USER MOD reduce.3.24.130724 H: found=0, std=0, add=1344, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1346 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 42 SER OG : rot 180:sc= 0.506 USER MOD Set 1.2: B 46 LYS NZ :NH3+ -109:sc= 0.557 (180deg=0) USER MOD Set 2.1: A 42 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 46 LYS NZ :NH3+ -152:sc= 1.57 (180deg=0.263) USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0307 USER MOD Single : A 9 ASN : amide:sc= 0 X(o=0,f=-0.044) USER MOD Single : A 10 LYS NZ :NH3+ -176:sc= 1.26 (180deg=1.11) USER MOD Single : A 15 LYS NZ :NH3+ 177:sc= 1.28 (180deg=1.23) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot 78:sc= 1.18 USER MOD Single : A 25 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0772) USER MOD Single : A 26 LYS NZ :NH3+ 147:sc= 1.3 (180deg=0.885) USER MOD Single : A 35 LYS NZ :NH3+ 163:sc= 1.27 (180deg=0.662) USER MOD Single : A 37 SER OG : rot 73:sc= 1.03 USER MOD Single : A 39 ASN : amide:sc= 0.98 K(o=0.98,f=-0.66) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc= -0.131 X(o=-0.13,f=-0.23) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= 1.22 K(o=1.2,f=-0.62) USER MOD Single : A 57 LYS NZ :NH3+ 178:sc= 0.124 (180deg=0.119) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 26:sc= 1.12 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 171:sc= 1.2 (180deg=1.05) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 74:sc= 1.26 USER MOD Single : A 76 SER OG : rot -170:sc= -0.278 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 129:sc= -0.177 (180deg=-0.809) USER MOD Single : A 84 THR OG1 : rot 180:sc= -0.0049 USER MOD Single : A 86 SER OG : rot 72:sc= 0.00379 USER MOD Single : B 10 LYS NZ :NH3+ -156:sc= 1.31 (180deg=1.07) USER MOD Single : B 15 LYS NZ :NH3+ -156:sc= 1.17 (180deg=1.1) USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 SER OG : rot 87:sc= 1.21 USER MOD Single : B 25 LYS NZ :NH3+ -166:sc= -0.0432 (180deg=-0.231) USER MOD Single : B 26 LYS NZ :NH3+ 169:sc= 1.32 (180deg=1.03) USER MOD Single : B 35 LYS NZ :NH3+ 164:sc= -0.0267 (180deg=-0.289) USER MOD Single : B 37 SER OG : rot 74:sc= 0.419 USER MOD Single : B 39 ASN : amide:sc= 1.11 K(o=1.1,f=-0.68) USER MOD Single : B 44 LYS NZ :NH3+ -150:sc= 1.67 (180deg=0.306) USER MOD Single : B 47 THR OG1 : rot 89:sc= 0.104 USER MOD Single : B 50 GLN : amide:sc= -0.0232 X(o=-0.023,f=-0.26) USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 ASN : amide:sc= 1.19 K(o=1.2,f=-0.1) USER MOD Single : B 57 LYS NZ :NH3+ -122:sc= -0.763 (180deg=-1.32) USER MOD Single : B 62 TYR OH : rot 165:sc= 0.596 USER MOD Single : B 63 THR OG1 : rot -76:sc= 0.635 USER MOD Single : B 64 TYR OH : rot 180:sc= 0 USER MOD Single : B 69 LYS NZ :NH3+ 174:sc= 0.66 (180deg=0.501) USER MOD Single : B 71 TYR OH : rot 180:sc= 0 USER MOD Single : B 73 SER OG : rot 68:sc= 1.26 USER MOD Single : B 76 SER OG : rot 73:sc= 1.23 USER MOD Single : B 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 80 LYS NZ :NH3+ 173:sc=-0.00378 (180deg=-0.0921) USER MOD Single : B 84 THR OG1 : rot 67:sc= 1.24 USER MOD Single : B 86 SER OG : rot -139:sc= 1.18 USER MOD ----------------------------------------------------------------- ATOM 77 N GLN A 6 -20.880 16.105 -7.363 1.00 1.91 N ATOM 78 CA GLN A 6 -20.582 14.710 -7.653 1.00 1.87 C ATOM 79 C GLN A 6 -19.332 14.584 -8.525 1.00 1.83 C ATOM 80 O GLN A 6 -18.416 13.821 -8.204 1.00 1.77 O ATOM 81 CB GLN A 6 -21.768 14.040 -8.349 1.00 1.89 C ATOM 82 CG GLN A 6 -21.533 12.566 -8.647 1.00 1.95 C ATOM 83 CD GLN A 6 -22.585 11.972 -9.562 1.00 1.96 C ATOM 84 OE1 GLN A 6 -22.455 12.006 -10.784 1.00 2.22 O ATOM 85 NE2 GLN A 6 -23.627 11.410 -8.977 1.00 2.13 N ATOM 0 HA GLN A 6 -20.395 14.207 -6.704 1.00 1.87 H new ATOM 0 HB2 GLN A 6 -22.654 14.141 -7.721 1.00 1.89 H new ATOM 0 HB3 GLN A 6 -21.977 14.564 -9.282 1.00 1.89 H new ATOM 0 HG2 GLN A 6 -20.551 12.446 -9.105 1.00 1.95 H new ATOM 0 HG3 GLN A 6 -21.518 12.009 -7.710 1.00 1.95 H new ATOM 0 HE21 GLN A 6 -23.698 11.402 -7.960 1.00 2.13 H new ATOM 0 HE22 GLN A 6 -24.361 10.983 -9.543 1.00 2.13 H new ATOM 94 N THR A 7 -19.293 15.349 -9.613 1.00 1.86 N ATOM 95 CA THR A 7 -18.167 15.308 -10.540 1.00 1.83 C ATOM 96 C THR A 7 -16.871 15.768 -9.881 1.00 1.79 C ATOM 97 O THR A 7 -15.826 15.134 -10.038 1.00 1.71 O ATOM 98 CB THR A 7 -18.442 16.169 -11.785 1.00 1.88 C ATOM 99 OG1 THR A 7 -19.149 17.359 -11.412 1.00 2.15 O ATOM 100 CG2 THR A 7 -19.251 15.386 -12.809 1.00 1.95 C ATOM 0 H THR A 7 -20.029 16.005 -9.874 1.00 1.86 H new ATOM 0 HA THR A 7 -18.049 14.267 -10.842 1.00 1.83 H new ATOM 0 HB THR A 7 -17.487 16.444 -12.233 1.00 1.88 H new ATOM 0 HG1 THR A 7 -19.319 17.902 -12.210 1.00 2.15 H new ATOM 0 HG21 THR A 7 -19.435 16.012 -13.682 1.00 1.95 H new ATOM 0 HG22 THR A 7 -18.695 14.498 -13.110 1.00 1.95 H new ATOM 0 HG23 THR A 7 -20.203 15.087 -12.369 1.00 1.95 H new ATOM 108 N ARG A 8 -16.948 16.867 -9.139 1.00 1.84 N ATOM 109 CA ARG A 8 -15.783 17.420 -8.457 1.00 1.82 C ATOM 110 C ARG A 8 -15.265 16.473 -7.378 1.00 1.75 C ATOM 111 O ARG A 8 -14.058 16.281 -7.230 1.00 1.69 O ATOM 112 CB ARG A 8 -16.138 18.770 -7.833 1.00 1.94 C ATOM 113 CG ARG A 8 -14.978 19.450 -7.116 1.00 2.03 C ATOM 114 CD ARG A 8 -13.827 19.765 -8.059 1.00 2.06 C ATOM 115 NE ARG A 8 -14.290 20.231 -9.362 1.00 2.06 N ATOM 116 CZ ARG A 8 -13.907 19.698 -10.521 1.00 2.08 C ATOM 117 NH1 ARG A 8 -13.019 18.707 -10.540 1.00 2.10 N ATOM 118 NH2 ARG A 8 -14.411 20.161 -11.655 1.00 2.22 N ATOM 0 H ARG A 8 -17.809 17.395 -8.994 1.00 1.84 H new ATOM 0 HA ARG A 8 -14.993 17.553 -9.197 1.00 1.82 H new ATOM 0 HB2 ARG A 8 -16.506 19.434 -8.615 1.00 1.94 H new ATOM 0 HB3 ARG A 8 -16.955 18.627 -7.125 1.00 1.94 H new ATOM 0 HG2 ARG A 8 -15.329 20.372 -6.653 1.00 2.03 H new ATOM 0 HG3 ARG A 8 -14.622 18.806 -6.312 1.00 2.03 H new ATOM 0 HD2 ARG A 8 -13.189 20.526 -7.609 1.00 2.06 H new ATOM 0 HD3 ARG A 8 -13.214 18.873 -8.191 1.00 2.06 H new ATOM 0 HE ARG A 8 -14.946 21.012 -9.387 1.00 2.06 H new ATOM 0 HH11 ARG A 8 -12.630 18.354 -9.666 1.00 2.10 H new ATOM 0 HH12 ARG A 8 -12.727 18.301 -11.429 1.00 2.10 H new ATOM 0 HH21 ARG A 8 -15.089 20.923 -11.638 1.00 2.22 H new ATOM 0 HH22 ARG A 8 -14.121 19.756 -12.545 1.00 2.22 H new ATOM 132 N ASN A 9 -16.188 15.881 -6.638 1.00 1.76 N ATOM 133 CA ASN A 9 -15.849 14.962 -5.556 1.00 1.72 C ATOM 134 C ASN A 9 -15.153 13.709 -6.079 1.00 1.61 C ATOM 135 O ASN A 9 -14.097 13.324 -5.573 1.00 1.56 O ATOM 136 CB ASN A 9 -17.115 14.577 -4.785 1.00 1.78 C ATOM 137 CG ASN A 9 -16.877 13.506 -3.739 1.00 1.75 C ATOM 138 OD1 ASN A 9 -17.025 12.315 -4.014 1.00 1.75 O ATOM 139 ND2 ASN A 9 -16.522 13.923 -2.532 1.00 1.84 N ATOM 0 H ASN A 9 -17.190 16.021 -6.767 1.00 1.76 H new ATOM 0 HA ASN A 9 -15.155 15.472 -4.888 1.00 1.72 H new ATOM 0 HB2 ASN A 9 -17.521 15.465 -4.300 1.00 1.78 H new ATOM 0 HB3 ASN A 9 -17.869 14.226 -5.490 1.00 1.78 H new ATOM 0 HD21 ASN A 9 -16.360 13.247 -1.786 1.00 1.84 H new ATOM 0 HD22 ASN A 9 -16.411 14.920 -2.349 1.00 1.84 H new ATOM 146 N LYS A 10 -15.733 13.090 -7.107 1.00 1.60 N ATOM 147 CA LYS A 10 -15.175 11.865 -7.681 1.00 1.52 C ATOM 148 C LYS A 10 -13.789 12.113 -8.284 1.00 1.47 C ATOM 149 O LYS A 10 -12.911 11.252 -8.215 1.00 1.41 O ATOM 150 CB LYS A 10 -16.139 11.279 -8.730 1.00 1.53 C ATOM 151 CG LYS A 10 -15.634 11.358 -10.165 1.00 1.59 C ATOM 152 CD LYS A 10 -15.750 10.020 -10.878 1.00 1.70 C ATOM 153 CE LYS A 10 -14.759 9.916 -12.029 1.00 2.07 C ATOM 154 NZ LYS A 10 -14.995 8.712 -12.868 1.00 2.48 N ATOM 0 H LYS A 10 -16.587 13.416 -7.559 1.00 1.60 H new ATOM 0 HA LYS A 10 -15.055 11.137 -6.878 1.00 1.52 H new ATOM 0 HB2 LYS A 10 -16.333 10.235 -8.483 1.00 1.53 H new ATOM 0 HB3 LYS A 10 -17.091 11.805 -8.664 1.00 1.53 H new ATOM 0 HG2 LYS A 10 -16.203 12.111 -10.710 1.00 1.59 H new ATOM 0 HG3 LYS A 10 -14.593 11.682 -10.167 1.00 1.59 H new ATOM 0 HD2 LYS A 10 -15.572 9.212 -10.169 1.00 1.70 H new ATOM 0 HD3 LYS A 10 -16.764 9.895 -11.257 1.00 1.70 H new ATOM 0 HE2 LYS A 10 -14.831 10.809 -12.650 1.00 2.07 H new ATOM 0 HE3 LYS A 10 -13.745 9.886 -11.631 1.00 2.07 H new ATOM 0 HZ1 LYS A 10 -14.256 8.647 -13.597 1.00 2.48 H new ATOM 0 HZ2 LYS A 10 -14.968 7.861 -12.270 1.00 2.48 H new ATOM 0 HZ3 LYS A 10 -15.927 8.784 -13.325 1.00 2.48 H new ATOM 168 N GLU A 11 -13.587 13.296 -8.856 1.00 1.52 N ATOM 169 CA GLU A 11 -12.308 13.633 -9.466 1.00 1.50 C ATOM 170 C GLU A 11 -11.233 13.815 -8.397 1.00 1.45 C ATOM 171 O GLU A 11 -10.092 13.387 -8.568 1.00 1.38 O ATOM 172 CB GLU A 11 -12.431 14.906 -10.306 1.00 1.58 C ATOM 173 CG GLU A 11 -11.328 15.057 -11.344 1.00 1.63 C ATOM 174 CD GLU A 11 -11.106 16.496 -11.764 1.00 1.77 C ATOM 175 OE1 GLU A 11 -11.981 17.064 -12.457 1.00 1.96 O ATOM 176 OE2 GLU A 11 -10.060 17.068 -11.403 1.00 1.90 O ATOM 0 H GLU A 11 -14.290 14.033 -8.909 1.00 1.52 H new ATOM 0 HA GLU A 11 -12.017 12.809 -10.118 1.00 1.50 H new ATOM 0 HB2 GLU A 11 -13.397 14.907 -10.811 1.00 1.58 H new ATOM 0 HB3 GLU A 11 -12.417 15.772 -9.644 1.00 1.58 H new ATOM 0 HG2 GLU A 11 -10.399 14.654 -10.941 1.00 1.63 H new ATOM 0 HG3 GLU A 11 -11.579 14.462 -12.222 1.00 1.63 H new ATOM 183 N LEU A 12 -11.619 14.431 -7.288 1.00 1.51 N ATOM 184 CA LEU A 12 -10.703 14.695 -6.186 1.00 1.50 C ATOM 185 C LEU A 12 -10.157 13.403 -5.582 1.00 1.40 C ATOM 186 O LEU A 12 -8.942 13.225 -5.482 1.00 1.33 O ATOM 187 CB LEU A 12 -11.401 15.529 -5.109 1.00 1.62 C ATOM 188 CG LEU A 12 -10.574 15.806 -3.853 1.00 1.65 C ATOM 189 CD1 LEU A 12 -9.353 16.656 -4.183 1.00 1.69 C ATOM 190 CD2 LEU A 12 -11.429 16.497 -2.801 1.00 1.82 C ATOM 0 H LEU A 12 -12.571 14.760 -7.127 1.00 1.51 H new ATOM 0 HA LEU A 12 -9.858 15.256 -6.585 1.00 1.50 H new ATOM 0 HB2 LEU A 12 -11.696 16.483 -5.547 1.00 1.62 H new ATOM 0 HB3 LEU A 12 -12.317 15.017 -4.814 1.00 1.62 H new ATOM 0 HG LEU A 12 -10.228 14.852 -3.455 1.00 1.65 H new ATOM 0 HD11 LEU A 12 -8.781 16.839 -3.274 1.00 1.69 H new ATOM 0 HD12 LEU A 12 -8.728 16.130 -4.905 1.00 1.69 H new ATOM 0 HD13 LEU A 12 -9.676 17.607 -4.607 1.00 1.69 H new ATOM 0 HD21 LEU A 12 -10.828 16.688 -1.912 1.00 1.82 H new ATOM 0 HD22 LEU A 12 -11.801 17.442 -3.198 1.00 1.82 H new ATOM 0 HD23 LEU A 12 -12.271 15.857 -2.539 1.00 1.82 H new ATOM 202 N LEU A 13 -11.051 12.495 -5.199 1.00 1.41 N ATOM 203 CA LEU A 13 -10.638 11.233 -4.588 1.00 1.35 C ATOM 204 C LEU A 13 -9.853 10.361 -5.567 1.00 1.23 C ATOM 205 O LEU A 13 -8.919 9.661 -5.172 1.00 1.18 O ATOM 206 CB LEU A 13 -11.849 10.465 -4.029 1.00 1.43 C ATOM 207 CG LEU A 13 -12.999 10.195 -5.006 1.00 1.43 C ATOM 208 CD1 LEU A 13 -12.822 8.844 -5.687 1.00 1.81 C ATOM 209 CD2 LEU A 13 -14.332 10.245 -4.273 1.00 1.76 C ATOM 0 H LEU A 13 -12.060 12.607 -5.300 1.00 1.41 H new ATOM 0 HA LEU A 13 -9.975 11.479 -3.758 1.00 1.35 H new ATOM 0 HB2 LEU A 13 -11.497 9.508 -3.643 1.00 1.43 H new ATOM 0 HB3 LEU A 13 -12.246 11.024 -3.181 1.00 1.43 H new ATOM 0 HG LEU A 13 -12.988 10.969 -5.773 1.00 1.43 H new ATOM 0 HD11 LEU A 13 -13.649 8.673 -6.376 1.00 1.81 H new ATOM 0 HD12 LEU A 13 -11.882 8.835 -6.239 1.00 1.81 H new ATOM 0 HD13 LEU A 13 -12.808 8.056 -4.934 1.00 1.81 H new ATOM 0 HD21 LEU A 13 -15.142 10.052 -4.977 1.00 1.76 H new ATOM 0 HD22 LEU A 13 -14.345 9.488 -3.489 1.00 1.76 H new ATOM 0 HD23 LEU A 13 -14.466 11.231 -3.828 1.00 1.76 H new ATOM 221 N LEU A 14 -10.212 10.429 -6.844 1.00 1.21 N ATOM 222 CA LEU A 14 -9.542 9.632 -7.865 1.00 1.13 C ATOM 223 