B 77 -0.451 -0.970 -7.151 1.00 0.75 H new ATOM 0 HG2 LYS B 77 -1.613 -1.842 -9.003 1.00 0.93 H new ATOM 0 HG3 LYS B 77 -3.036 -2.234 -8.059 1.00 0.93 H new ATOM 0 HD2 LYS B 77 -3.937 -0.191 -8.404 1.00 1.09 H new ATOM 0 HD3 LYS B 77 -2.473 0.618 -7.879 1.00 1.09 H new ATOM 0 HE2 LYS B 77 -1.486 0.370 -10.118 1.00 1.34 H new ATOM 0 HE3 LYS B 77 -2.872 -0.556 -10.659 1.00 1.34 H new ATOM 0 HZ1 LYS B 77 -3.650 1.415 -11.326 1.00 1.68 H new ATOM 0 HZ2 LYS B 77 -4.028 1.696 -9.695 1.00 1.68 H new ATOM 0 HZ3 LYS B 77 -2.580 2.298 -10.347 1.00 1.68 H new ATOM 3032 N ILE B 78 -0.581 -1.984 -3.973 1.00 0.66 N ATOM 3033 CA ILE B 78 0.312 -1.752 -2.850 1.00 0.64 C ATOM 3034 C ILE B 78 0.818 -3.078 -2.283 1.00 0.63 C ATOM 3035 O ILE B 78 1.964 -3.169 -1.849 1.00 0.64 O ATOM 3036 CB ILE B 78 -0.378 -0.898 -1.743 1.00 0.67 C ATOM 3037 CG1 ILE B 78 0.499 0.305 -1.371 1.00 0.90 C ATOM 3038 CG2 ILE B 78 -0.714 -1.712 -0.497 1.00 0.79 C ATOM 3039 CD1 ILE B 78 1.790 -0.060 -0.659 1.00 1.15 C ATOM 0 H ILE B 78 -1.542 -1.681 -3.815 1.00 0.66 H new ATOM 0 HA ILE B 78 1.169 -1.186 -3.214 1.00 0.64 H new ATOM 0 HB ILE B 78 -1.322 -0.545 -2.158 1.00 0.67 H new ATOM 0 HG12 ILE B 78 0.742 0.857 -2.279 1.00 0.90 H new ATOM 0 HG13 ILE B 78 -0.077 0.976 -0.734 1.00 0.90 H new ATOM 0 HG21 ILE B 78 -1.192 -1.068 0.241 1.00 0.79 H new ATOM 0 HG22 ILE B 78 -1.391 -2.523 -0.764 1.00 0.79 H new ATOM 0 HG23 ILE B 78 0.202 -2.128 -0.076 1.00 0.79 H new ATOM 0 HD11 ILE B 78 2.350 0.847 -0.432 1.00 1.15 H new ATOM 0 HD12 ILE B 78 1.558 -0.585 0.268 1.00 1.15 H new ATOM 0 HD13 ILE B 78 2.390 -0.705 -1.301 1.00 1.15 H new ATOM 3051 N GLU B 79 -0.031 -4.109 -2.318 1.00 0.65 N ATOM 3052 CA GLU B 79 0.341 -5.426 -1.802 1.00 0.67 C ATOM 3053 C GLU B 79 1.547 -5.976 -2.551 1.00 0.67 C ATOM 3054 O GLU B 79 2.474 -6.509 -1.946 1.00 0.70 O ATOM 3055 CB GLU B 79 -0.825 -6.413 -1.915 1.00 0.71 C ATOM 3056 CG GLU B 79 -0.505 -7.801 -1.372 1.00 0.77 C ATOM 3057 CD GLU B 79 -1.110 -8.911 -2.207 1.00 1.10 C ATOM 3058 OE1 GLU B 79 -1.080 -8.815 -3.453 1.00 1.74 O ATOM 3059 OE2 GLU B 79 -1.620 -9.892 -1.619 1.00 1.59 O ATOM 0 H GLU B 79 -0.977 -4.056 -2.697 1.00 0.65 H new ATOM 0 HA GLU B 79 0.597 -5.306 -0.749 1.00 0.67 H new ATOM 0 HB2 GLU B 79 -1.684 -6.011 -1.377 1.00 0.71 H new ATOM 0 HB3 GLU B 79 -1.116 -6.500 -2.962 1.00 0.71 H new ATOM 0 HG2 GLU B 79 0.577 -7.930 -1.332 1.00 0.77 H new ATOM 0 HG3 GLU B 79 -0.873 -7.880 -0.349 1.00 0.77 H new ATOM 3066 N LYS B 80 1.534 -5.826 -3.872 1.00 0.67 N ATOM 3067 CA LYS B 80 2.625 -6.309 -4.705 1.00 0.69 C ATOM 3068 C LYS B 80 3.924 -5.583 -4.372 1.00 0.68 C ATOM 3069 O LYS B 80 5.005 -6.168 -4.434 1.00 0.72 O ATOM 3070 CB LYS B 80 2.282 -6.148 -6.184 1.00 0.72 C ATOM 3071 CG LYS B 80 2.069 -7.476 -6.893 1.00 0.79 C ATOM 3072 CD LYS B 80 1.467 -7.296 -8.276 1.00 1.18 C ATOM 3073 CE LYS B 80 1.073 -8.637 -8.882 1.00 1.78 C ATOM 3074 NZ LYS B 80 0.068 -9.355 -8.047 1.00 2.05 N ATOM 0 H LYS B 80 0.779 -5.373 -4.387 1.00 0.67 H new ATOM 0 HA LYS B 80 2.767 -7.370 -4.498 1.00 0.69 H new ATOM 0 HB2 LYS B 80 1.380 -5.543 -6.278 1.00 0.72 H new ATOM 0 HB3 LYS B 80 3.085 -5.602 -6.680 1.00 0.72 H new ATOM 0 HG2 LYS B 80 3.022 -7.998 -6.978 1.00 0.79 H new ATOM 0 HG3 LYS B 80 1.413 -8.106 -6.292 1.00 0.79 H new ATOM 0 HD2 LYS B 80 0.591 -6.650 -8.213 1.00 1.18 H new ATOM 0 HD3 LYS B 80 2.185 -6.797 -8.926 1.00 1.18 H new ATOM 0 HE2 LYS B 80 0.667 -8.478 -9.881 1.00 1.78 H new ATOM 0 HE3 LYS B 80 1.961 -9.259 -8.994 1.00 1.78 H new ATOM 0 HZ1 LYS B 80 -0.431 -10.056 -8.631 1.00 2.05 H new ATOM 0 HZ2 LYS B 80 0.550 -9.838 -7.262 1.00 2.05 H new ATOM 0 HZ3 LYS B 80 -0.617 -8.672 -7.665 1.00 2.05 H new ATOM 3088 N LEU B 81 3.816 -4.311 -4.015 1.00 0.65 N ATOM 3089 CA LEU B 81 4.989 -3.524 -3.653 1.00 0.67 C ATOM 3090 C LEU B 81 5.547 -4.001 -2.320 1.00 0.68 C ATOM 3091 O LEU B 81 6.760 -4.053 -2.125 1.00 0.72 O ATOM 3092 CB LEU B 81 4.643 -2.034 -3.581 1.00 0.67 C ATOM 3093 CG LEU B 81 5.179 -1.176 -4.729 1.00 0.78 C ATOM 3094 CD1 LEU B 81 6.701 -1.173 -4.734 1.00 1.02 C ATOM 3095 CD2 LEU B 81 4.644 -1.667 -6.067 1.00 0.97 C ATOM 0 H LEU B 81 2.933 -3.803 -3.968 1.00 0.65 H new ATOM 0 HA LEU B 81 5.747 -3.661 -4.424 1.00 0.67 H new ATOM 0 HB2 LEU B 81 3.558 -1.932 -3.550 1.00 0.67 H new ATOM 0 HB3 LEU B 81 5.027 -1.635 -2.642 1.00 0.67 H new ATOM 0 HG LEU B 81 4.833 -0.154 -4.576 1.00 0.78 H new ATOM 0 HD11 LEU B 81 7.061 -0.557 -5.558 1.00 1.02 H new ATOM 0 HD12 LEU B 81 7.067 -0.767 -3.791 1.00 1.02 H new ATOM 0 HD13 