C LEU A 14 -8.088 10.063 -8.034 1.00 1.11 C ATOM 224 O LEU A 14 -7.189 9.226 -8.132 1.00 1.04 O ATOM 225 CB LEU A 14 -10.286 9.731 -9.202 1.00 1.16 C ATOM 226 CG LEU A 14 -9.884 8.688 -10.252 1.00 1.09 C ATOM 227 CD1 LEU A 14 -10.089 7.279 -9.717 1.00 1.11 C ATOM 228 CD2 LEU A 14 -10.685 8.895 -11.530 1.00 1.23 C ATOM 0 H LEU A 14 -10.961 11.026 -7.196 1.00 1.21 H new ATOM 0 HA LEU A 14 -9.552 8.593 -7.536 1.00 1.13 H new ATOM 0 HB2 LEU A 14 -11.355 9.638 -9.012 1.00 1.16 H new ATOM 0 HB3 LEU A 14 -10.121 10.725 -9.619 1.00 1.16 H new ATOM 0 HG LEU A 14 -8.825 8.815 -10.478 1.00 1.09 H new ATOM 0 HD11 LEU A 14 -9.798 6.555 -10.478 1.00 1.11 H new ATOM 0 HD12 LEU A 14 -9.477 7.135 -8.826 1.00 1.11 H new ATOM 0 HD13 LEU A 14 -11.139 7.136 -9.463 1.00 1.11 H new ATOM 0 HD21 LEU A 14 -10.391 8.149 -12.268 1.00 1.23 H new ATOM 0 HD22 LEU A 14 -11.748 8.792 -11.314 1.00 1.23 H new ATOM 0 HD23 LEU A 14 -10.490 9.892 -11.924 1.00 1.23 H new ATOM 240 N LYS A 15 -7.856 11.367 -8.043 1.00 1.19 N ATOM 241 CA LYS A 15 -6.507 11.895 -8.204 1.00 1.19 C ATOM 242 C LYS A 15 -5.709 11.772 -6.914 1.00 1.14 C ATOM 243 O LYS A 15 -4.481 11.671 -6.942 1.00 1.09 O ATOM 244 CB LYS A 15 -6.561 13.353 -8.649 1.00 1.32 C ATOM 245 CG LYS A 15 -7.149 13.533 -10.037 1.00 1.56 C ATOM 246 CD LYS A 15 -7.102 14.977 -10.495 1.00 1.68 C ATOM 247 CE LYS A 15 -7.472 15.082 -11.962 1.00 1.70 C ATOM 248 NZ LYS A 15 -7.667 16.492 -12.385 1.00 1.93 N ATOM 0 H LYS A 15 -8.580 12.078 -7.941 1.00 1.19 H new ATOM 0 HA LYS A 15 -6.005 11.305 -8.971 1.00 1.19 H new ATOM 0 HB2 LYS A 15 -7.154 13.923 -7.934 1.00 1.32 H new ATOM 0 HB3 LYS A 15 -5.554 13.769 -8.631 1.00 1.32 H new ATOM 0 HG2 LYS A 15 -6.602 12.911 -10.745 1.00 1.56 H new ATOM 0 HG3 LYS A 15 -8.182 13.186 -10.040 1.00 1.56 H new ATOM 0 HD2 LYS A 15 -7.788 15.577 -9.897 1.00 1.68 H new ATOM 0 HD3 LYS A 15 -6.103 15.383 -10.336 1.00 1.68 H new ATOM 0 HE2 LYS A 15 -6.688 14.627 -12.567 1.00 1.70 H new ATOM 0 HE3 LYS A 15 -8.386 14.518 -12.147 1.00 1.70 H new ATOM 0 HZ1 LYS A 15 -7.869 16.524 -13.405 1.00 1.93 H new ATOM 0 HZ2 LYS A 15 -8.465 16.904 -11.861 1.00 1.93 H new ATOM 0 HZ3 LYS A 15 -6.804 17.037 -12.186 1.00 1.93 H new ATOM 262 N LYS A 16 -6.407 11.785 -5.785 1.00 1.17 N ATOM 263 CA LYS A 16 -5.761 11.667 -4.489 1.00 1.16 C ATOM 264 C LYS A 16 -5.117 10.292 -4.327 1.00 1.04 C ATOM 265 O LYS A 16 -3.953 10.176 -3.939 1.00 1.05 O ATOM 266 CB LYS A 16 -6.771 11.906 -3.365 1.00 1.26 C ATOM 267 CG LYS A 16 -6.630 13.261 -2.686 1.00 1.32 C ATOM 268 CD LYS A 16 -5.398 13.311 -1.791 1.00 1.30 C ATOM 269 CE LYS A 16 -5.187 14.694 -1.200 1.00 1.50 C ATOM 270 NZ LYS A 16 -4.053 14.724 -0.234 1.00 1.62 N ATOM 0 H LYS A 16 -7.422 11.876 -5.744 1.00 1.17 H new ATOM 0 HA LYS A 16 -4.980 12.425 -4.430 1.00 1.16 H new ATOM 0 HB2 LYS A 16 -7.779 11.817 -3.771 1.00 1.26 H new ATOM 0 HB3 LYS A 16 -6.659 11.122 -2.616 1.00 1.26 H new ATOM 0 HG2 LYS A 16 -6.564 14.043 -3.442 1.00 1.32 H new ATOM 0 HG3 LYS A 16 -7.521 13.466 -2.092 1.00 1.32 H new ATOM 0 HD2 LYS A 16 -5.504 12.584 -0.986 1.00 1.30 H new ATOM 0 HD3 LYS A 16 -4.518 13.024 -2.367 1.00 1.30 H new ATOM 0 HE2 LYS A 16 -4.997 15.406 -2.003 1.00 1.50 H new ATOM 0 HE3 LYS A 16 -6.099 15.016 -0.698 1.00 1.50 H new ATOM 0 HZ1 LYS A 16 -3.945 15.687 0.145 1.00 1.62 H new ATOM 0 HZ2 LYS A 16 -4.245 14.064 0.547 1.00 1.62 H new ATOM 0 HZ3 LYS A 16 -3.177 14.442 -0.718 1.00 1.62 H new ATOM 284 N ILE A 17 -5.878 9.255 -4.648 1.00 0.96 N ATOM 285 CA ILE A 17 -5.393 7.886 -4.534 1.00 0.88 C ATOM 286 C ILE A 17 -4.368 7.578 -5.627 1.00 0.85 C ATOM 287 O ILE A 17 -3.444 6.788 -5.422 1.00 0.83 O ATOM 288 CB ILE A 17 -6.562 6.876 -4.594 1.00 0.85 C ATOM 289 CG1 ILE A 17 -7.579 7.201 -3.502 1.00 1.01 C ATOM 290 CG2 ILE A 17 -6.047 5.450 -4.433 1.00 0.89 C ATOM 291 CD1 ILE A 17 -8.813 6.326 -3.528 1.00 1.02 C ATOM 0 H ILE A 17 -6.836 9.336 -4.990 1.00 0.96 H new ATOM 0 HA ILE A 17 -4.905 7.787 -3.565 1.00 0.88 H new ATOM 0 HB ILE A 17 -7.047 6.954 -5.567 1.00 0.85 H new ATOM 0 HG12 ILE A 17 -7.096 7.102 -2.530 1.00 1.01 H new ATOM 0 HG13 ILE A 17 -7.883 8.243 -3.602 1.00 1.01 H new ATOM 0 HG21 ILE A 17 -6.884 4.754 -4.478 1.00 0.89 H new ATOM 0 HG22 ILE A 17 -5.344 5.224 -5.235 1.00 0.89 H new ATOM 0 HG23 ILE A 17 -5.544 5.351 -3.471 1.00 0.89 H new ATOM 0 HD11 ILE A 17 -9.485 6.620 -2.722 1.00 1.02 H new ATOM 0 HD12 ILE A 17 -9.322 6.443 -4.485 1.00 1.02 H new ATOM 0 HD13 ILE A 17 -8.523 5.284 -3.396 1.00 1.02 H new ATOM 303 N ASP A 18 -4.524 8.218 -6.780 1.00 0.90 N ATOM 304 CA ASP A 18 -3.604 8.016 -7.896 1.00 0.93 C ATOM 305 C ASP A 18 -2.202 8.480 -7.515 1.00 0.93 C ATOM 306 O ASP A 18 -1.215 7.781 -7.734 1.00 0.93 O ATOM 307 CB ASP A 18 -4.086 8.772 -9.133 1.00 1.04 C ATOM 308 CG ASP A 18 -3.395 8.313 -10.402 1.00 1.20 C ATOM 309 OD1 ASP A 18 -3.829 7.295 -10.984 1.00 1.66 O ATOM 310 OD2 ASP A 18 -2.438 8.981 -10.846 1.00 1.62 O ATOM 0 H ASP A 18 -5.277 8.880 -6.968 1.00 0.90 H new ATOM 0 HA ASP A 18 -3.574 6.951 -8.128 1.00 0.93 H new ATOM 0 HB2 ASP A 18 -5.162 8.637 -9.240 1.00 1.04 H new ATOM 0 HB3 ASP A 18 -3.911 9.839 -8.994 1.00 1.04 H new ATOM 315 N SER A 19 -2.131 9.664 -6.921 1.00 0.99 N ATOM 316 CA SER A 19 -0.858 10.234 -6.490 1.00 1.03 C ATOM 317 C SER A 19 -0.280 9.440 -5.324 1.00 0.96 C ATOM 318 O SER A 19 0.938 9.355 -5.146 1.00 0.96 O ATOM 319 CB SER A 19 -1.044 11.693 -6.067 1.00 1.17 C ATOM 320 OG SER A 19 -1.815 12.415 -7.016 1.00 1.28 O ATOM 0 H SER A 19 -2.942 10.251 -6.725 1.00 0.99 H new ATOM 0 HA SER A 19 -0.166 10.187 -7.331 1.00 1.03 H new ATOM 0 HB2 SER A 19 -1.534 11.731 -5.094 1.00 1.17 H new ATOM 0 HB3 SER A 19 -0.069 12.167 -5.952 1.00 1.17 H new ATOM 0 HG SER A 19 -2.764 12.198 -6.900 1.00 1.28 H new ATOM 326 N LEU A 20 -1.180 8.871 -4.536 1.00 0.92 N ATOM 327 CA LEU A 20 -0.825 8.081 -3.370 1.00 0.90 C ATOM 328 C LEU A 20 0.097 6.918 -3.743 1.00 0.84 C ATOM 329 O LEU A 20 1.168 6.754 -3.161 1.00 0.86 O ATOM 330 CB LEU A 20 -2.103 7.560 -2.717 1.00 0.92 C ATOM 331 CG LEU A 20 -1.935 6.916 -1.347 1.00 1.01 C ATOM 332 CD1 LEU A 20 -1.606 7.978 -0.306 1.00 1.37 C ATOM 333 CD2 LEU A 20 -3.203 6.162 -0.986 1.00 1.14 C ATOM 0 H LEU A 20 -2.185 8.946 -4.691 1.00 0.92 H new ATOM 0 HA LEU A 20 -0.282 8.713 -2.668 1.00 0.90 H new ATOM 0 HB2 LEU A 20 -2.804 8.389 -2.624 1.00 0.92 H new ATOM 0 HB3 LEU A 20 -2.559 6.831 -3.387 1.00 0.92 H new ATOM 0 HG LEU A 20 -1.107 6.208 -1.372 1.00 1.01 H new ATOM 0 HD11 LEU A 20 -1.488 7.507 0.670 1.00 1.37 H new ATOM 0 HD12 LEU A 20 -0.679 8.482 -0.580 1.00 1.37 H new ATOM 0 HD13 LEU A 20 -2.415 8.707 -0.261 1.00 1.37 H new ATOM 0 HD21 LEU A 20 -3.085 5.700 -0.006 1.00 1.14 H new ATOM 0 HD22 LEU A 20 -4.044 6.855 -0.962 1.00 1.14 H new ATOM 0 HD23 LEU A 20 -3.391 5.389 -1.731 1.00 1.14 H new ATOM 345 N ILE A 21 -0.313 6.136 -4.734 1.00 0.80 N ATOM 346 CA ILE A 21 0.485 4.997 -5.181 1.00 0.79 C ATOM 347 C ILE A 21 1.737 5.462 -5.922 1.00 0.81 C ATOM 348 O ILE A 21 2.747 4.764 -5.931 1.00 0.83 O ATOM 349 CB ILE A 21 -0.324 4.024 -6.073 1.00 0.81 C ATOM 350 CG1 ILE A 21 -1.024 4.774 -7.214 1.00 1.06 C ATOM 351 CG2 ILE A 21 -1.336 3.262 -5.226 1.00 1.04 C ATOM 352 CD1 ILE A 21 -1.699 3.865 -8.219 1.00 1.23 C ATOM 0 H ILE A 21 -1.188 6.267 -5.242 1.00 0.80 H new ATOM 0 HA ILE A 21 0.781 4.455 -4.283 1.00 0.79 H new ATOM 0 HB ILE A 21 0.367 3.310 -6.522 1.00 0.81 H new ATOM 0 HG12 ILE A 21 -1.768 5.448 -6.790 1.00 1.06 H new ATOM 0 HG13 ILE A 21 -0.292 5.393 -7.732 1.00 1.06 H new ATOM 0 HG21 ILE A 21 -1.901 2.580 -5.861 1.00 1.04 H new ATOM 0 HG22 ILE A 21 -0.812 2.693 -4.458 1.00 1.04 H new ATOM 0 HG23 ILE A 21 -2.019 3.967 -4.753 1.00 1.04 H new ATOM 0 HD11 ILE A 21 -2.171 4.468 -8.995 1.00 1.23 H new ATOM 0 HD12 ILE A 21 -0.956 3.208 -8.672 1.00 1.23 H new ATOM 0 HD13 ILE A 21 -2.456 3.264 -7.715 1.00 1.23 H new ATOM 364 N GLU A 22 1.673 6.640 -6.538 1.00 0.84 N ATOM 365 CA GLU A 22 2.824 7.188 -7.251 1.00 0.90 C ATOM 366 C GLU A 22 3.978 7.426 -6.281 1.00 0.90 C ATOM 367 O GLU A 22 5.124 7.081 -6.562 1.00 0.93 O ATOM 368 CB GLU A 22 2.468 8.508 -7.936 1.00 0.98 C ATOM 369 CG GLU A 22 1.564 8.359 -9.143 1.00 1.29 C ATOM 370 CD GLU A 22 1.307 9.686 -9.835 1.00 1.78 C ATOM 371 OE1 GLU A 22 0.792 10.617 -9.179 1.00 2.29 O ATOM 372 OE2 GLU A 22 1.625 9.809 -11.036 1.00 2.22 O ATOM 0 H GLU A 22 0.842 7.230 -6.558 1.00 0.84 H new ATOM 0 HA GLU A 22 3.121 6.465 -8.010 1.00 0.90 H new ATOM 0 HB2 GLU A 22 1.982 9.161 -7.211 1.00 0.98 H new ATOM 0 HB3 GLU A 22 3.388 9.004 -8.245 1.00 0.98 H new ATOM 0 HG2 GLU A 22 2.017 7.664 -9.850 1.00 1.29 H new ATOM 0 HG3 GLU A 22 0.614 7.924 -8.832 1.00 1.29 H new ATOM 379 N ALA A 23 3.656 8.013 -5.135 1.00 0.89 N ATOM 380 CA ALA A 23 4.647 8.315 -4.113 1.00 0.92 C ATOM 381 C ALA A 23 5.300 7.047 -3.576 1.00 0.88 C ATOM 382 O ALA A 23 6.523 6.942 -3.539 1.00 0.89 O ATOM 383 CB ALA A 23 4.010 9.096 -2.974 1.00 0.94 C ATOM 0 H ALA A 23 2.706 8.291 -4.890 1.00 0.89 H new ATOM 0 HA ALA A 23 5.424 8.924 -4.575 1.00 0.92 H new ATOM 0 HB1 ALA A 23 4.763 9.315 -2.217 1.00 0.94 H new ATOM 0 HB2 ALA A 23 3.600 10.030 -3.358 1.00 0.94 H new ATOM 0 HB3 ALA A 23 3.210 8.504 -2.529 1.00 0.94 H new ATOM 389 N ILE A 24 4.477 6.079 -3.182 1.00 0.86 N ATOM 390 CA ILE A 24 4.974 4.819 -2.634 1.00 0.85 C ATOM 391 C ILE A 24 5.801 4.057 -3.664 1.00 0.83 C ATOM 392 O ILE A 24 6.840 3.486 -3.335 1.00 0.83 O ATOM 393 CB ILE A 24 3.818 3.930 -2.124 1.00 0.87 C ATOM 394 CG1 ILE A 24 2.886 4.762 -1.237 1.00 1.12 C ATOM 395 CG2 ILE A 24 4.365 2.730 -1.358 1.00 1.03 C ATOM 396 CD1 ILE A 24 1.897 3.954 -0.421 1.00 1.05 C ATOM 0 H ILE A 24 3.460 6.143 -3.232 1.00 0.86 H new ATOM 0 HA ILE A 24 5.615 5.069 -1.788 1.00 0.85 H new ATOM 0 HB ILE A 24 3.252 3.554 -2.976 1.00 0.87 H new ATOM 0 HG12 ILE A 24 3.493 5.361 -0.558 1.00 1.12 H new ATOM 0 HG13 ILE A 24 2.333 5.458 -1.868 1.00 1.12 H new ATOM 0 HG21 ILE A 24 3.537 2.115 -1.006 1.00 1.03 H new ATOM 0 HG22 ILE A 24 5.003 2.139 -2.015 1.00 1.03 H new ATOM 0 HG23 ILE A 24 4.947 3.078 -0.504 1.00 1.03 H new ATOM 0 HD11 ILE A 24 1.281 4.627 0.175 1.00 1.05 H new ATOM 0 HD12 ILE A 24 1.260 3.376 -1.090 1.00 1.05 H new ATOM 0 HD13 ILE A 24 2.438 3.277 0.240 1.00 1.05 H new ATOM 408 N LYS A 25 5.350 4.074 -4.915 1.00 0.83 N ATOM 409 CA LYS A 25 6.060 3.395 -5.992 1.00 0.84 C ATOM 410 C LYS A 25 7.424 4.042 -6.209 1.00 0.86 C ATOM 411 O LYS A 25 8.404 3.369 -6.523 1.00 0.86 O ATOM 412 CB LYS A 25 5.246 3.442 -7.287 1.00 0.88 C ATOM 413 CG LYS A 25 5.826 2.589 -8.400 1.00 0.96 C ATOM 414 CD LYS A 25 5.582 1.112 -8.154 1.00 1.13 C ATOM 415 CE LYS A 25 6.672 0.253 -8.782 1.00 1.39 C ATOM 416 NZ LYS A 25 6.857 0.543 -10.232 1.00 1.61 N ATOM 0 H LYS A 25 4.497 4.550 -5.207 1.00 0.83 H new ATOM 0 HA LYS A 25 6.201 2.352 -5.709 1.00 0.84 H new ATOM 0 HB2 LYS A 25 4.229 3.111 -7.079 1.00 0.88 H new ATOM 0 HB3 LYS A 25 5.181 4.475 -7.628 1.00 0.88 H new ATOM 0 HG2 LYS A 25 5.380 2.879 -9.352 1.00 0.96 H new ATOM 0 HG3 LYS A 25 6.897 2.773 -8.480 1.00 0.96 H new ATOM 0 HD2 LYS A 25 5.541 0.923 -7.081 1.00 1.13 H new ATOM 0 HD3 LYS A 25 4.613 0.829 -8.565 1.00 1.13 H new ATOM 0 HE2 LYS A 25 7.612 0.422 -8.257 1.00 1.39 H new ATOM 0 HE3 LYS A 25 6.421 -0.800 -8.654 1.00 1.39 H new ATOM 0 HZ1 LYS A 25 7.468 -0.184 -10.656 1.00 1.61 H new ATOM 0 HZ2 LYS A 25 5.932 0.538 -10.708 1.00 1.61 H new ATOM 0 HZ3 LYS A 25 7.300 1.477 -10.345 1.00 1.61 H new ATOM 430 N LYS A 26 7.483 5.351 -6.030 1.00 0.87 N ATOM 431 CA LYS A 26 8.730 6.081 -6.193 1.00 0.91 C ATOM 432 C LYS A 26 9.671 5.820 -5.024 1.00 0.90 C ATOM 433 O LYS A 26 10.883 5.708 -5.213 1.00 0.91 O ATOM 434 CB LYS A 26 8.464 7.581 -6.324 1.00 0.97 C ATOM 435 CG LYS A 26 8.318 8.049 -7.768 1.00 1.07 C ATOM 436 CD LYS A 26 9.578 8.742 -8.272 1.00 1.21 C ATOM 437 CE LYS A 26 10.788 7.821 -8.217 1.00 1.35 C ATOM 438 NZ LYS A 26 12.012 8.458 -8.771 1.00 1.42 N ATOM 0 H LYS A 26 6.684 5.930 -5.772 1.00 0.87 H new ATOM 0 HA LYS A 26 9.206 5.727 -7.107 1.00 0.91 H new ATOM 0 HB2 LYS A 26 7.555 7.830 -5.776 1.00 0.97 H new ATOM 0 HB3 LYS A 26 9.280 8.129 -5.853 1.00 0.97 H new ATOM 0 HG2 LYS A 26 8.095 7.194 -8.406 1.00 1.07 H new ATOM 0 HG3 LYS A 26 7.473 8.733 -7.844 1.00 1.07 H new ATOM 0 HD2 LYS A 26 9.423 9.078 -9.297 1.00 1.21 H new ATOM 0 HD3 LYS A 26 9.770 9.631 -7.671 1.00 1.21 H new ATOM 0 HE2 LYS A 26 10.971 7.527 -7.183 1.00 1.35 H new ATOM 0 HE3 LYS A 26 10.573 6.909 -8.774 1.00 1.35 H new ATOM 0 HZ1 LYS A 26 12.847 8.111 -8.257 1.00 1.42 H new ATOM 0 HZ2 LYS A 26 12.102 8.219 -9.779 1.00 1.42 H new ATOM 0 HZ3 LYS A 26 11.944 9.490 -8.665 1.00 1.42 H new ATOM 452 N ILE A 27 9.112 5.715 -3.824 1.00 0.88 N ATOM 453 CA ILE A 27 9.904 5.465 -2.621 1.00 0.89 C ATOM 454 C ILE A 27 10.688 4.161 -2.743 1.00 0.87 C ATOM 455 O ILE A 27 11.902 4.133 -2.530 1.00 0.90 O ATOM 456 CB ILE A 27 9.012 5.418 -1.353 1.00 0.90 C ATOM 457 CG1 ILE A 27 8.400 6.798 -1.063 1.00 0.90 C ATOM 458 CG2 ILE A 27 9.804 4.924 -0.146 1.00 0.93 C ATOM 459 CD1 ILE A 27 9.424 7.906 -0.914 1.00 1.31 C ATOM 0 H ILE A 27 8.109 5.799 -3.656 1.00 0.88 H new ATOM 0 HA ILE A 27 10.605 6.294 -2.522 1.00 0.89 H new ATOM 0 HB ILE A 27 8.201 4.714 -1.542 1.00 0.90 H new ATOM 0 HG12 ILE A 27 7.714 7.057 -1.870 1.00 0.90 H new ATOM 0 HG13 ILE A 27 7.809 6.738 -0.149 1.00 0.90 H new ATOM 0 HG21 ILE A 27 9.156 4.900 0.730 1.00 0.93 H new ATOM 0 HG22 ILE A 27 10.182 3.921 -0.345 1.00 0.93 H new ATOM 0 HG23 ILE A 27 10.641 5.597 0.040 1.00 0.93 H new ATOM 0 HD11 ILE A 27 8.914 8.848 -0.711 1.00 1.31 H new ATOM 0 HD12 ILE A 27 10.096 7.672 -0.088 1.00 1.31 H new ATOM 0 HD13 ILE A 27 9.999 7.996 -1.835 1.00 1.31 H new ATOM 471 N ILE A 28 9.996 3.089 -3.106 1.00 0.83 N ATOM 472 CA ILE A 28 10.630 1.784 -3.249 1.00 0.82 C ATOM 473 C ILE A 28 11.657 1.787 -4.388 1.00 0.83 C ATOM 474 O ILE A 28 12.685 1.107 -4.312 1.00 0.84 O ATOM 475 CB ILE A 28 9.591 0.653 -3.465 1.00 0.82 C ATOM 476 CG1 ILE A 28 10.260 -0.717 -3.351 1.00 0.88 C ATOM 477 CG2 ILE A 28 8.887 0.790 -4.806 1.00 0.88 C ATOM 478 CD1 ILE A 28 10.582 -1.115 -1.927 1.00 1.05 C ATOM 0 H ILE A 28 8.996 3.097 -3.307 1.00 0.83 H new ATOM 0 HA ILE A 28 11.150 1.583 -2.312 1.00 0.82 H new ATOM 0 HB ILE A 28 8.837 0.743 -2.683 1.00 0.82 H new ATOM 0 HG12 ILE A 28 9.606 -1.470 -3.791 1.00 0.88 H new ATOM 0 HG13 ILE A 28 11.180 -0.713 -3.936 1.00 0.88 H new ATOM 0 HG21 ILE A 28 8.166 -0.019 -4.923 1.00 0.88 H new ATOM 0 HG22 ILE A 28 8.368 1.747 -4.848 1.00 0.88 H new ATOM 0 HG23 ILE A 28 9.622 0.740 -5.609 1.00 0.88 H new ATOM 0 HD11 ILE A 28 11.055 -2.097 -1.922 1.00 1.05 H new ATOM 0 HD12 ILE A 28 11.261 -0.383 -1.489 1.00 1.05 H new ATOM 0 HD13 ILE A 28 9.663 -1.152 -1.343 1.00 1.05 H new ATOM 490 N ALA A 29 11.373 2.553 -5.438 1.00 0.84 N ATOM 491 CA ALA A 29 12.261 2.651 -6.592 1.00 0.87 C ATOM 492 C ALA A 29 13.577 3.320 -6.221 1.00 0.90 C ATOM 493 O ALA A 29 14.640 2.959 -6.728 1.00 0.93 O ATOM 494 CB ALA A 29 11.578 3.416 -7.713 1.00 0.90 C ATOM 0 H ALA A 29 10.528 3.119 -5.513 1.00 0.84 H new ATOM 0 HA ALA A 29 12.484 1.640 -6.934 1.00 0.87 H new ATOM 0 HB1 ALA A 29 12.249 3.483 -8.569 1.00 0.90 H new ATOM 0 HB2 ALA A 29 10.667 2.895 -8.006 1.00 0.90 H new ATOM 0 HB3 ALA A 29 11.327 4.419 -7.369 1.00 0.90 H new ATOM 500 N GLU A 30 13.503 4.309 -5.344 1.00 0.93 N ATOM 501 CA GLU A 30 14.694 5.016 -4.902 1.00 0.99 C ATOM 502 C GLU A 30 15.536 4.126 -3.997 1.00 0.99 C ATOM 503 O GLU A 30 16.764 4.192 -4.021 1.00 1.01 O ATOM 504 CB GLU A 30 14.325 6.306 -4.161 1.00 1.06 C ATOM 505 CG GLU A 30 13.589 7.323 -5.018 1.00 1.10 C ATOM 506 CD GLU A 30 14.325 7.659 -6.299 1.00 1.18 C ATOM 507 OE1 GLU A 30 15.300 8.438 -6.248 1.00 1.46 O ATOM 508 OE2 GLU A 30 13.921 7.161 -7.369 1.00 1.25 O ATOM 0 H GLU A 30 12.633 4.639 -4.926 1.00 0.93 H new ATOM 0 HA GLU A 30 15.274 5.278 -5.787 1.00 0.99 H new ATOM 0 HB2 GLU A 30 13.704 6.054 -3.301 1.00 1.06 H new ATOM 0 HB3 GLU A 30 15.235 6.764 -3.774 1.00 1.06 H new ATOM 0 HG2 GLU A 30 12.600 6.935 -5.264 1.00 1.10 H new ATOM 0 HG3 GLU A 30 13.439 8.236 -4.441 1.00 1.10 H new ATOM 515 N PHE A 31 14.863 3.287 -3.214 1.00 0.97 N ATOM 516 CA PHE A 31 15.533 2.378 -2.285 1.00 1.00 C ATOM 517 C PHE A 31 16.527 1.462 -3.003 1.00 0.97 C ATOM 518 O PHE A 31 17.684 1.357 -2.598 1.00 1.00 O ATOM 519 CB PHE A 31 14.500 1.527 -1.530 1.00 1.02 C ATOM 520 CG PHE A 31 13.900 2.193 -0.322 1.00 1.10 C ATOM 521 CD1 PHE A 31 14.050 3.555 -0.100 1.00 1.79 C ATOM 522 CD2 PHE A 31 13.175 1.447 0.588 1.00 1.42 C ATOM 523 CE1 PHE A 31 13.492 4.154 1.010 1.00 1.98 C ATOM 524 CE2 PHE A 31 12.614 2.040 1.703 1.00 1.58 C ATOM 525 CZ PHE A 31 12.769 3.397 1.912 1.00 1.54 C ATOM 0 H PHE A 31 13.845 3.217 -3.204 1.00 0.97 H new ATOM 0 HA PHE A 31 16.089 2.992 -1.576 1.00 1.00 H new ATOM 0 HB2 PHE A 31 13.697 1.260 -2.217 1.00 1.02 H new ATOM 0 HB3 PHE A 31 14.974 0.597 -1.217 1.00 1.02 H new ATOM 0 HD1 PHE A 31 14.610 4.152 -0.804 1.00 1.79 H new ATOM 0 HD2 PHE A 31 13.045 0.387 0.426 1.00 1.42 H new ATOM 0 HE1 PHE A 31 13.620 5.214 1.174 1.00 1.98 H new ATOM 0 HE2 PHE A 31 12.056 1.444 2.410 1.00 1.58 H new ATOM 0 HZ PHE A 31 12.326 3.865 2.779 1.00 1.54 H new ATOM 535 N ASP A 32 16.080 0.817 -4.074 1.00 0.93 N ATOM 536 CA ASP A 32 16.950 -0.095 -4.815 1.00 0.92 C ATOM 537 C ASP A 32 18.049 0.672 -5.552 1.00 0.92 C ATOM 538 O ASP A 32 19.159 0.165 -5.723 1.00 0.93 O ATOM 539 CB ASP A 32 16.146 -0.988 -5.777 1.00 0.94 C ATOM 540 CG ASP A 32 15.751 -0.304 -7.075 1.00 1.15 C ATOM 541 OD1 ASP A 32 16.596 -0.202 -7.985 1.00 1.54 O ATOM 542 OD2 ASP A 32 14.572 0.087 -7.209 1.00 1.45 O ATOM 0 H ASP A 32 15.135 0.905 -4.447 1.00 0.93 H new ATOM 0 HA ASP A 32 17.431 -0.753 -4.091 1.00 0.92 H new ATOM 0 HB2 ASP A 32 16.735 -1.875 -6.011 1.00 0.94 H new ATOM 0 HB3 ASP A 32 15.244 -1.330 -5.270 1.00 0.94 H new ATOM 547 N VAL A 33 17.749 1.902 -5.955 1.00 0.93 N ATOM 548 CA VAL A 33 18.723 2.731 -6.651 1.00 0.95 C ATOM 549 C VAL A 33 19.852 3.144 -5.704 1.00 0.96 C ATOM 550 O VAL A 33 21.031 3.036 -6.041 1.00 0.97 O ATOM 551 CB VAL A 33 18.060 3.987 -7.264 1.00 0.99 C ATOM 552 CG1 VAL A 33 19.102 5.041 -7.619 1.00 1.06 C ATOM 553 CG2 VAL A 33 17.250 3.602 -8.495 1.00 0.98 C ATOM 0 H VAL A 33 16.841 2.345 -5.812 1.00 0.93 H new ATOM 0 HA VAL A 33 19.140 2.136 -7.464 1.00 0.95 H new ATOM 0 HB VAL A 33 17.390 4.418 -6.520 1.00 0.99 H new ATOM 0 HG11 VAL A 33 18.607 5.912 -8.048 1.00 1.06 H new ATOM 0 HG12 VAL A 33 19.642 5.337 -6.719 1.00 1.06 H new ATOM 0 HG13 VAL A 33 19.804 4.629 -8.344 1.00 1.06 H new ATOM 0 HG21 VAL A 33 16.787 4.493 -8.919 1.00 0.98 H new ATOM 0 HG22 VAL A 33 17.908 3.147 -9.236 1.00 0.98 H new ATOM 0 HG23 VAL A 33 16.475 2.890 -8.212 1.00 0.98 H new ATOM 563 N VAL A 34 19.481 3.593 -4.507 1.00 0.98 N ATOM 564 CA VAL A 34 20.457 4.027 -3.510 1.00 1.02 C ATOM 565 C VAL A 34 21.401 2.887 -3.124 1.00 1.02 C ATOM 566 O VAL A 34 22.603 3.098 -2.941 1.00 1.04 O ATOM 567 CB VAL A 34 19.765 4.584 -2.243 1.00 1.07 C ATOM 568 CG1 VAL A 34 20.782 4.882 -1.148 1.00 1.14 C ATOM 569 CG2 VAL A 34 18.978 5.839 -2.579 1.00 1.08 C ATOM 0 H VAL A 34 18.510 3.666 -4.204 1.00 0.98 H new ATOM 0 HA VAL A 34 21.041 4.827 -3.966 1.00 1.02 H new ATOM 0 HB VAL A 34 19.079 3.822 -1.873 1.00 1.07 H new ATOM 0 HG11 VAL A 34 20.267 5.272 -0.270 1.00 1.14 H new ATOM 0 HG12 VAL A 34 21.310 3.966 -0.882 1.00 1.14 H new ATOM 0 HG13 VAL A 34 21.498 5.622 -1.507 1.00 1.14 H new ATOM 0 HG21 VAL A 34 18.497 6.219 -1.678 1.00 1.08 H new ATOM 0 HG22 VAL A 34 19.653 6.596 -2.977 1.00 1.08 H new ATOM 0 HG23 VAL A 34 18.218 5.603 -3.324 1.00 1.08 H new ATOM 579 N LYS A 35 20.854 1.682 -3.017 1.00 1.00 N ATOM 580 CA LYS A 35 21.636 0.502 -2.669 1.00 1.02 C ATOM 581 C LYS A 35 22.769 0.276 -3.671 1.00 1.01 C ATOM 582 O LYS A 35 23.916 0.043 -3.289 1.00 1.04 O ATOM 583 CB LYS A 35 20.725 -0.729 -2.614 1.00 1.02 C ATOM 584 CG LYS A 35 21.480 -2.050 -2.596 1.00 1.06 C ATOM 585 CD LYS A 35 20.536 -3.241 -2.577 1.00 1.23 C ATOM 586 CE LYS A 35 21.300 -4.552 -2.689 1.00 1.45 C ATOM 587 NZ LYS A 35 21.661 -4.878 -4.096 1.00 1.92 N ATOM 0 H LYS A 35 19.863 1.496 -3.168 1.00 1.00 H new ATOM 0 HA LYS A 35 22.082 0.664 -1.688 1.00 1.02 H new ATOM 0 HB2 LYS A 35 20.099 -0.667 -1.724 1.00 1.02 H new ATOM 0 HB3 LYS A 35 20.057 -0.714 -3.475 1.00 1.02 H new ATOM 0 HG2 LYS A 35 22.125 -2.112 -3.473 1.00 1.06 H new ATOM 0 HG3 LYS A 35 22.128 -2.086 -1.720 1.00 1.06 H new ATOM 0 HD2 LYS A 35 19.955 -3.233 -1.654 1.00 1.23 H new ATOM 0 HD3 LYS A 35 19.827 -3.159 -3.401 1.00 1.23 H new ATOM 0 HE2 LYS A 35 22.207 -4.493 -2.088 1.00 1.45 H new ATOM 0 HE3 LYS A 35 20.695 -5.359 -2.275 1.00 1.45 H new ATOM 0 HZ1 LYS A 35 22.408 -5.601 -4.104 1.00 1.92 H new ATOM 0 HZ2 LYS A 35 20.823 -5.240 -4.594 1.00 1.92 H new ATOM 0 HZ3 LYS A 35 22.004 -4.021 -4.574 1.00 1.92 H new ATOM 601 N GLU A 36 22.434 0.333 -4.946 1.00 0.99 N ATOM 602 CA GLU A 36 23.418 0.139 -6.000 1.00 1.00 C ATOM 603 C GLU A 36 24.329 1.355 -6.154 1.00 0.99 C ATOM 604 O GLU A 36 25.499 1.225 -6.520 1.00 1.01 O ATOM 605 CB GLU A 36 22.722 -0.187 -7.321 1.00 1.03 C ATOM 606 CG GLU A 36 22.866 -1.643 -7.738 1.00 1.31 C ATOM 607 CD GLU A 36 23.044 -2.583 -6.555 1.00 1.41 C ATOM 608 OE1 GLU A 36 22.031 -2.985 -5.948 1.00 1.71 O ATOM 609 OE2 GLU A 36 24.202 -2.928 -6.233 1.00 1.44 O ATOM 0 H GLU A 36 21.487 0.512 -5.280 1.00 0.99 H new ATOM 0 HA GLU A 36 24.048 -0.704 -5.717 1.00 1.00 H new ATOM 0 HB2 GLU A 36 21.663 0.055 -7.234 1.00 1.03 H new ATOM 0 HB3 GLU A 36 23.131 0.450 -8.105 1.00 1.03 H new ATOM 0 HG2 GLU A 36 21.984 -1.942 -8.304 1.00 1.31 H new ATOM 0 HG3 GLU A 36 23.722 -1.741 -8.406 1.00 1.31 H new ATOM 616 N SER A 37 23.797 2.525 -5.883 1.00 0.00 N ATOM 617 CA SER A 37 24.556 3.767 -6.000 1.00 0.00 C ATOM 618 C SER A 37 25.729 3.775 -5.048 1.00 0.00 C ATOM 619 O SER A 37 26.862 4.102 -5.432 1.00 0.00 O ATOM 620 CB SER A 37 23.639 4.996 -5.784 1.00 0.00 C ATOM 621 OG SER A 37 22.663 5.151 -6.819 1.00 0.00 O ATOM 0 H SER A 37 22.832 2.651 -5.576 1.00 0.00 H new ATOM 0 HA SER A 37 24.956 3.828 -7.012 1.00 0.00 H new ATOM 0 HB2 SER A 37 23.131 4.900 -4.824 1.00 0.00 H new ATOM 0 HB3 SER A 37 24.252 5.896 -5.732 1.00 0.00 H new ATOM 0 HG SER A 37 21.969 4.467 -6.719 1.00 0.00 H new ATOM 627 N VAL A 38 25.496 3.388 -3.792 1.00 1.03 N ATOM 628 CA VAL A 38 26.559 3.344 -2.794 1.00 1.06 C ATOM 629 C VAL A 38 27.569 2.250 -3.139 1.00 1.07 C ATOM 630 O VAL A 38 28.739 2.334 -2.773 1.00 1.09 O ATOM 631 CB VAL A 38 26.029 3.139 -1.353 1.00 1.10 C ATOM 632 CG1 VAL A 38 25.175 4.319 -0.917 1.00 1.12 C ATOM 633 CG2 VAL A 38 25.248 1.840 -1.220 1.00 1.10 C ATOM 0 H VAL A 38 24.581 3.101 -3.445 1.00 1.03 H new ATOM 0 HA VAL A 38 27.047 4.318 -2.818 1.00 1.06 H new ATOM 0 HB VAL A 38 26.896 3.074 -0.695 1.00 1.10 H new ATOM 0 HG11 VAL A 38 24.814 4.152 0.098 1.00 1.12 H new ATOM 0 HG12 VAL A 38 25.772 5.230 -0.944 1.00 1.12 H new ATOM 0 HG13 VAL A 38 24.325 4.422 -1.592 1.00 1.12 H new ATOM 0 HG21 VAL A 38 24.893 1.732 -0.195 1.00 1.10 H new ATOM 0 HG22 VAL A 38 24.396 1.857 -1.899 1.00 1.10 H new ATOM 0 HG23 VAL A 38 25.895 0.999 -1.470 1.00 1.10 H new ATOM 643 N ASN A 39 27.098 1.229 -3.848 1.00 1.05 N ATOM 644 CA ASN A 39 27.947 0.114 -4.267 1.00 1.08 C ATOM 645 C ASN A 39 29.047 0.618 -5.197 1.00 1.07 C ATOM 646 O ASN A 39 30.235 0.369 -4.981 1.00 1.10 O ATOM 647 CB ASN A 39 27.108 -0.948 -4.990 1.00 1.10 C ATOM 648 CG ASN A 39 27.603 -2.362 -4.755 1.00 1.41 C ATOM 649 OD1 ASN A 39 28.753 -2.587 -4.377 1.00 1.68 O ATOM 650 ND2 ASN A 39 26.726 -3.327 -4.983 1.00 1.72 N ATOM 0 H ASN A 39 26.126 1.149 -4.147 1.00 1.05 H new ATOM 0 HA ASN A 39 28.400 -0.332 -3.382 1.00 1.08 H new ATOM 0 HB2 ASN A 39 26.073 -0.872 -4.657 1.00 1.10 H new ATOM 0 HB3 ASN A 39 27.115 -0.741 -6.060 1.00 1.10 H new ATOM 0 HD21 ASN A 39 26.993 -4.302 -4.846 1.00 1.72 H new ATOM 0 HD22 ASN A 39 25.783 -3.096 -5.295 1.00 1.72 H new ATOM 657 N GLU A 40 28.639 1.351 -6.226 1.00 1.06 N ATOM 658 CA GLU A 40 29.576 1.898 -7.193 1.00 1.08 C ATOM 659 C GLU A 40 30.452 2.966 -6.548 1.00 1.06 C ATOM 660 O GLU A 40 31.659 3.032 -6.800 1.00 1.09 O ATOM 661 CB GLU A 40 28.830 2.497 -8.386 1.00 1.11 C ATOM 662 CG GLU A 40 27.969 1.496 -9.147 1.00 1.33 C ATOM 663 CD GLU A 40 28.776 0.405 -9.828 1.00 1.77 C ATOM 664 OE1 GLU A 40 30.024 0.393 -9.701 1.00 2.13 O ATOM 665 OE2 GLU A 40 28.164 -0.453 -10.499 1.00 2.31 O ATOM 0 H GLU A 40 27.662 1.579 -6.410 1.00 1.06 H new ATOM 0 HA GLU A 40 30.210 1.084 -7.544 1.00 1.08 H new ATOM 0 HB2 GLU A 40 28.196 3.311 -8.033 1.00 1.11 H new ATOM 0 HB3 GLU A 40 29.555 2.933 -9.073 1.00 1.11 H new ATOM 0 HG2 GLU A 40 27.261 1.037 -8.457 1.00 1.33 H new ATOM 0 HG3 GLU A 40 27.384 2.027 -9.897 1.00 1.33 H new ATOM 672 N LEU A 41 29.835 3.787 -5.702 1.00 1.04 N ATOM 673 CA LEU A 41 30.540 4.867 -5.018 1.00 1.05 C ATOM 674 C LEU A 41 31.678 4.324 -4.153 1.00 1.08 C ATOM 675 O LEU A 41 32.753 4.915 -4.087 1.00 1.12 O ATOM 676 CB LEU A 41 29.568 5.678 -4.157 1.00 1.04 C ATOM 677 CG LEU A 41 30.017 7.107 -3.828 1.00 1.04 C ATOM 678 CD1 LEU A 41 30.128 7.945 -5.097 1.00 1.19 C ATOM 679 CD2 LEU A 41 29.048 7.758 -2.854 1.00 1.07 C ATOM 0 H LEU A 41 28.843 3.724 -5.473 1.00 1.04 H new ATOM 0 HA LEU A 41 30.971 5.519 -5.778 1.00 1.05 H new ATOM 0 HB2 LEU A 41 28.608 5.726 -4.670 1.00 1.04 H new ATOM 0 HB3 LEU A 41 29.403 5.142 -3.222 1.00 1.04 H new ATOM 0 HG LEU A 41 31.001 7.054 -3.362 1.00 1.04 H new ATOM 0 HD11 LEU A 41 30.448 8.955 -4.839 1.00 1.19 H new ATOM 0 HD12 LEU A 41 30.858 7.493 -5.769 1.00 1.19 H new ATOM 0 HD13 LEU A 41 29.157 7.987 -5.591 1.00 1.19 H new ATOM 0 HD21 LEU A 41 29.382 8.771 -2.631 1.00 1.07 H new ATOM 0 HD22 LEU A 41 28.054 7.793 -3.299 1.00 1.07 H new ATOM 0 HD23 LEU A 41 29.013 7.177 -1.932 1.00 1.07 H new ATOM 691 N SER A 42 31.439 3.186 -3.511 1.00 1.07 N ATOM 692 CA SER A 42 32.435 2.554 -2.652 1.00 1.12 C ATOM 693 C SER A 42 33.643 2.084 -3.454 1.00 1.16 C ATOM 694 O SER A 42 34.784 2.167 -2.989 1.00 1.20 O ATOM 695 CB SER A 42 31.805 1.362 -1.916 1.00 1.13 C ATOM 696 OG SER A 42 32.796 0.530 -1.325 1.00 1.47 O ATOM 0 H SER A 42 30.556 2.678 -3.570 1.00 1.07 H new ATOM 0 HA SER A 42 32.776 3.295 -1.929 1.00 1.12 H new ATOM 0 HB2 SER A 42 31.127 1.727 -1.144 1.00 1.13 H new ATOM 0 HB3 SER A 42 31.207 0.777 -2.615 1.00 1.13 H new ATOM 0 HG SER A 42 32.362 -0.218 -0.863 1.00 1.47 H new ATOM 702 N GLU A 43 33.395 1.596 -4.659 1.00 1.16 N ATOM 703 CA GLU A 43 34.469 1.096 -5.504 1.00 1.22 C ATOM 704 C GLU A 43 35.336 2.233 -6.042 1.00 1.21 C ATOM 705 O GLU A 43 36.533 2.055 -6.272 1.00 1.25 O ATOM 706 CB GLU A 43 33.910 0.257 -6.650 1.00 1.27 C ATOM 707 CG GLU A 43 34.743 -0.981 -6.937 1.00 1.60 C ATOM 708 CD GLU A 43 35.126 -1.727 -5.671 1.00 1.71 C ATOM 709 OE1 GLU A 43 36.059 -1.283 -4.965 1.00 1.98 O ATOM 710 OE2 GLU A 43 34.504 -2.762 -5.374 1.00 1.94 O ATOM 0 H GLU A 43 32.465 1.535 -5.073 1.00 1.16 H new ATOM 0 HA GLU A 43 35.103 0.460 -4.887 1.00 1.22 H new ATOM 0 HB2 GLU A 43 32.891 -0.045 -6.409 1.00 1.27 H new ATOM 0 HB3 GLU A 43 33.857 0.870 -7.550 1.00 1.27 H new ATOM 0 HG2 GLU A 43 34.184 -1.648 -7.593 1.00 1.60 H new ATOM 0 HG3 GLU A 43 35.647 -0.691 -7.472 1.00 1.60 H new ATOM 717 N LYS A 44 34.739 3.401 -6.228 1.00 1.18 N ATOM 718 CA LYS A 44 35.471 4.560 -6.722 1.00 1.20 C ATOM 719 C LYS A 44 36.264 5.189 -5.587 1.00 1.20 C ATOM 720 O LYS A 44 37.404 5.610 -5.763 1.00 1.25 O ATOM 721 CB LYS A 44 34.498 5.584 -7.311 1.00 1.22 C ATOM 722 CG LYS A 44 33.680 5.052 -8.479 1.00 1.25 C ATOM 723 CD LYS A 44 34.553 4.773 -9.688 1.00 1.46 C ATOM 724 CE LYS A 44 33.718 4.537 -10.935 1.00 1.75 C ATOM 725 NZ LYS A 44 34.531 4.631 -12.173 1.00 2.12 N ATOM 0 H LYS A 44 33.750 3.572 -6.045 1.00 1.18 H new ATOM 0 HA LYS A 44 36.159 4.239 -7.504 1.00 1.20 H new ATOM 0 HB2 LYS A 44 33.819 5.919 -6.527 1.00 1.22 H new ATOM 0 HB3 LYS A 44 35.060 6.458 -7.641 1.00 1.22 H new ATOM 0 HG2 LYS A 44 33.168 4.137 -8.179 1.00 1.25 H new ATOM 0 HG3 LYS A 44 32.910 5.776 -8.745 1.00 1.25 H new ATOM 0 HD2 LYS A 44 35.227 5.614 -9.854 1.00 1.46 H new ATOM 0 HD3 LYS A 44 35.175 3.899 -9.495 1.00 1.46 H new ATOM 0 HE2 LYS A 44 33.254 3.552 -10.880 1.00 1.75 H new ATOM 0 HE3 LYS A 44 32.911 5.268 -10.975 1.00 1.75 H new ATOM 0 HZ1 LYS A 44 33.924 4.464 -13.001 1.00 2.12 H new ATOM 0 HZ2 LYS A 44 34.954 5.579 -12.240 1.00 2.12 H new ATOM 0 HZ3 LYS A 44 35.286 3.916 -12.148 1.00 2.12 H new ATOM 739 N ALA A 45 35.645 5.233 -4.415 1.00 1.17 N ATOM 740 CA ALA A 45 36.269 5.796 -3.226 1.00 1.18 C ATOM 741 C ALA A 45 37.315 4.845 -2.660 1.00 1.18 C ATOM 742 O ALA A 45 38.052 5.189 -1.740 1.00 1.19 O ATOM 743 CB ALA A 45 35.209 6.092 -2.179 1.00 1.21 C ATOM 0 H ALA A 45 34.700 4.881 -4.262 1.00 1.17 H new ATOM 0 HA ALA A 45 36.769 6.724 -3.504 1.00 1.18 H new ATOM 0 HB1 ALA A 45 35.682 6.513 -1.292 1.00 1.21 H new ATOM 0 HB2 ALA A 45 34.490 6.806 -2.581 1.00 1.21 H new ATOM 0 HB3 ALA A 45 34.693 5.169 -1.912 1.00 1.21 H new ATOM 749 N LYS A 46 37.374 3.646 -3.224 1.00 1.21 N ATOM 750 CA LYS A 46 38.320 2.630 -2.785 1.00 1.24 C ATOM 751 C LYS A 46 39.764 3.046 -3.077 1.00 1.24 C ATOM 752 O LYS A 46 40.703 2.474 -2.529 1.00 1.27 O ATOM 753 CB LYS A 46 38.014 1.296 -3.474 1.00 1.32 C ATOM 754 CG LYS A 46 38.453 0.078 -2.678 1.00 1.61 C ATOM 755 CD LYS A 46 37.650 -0.076 -1.398 1.00 2.02 C ATOM 756 CE LYS A 46 36.510 -1.069 -1.560 1.00 2.38 C ATOM 757 NZ LYS A 46 35.457 -0.576 -2.486 1.00 2.75 N ATOM 0 H LYS A 46 36.772 3.352 -3.993 1.00 1.21 H new ATOM 0 HA LYS A 46 38.213 2.517 -1.706 1.00 1.24 H new ATOM 0 HB2 LYS A 46 36.942 1.231 -3.658 1.00 1.32 H new ATOM 0 HB3 LYS A 46 38.506 1.279 -4.447 1.00 1.32 H new ATOM 0 HG2 LYS A 46 38.338 -0.817 -3.289 1.00 1.61 H new ATOM 0 HG3 LYS A 46 39.512 0.164 -2.435 1.00 1.61 H new ATOM 0 HD2 LYS A 46 38.308 -0.407 -0.594 1.00 2.02 H new ATOM 0 HD3 LYS A 46 37.248 0.893 -1.103 1.00 2.02 H new ATOM 0 HE2 LYS A 46 36.905 -2.014 -1.933 1.00 2.38 H new ATOM 0 HE3 LYS A 46 36.067 -1.272 -0.585 1.00 2.38 H new ATOM 0 HZ1 LYS A 46 34.542 -0.996 -2.226 1.00 2.75 H new ATOM 0 HZ2 LYS A 46 35.394 0.460 -2.420 1.00 2.75 H new ATOM 0 HZ3 LYS A 46 35.697 -0.847 -3.461 1.00 2.75 H new ATOM 771 N THR A 47 39.934 4.043 -3.936 1.00 1.23 N ATOM 772 CA THR A 47 41.262 4.528 -4.300 1.00 1.26 C ATOM 773 C THR A 47 41.614 5.806 -3.543 1.00 1.21 C ATOM 774 O THR A 47 42.600 6.471 -3.857 1.00 1.30 O ATOM 775 CB THR A 47 41.352 4.804 -5.811 1.00 1.39 C ATOM 776 OG1 THR A 47 40.401 3.987 -6.505 1.00 1.54 O ATOM 777 CG2 THR A 47 42.751 4.514 -6.333 1.00 1.62 C ATOM 0 H THR A 47 39.167 4.534 -4.396 1.00 1.23 H new ATOM 0 HA THR A 47 41.971 3.746 -4.029 1.00 1.26 H new ATOM 0 HB THR A 47 41.131 5.857 -5.984 1.00 1.39 H new ATOM 0 HG1 THR A 47 40.458 4.165 -7.467 1.00 1.54 H new ATOM 0 HG21 THR A 47 42.789 4.717 -7.403 1.00 1.62 H new ATOM 0 HG22 THR A 47 43.471 5.150 -5.817 1.00 1.62 H new ATOM 0 HG23 THR A 47 42.997 3.467 -6.153 1.00 1.62 H new ATOM 785 N ASP A 48 40.810 6.150 -2.546 1.00 1.15 N ATOM 786 CA ASP A 48 41.052 7.360 -1.766 1.00 1.15 C ATOM 787 C ASP A 48 40.713 7.138 -0.295 1.00 1.09 C ATOM 788 O ASP A 48 39.576 6.823 0.043 1.00 1.06 O ATOM 789 CB ASP A 48 40.223 8.519 -2.325 1.00 1.24 C ATOM 790 CG ASP A 48 40.574 9.851 -1.690 1.00 1.32 C ATOM 791 OD1 ASP A 48 39.967 10.202 -0.660 1.00 1.41 O ATOM 792 OD2 ASP A 48 41.452 10.554 -2.229 1.00 1.50 O ATOM 0 H ASP A 48 39.991 5.615 -2.259 1.00 1.15 H new ATOM 0 HA ASP A 48 42.111 7.607 -1.840 1.00 1.15 H new ATOM 0 HB2 ASP A 48 40.376 8.583 -3.402 1.00 1.24 H new ATOM 0 HB3 ASP A 48 39.165 8.313 -2.166 1.00 1.24 H new ATOM 797 N PRO A 49 41.698 7.304 0.599 1.00 1.12 N ATOM 798 CA PRO A 49 41.505 7.107 2.040 1.00 1.13 C ATOM 799 C PRO A 49 40.430 8.018 2.633 1.00 1.17 C ATOM 800 O PRO A 49 39.642 7.588 3.478 1.00 1.18 O ATOM 801 CB PRO A 49 42.876 7.427 2.648 1.00 1.22 C ATOM 802 CG PRO A 49 43.610 8.184 1.595 1.00 1.25 C ATOM 803 CD PRO A 49 43.080 7.694 0.278 1.00 1.19 C ATOM 0 HA PRO A 49 41.158 6.096 2.253 1.00 1.13 H new ATOM 0 HB2 PRO A 49 42.774 8.019 3.558 1.00 1.22 H new ATOM 0 HB3 PRO A 49 43.408 6.515 2.919 1.00 1.22 H new ATOM 0 HG2 PRO A 49 43.450 9.257 1.704 1.00 1.25 H new ATOM 0 HG3 PRO A 49 44.684 8.013 1.670 1.00 1.25 H new ATOM 0 HD2 PRO A 49 43.112 8.472 -0.484 1.00 1.19 H new ATOM 0 HD3 PRO A 49 43.659 6.852 -0.101 1.00 1.19 H new ATOM 811 N GLN A 50 40.381 9.262 2.168 1.00 1.23 N ATOM 812 CA GLN A 50 39.413 10.230 2.664 1.00 1.30 C ATOM 813 C GLN A 50 38.010 9.873 2.192 1.00 1.21 C ATOM 814 O GLN A 50 37.067 9.844 2.982 1.00 1.22 O ATOM 815 CB GLN A 50 39.779 11.633 2.183 1.00 1.43 C ATOM 816 CG GLN A 50 39.925 12.652 3.301 1.00 1.59 C ATOM 817 CD GLN A 50 41.051 12.314 4.251 1.00 1.77 C ATOM 818 OE1 GLN A 50 40.834 11.727 5.312 1.00 2.00 O ATOM 819 NE2 GLN A 50 42.265 12.677 3.873 1.00 1.96 N ATOM 0 H GLN A 50 41.004 9.623 1.445 1.00 1.23 H new ATOM 0 HA GLN A 50 39.432 10.208 3.754 1.00 1.30 H new ATOM 0 HB2 GLN A 50 40.715 11.582 1.627 1.00 1.43 H new ATOM 0 HB3 GLN A 50 39.014 11.979 1.488 1.00 1.43 H new ATOM 0 HG2 GLN A 50 40.102 13.637 2.869 1.00 1.59 H new ATOM 0 HG3 GLN A 50 38.990 12.712 3.858 1.00 1.59 H new ATOM 0 HE21 GLN A 50 42.399 13.162 2.986 1.00 1.96 H new ATOM 0 HE22 GLN A 50 43.067 12.472 4.469 1.00 1.96 H new ATOM 828 N ALA A 51 37.888 9.596 0.899 1.00 1.16 N ATOM 829 CA ALA A 51 36.608 9.237 0.305 1.00 1.11 C ATOM 830 C ALA A 51 36.082 7.930 0.880 1.00 1.02 C ATOM 831 O ALA A 51 34.891 7.793 1.146 1.00 1.00 O ATOM 832 CB ALA A 51 36.735 9.143 -1.207 1.00 1.15 C ATOM 0 H ALA A 51 38.666 9.614 0.239 1.00 1.16 H new ATOM 0 HA ALA A 51 35.891 10.021 0.548 1.00 1.11 H new ATOM 0 HB1 ALA A 51 35.770 8.874 -1.637 1.00 1.15 H new ATOM 0 HB2 ALA A 51 37.054 10.106 -1.606 1.00 1.15 H new ATOM 0 HB3 ALA A 51 37.472 8.382 -1.464 1.00 1.15 H new ATOM 838 N ALA A 52 36.977 6.969 1.069 1.00 1.01 N ATOM 839 CA ALA A 52 36.599 5.676 1.630 1.00 1.01 C ATOM 840 C ALA A 52 36.090 5.845 3.054 1.00 1.04 C ATOM 841 O ALA A 52 35.138 5.185 3.467 1.00 1.05 O ATOM 842 CB ALA A 52 37.775 4.716 1.599 1.00 1.07 C ATOM 0 H ALA A 52 37.968 7.059 0.843 1.00 1.01 H new ATOM 0 HA ALA A 52 35.797 5.258 1.021 1.00 1.01 H new ATOM 0 HB1 ALA A 52 37.473 3.758 2.021 1.00 1.07 H new ATOM 0 HB2 ALA A 52 38.100 4.572 0.569 1.00 1.07 H new ATOM 