LEU B 81 7.066 -2.193 -4.857 1.00 1.02 H new ATOM 0 HD21 LEU B 81 5.038 -1.042 -6.868 1.00 0.97 H new ATOM 0 HD22 LEU B 81 4.954 -2.700 -6.226 1.00 0.97 H new ATOM 0 HD23 LEU B 81 3.555 -1.611 -6.066 1.00 0.97 H new ATOM 3107 N ILE B 82 4.647 -4.358 -1.410 1.00 0.68 N ATOM 3108 CA ILE B 82 5.035 -4.856 -0.095 1.00 0.72 C ATOM 3109 C ILE B 82 5.768 -6.185 -0.242 1.00 0.77 C ATOM 3110 O ILE B 82 6.793 -6.412 0.401 1.00 0.81 O ATOM 3111 CB ILE B 82 3.809 -5.029 0.831 1.00 0.72 C ATOM 3112 CG1 ILE B 82 3.081 -3.689 0.986 1.00 0.70 C ATOM 3113 CG2 ILE B 82 4.225 -5.582 2.192 1.00 0.78 C ATOM 3114 CD1 ILE B 82 1.874 -3.746 1.897 1.00 0.72 C ATOM 0 H ILE B 82 3.639 -4.311 -1.560 1.00 0.68 H new ATOM 0 HA ILE B 82 5.697 -4.121 0.362 1.00 0.72 H new ATOM 0 HB ILE B 82 3.128 -5.749 0.377 1.00 0.72 H new ATOM 0 HG12 ILE B 82 3.781 -2.949 1.374 1.00 0.70 H new ATOM 0 HG13 ILE B 82 2.765 -3.343 0.002 1.00 0.70 H new ATOM 0 HG21 ILE B 82 3.344 -5.694 2.824 1.00 0.78 H new ATOM 0 HG22 ILE B 82 4.703 -6.553 2.060 1.00 0.78 H new ATOM 0 HG23 ILE B 82 4.926 -4.894 2.665 1.00 0.78 H new ATOM 0 HD11 ILE B 82 1.415 -2.759 1.954 1.00 0.72 H new ATOM 0 HD12 ILE B 82 1.152 -4.460 1.500 1.00 0.72 H new ATOM 0 HD13 ILE B 82 2.185 -4.060 2.893 1.00 0.72 H new ATOM 3126 N GLU B 83 5.241 -7.045 -1.114 1.00 0.78 N ATOM 3127 CA GLU B 83 5.838 -8.350 -1.381 1.00 0.85 C ATOM 3128 C GLU B 83 7.220 -8.181 -2.007 1.00 0.87 C ATOM 3129 O GLU B 83 8.096 -9.026 -1.848 1.00 0.94 O ATOM 3130 CB GLU B 83 4.939 -9.161 -2.315 1.00 0.88 C ATOM 3131 CG GLU B 83 5.025 -10.663 -2.086 1.00 1.11 C ATOM 3132 CD GLU B 83 3.912 -11.192 -1.201 1.00 1.73 C ATOM 3133 OE1 GLU B 83 3.414 -10.442 -0.340 1.00 2.41 O ATOM 3134 OE2 GLU B 83 3.536 -12.374 -1.360 1.00 2.25 O ATOM 0 H GLU B 83 4.394 -6.857 -1.651 1.00 0.78 H new ATOM 0 HA GLU B 83 5.941 -8.885 -0.437 1.00 0.85 H new ATOM 0 HB2 GLU B 83 3.906 -8.840 -2.182 1.00 0.88 H new ATOM 0 HB3 GLU B 83 5.210 -8.943 -3.348 1.00 0.88 H new ATOM 0 HG2 GLU B 83 4.991 -11.174 -3.048 1.00 1.11 H new ATOM 0 HG3 GLU B 83 5.987 -10.901 -1.632 1.00 1.11 H new ATOM 3141 N THR B 84 7.403 -7.080 -2.724 1.00 0.83 N ATOM 3142 CA THR B 84 8.684 -6.787 -3.349 1.00 0.87 C ATOM 3143 C THR B 84 9.674 -6.292 -2.299 1.00 0.91 C