0 HB3 ALA A 52 38.597 5.128 2.185 1.00 1.07 H new ATOM 848 N GLU A 53 36.726 6.743 3.800 1.00 1.10 N ATOM 849 CA GLU A 53 36.325 7.019 5.174 1.00 1.20 C ATOM 850 C GLU A 53 34.971 7.733 5.177 1.00 1.18 C ATOM 851 O GLU A 53 34.195 7.632 6.131 1.00 1.23 O ATOM 852 CB GLU A 53 37.393 7.859 5.878 1.00 1.32 C ATOM 853 CG GLU A 53 37.336 7.775 7.393 1.00 1.52 C ATOM 854 CD GLU A 53 37.370 6.346 7.898 1.00 1.64 C ATOM 855 OE1 GLU A 53 38.387 5.652 7.674 1.00 1.87 O ATOM 856 OE2 GLU A 53 36.372 5.902 8.511 1.00 1.65 O ATOM 0 H GLU A 53 37.522 7.292 3.475 1.00 1.10 H new ATOM 0 HA GLU A 53 36.225 6.081 5.720 1.00 1.20 H new ATOM 0 HB2 GLU A 53 38.378 7.534 5.542 1.00 1.32 H new ATOM 0 HB3 GLU A 53 37.281 8.900 5.576 1.00 1.32 H new ATOM 0 HG2 GLU A 53 38.176 8.326 7.816 1.00 1.52 H new ATOM 0 HG3 GLU A 53 36.426 8.260 7.746 1.00 1.52 H new ATOM 863 N LYS A 54 34.689 8.455 4.093 1.00 1.14 N ATOM 864 CA LYS A 54 33.421 9.158 3.950 1.00 1.15 C ATOM 865 C LYS A 54 32.313 8.144 3.712 1.00 1.06 C ATOM 866 O LYS A 54 31.203 8.293 4.214 1.00 1.08 O ATOM 867 CB LYS A 54 33.471 10.170 2.793 1.00 1.20 C ATOM 868 CG LYS A 54 34.176 11.473 3.139 1.00 1.43 C ATOM 869 CD LYS A 54 34.452 12.306 1.893 1.00 1.56 C ATOM 870 CE LYS A 54 33.168 12.713 1.178 1.00 1.86 C ATOM 871 NZ LYS A 54 33.450 13.451 -0.081 1.00 2.25 N ATOM 0 H LYS A 54 35.324 8.567 3.302 1.00 1.14 H new ATOM 0 HA LYS A 54 33.224 9.714 4.867 1.00 1.15 H new ATOM 0 HB2 LYS A 54 33.976 9.710 1.944 1.00 1.20 H new ATOM 0 HB3 LYS A 54 32.453 10.393 2.475 1.00 1.20 H new ATOM 0 HG2 LYS A 54 33.562 12.047 3.833 1.00 1.43 H new ATOM 0 HG3 LYS A 54 35.115 11.256 3.648 1.00 1.43 H new ATOM 0 HD2 LYS A 54 35.010 13.200 2.172 1.00 1.56 H new ATOM 0 HD3 LYS A 54 35.082 11.737 1.209 1.00 1.56 H new ATOM 0 HE2 LYS A 54 32.579 11.824 0.954 1.00 1.86 H new ATOM 0 HE3 LYS A 54 32.566 13.337 1.838 1.00 1.86 H new ATOM 0 HZ1 LYS A 54 32.553 13.711 -0.539 1.00 2.25 H new ATOM 0 HZ2 LYS A 54 33.991 14.312 0.135 1.00 2.25 H new ATOM 0 HZ3 LYS A 54 34.003 12.846 -0.721 1.00 2.25 H new ATOM 885 N LEU A 55 32.634 7.102 2.955 1.00 0.98 N ATOM 886 CA LEU A 55 31.674 6.046 2.666 1.00 0.95 C ATOM 887 C LEU A 55 31.422 5.213 3.915 1.00 0.98 C ATOM 888 O LEU A 55 30.313 4.728 4.135 1.00 1.00 O ATOM 889 CB LEU A 55 32.181 5.150 1.525 1.00 0.93 C ATOM 890 CG LEU A 55 31.577 5.437 0.144 1.00 1.05 C ATOM 891 CD1 LEU A 55 30.076 5.188 0.152 1.00 1.34 C ATOM 892 CD2 LEU A 55 31.880 6.864 -0.287 1.00 1.22 C ATOM 0 H LEU A 55 33.552 6.966 2.531 1.00 0.98 H new ATOM 0 HA LEU A 55 30.737 6.507 2.352 1.00 0.95 H new ATOM 0 HB2 LEU A 55 33.264 5.254 1.458 1.00 0.93 H new ATOM 0 HB3 LEU A 55 31.976 4.111 1.783 1.00 0.93 H new ATOM 0 HG LEU A 55 32.033 4.757 -0.576 1.00 1.05 H new ATOM 0 HD11 LEU A 55 29.667 5.397 -0.837 1.00 1.34 H new ATOM 0 HD12 LEU A 55 29.881 4.148 0.412 1.00 1.34 H new ATOM 0 HD13 LEU A 55 29.603 5.840 0.886 1.00 1.34 H new ATOM 0 HD21 LEU A 55 31.443 7.048 -1.269 1.00 1.22 H new ATOM 0 HD22 LEU A 55 31.455 7.560 0.436 1.00 1.22 H new ATOM 0 HD23 LEU A 55 32.959 7.007 -0.337 1.00 1.22 H new ATOM 904 N ASN A 56 32.459 5.071 4.735 1.00 1.04 N ATOM 905 CA ASN A 56 32.375 4.306 5.974 1.00 1.14 C ATOM 906 C ASN A 56 31.290 4.873 6.887 1.00 1.19 C ATOM 907 O ASN A 56 30.407 4.150 7.351 1.00 1.25 O ATOM 908 CB ASN A 56 33.726 4.315 6.689 1.00 1.25 C ATOM 909 CG ASN A 56 33.715 3.497 7.963 1.00 1.42 C ATOM 910 OD1 ASN A 56 32.984 2.512 8.081 1.00 1.48 O ATOM 911 ND2 ASN A 56 34.541 3.884 8.920 1.00 1.57 N ATOM 0 H ASN A 56 33.377 5.481 4.560 1.00 1.04 H new ATOM 0 HA ASN A 56 32.112 3.277 5.727 1.00 1.14 H new ATOM 0 HB2 ASN A 56 34.491 3.925 6.018 1.00 1.25 H new ATOM 0 HB3 ASN A 56 34.002 5.343 6.924 1.00 1.25 H new ATOM 0 HD21 ASN A 56 34.589 3.361 9.795 1.00 1.57 H new ATOM 0 HD22 ASN A 56 35.130 4.705 8.784 1.00 1.57 H new ATOM 918 N LYS A 57 31.351 6.175 7.126 1.00 1.20 N ATOM 919 CA LYS A 57 30.370 6.847 7.974 1.00 1.28 C ATOM 920 C LYS A 57 29.000 6.889 7.299 1.00 1.22 C ATOM 921 O LYS A 57 27.973 6.926 7.974 1.00 1.27 O ATOM 922 CB LYS A 57 30.831 8.263 8.346 1.00 1.39 C ATOM 923 CG LYS A 57 31.308 9.096 7.163 1.00 1.52 C ATOM 924 CD LYS A 57 31.633 10.525 7.573 1.00 1.63 C ATOM 925 CE LYS A 57 32.774 10.580 8.571 1.00 1.74 C ATOM 926 NZ LYS A 57 34.068 10.164 7.971 1.00 1.86 N ATOM 0 H LYS A 57 32.070 6.790 6.745 1.00 1.20 H new ATOM 0 HA LYS A 57 30.281 6.269 8.894 1.00 1.28 H new ATOM 0 HB2 LYS A 57 30.008 8.784 8.834 1.00 1.39 H new ATOM 0 HB3 LYS A 57 31.639 8.190 9.074 1.00 1.39 H new ATOM 0 HG2 LYS A 57 32.193 8.633 6.726 1.00 1.52 H new ATOM 0 HG3 LYS A 57 30.538 9.105 6.391 1.00 1.52 H new ATOM 0 HD2 LYS A 57 31.895 11.106 6.689 1.00 1.63 H new ATOM 0 HD3 LYS A 57 30.747 10.989 8.008 1.00 1.63 H new ATOM 0 HE2 LYS A 57 32.866 11.594 8.959 1.00 1.74 H new ATOM 0 HE3 LYS A 57 32.544 9.934 9.418 1.00 1.74 H new ATOM 0 HZ1 LYS A 57 34.823 10.250 8.681 1.00 1.86 H new ATOM 0 HZ2 LYS A 57 34.002 9.176 7.654 1.00 1.86 H new ATOM 0 HZ3 LYS A 57 34.286 10.775 7.158 1.00 1.86 H new ATOM 940 N LEU A 58 28.995 6.913 5.967 1.00 1.12 N ATOM 941 CA LEU A 58 27.752 6.959 5.200 1.00 1.10 C ATOM 942 C LEU A 58 26.917 5.693 5.411 1.00 1.08 C ATOM 943 O LEU A 58 25.751 5.768 5.801 1.00 1.11 O ATOM 944 CB LEU A 58 28.061 7.128 3.709 1.00 1.06 C ATOM 945 CG LEU A 58 27.619 8.453 3.082 1.00 1.22 C ATOM 946 CD1 LEU A 58 26.106 8.590 3.109 1.00 1.35 C ATOM 947 CD2 LEU A 58 28.273 9.624 3.793 1.00 1.39 C ATOM 0 H LEU A 58 29.840 6.901 5.396 1.00 1.12 H new ATOM 0 HA LEU A 58 27.174 7.812 5.554 1.00 1.10 H new ATOM 0 HB2 LEU A 58 29.136 7.021 3.566 1.00 1.06 H new ATOM 0 HB3 LEU A 58 27.584 6.313 3.164 1.00 1.06 H new ATOM 0 HG LEU A 58 27.940 8.457 2.040 1.00 1.22 H new ATOM 0 HD11 LEU A 58 25.819 9.540 2.658 1.00 1.35 H new ATOM 0 HD12 LEU A 58 25.656 7.771 2.548 1.00 1.35 H new ATOM 0 HD13 LEU A 58 25.756 8.558 4.141 1.00 1.35 H new ATOM 0 HD21 LEU A 58 27.947 10.557 3.333 1.00 1.39 H new ATOM 0 HD22 LEU A 58 27.986 9.618 4.844 1.00 1.39 H new ATOM 0 HD23 LEU A 58 29.357 9.539 3.712 1.00 1.39 H new ATOM 959 N ILE A 59 27.523 4.534 5.173 1.00 1.07 N ATOM 960 CA ILE A 59 26.818 3.263 5.327 1.00 1.12 C ATOM 961 C ILE A 59 26.424 3.037 6.787 1.00 1.22 C ATOM 962 O ILE A 59 25.338 2.536 7.079 1.00 1.28 O ATOM 963 CB ILE A 59 27.656 2.068 4.798 1.00 1.15 C ATOM 964 CG1 ILE A 59 26.898 0.745 4.977 1.00 1.28 C ATOM 965 CG2 ILE A 59 29.018 1.995 5.474 1.00 1.26 C ATOM 966 CD1 ILE A 59 25.769 0.549 3.984 1.00 1.39 C ATOM 0 H ILE A 59 28.494 4.447 4.875 1.00 1.07 H new ATOM 0 HA ILE A 59 25.912 3.320 4.724 1.00 1.12 H new ATOM 0 HB ILE A 59 27.820 2.233 3.733 1.00 1.15 H new ATOM 0 HG12 ILE A 59 27.601 -0.082 4.881 1.00 1.28 H new ATOM 0 HG13 ILE A 59 26.492 0.703 5.988 1.00 1.28 H new ATOM 0 HG21 ILE A 59 29.576 1.146 5.078 1.00 1.26 H new ATOM 0 HG22 ILE A 59 29.570 2.914 5.280 1.00 1.26 H new ATOM 0 HG23 ILE A 59 28.885 1.872 6.549 1.00 1.26 H new ATOM 0 HD11 ILE A 59 25.280 -0.407 4.173 1.00 1.39 H new ATOM 0 HD12 ILE A 59 25.044 1.355 4.094 1.00 1.39 H new ATOM 0 HD13 ILE A 59 26.170 0.558 2.971 1.00 1.39 H new ATOM 978 N GLU A 60 27.301 3.443 7.696 1.00 1.27 N ATOM 979 CA GLU A 60 27.051 3.301 9.122 1.00 1.41 C ATOM 980 C GLU A 60 25.832 4.131 9.525 1.00 1.39 C ATOM 981 O GLU A 60 24.980 3.681 10.297 1.00 1.49 O ATOM 982 CB GLU A 60 28.286 3.751 9.899 1.00 1.52 C ATOM 983 CG GLU A 60 28.174 3.572 11.398 1.00 1.73 C ATOM 984 CD GLU A 60 29.400 4.072 12.122 1.00 2.09 C ATOM 985 OE1 GLU A 60 29.636 5.301 12.117 1.00 2.28 O ATOM 986 OE2 GLU A 60 30.128 3.245 12.706 1.00 2.61 O ATOM 0 H GLU A 60 28.196 3.875 7.468 1.00 1.27 H new ATOM 0 HA GLU A 60 26.846 2.256 9.354 1.00 1.41 H new ATOM 0 HB2 GLU A 60 29.151 3.192 9.541 1.00 1.52 H new ATOM 0 HB3 GLU A 60 28.475 4.803 9.683 1.00 1.52 H new ATOM 0 HG2 GLU A 60 27.296 4.105 11.762 1.00 1.73 H new ATOM 0 HG3 GLU A 60 28.023 2.517 11.627 1.00 1.73 H new ATOM 993 N GLY A 61 25.744 5.332 8.967 1.00 1.30 N ATOM 994 CA GLY A 61 24.635 6.220 9.256 1.00 1.30 C ATOM 995 C GLY A 61 23.318 5.663 8.765 1.00 1.26 C ATOM 996 O GLY A 61 22.270 5.953 9.332 1.00 1.27 O ATOM 0 H GLY A 61 26.429 5.710 8.313 1.00 1.30 H new ATOM 0 HA2 GLY A 61 24.578 6.390 10.331 1.00 1.30 H new ATOM 0 HA3 GLY A 61 24.815 7.188 8.789 1.00 1.30 H new ATOM 1000 N TYR A 62 23.371 4.864 7.703 1.00 1.25 N ATOM 1001 CA TYR A 62 22.170 4.250 7.156 1.00 1.31 C ATOM 1002 C TYR A 62 21.620 3.207 8.126 1.00 1.43 C ATOM 1003 O TYR A 62 20.417 3.168 8.392 1.00 1.47 O ATOM 1004 CB TYR A 62 22.449 3.607 5.793 1.00 1.39 C ATOM 1005 CG TYR A 62 22.528 4.601 4.653 1.00 1.59 C ATOM 1006 CD1 TYR A 62 21.591 5.622 4.528 1.00 2.27 C ATOM 1007 CD2 TYR A 62 23.532 4.516 3.697 1.00 2.03 C ATOM 1008 CE1 TYR A 62 21.656 6.527 3.488 1.00 2.80 C ATOM 1009 CE2 TYR A 62 23.602 5.421 2.654 1.00 2.60 C ATOM 1010 CZ TYR A 62 22.661 6.423 2.556 1.00 2.80 C ATOM 1011 OH TYR A 62 22.727 7.324 1.520 1.00 3.54 O ATOM 0 H TYR A 62 24.231 4.629 7.207 1.00 1.25 H new ATOM 0 HA TYR A 62 21.425 5.034 7.016 1.00 1.31 H new ATOM 0 HB2 TYR A 62 23.387 3.055 5.847 1.00 1.39 H new ATOM 0 HB3 TYR A 62 21.665 2.882 5.577 1.00 1.39 H new ATOM 0 HD1 TYR A 62 20.799 5.708 5.257 1.00 2.27 H new ATOM 0 HD2 TYR A 62 24.270 3.731 3.769 1.00 2.03 H new ATOM 0 HE1 TYR A 62 20.920 7.314 3.407 1.00 2.80 H new ATOM 0 HE2 TYR A 62 24.390 5.343 1.920 1.00 2.60 H new ATOM 0 HH TYR A 62 23.496 7.112 0.951 1.00 3.54 H new ATOM 1021 N THR A 63 22.511 2.380 8.670 1.00 1.55 N ATOM 1022 CA THR A 63 22.117 1.349 9.621 1.00 1.74 C ATOM 1023 C THR A 63 21.662 1.971 10.942 1.00 1.68 C ATOM 1024 O THR A 63 20.856 1.393 11.670 1.00 1.81 O ATOM 1025 CB THR A 63 23.264 0.352 9.882 1.00 1.96 C ATOM 1026 OG1 THR A 63 24.519 1.046 9.944 1.00 2.00 O ATOM 1027 CG2 THR A 63 23.321 -0.706 8.791 1.00 2.37 C ATOM 0 H THR A 63 23.510 2.406 8.467 1.00 1.55 H new ATOM 0 HA THR A 63 21.283 0.805 9.178 1.00 1.74 H new ATOM 0 HB THR A 63 23.074 -0.139 10.836 1.00 1.96 H new ATOM 0 HG1 THR A 63 24.367 1.973 10.221 1.00 2.00 H new ATOM 0 HG21 THR A 63 24.138 -1.398 8.997 1.00 2.37 H new ATOM 0 HG22 THR A 63 22.379 -1.254 8.766 1.00 2.37 H new ATOM 0 HG23 THR A 63 23.487 -0.226 7.827 1.00 2.37 H new ATOM 1035 N TYR A 64 22.185 3.154 11.241 1.00 1.56 N ATOM 1036 CA TYR A 64 21.833 3.869 12.461 1.00 1.61 C ATOM 1037 C TYR A 64 20.857 4.987 12.143 1.00 1.32 C ATOM 1038 O TYR A 64 20.745 5.966 12.887 1.00 1.40 O ATOM 1039 CB TYR A 64 23.082 4.481 13.103 1.00 1.89 C ATOM 1040 CG TYR A 64 23.966 3.509 13.858 1.00 2.36 C ATOM 1041 CD1 TYR A 64 23.614 3.056 15.123 1.00 2.88 C ATOM 1042 CD2 TYR A 64 25.164 3.067 13.313 1.00 2.94 C ATOM 1043 CE1 TYR A 64 24.430 2.186 15.820 1.00 3.56 C ATOM 1044 CE2 TYR A 64 25.987 2.202 14.004 1.00 3.61 C ATOM 1045 CZ TYR A 64 25.617 1.762 15.256 1.00 3.79 C ATOM 1046 OH TYR A 64 26.440 0.901 15.950 1.00 4.61 O ATOM 0 H TYR A 64 22.859 3.641 10.650 1.00 1.56 H new ATOM 0 HA TYR A 64 21.378 3.159 13.151 1.00 1.61 H new ATOM 0 HB2 TYR A 64 23.676 4.955 12.322 1.00 1.89 H new ATOM 0 HB3 TYR A 64 22.769 5.269 13.788 1.00 1.89 H new ATOM 0 HD1 TYR A 64 22.688 3.389 15.569 1.00 2.88 H new ATOM 0 HD2 TYR A 64 25.457 3.406 12.330 1.00 2.94 H new ATOM 0 HE1 TYR A 64 24.141 1.839 16.801 1.00 3.56 H new ATOM 0 HE2 TYR A 64 26.917 1.871 13.566 1.00 3.61 H new ATOM 0 HH TYR A 64 27.233 0.701 15.411 1.00 4.61 H new ATOM 1056 N GLY A 65 20.164 4.845 11.030 1.00 1.16 N ATOM 1057 CA GLY A 65 19.219 5.858 10.620 1.00 1.08 C ATOM 1058 C GLY A 65 17.883 5.733 11.318 1.00 1.03 C ATOM 1059 O GLY A 65 17.090 4.845 10.998 1.00 1.02 O ATOM 0 H GLY A 65 20.238 4.046 10.401 1.00 1.16 H new ATOM 0 HA2 GLY A 65 19.639 6.843 10.823 1.00 1.08 H new ATOM 0 HA3 GLY A 65 19.068 5.792 9.543 1.00 1.08 H new ATOM 1063 N GLU A 66 17.638 6.620 12.276 1.00 1.04 N ATOM 1064 CA GLU A 66 16.375 6.636 13.005 1.00 1.03 C ATOM 1065 C GLU A 66 15.256 6.999 12.045 1.00 0.98 C ATOM 1066 O GLU A 66 14.155 6.451 12.108 1.00 0.98 O ATOM 1067 CB GLU A 66 16.433 7.643 14.154 1.00 1.10 C ATOM 1068 CG GLU A 66 16.938 7.048 15.458 1.00 1.55 C ATOM 1069 CD GLU A 66 15.883 6.227 16.162 1.00 1.48 C ATOM 1070 OE1 GLU A 66 15.051 6.815 16.880 1.00 1.79 O ATOM 1071 OE2 GLU A 66 15.881 4.991 16.012 1.00 1.73 O ATOM 0 H GLU A 66 18.300 7.340 12.567 1.00 1.04 H new ATOM 0 HA GLU A 66 16.189 5.649 13.429 1.00 1.03 H new ATOM 0 HB2 GLU A 66 17.080 8.472 13.868 1.00 1.10 H new ATOM 0 HB3 GLU A 66 15.437 8.057 14.314 1.00 1.10 H new ATOM 0 HG2 GLU A 66 17.807 6.422 15.256 1.00 1.55 H new ATOM 0 HG3 GLU A 66 17.269 7.851 16.117 1.00 1.55 H new ATOM 1078 N GLU A 67 15.566 7.923 11.146 1.00 0.98 N ATOM 1079 CA GLU A 67 14.626 8.365 10.138 1.00 0.98 C ATOM 1080 C GLU A 67 14.237 7.195 9.241 1.00 0.95 C ATOM 1081 O GLU A 67 13.076 7.044 8.870 1.00 0.93 O ATOM 1082 CB GLU A 67 15.234 9.502 9.304 1.00 1.05 C ATOM 1083 CG GLU A 67 15.588 10.742 10.117 1.00 1.33 C ATOM 1084 CD GLU A 67 17.041 10.765 10.566 1.00 1.79 C ATOM 1085 OE1 GLU A 67 17.525 9.739 11.094 1.00 2.37 O ATOM 1086 OE2 GLU A 67 17.698 11.814 10.396 1.00 2.46 O ATOM 0 H GLU A 67 16.475 8.383 11.099 1.00 0.98 H new ATOM 0 HA GLU A 67 13.730 8.742 10.631 1.00 0.98 H new ATOM 0 HB2 GLU A 67 16.133 9.135 8.808 1.00 1.05 H new ATOM 0 HB3 GLU A 67 14.530 9.782 8.521 1.00 1.05 H new ATOM 0 HG2 GLU A 67 15.384 11.631 9.520 1.00 1.33 H new ATOM 0 HG3 GLU A 67 14.942 10.791 10.994 1.00 1.33 H new ATOM 1093 N ARG A 68 15.218 6.346 8.931 1.00 0.97 N ATOM 1094 CA ARG A 68 14.987 5.175 8.090 1.00 0.99 C ATOM 1095 C ARG A 68 14.036 4.211 8.795 1.00 0.96 C ATOM 1096 O ARG A 68 13.160 3.605 8.171 1.00 0.97 O ATOM 1097 CB ARG A 68 16.318 4.484 7.764 1.00 1.06 C ATOM 1098 CG ARG A 68 16.254 3.561 6.550 1.00 1.17 C ATOM 1099 CD ARG A 68 15.872 2.134 6.929 1.00 1.27 C ATOM 1100 NE ARG A 68 15.421 1.360 5.766 1.00 1.43 N ATOM 1101 CZ ARG A 68 14.360 0.549 5.767 1.00 1.40 C ATOM 1102 NH1 ARG A 68 13.665 0.356 6.877 1.00 1.41 N ATOM 1103 NH2 ARG A 68 14.006 -0.080 4.649 1.00 1.70 N ATOM 0 H ARG A 68 16.181 6.449 9.251 1.00 0.97 H new ATOM 0 HA ARG A 68 14.530 5.493 7.153 1.00 0.99 H new ATOM 0 HB2 ARG A 68 17.078 5.245 7.590 1.00 1.06 H new ATOM 0 HB3 ARG A 68 16.638 3.906 8.631 1.00 1.06 H new ATOM 0 HG2 ARG A 68 15.528 3.952 5.837 1.00 1.17 H new ATOM 0 HG3 ARG A 68 17.222 3.555 6.049 1.00 1.17 H new ATOM 0 HD2 ARG A 68 16.729 1.638 7.385 1.00 1.27 H new ATOM 0 HD3 ARG A 68 15.081 2.157 7.679 1.00 1.27 H new ATOM 0 HE ARG A 68 15.953 1.447 4.900 1.00 1.43 H new ATOM 0 HH11 ARG A 68 13.939 0.828 7.739 1.00 1.41 H new ATOM 0 HH12 ARG A 68 12.856 -0.265 6.871 1.00 1.41 H new ATOM 0 HH21 ARG A 68 14.545 0.058 3.794 1.00 1.70 H new ATOM 0 HH22 ARG A 68 13.196 -0.700 4.647 1.00 1.70 H new ATOM 1117 N LYS A 69 14.209 4.095 10.104 1.00 0.95 N ATOM 1118 CA LYS A 69 13.372 3.232 10.925 1.00 0.97 C ATOM 1119 C LYS A 69 11.935 3.748 10.930 1.00 0.91 C ATOM 1120 O LYS A 69 10.978 2.968 10.928 1.00 0.92 O ATOM 1121 CB LYS A 69 13.922 3.177 12.352 1.00 1.04 C ATOM 1122 CG LYS A 69 13.134 2.272 13.285 1.00 1.31 C ATOM 1123 CD LYS A 69 13.475 2.544 14.742 1.00 1.43 C ATOM 1124 CE LYS A 69 12.858 3.850 15.223 1.00 1.48 C ATOM 1125 NZ LYS A 69 13.358 4.246 16.565 1.00 1.54 N ATOM 0 H LYS A 69 14.930 4.594 10.625 1.00 0.95 H new ATOM 0 HA LYS A 69 13.380 2.225 10.507 1.00 0.97 H new ATOM 0 HB2 LYS A 69 14.956 2.835 12.319 1.00 1.04 H new ATOM 0 HB3 LYS A 69 13.933 4.186 12.765 1.00 1.04 H new ATOM 0 HG2 LYS A 69 12.066 2.424 13.125 1.00 1.31 H new ATOM 0 HG3 LYS A 69 13.347 1.229 13.049 1.00 1.31 H new ATOM 0 HD2 LYS A 69 13.117 1.721 15.361 1.00 1.43 H new ATOM 0 HD3 LYS A 69 14.558 2.585 14.862 1.00 1.43 H new ATOM 0 HE2 LYS A 69 13.080 4.641 14.506 1.00 1.48 H new ATOM 0 HE3 LYS A 69 11.773 3.747 15.257 1.00 1.48 H new ATOM 0 HZ1 LYS A 69 13.033 5.209 16.787 1.00 1.54 H new ATOM 0 HZ2 LYS A 69 12.994 3.584 17.280 1.00 1.54 H new ATOM 0 HZ3 LYS A 69 14.398 4.223 16.569 1.00 1.54 H new ATOM 1139 N LEU A 70 11.797 5.071 10.919 1.00 0.90 N ATOM 1140 CA LEU A 70 10.485 5.706 10.912 1.00 0.88 C ATOM 1141 C LEU A 70 9.758 5.415 9.601 1.00 0.85 C ATOM 1142 O LEU A 70 8.542 5.226 9.588 1.00 0.85 O ATOM 1143 CB LEU A 70 10.612 7.220 11.124 1.00 0.93 C ATOM 1144 CG LEU A 70 9.286 7.986 11.170 1.00 1.01 C ATOM 1145 CD1 LEU A 70 8.424 7.513 12.326 1.00 1.14 C ATOM 1146 CD2 LEU A 70 9.541 9.476 11.274 1.00 1.15 C ATOM 0 H LEU A 70 12.580 5.724 10.915 1.00 0.90 H new ATOM 0 HA LEU A 70 9.902 5.291 11.735 1.00 0.88 H new ATOM 0 HB2 LEU A 70 11.148 7.396 12.057 1.00 0.93 H new ATOM 0 HB3 LEU A 70 11.224 7.633 10.322 1.00 0.93 H new ATOM 0 HG LEU A 70 8.747 7.787 10.244 1.00 1.01 H new ATOM 0 HD11 LEU A 70 7.489 8.073 12.336 1.00 1.14 H new ATOM 0 HD12 LEU A 70 8.210 6.451 12.209 1.00 1.14 H new ATOM 0 HD13 LEU A 70 8.954 7.675 13.265 1.00 1.14 H new ATOM 0 HD21 LEU A 70 8.589 10.007 11.306 1.00 1.15 H new ATOM 0 HD22 LEU A 70 10.104 9.686 12.183 1.00 1.15 H new ATOM 0 HD23 LEU A 70 10.113 9.809 10.408 1.00 1.15 H new ATOM 1158 N TYR A 71 10.509 5.373 8.503 1.00 0.84 N ATOM 1159 CA TYR A 71 9.924 5.084 7.194 1.00 0.86 C ATOM 1160 C TYR A 71 9.326 3.680 7.195 1.00 0.85 C ATOM 1161 O TYR A 71 8.212 3.462 6.718 1.00 0.85 O ATOM 1162 CB TYR A 71 10.973 5.186 6.076 1.00 0.91 C ATOM 1163 CG TYR A 71 11.709 6.507 6.005 1.00 0.92 C ATOM 1164 CD1 TYR A 71 11.139 7.685 6.473 1.00 0.94 C ATOM 1165 CD2 TYR A 71 12.988 6.572 5.460 1.00 0.99 C ATOM 1166 CE1 TYR A 71 11.823 8.883 6.402 1.00 1.01 C ATOM 1167 CE2 TYR A 71 13.677 7.768 5.386 1.00 1.05 C ATOM 1168 CZ TYR A 71 13.090 8.920 5.859 1.00 1.05 C ATOM 1169 OH TYR A 71 13.771 10.115 5.792 1.00 1.16 O ATOM 0 H TYR A 71 11.516 5.534 8.492 1.00 0.84 H new ATOM 0 HA TYR A 71 9.146 5.823 7.005 1.00 0.86 H new ATOM 0 HB2 TYR A 71 11.703 4.388 6.210 1.00 0.91 H new ATOM 0 HB3 TYR A 71 10.480 5.010 5.120 1.00 0.91 H new ATOM 0 HD1 TYR A 71 10.147 7.663 6.898 1.00 0.94 H new ATOM 0 HD2 TYR A 71 13.451 5.670 5.088 1.00 0.99 H new ATOM 0 HE1 TYR A 71 11.366 9.789 6.771 1.00 1.01 H new ATOM 0 HE2 TYR A 71 14.669 7.799 4.960 1.00 1.05 H new ATOM 0 HH TYR A 71 14.650 9.968 5.384 1.00 1.16 H new ATOM 1179 N ASP A 72 10.076 2.738 7.759 1.00 0.86 N ATOM 1180 CA ASP A 72 9.646 1.348 7.841 1.00 0.90 C ATOM 1181 C ASP A 72 8.401 1.232 8.706 1.00 0.87 C ATOM 1182 O ASP A 72 7.465 0.499 8.378 1.00 0.87 O ATOM 1183 CB ASP A 72 10.768 0.483 8.420 1.00 0.98 C ATOM 1184 CG ASP A 72 10.773 -0.917 7.846 1.00 1.21 C ATOM 1185 OD1 ASP A 72 10.082 -1.797 8.399 1.00 1.47 O ATOM 1186 OD2 ASP A 72 11.479 -1.144 6.841 1.00 1.48 O ATOM 0 H ASP A 72 10.993 2.916 8.169 1.00 0.86 H new ATOM 0 HA ASP A 72 9.410 0.996 6.837 1.00 0.90 H new ATOM 0 HB2 ASP A 72 11.729 0.958 8.220 1.00 0.98 H new ATOM 0 HB3 ASP A 72 10.658 0.428 9.503 1.00 0.98 H new ATOM 1191 N SER A 73 8.380 2.000 9.792 1.00 0.85 N ATOM 1192 CA SER A 73 7.254 2.001 10.715 1.00 0.85 C ATOM 1193 C SER A 73 6.004 2.573 10.044 1.00 0.81 C ATOM 1194 O SER A 73 4.875 2.267 10.439 1.00 0.80 O ATOM 1195 CB SER A 73 7.604 2.812 11.963 1.00 0.90 C ATOM 1196 OG SER A 73 8.833 2.378 12.531 1.00 0.96 O ATOM 0 H SER A 73 9.136 2.633 10.053 1.00 0.85 H new ATOM 0 HA SER A 73 7.043 0.972 11.007 1.00 0.85 H new ATOM 0 HB2 SER A 73 7.673 3.869 11.705 1.00 0.90 H new ATOM 0 HB3 SER A 73 6.806 2.714 12.699 1.00 0.90 H new ATOM 0 HG SER A 73 9.578 2.690 11.976 1.00 0.96 H new ATOM 1202 N ALA A 74 6.211 3.403 9.029 1.00 0.80 N ATOM 1203 CA ALA A 74 5.104 3.994 8.298 1.00 0.79 C ATOM 1204 C ALA A 74 4.431 2.934 7.438 1.00 0.76 C ATOM 1205 O ALA A 74 3.218 2.971 7.219 1.00 0.75 O ATOM 1206 CB ALA A 74 5.582 5.162 7.446 1.00 0.82 C ATOM 0 H ALA A 74 7.135 3.680 8.696 1.00 0.80 H new ATOM 0 HA ALA A 74 4.376 4.380 9.011 1.00 0.79 H new ATOM 0 HB1 ALA A 74 4.736 5.589 6.907 1.00 0.82 H new ATOM 0 HB2 ALA A 74 6.025 5.923 8.088 1.00 0.82 H new ATOM 0 HB3 ALA A 74 6.327 4.811 6.732 1.00 0.82 H new ATOM 1212 N LEU A 75 5.224 1.979 6.964 1.00 0.77 N ATOM 1213 CA LEU A 75 4.698 0.894 6.153 1.00 0.78 C ATOM 1214 C LEU A 75 3.853 -0.029 7.026 1.00 0.77 C ATOM 1215 O LEU A 75 2.845 -0.581 6.580 1.00 0.77 O ATOM 1216 CB LEU A 75 5.836 0.105 5.497 1.00 0.83 C ATOM 1217 CG LEU A 75 5.670 -0.168 3.998 1.00 0.92 C ATOM 1218 CD1 LEU A 75 4.412 -0.983 3.729 1.00 1.13 C ATOM 1219 CD2 LEU A 75 5.641 1.134 3.215 1.00 1.15 C ATOM 0 H LEU A 75 6.230 1.937 7.128 1.00 0.77 H new ATOM 0 HA LEU A 75 4.077 1.315 5.362 1.00 0.78 H new ATOM 0 HB2 LEU A 75 6.767 0.650 5.648 1.00 0.83 H new ATOM 0 HB3 LEU A 75 5.938 -0.849 6.013 1.00 0.83 H new ATOM 0 HG LEU A 75 6.529 -0.750 3.665 1.00 0.92 H new ATOM 0 HD11 LEU A 75 4.317 -1.163 2.658 1.00 1.13 H new ATOM 0 HD12 LEU A 75 4.477 -1.937 4.253 1.00 1.13 H new ATOM 0 HD13 LEU A 75 3.540 -0.433 4.083 1.00 1.13 H new ATOM 0 HD21 LEU A 75 5.523 0.918 2.153 1.00 1.15 H new ATOM 0 HD22 LEU A 75 4.805 1.745 3.556 1.00 1.15 H new ATOM 0 HD23 LEU A 75 6.574 1.675 3.373 1.00 1.15 H new ATOM 1231 N SER A 76 4.274 -0.186 8.280 1.00 0.78 N ATOM 1232 CA SER A 76 3.546 -1.013 9.230 1.00 0.80 C ATOM 1233 C SER A 76 2.156 -0.421 9.455 1.00 0.76 C ATOM 1234 O SER A 76 1.181 -1.141 9.676 1.00 0.77 O ATOM 1235 CB SER A 76 4.318 -1.102 10.550 1.00 0.85 C ATOM 1236 OG SER A 76 5.696 -0.844 10.347 1.00 0.88 O ATOM 0 H SER A 76 5.115 0.250 8.658 1.00 0.78 H new ATOM 0 HA SER A 76 3.440 -2.021 8.830 1.00 0.80 H new ATOM 0 HB2 SER A 76 3.911 -0.385 11.263 1.00 0.85 H new ATOM 0 HB3 SER A 76 4.190 -2.093 10.985 1.00 0.85 H new ATOM 0 HG SER A 76 6.193 -1.059 11.164 1.00 0.88 H new ATOM 1242 N LYS A 77 2.080 0.902 9.371 1.00 0.75 N ATOM 1243 CA LYS A 77 0.826 1.622 9.538 1.00 0.74 C ATOM 1244 C LYS A 77 -0.123 1.286 8.398 1.00 0.71 C ATOM 1245 O LYS A 77 -1.330 1.156 8.595 1.00 0.70 O ATOM 1246 CB LYS A 77 1.080 3.130 9.574 1.00 0.76 C ATOM 1247 CG LYS A 77 1.688 3.629 10.874 1.00 0.90 C ATOM 1248 CD LYS A 77 0.776 4.626 11.565 1.00 0.98 C ATOM 1249 CE LYS A 77 -0.517 3.973 12.027 1.00 1.35 C ATOM 1250 NZ LYS A 77 -1.580 4.972 12.293 1.00 1.61 N ATOM 0 H LYS A 77 2.883 1.503 9.186 1.00 0.75 H new ATOM 0 HA LYS A 77 0.373 1.319 10.482 1.00 0.74 H new ATOM 0 HB2 LYS A 77 1.743 3.395 8.751 1.00 0.76 H new ATOM 0 HB3 LYS A 77 0.137 3.650 9.404 1.00 0.76 H new ATOM 0 HG2 LYS A 77 1.876 2.785 11.537 1.00 0.90 H new ATOM 0 HG3 LYS A 77 2.652 4.095 10.671 1.00 0.90 H new ATOM 0 HD2 LYS A 77 1.292 5.059 12.422 1.00 0.98 H new ATOM 0 HD3 LYS A 77 0.548 5.445 10.883 1.00 0.98 H new ATOM 0 HE2 LYS A 77 -0.861 3.272 11.267 1.00 1.35 H new ATOM 0 HE3 LYS A 77 -0.328 3.395 12.932 1.00 1.35 H new ATOM 0 HZ1 LYS A 77 -2.444 4.485 12.605 1.00 1.61 H new ATOM 0 HZ2 LYS A 77 -1.263 5.626 13.037 1.00 1.61 H new ATOM 0 HZ3 LYS A 77 -1.779 5.507 11.424 1.00 1.61 H new ATOM 1264 N ILE A 78 0.440 1.140 7.204 1.00 0.71 N ATOM 1265 CA ILE A 78 -0.337 0.803 6.023 1.00 0.71 C ATOM 1266 C ILE A 78 -0.953 -0.584 6.179 