ATOM 3144 O THR B 84 10.855 -6.628 -2.340 1.00 0.98 O ATOM 3145 CB THR B 84 8.547 -5.737 -4.472 1.00 0.84 C ATOM 3146 OG1 THR B 84 7.527 -6.138 -5.400 1.00 0.84 O ATOM 3147 CG2 THR B 84 9.864 -5.549 -5.217 1.00 0.87 C ATOM 0 H THR B 84 6.682 -6.377 -2.886 1.00 0.83 H new ATOM 0 HA THR B 84 9.052 -7.710 -3.797 1.00 0.87 H new ATOM 0 HB THR B 84 8.272 -4.789 -4.010 1.00 0.84 H new ATOM 0 HG1 THR B 84 6.658 -6.148 -4.947 1.00 0.84 H new ATOM 0 HG21 THR B 84 9.735 -4.803 -6.002 1.00 0.87 H new ATOM 0 HG22 THR B 84 10.632 -5.213 -4.520 1.00 0.87 H new ATOM 0 HG23 THR B 84 10.168 -6.496 -5.663 1.00 0.87 H new ATOM 3155 N LEU B 85 9.178 -5.494 -1.357 1.00 0.90 N ATOM 3156 CA LEU B 85 10.007 -4.973 -0.280 1.00 0.98 C ATOM 3157 C LEU B 85 10.390 -6.099 0.676 1.00 1.07 C ATOM 3158 O LEU B 85 11.494 -6.120 1.220 1.00 1.22 O ATOM 3159 CB LEU B 85 9.260 -3.875 0.483 1.00 0.97 C ATOM 3160 CG LEU B 85 10.049 -3.218 1.618 1.00 0.91 C ATOM 3161 CD1 LEU B 85 10.734 -1.947 1.134 1.00 1.03 C ATOM 3162 CD2 LEU B 85 9.143 -2.932 2.810 1.00 1.01 C ATOM 0 H LEU B 85 8.204 -5.195 -1.320 1.00 0.90 H new ATOM 0 HA LEU B 85 10.913 -4.547 -0.712 1.00 0.98 H new ATOM 0 HB2 LEU B 85 8.961 -3.102 -0.225 1.00 0.97 H new ATOM 0 HB3 LEU B 85 8.345 -4.300 0.896 1.00 0.97 H new ATOM 0 HG LEU B 85 10.823 -3.913 1.943 1.00 0.91 H new ATOM 0 HD11 LEU B 85 11.289 -1.497 1.957 1.00 1.03 H new ATOM 0 HD12 LEU B 85 11.421 -2.190 0.323 1.00 1.03 H new ATOM 0 HD13 LEU B 85 9.983 -1.243 0.775 1.00 1.03 H new ATOM 0 HD21 LEU B 85 9.724 -2.465 3.605 1.00 1.01 H new ATOM 0 HD22 LEU B 85 8.341 -2.260 2.504 1.00 1.01 H new ATOM 0 HD23 LEU B 85 8.715 -3.866 3.174 1.00 1.01 H new ATOM 3174 N SER B 86 9.464 -7.030 0.867 1.00 1.08 N ATOM 3175 CA SER B 86 9.675 -8.171 1.745 1.00 1.20 C ATOM 3176 C SER B 86 9.115 -9.434 1.091 1.00 1.59 C ATOM 3177 O SER B 86 7.929 -9.726 1.226 1.00 2.11 O ATOM 3178 CB SER B 86 8.991 -7.932 3.096 1.00 1.48 C ATOM 3179 OG SER B 86 8.580 -6.576 3.231 1.00 1.78 O ATOM 0 H SER B 86 8.548 -7.015 0.418 1.00 1.08 H new ATOM 0 HA SER B 86 10.745 -8.298 1.913 1.00 1.20 H new ATOM 0 HB2 SER B 86 8.126 -8.588 3.190 1.00 1.48 H new ATOM 0 HB3 SER B 86 9.676 -8.190 3.904 1.00 1.48 H new ATOM 0 HG SER B 86 8.145 -6.451 4.100 1.00 1.78 H new