1.00 0.70 C ATOM 1267 O ILE A 78 -2.127 -0.797 5.873 1.00 0.69 O ATOM 1268 CB ILE A 78 0.539 0.830 4.752 1.00 0.77 C ATOM 1269 CG1 ILE A 78 1.246 2.183 4.607 1.00 1.04 C ATOM 1270 CG2 ILE A 78 -0.300 0.530 3.519 1.00 0.84 C ATOM 1271 CD1 ILE A 78 0.318 3.346 4.318 1.00 1.33 C ATOM 0 H ILE A 78 1.439 1.251 7.031 1.00 0.71 H new ATOM 0 HA ILE A 78 -1.126 1.548 5.919 1.00 0.71 H new ATOM 0 HB ILE A 78 1.301 0.057 4.847 1.00 0.77 H new ATOM 0 HG12 ILE A 78 1.796 2.392 5.525 1.00 1.04 H new ATOM 0 HG13 ILE A 78 1.980 2.112 3.805 1.00 1.04 H new ATOM 0 HG21 ILE A 78 0.334 0.553 2.633 1.00 0.84 H new ATOM 0 HG22 ILE A 78 -0.750 -0.458 3.617 1.00 0.84 H new ATOM 0 HG23 ILE A 78 -1.086 1.279 3.423 1.00 0.84 H new ATOM 0 HD11 ILE A 78 0.900 4.263 4.231 1.00 1.33 H new ATOM 0 HD12 ILE A 78 -0.214 3.164 3.384 1.00 1.33 H new ATOM 0 HD13 ILE A 78 -0.401 3.449 5.131 1.00 1.33 H new ATOM 1283 N GLU A 79 -0.151 -1.515 6.678 1.00 0.72 N ATOM 1284 CA GLU A 79 -0.591 -2.889 6.890 1.00 0.74 C ATOM 1285 C GLU A 79 -1.738 -2.944 7.900 1.00 0.73 C ATOM 1286 O GLU A 79 -2.690 -3.719 7.745 1.00 0.74 O ATOM 1287 CB GLU A 79 0.591 -3.732 7.381 1.00 0.79 C ATOM 1288 CG GLU A 79 0.231 -5.173 7.713 1.00 1.00 C ATOM 1289 CD GLU A 79 0.134 -6.056 6.485 1.00 1.32 C ATOM 1290 OE1 GLU A 79 -0.875 -5.962 5.757 1.00 1.93 O ATOM 1291 OE2 GLU A 79 1.060 -6.863 6.256 1.00 1.95 O ATOM 0 H GLU A 79 0.818 -1.342 6.946 1.00 0.72 H new ATOM 0 HA GLU A 79 -0.956 -3.292 5.945 1.00 0.74 H new ATOM 0 HB2 GLU A 79 1.368 -3.730 6.616 1.00 0.79 H new ATOM 0 HB3 GLU A 79 1.016 -3.261 8.268 1.00 0.79 H new ATOM 0 HG2 GLU A 79 0.981 -5.582 8.390 1.00 1.00 H new ATOM 0 HG3 GLU A 79 -0.721 -5.191 8.243 1.00 1.00 H new ATOM 1298 N LYS A 80 -1.643 -2.117 8.938 1.00 0.72 N ATOM 1299 CA LYS A 80 -2.670 -2.069 9.969 1.00 0.73 C ATOM 1300 C LYS A 80 -3.993 -1.578 9.395 1.00 0.72 C ATOM 1301 O LYS A 80 -5.062 -2.045 9.791 1.00 0.75 O ATOM 1302 CB LYS A 80 -2.219 -1.180 11.131 1.00 0.74 C ATOM 1303 CG LYS A 80 -1.046 -1.762 11.905 1.00 0.81 C ATOM 1304 CD LYS A 80 -0.671 -0.900 13.103 1.00 0.96 C ATOM 1305 CE LYS A 80 -1.453 -1.290 14.347 1.00 1.35 C ATOM 1306 NZ LYS A 80 -1.209 -2.699 14.746 1.00 1.71 N ATOM 0 H LYS A 80 -0.866 -1.473 9.085 1.00 0.72 H new ATOM 0 HA LYS A 80 -2.823 -3.080 10.348 1.00 0.73 H new ATOM 0 HB2 LYS A 80 -1.941 -0.200 10.744 1.00 0.74 H new ATOM 0 HB3 LYS A 80 -3.057 -1.029 11.812 1.00 0.74 H new ATOM 0 HG2 LYS A 80 -1.298 -2.766 12.245 1.00 0.81 H new ATOM 0 HG3 LYS A 80 -0.186 -1.857 11.243 1.00 0.81 H new ATOM 0 HD2 LYS A 80 0.397 -0.996 13.300 1.00 0.96 H new ATOM 0 HD3 LYS A 80 -0.859 0.148 12.870 1.00 0.96 H new ATOM 0 HE2 LYS A 80 -1.178 -0.629 15.169 1.00 1.35 H new ATOM 0 HE3 LYS A 80 -2.518 -1.145 14.165 1.00 1.35 H new ATOM 0 HZ1 LYS A 80 -0.954 -2.735 15.754 1.00 1.71 H new ATOM 0 HZ2 LYS A 80 -2.071 -3.259 14.587 1.00 1.71 H new ATOM 0 HZ3 LYS A 80 -0.431 -3.091 14.178 1.00 1.71 H new ATOM 1320 N LEU A 81 -3.908 -0.659 8.445 1.00 0.69 N ATOM 1321 CA LEU A 81 -5.091 -0.119 7.793 1.00 0.71 C ATOM 1322 C LEU A 81 -5.800 -1.231 7.027 1.00 0.72 C ATOM 1323 O LEU A 81 -7.020 -1.396 7.125 1.00 0.76 O ATOM 1324 CB LEU A 81 -4.692 1.013 6.836 1.00 0.71 C ATOM 1325 CG LEU A 81 -5.662 2.200 6.755 1.00 0.78 C ATOM 1326 CD1 LEU A 81 -7.044 1.752 6.307 1.00 1.00 C ATOM 1327 CD2 LEU A 81 -5.743 2.919 8.091 1.00 0.94 C ATOM 0 H LEU A 81 -3.028 -0.270 8.107 1.00 0.69 H new ATOM 0 HA LEU A 81 -5.767 0.285 8.546 1.00 0.71 H new ATOM 0 HB2 LEU A 81 -3.714 1.389 7.137 1.00 0.71 H new ATOM 0 HB3 LEU A 81 -4.578 0.594 5.836 1.00 0.71 H new ATOM 0 HG LEU A 81 -5.276 2.895 6.010 1.00 0.78 H new ATOM 0 HD11 LEU A 81 -7.708 2.615 6.259 1.00 1.00 H new ATOM 0 HD12 LEU A 81 -6.976 1.292 5.321 1.00 1.00 H new ATOM 0 HD13 LEU A 81 -7.440 1.028 7.019 1.00 1.00 H new ATOM 0 HD21 LEU A 81 -6.436 3.757 8.012 1.00 0.94 H new ATOM 0 HD22 LEU A 81 -6.096 2.227 8.856 1.00 0.94 H new ATOM 0 HD23 LEU A 81 -4.755 3.290 8.365 1.00 0.94 H new ATOM 1339 N ILE A 82 -5.016 -2.006 6.284 1.00 0.72 N ATOM 1340 CA ILE A 82 -5.541 -3.124 5.510 1.00 0.76 C ATOM 1341 C ILE A 82 -6.181 -4.148 6.444 1.00 0.80 C ATOM 1342 O ILE A 82 -7.185 -4.777 6.108 1.00 0.84 O ATOM 1343 CB ILE A 82 -4.426 -3.792 4.668 1.00 0.75 C ATOM 1344 CG1 ILE A 82 -3.759 -2.751 3.758 1.00 0.74 C ATOM 1345 CG2 ILE A 82 -4.986 -4.940 3.840 1.00 0.80 C ATOM 1346 CD1 ILE A 82 -2.464 -3.223 3.124 1.00 0.77 C ATOM 0 H ILE A 82 -4.007 -1.878 6.202 1.00 0.72 H new ATOM 0 HA ILE A 82 -6.297 -2.741 4.825 1.00 0.76 H new ATOM 0 HB ILE A 82 -3.677 -4.199 5.348 1.00 0.75 H new ATOM 0 HG12 ILE A 82 -4.457 -2.473 2.969 1.00 0.74 H new ATOM 0 HG13 ILE A 82 -3.560 -1.850 4.339 1.00 0.74 H new ATOM 0 HG21 ILE A 82 -4.184 -5.393 3.257 1.00 0.80 H new ATOM 0 HG22 ILE A 82 -5.421 -5.688 4.503 1.00 0.80 H new ATOM 0 HG23 ILE A 82 -5.755 -4.562 3.166 1.00 0.80 H new ATOM 0 HD11 ILE A 82 -2.056 -2.431 2.497 1.00 0.77 H new ATOM 0 HD12 ILE A 82 -1.746 -3.473 3.905 1.00 0.77 H new ATOM 0 HD13 ILE A 82 -2.658 -4.105 2.514 1.00 0.77 H new ATOM 1358 N GLU A 83 -5.606 -4.279 7.636 1.00 0.80 N ATOM 1359 CA GLU A 83 -6.114 -5.202 8.643 1.00 0.86 C ATOM 1360 C GLU A 83 -7.500 -4.764 9.114 1.00 0.85 C ATOM 1361 O GLU A 83 -8.355 -5.597 9.427 1.00 0.90 O ATOM 1362 CB GLU A 83 -5.150 -5.270 9.835 1.00 0.90 C ATOM 1363 CG GLU A 83 -5.375 -6.470 10.742 1.00 1.24 C ATOM 1364 CD GLU A 83 -4.878 -7.764 10.131 1.00 1.70 C ATOM 1365 OE1 GLU A 83 -3.679 -8.073 10.290 1.00 2.18 O ATOM 1366 OE2 GLU A 83 -5.680 -8.474 9.487 1.00 2.36 O ATOM 0 H GLU A 83 -4.782 -3.753 7.928 1.00 0.80 H new ATOM 0 HA GLU A 83 -6.193 -6.193 8.197 1.00 0.86 H new ATOM 0 HB2 GLU A 83 -4.127 -5.297 9.461 1.00 0.90 H new ATOM 0 HB3 GLU A 83 -5.251 -4.358 10.424 1.00 0.90 H new ATOM 0 HG2 GLU A 83 -4.867 -6.303 11.692 1.00 1.24 H new ATOM 0 HG3 GLU A 83 -6.439 -6.561 10.961 1.00 1.24 H new ATOM 1373 N THR A 84 -7.718 -3.449 9.146 1.00 0.82 N ATOM 1374 CA THR A 84 -8.997 -2.891 9.568 1.00 0.84 C ATOM 1375 C THR A 84 -10.042 -3.041 8.463 1.00 0.89 C ATOM 1376 O THR A 84 -11.241 -3.139 8.735 1.00 0.92 O ATOM 1377 CB THR A 84 -8.866 -1.401 9.948 1.00 0.83 C ATOM 1378 OG1 THR A 84 -7.590 -1.170 10.558 1.00 0.84 O ATOM 1379 CG2 THR A 84 -9.975 -0.978 10.907 1.00 0.85 C ATOM 0 H THR A 84 -7.022 -2.751 8.883 1.00 0.82 H new ATOM 0 HA THR A 84 -9.317 -3.448 10.449 1.00 0.84 H new ATOM 0 HB THR A 84 -8.955 -0.807 9.038 1.00 0.83 H new ATOM 0 HG1 THR A 84 -7.508 -0.223 10.797 1.00 0.84 H new ATOM 0 HG21 THR A 84 -9.857 0.076 11.157 1.00 0.85 H new ATOM 0 HG22 THR A 84 -10.944 -1.132 10.433 1.00 0.85 H new ATOM 0 HG23 THR A 84 -9.917 -1.575 11.817 1.00 0.85 H new ATOM 1387 N LEU A 85 -9.576 -3.056 7.217 1.00 0.93 N ATOM 1388 CA LEU A 85 -10.461 -3.210 6.069 1.00 1.01 C ATOM 1389 C LEU A 85 -11.090 -4.597 6.089 1.00 1.08 C ATOM 1390 O LEU A 85 -12.254 -4.777 5.721 1.00 1.17 O ATOM 1391 CB LEU A 85 -9.690 -3.000 4.763 1.00 1.04 C ATOM 1392 CG LEU A 85 -9.234 -1.562 4.496 1.00 1.05 C ATOM 1393 CD1 LEU A 85 -8.368 -1.496 3.244 1.00 1.22 C ATOM 1394 CD2 LEU A 85 -10.441 -0.645 4.355 1.00 1.13 C ATOM 0 H LEU A 85 -8.589 -2.963 6.978 1.00 0.93 H new ATOM 0 HA LEU A 85 -11.247 -2.457 6.128 1.00 1.01 H new ATOM 0 HB2 LEU A 85 -8.812 -3.647 4.770 1.00 1.04 H new ATOM 0 HB3 LEU A 85 -10.318 -3.325 3.933 1.00 1.04 H new ATOM 0 HG LEU A 85 -8.636 -1.227 5.343 1.00 1.05 H new ATOM 0 HD11 LEU A 85 -8.055 -0.466 3.072 1.00 1.22 H new ATOM 0 HD12 LEU A 85 -7.488 -2.126 3.377 1.00 1.22 H new ATOM 0 HD13 LEU A 85 -8.941 -1.849 2.386 1.00 1.22 H new ATOM 0 HD21 LEU A 85 -10.104 0.374 4.166 1.00 1.13 H new ATOM 0 HD22 LEU A 85 -11.060 -0.983 3.524 1.00 1.13 H new ATOM 0 HD23 LEU A 85 -11.025 -0.669 5.275 1.00 1.13 H new ATOM 1406 N SER A 86 -10.301 -5.572 6.519 1.00 1.18 N ATOM 1407 CA SER A 86 -10.757 -6.946 6.626 1.00 1.31 C ATOM 1408 C SER A 86 -11.803 -7.065 7.736 1.00 1.73 C ATOM 1409 O SER A 86 -11.664 -6.447 8.795 1.00 2.31 O ATOM 1410 CB SER A 86 -9.565 -7.865 6.908 1.00 1.71 C ATOM 1411 OG SER A 86 -8.613 -7.793 5.858 1.00 1.97 O ATOM 0 H SER A 86 -9.331 -5.431 6.802 1.00 1.18 H new ATOM 0 HA SER A 86 -11.217 -7.248 5.685 1.00 1.31 H new ATOM 0 HB2 SER A 86 -9.096 -7.581 7.850 1.00 1.71 H new ATOM 0 HB3 SER A 86 -9.911 -8.892 7.021 1.00 1.71 H new ATOM 0 HG SER A 86 -8.152 -6.929 5.893 1.00 1.97 H new ATOM 1914 N LYS B 10 16.873 13.752 2.544 1.00 1.52 N ATOM 1915 CA LYS B 10 16.263 13.243 3.768 1.00 1.44 C ATOM 1916 C LYS B 10 14.923 13.915 4.068 1.00 1.38 C ATOM 1917 O LYS B 10 13.947 13.234 4.391 1.00 1.32 O ATOM 1918 CB LYS B 10 17.213 13.421 4.951 1.00 1.48 C ATOM 1919 CG LYS B 10 16.972 12.419 6.064 1.00 1.54 C ATOM 1920 CD LYS B 10 18.038 12.502 7.142 1.00 1.71 C ATOM 1921 CE LYS B 10 18.008 13.845 7.852 1.00 2.08 C ATOM 1922 NZ LYS B 10 18.830 13.831 9.088 1.00 2.41 N ATOM 0 HA LYS B 10 16.071 12.181 3.613 1.00 1.44 H new ATOM 0 HB2 LYS B 10 18.241 13.326 4.601 1.00 1.48 H new ATOM 0 HB3 LYS B 10 17.103 14.430 5.349 1.00 1.48 H new ATOM 0 HG2 LYS B 10 15.993 12.598 6.508 1.00 1.54 H new ATOM 0 HG3 LYS B 10 16.954 11.412 5.648 1.00 1.54 H new ATOM 0 HD2 LYS B 10 17.887 11.702 7.867 1.00 1.71 H new ATOM 0 HD3 LYS B 10 19.021 12.347 6.696 1.00 1.71 H new ATOM 0 HE2 LYS B 10 18.375 14.620 7.180 1.00 2.08 H new ATOM 0 HE3 LYS B 10 16.979 14.101 8.102 1.00 2.08 H new ATOM 0 HZ1 LYS B 10 18.488 14.565 9.741 1.00 2.41 H new ATOM 0 HZ2 LYS B 10 18.755 12.900 9.544 1.00 2.41 H new ATOM 0 HZ3 LYS B 10 19.824 14.019 8.846 1.00 2.41 H new ATOM 1936 N GLU B 11 14.879 15.242 3.964 1.00 1.42 N ATOM 1937 CA GLU B 11 13.650 15.995 4.228 1.00 1.39 C ATOM 1938 C GLU B 11 12.553 15.592 3.250 1.00 1.36 C ATOM 1939 O GLU B 11 11.381 15.501 3.616 1.00 1.30 O ATOM 1940 CB GLU B 11 13.904 17.504 4.124 1.00 1.47 C ATOM 1941 CG GLU B 11 12.827 18.358 4.781 1.00 1.48 C ATOM 1942 CD GLU B 11 12.373 19.511 3.905 1.00 1.62 C ATOM 1943 OE1 GLU B 11 13.211 20.091 3.188 1.00 1.72 O ATOM 1944 OE2 GLU B 11 11.172 19.850 3.933 1.00 1.90 O ATOM 0 H GLU B 11 15.678 15.819 3.699 1.00 1.42 H new ATOM 0 HA GLU B 11 13.326 15.761 5.242 1.00 1.39 H new ATOM 0 HB2 GLU B 11 14.866 17.733 4.583 1.00 1.47 H new ATOM 0 HB3 GLU B 11 13.980 17.778 3.072 1.00 1.47 H new ATOM 0 HG2 GLU B 11 11.969 17.730 5.021 1.00 1.48 H new ATOM 0 HG3 GLU B 11 13.207 18.752 5.724 1.00 1.48 H new ATOM 1951 N LEU B 12 12.945 15.338 2.011 1.00 1.43 N ATOM 1952 CA LEU B 12 12.004 14.949 0.975 1.00 1.45 C ATOM 1953 C LEU B 12 11.345 13.617 1.315 1.00 1.36 C ATOM 1954 O LEU B 12 10.125 13.478 1.214 1.00 1.32 O ATOM 1955 CB LEU B 12 12.718 14.853 -0.377 1.00 1.57 C ATOM 1956 CG LEU B 12 11.801 14.726 -1.594 1.00 1.73 C ATOM 1957 CD1 LEU B 12 11.131 16.055 -1.901 1.00 1.89 C ATOM 1958 CD2 LEU B 12 12.582 14.227 -2.802 1.00 1.89 C ATOM 0 H LEU B 12 13.914 15.395 1.699 1.00 1.43 H new ATOM 0 HA LEU B 12 11.227 15.711 0.914 1.00 1.45 H new ATOM 0 HB2 LEU B 12 13.341 15.738 -0.503 1.00 1.57 H new ATOM 0 HB3 LEU B 12 13.387 13.993 -0.356 1.00 1.57 H new ATOM 0 HG LEU B 12 11.024 13.997 -1.363 1.00 1.73 H new ATOM 0 HD11 LEU B 12 10.483 15.943 -2.770 1.00 1.89 H new ATOM 0 HD12 LEU B 12 10.537 16.370 -1.043 1.00 1.89 H new ATOM 0 HD13 LEU B 12 11.892 16.807 -2.110 1.00 1.89 H new ATOM 0 HD21 LEU B 12 11.913 14.143 -3.658 1.00 1.89 H new ATOM 0 HD22 LEU B 12 13.382 14.930 -3.034 1.00 1.89 H new ATOM 0 HD23 LEU B 12 13.011 13.250 -2.580 1.00 1.89 H new ATOM 1970 N LEU B 13 12.151 12.651 1.743 1.00 1.35 N ATOM 1971 CA LEU B 13 11.636 11.330 2.083 1.00 1.30 C ATOM 1972 C LEU B 13 10.776 11.380 3.344 1.00 1.18 C ATOM 1973 O LEU B 13 9.701 10.783 3.391 1.00 1.15 O ATOM 1974 CB LEU B 13 12.790 10.338 2.271 1.00 1.35 C ATOM 1975 CG LEU B 13 13.672 10.120 1.036 1.00 1.32 C ATOM 1976 CD1 LEU B 13 14.865 9.241 1.377 1.00 1.48 C ATOM 1977 CD2 LEU B 13 12.873 9.506 -0.103 1.00 1.50 C ATOM 0 H LEU B 13 13.158 12.757 1.862 1.00 1.35 H new ATOM 0 HA LEU B 13 11.009 10.993 1.257 1.00 1.30 H new ATOM 0 HB2 LEU B 13 13.419 10.688 3.090 1.00 1.35 H new ATOM 0 HB3 LEU B 13 12.376 9.377 2.576 1.00 1.35 H new ATOM 0 HG LEU B 13 14.039 11.094 0.710 1.00 1.32 H new ATOM 0 HD11 LEU B 13 15.478 9.099 0.487 1.00 1.48 H new ATOM 0 HD12 LEU B 13 15.460 9.720 2.155 1.00 1.48 H new ATOM 0 HD13 LEU B 13 14.513 8.273 1.734 1.00 1.48 H new ATOM 0 HD21 LEU B 13 13.522 9.362 -0.967 1.00 1.50 H new ATOM 0 HD22 LEU B 13 12.470 8.544 0.213 1.00 1.50 H new ATOM 0 HD23 LEU B 13 12.053 10.172 -0.373 1.00 1.50 H new ATOM 1989 N LEU B 14 11.239 12.113 4.350 1.00 1.15 N ATOM 1990 CA LEU B 14 10.509 12.240 5.611 1.00 1.07 C ATOM 1991 C LEU B 14 9.150 12.894 5.391 1.00 1.07 C ATOM 1992 O LEU B 14 8.127 12.393 5.861 1.00 1.02 O ATOM 1993 CB LEU B 14 11.326 13.055 6.625 1.00 1.08 C ATOM 1994 CG LEU B 14 10.788 13.036 8.059 1.00 1.04 C ATOM 1995 CD1 LEU B 14 11.042 11.687 8.708 1.00 1.06 C ATOM 1996 CD2 LEU B 14 11.413 14.153 8.884 1.00 1.14 C ATOM 0 H LEU B 14 12.118 12.630 4.319 1.00 1.15 H new ATOM 0 HA LEU B 14 10.349 11.238 6.009 1.00 1.07 H new ATOM 0 HB2 LEU B 14 12.348 12.677 6.632 1.00 1.08 H new ATOM 0 HB3 LEU B 14 11.371 14.089 6.284 1.00 1.08 H new ATOM 0 HG LEU B 14 9.711 13.201 8.021 1.00 1.04 H new ATOM 0 HD11 LEU B 14 10.653 11.694 9.726 1.00 1.06 H new ATOM 0 HD12 LEU B 14 10.542 10.907 8.134 1.00 1.06 H new ATOM 0 HD13 LEU B 14 12.114 11.490 8.731 1.00 1.06 H new ATOM 0 HD21 LEU B 14 11.017 14.121 9.899 1.00 1.14 H new ATOM 0 HD22 LEU B 14 12.495 14.023 8.912 1.00 1.14 H new ATOM 0 HD23 LEU B 14 11.175 15.116 8.432 1.00 1.14 H new ATOM 2008 N LYS B 15 9.137 13.993 4.650 1.00 1.15 N ATOM 2009 CA LYS B 15 7.902 14.719 4.377 1.00 1.18 C ATOM 2010 C LYS B 15 6.950 13.880 3.526 1.00 1.13 C ATOM 2011 O LYS B 15 5.730 13.953 3.688 1.00 1.11 O ATOM 2012 CB LYS B 15 8.214 16.043 3.675 1.00 1.32 C ATOM 2013 CG LYS B 15 7.130 17.100 3.841 1.00 1.46 C ATOM 2014 CD LYS B 15 7.719 18.495 3.992 1.00 1.55 C ATOM 2015 CE LYS B 15 8.176 19.065 2.657 1.00 1.76 C ATOM 2016 NZ LYS B 15 8.840 20.383 2.821 1.00 1.80 N ATOM 0 H LYS B 15 9.969 14.403 4.226 1.00 1.15 H new ATOM 0 HA LYS B 15 7.411 14.928 5.328 1.00 1.18 H new ATOM 0 HB2 LYS B 15 9.154 16.436 4.063 1.00 1.32 H new ATOM 0 HB3 LYS B 15 8.363 15.853 2.612 1.00 1.32 H new ATOM 0 HG2 LYS B 15 6.465 17.078 2.977 1.00 1.46 H new ATOM 0 HG3 LYS B 15 6.524 16.865 4.716 1.00 1.46 H new ATOM 0 HD2 LYS B 15 6.975 19.157 4.434 1.00 1.55 H new ATOM 0 HD3 LYS B 15 8.564 18.460 4.680 1.00 1.55 H new ATOM 0 HE2 LYS B 15 8.865 18.367 2.180 1.00 1.76 H new ATOM 0 HE3 LYS B 15 7.318 19.170 1.993 1.00 1.76 H new ATOM 0 HZ1 LYS B 15 8.773 20.918 1.932 1.00 1.80 H new ATOM 0 HZ2 LYS B 15 8.372 20.915 3.582 1.00 1.80 H new ATOM 0 HZ3 LYS B 15 9.841 20.240 3.064 1.00 1.80 H new ATOM 2030 N LYS B 16 7.509 13.072 2.633 1.00 1.14 N ATOM 2031 CA LYS B 16 6.700 12.229 1.757 1.00 1.14 C ATOM 2032 C LYS B 16 6.071 11.074 2.526 1.00 1.03 C ATOM 2033 O LYS B 16 4.909 10.733 2.301 1.00 1.01 O ATOM 2034 CB LYS B 16 7.538 11.690 0.595 1.00 1.22 C ATOM 2035 CG LYS B 16 7.550 12.607 -0.621 1.00 1.31 C ATOM 2036 CD LYS B 16 6.229 12.560 -1.377 1.00 1.30 C ATOM 2037 CE LYS B 16 6.188 13.592 -2.491 1.00 1.45 C ATOM 2038 NZ LYS B 16 4.884 13.574 -3.210 1.00 1.65 N ATOM 0 H LYS B 16 8.516 12.982 2.496 1.00 1.14 H new ATOM 0 HA LYS B 16 5.899 12.849 1.355 1.00 1.14 H new ATOM 0 HB2 LYS B 16 8.562 11.538 0.936 1.00 1.22 H new ATOM 0 HB3 LYS B 16 7.152 10.714 0.301 1.00 1.22 H new ATOM 0 HG2 LYS B 16 7.751 13.630 -0.303 1.00 1.31 H new ATOM 0 HG3 LYS B 16 8.361 12.316 -1.288 1.00 1.31 H new ATOM 0 HD2 LYS B 16 6.084 11.564 -1.796 1.00 1.30 H new ATOM 0 HD3 LYS B 16 5.406 12.737 -0.685 1.00 1.30 H new ATOM 0 HE2 LYS B 16 6.360 14.584 -2.074 1.00 1.45 H new ATOM 0 HE3 LYS B 16 6.996 13.398 -3.197 1.00 1.45 H new ATOM 0 HZ1 LYS B 16 4.893 14.291 -3.963 1.00 1.65 H new ATOM 0 HZ2 LYS B 16 4.731 12.634 -3.629 1.00 1.65 H new ATOM 0 HZ3 LYS B 16 4.116 13.784 -2.541 1.00 1.65 H new ATOM 2052 N ILE B 17 6.837 10.481 3.432 1.00 0.98 N ATOM 2053 CA ILE B 17 6.352 9.363 4.235 1.00 0.92 C ATOM 2054 C ILE B 17 5.312 9.838 5.260 1.00 0.89 C ATOM 2055 O ILE B 17 4.280 9.189 5.467 1.00 0.86 O ATOM 2056 CB ILE B 17 7.530 8.627 4.941 1.00 0.94 C ATOM 2057 CG1 ILE B 17 7.968 7.420 4.109 1.00 1.00 C ATOM 2058 CG2 ILE B 17 7.153 8.185 6.349 1.00 1.00 C ATOM 2059 CD1 ILE B 17 8.637 7.783 2.802 1.00 0.96 C ATOM 0 H ILE B 17 7.799 10.755 3.631 1.00 0.98 H new ATOM 0 HA ILE B 17 5.868 8.653 3.564 1.00 0.92 H new ATOM 0 HB ILE B 17 8.360 9.329 5.025 1.00 0.94 H new ATOM 0 HG12 ILE B 17 8.654 6.814 4.700 1.00 1.00 H new ATOM 0 HG13 ILE B 17 7.096 6.801 3.899 1.00 1.00 H new ATOM 0 HG21 ILE B 17 8.000 7.676 6.809 1.00 1.00 H new ATOM 0 HG22 ILE B 17 6.887 9.058 6.945 1.00 1.00 H new ATOM 0 HG23 ILE B 17 6.303 7.505 6.301 1.00 1.00 H new ATOM 0 HD11 ILE B 17 8.917 6.873 2.272 1.00 0.96 H new ATOM 0 HD12 ILE B 17 7.947 8.362 2.189 1.00 0.96 H new ATOM 0 HD13 ILE B 17 9.530 8.376 3.002 1.00 0.96 H new ATOM 2071 N ASP B 18 5.576 10.988 5.870 1.00 0.94 N ATOM 2072 CA ASP B 18 4.677 11.559 6.872 1.00 0.99 C ATOM 2073 C ASP B 18 3.323 11.904 6.254 1.00 0.96 C ATOM 2074 O ASP B 18 2.270 11.644 6.841 1.00 0.94 O ATOM 2075 CB ASP B 18 5.316 12.806 7.492 1.00 1.14 C ATOM 2076 CG ASP B 18 4.462 13.447 8.570 1.00 1.29 C ATOM 2077 OD1 ASP B 18 4.097 12.757 9.546 1.00 1.88 O ATOM 2078 OD2 ASP B 18 4.177 14.658 8.464 1.00 1.59 O ATOM 0 H ASP B 18 6.409 11.547 5.688 1.00 0.94 H new ATOM 0 HA ASP B 18 4.511 10.818 7.654 1.00 0.99 H new ATOM 0 HB2 ASP B 18 6.283 12.537 7.917 1.00 1.14 H new ATOM 0 HB3 ASP B 18 5.506 13.537 6.706 1.00 1.14 H new ATOM 2083 N SER B 19 3.355 12.466 5.054 1.00 0.98 N ATOM 2084 CA SER B 19 2.134 12.838 4.346 1.00 0.99 C ATOM 2085 C SER B 19 1.387 11.601 3.855 1.00 0.91 C ATOM 2086 O SER B 19 0.158 11.597 3.755 1.00 0.90 O ATOM 2087 CB SER B 19 2.466 13.738 3.153 1.00 1.10 C ATOM 2088 OG SER B 19 3.155 14.911 3.561 1.00 1.21 O ATOM 0 H SER B 19 4.215 12.676 4.547 1.00 0.98 H new ATOM 0 HA SER B 19 1.495 13.379 5.044 1.00 0.99 H new ATOM 0 HB2 SER B 19 3.077 13.186 2.439 1.00 1.10 H new ATOM 0 HB3 SER B 19 1.546 14.016 2.638 1.00 1.10 H new ATOM 0 HG SER B 19 4.118 14.731 3.590 1.00 1.21 H new ATOM 2094 N LEU B 20 2.146 10.558 3.556 1.00 0.87 N ATOM 2095 CA LEU B 20 1.596 9.315 3.048 1.00 0.84 C ATOM 2096 C LEU B 20 0.624 8.684 4.038 1.00 0.80 C ATOM 2097 O LEU B 20 -0.510 8.362 3.681 1.00 0.79 O ATOM 2098 CB LEU B 20 2.733 8.341 2.744 1.00 0.86 C ATOM 2099 CG LEU B 20 2.351 7.133 1.894 1.00 0.91 C ATOM 2100 CD1 LEU B 20 2.121 7.559 0.455 1.00 1.07 C ATOM 2101 CD2 LEU B 20 3.439 6.080 1.984 1.00 1.35 C ATOM 0 H LEU B 20 3.161 10.551 3.659 1.00 0.87 H new ATOM 0 HA LEU B 20 1.043 9.537 2.136 1.00 0.84 H new ATOM 0 HB2 LEU B 20 3.528 8.885 2.235 1.00 0.86 H new ATOM 0 HB3 LEU B 20 3.145 7.984 3.688 1.00 0.86 H new ATOM 0 HG LEU B 20 1.423 6.703 2.271 1.00 0.91 H new ATOM 0 HD11 LEU B 20 1.849 6.689 -0.143 1.00 1.07 H new ATOM 0 HD12 LEU B 20 1.315 8.292 0.417 1.00 1.07 H new ATOM 0 HD13 LEU B 20 3.034 8.002 0.056 1.00 1.07 H new ATOM 0 HD21 LEU B 20 3.163 5.219 1.376 1.00 1.35 H new ATOM 0 HD22 LEU B 20 4.378 6.495 1.619 1.00 1.35 H new ATOM 0 HD23 LEU B 20 3.559 5.768 3.022 1.00 1.35 H new ATOM 2113 N ILE B 21 1.060 8.525 5.284 1.00 0.81 N ATOM 2114 CA ILE B 21 0.212 7.920 6.309 1.00 0.82 C ATOM 2115 C ILE B 21 -1.019 8.775 6.595 1.00 0.81 C ATOM 2116 O ILE B 21 -2.071 8.256 6.967 1.00 0.81 O ATOM 2117 CB ILE B 21 0.983 7.652 7.620 1.00 0.88 C ATOM 2118 CG1 ILE B 21 1.832 8.859 8.024 1.00 1.19 C ATOM 2119 CG2 ILE B 21 1.858 6.416 7.467 1.00 1.21 C ATOM 2120 CD1 ILE B 21 2.550 8.682 9.344 1.00 1.38 C ATOM 0 H ILE B 21 1.986 8.803 5.608 1.00 0.81 H new ATOM 0 HA ILE B 21 -0.115 6.961 5.908 1.00 0.82 H new ATOM 0 HB ILE B 21 0.254 7.478 8.412 1.00 0.88 H new ATOM 0 HG12 ILE B 21 2.568 9.052 7.243 1.00 1.19 H new ATOM 0 HG13 ILE B 21 1.192 9.739 8.084 1.00 1.19 H new ATOM 0 HG21 ILE B 21 2.398 6.235 8.396 1.00 1.21 H new ATOM 0 HG22 ILE B 21 1.232 5.554 7.237 1.00 1.21 H new ATOM 0 HG23 ILE B 21 2.571 6.573 6.658 1.00 1.21 H new ATOM 0 HD11 ILE B 21 3.131 9.577 9.565 1.00 1.38 H new ATOM 0 HD12 ILE B 21 1.820 8.519 10.137 1.00 1.38 H new ATOM 0 HD13 ILE B 21 3.217 7.822 9.283 1.00 1.38 H new ATOM 2132 N GLU B 22 -0.885 10.085 6.418 1.00 0.83 N ATOM 2133 CA GLU B 22 -2.000 10.996 6.637 1.00 0.86 C ATOM 2134 C GLU B 22 -3.073 10.790 5.575 1.00 0.83 C ATOM 2135 O GLU B 22 -4.262 10.694 5.884 1.00 0.84 O ATOM 2136 CB GLU B 22 -1.528 12.446 6.622 1.00 0.94 C ATOM 2137 CG GLU B 22 -0.627 12.790 7.789 1.00 1.11 C ATOM 2138 CD GLU B 22 -0.955 14.136 8.384 1.00 1.55 C ATOM 2139 OE1 GLU B 22 -0.406 15.147 7.907 1.00 1.98 O ATOM 2140 OE2 GLU B 22 -1.762 14.191 9.337 1.00 1.95 O ATOM 0 H GLU B 22 -0.019 10.537 6.125 1.00 0.83 H new ATOM 0 HA GLU B 22 -2.424 10.779 7.617 1.00 0.86 H new ATOM 0 HB2 GLU B 22 -0.996 12.639 5.691 1.00 0.94 H new ATOM 0 HB3 GLU B 22 -2.396 13.105 6.635 1.00 0.94 H new ATOM 0 HG2 GLU B 22 -0.721 12.022 8.557 1.00 1.11 H new ATOM 0 HG3 GLU B 22 0.412 12.784 7.458 1.00 1.11 H new ATOM 2147 N ALA B 23 -2.636 10.709 4.326 1.00 0.82 N ATOM 2148 CA ALA B 23 -3.546 10.512 3.206 1.00 0.83 C ATOM 2149 C ALA B 23 -4.301 9.195 3.345 1.00 0.79 C ATOM 2150 O ALA B 23 -5.483 9.108 3.015 1.00 0.80 O ATOM 2151 CB ALA B 23 -2.785 10.558 1.891 1.00 0.86 C ATOM 0 H ALA B 23 -1.653 10.777 4.062 1.00 0.82 H new ATOM 0 HA ALA B 23 -4.276 11.321 3.212 1.00 0.83 H new ATOM 0 HB1 ALA B 23 -3.479 10.409 1.064 1.00 0.86 H new ATOM 0 HB2 ALA B 23 -2.298 11.527 1.786 1.00 0.86 H new ATOM 0 HB3 ALA B 23 -2.032 9.770 1.879 1.00 0.86 H new ATOM 2157 N ILE B 24 -3.609 8.177 3.845 1.00 0.78 N ATOM 2158 CA ILE B 24 -4.211 6.866 4.047 1.00 0.78 C ATOM 2159 C ILE B 24 -5.340 6.959 5.081 1.00 0.74 C ATOM 2160 O ILE B 24 -6.388 6.322 4.940 1.00 0.74 O ATOM 2161 CB ILE B 24 -3.142 5.820 4.481 1.00 0.83 C ATOM 2162 CG1 ILE B 24 -2.842 4.863 3.327 1.00 0.99 C ATOM 2163 CG2 ILE B 24 -3.574 5.032 5.707 1.00 1.03 C ATOM 2164 CD1 ILE B 24 -2.025 5.484 2.219 1.00 0.89 C ATOM 0 H ILE B 24 -2.628 8.236 4.118 1.00 0.78 H new ATOM 0 HA ILE B 24 -4.634 6.530 3.100 1.00 0.78 H new ATOM 0 HB ILE B 24 -2.239 6.371 4.745 1.00 0.83 H new ATOM 0 HG12 ILE B 24 -2.310 3.995 3.716 1.00 0.99 H new ATOM 0 HG13 ILE B 24 -3.783 4.501 2.913 1.00 0.99 H new ATOM 0 HG21 ILE B 24 -2.796 4.315 5.971 1.00 1.03 H new ATOM 0 HG22 ILE B 24 -3.736 5.716 6.540 1.00 1.03 H new ATOM 0 HG23 ILE B 24 -4.500 4.499 5.489 1.00 1.03 H new ATOM 0 HD11 ILE B 24 -1.852 4.745 1.436 1.00 0.89 H new ATOM 0 HD12 ILE B 24 -2.564 6.335 1.802 1.00 0.89 H new ATOM 0 HD13 ILE B 24 -1.068 5.821 2.618 1.00 0.89 H new ATOM 2176 N LYS B 25 -5.122 7.781 6.100 1.00 0.74 N ATOM 2177 CA LYS B 25 -6.099 7.980 7.161 1.00 0.75 C ATOM 2178 C LYS B 25 -7.298 8.769 6.645 1.00 0.78 C ATOM 2179 O LYS B 25 -8.417 8.613 7.129 1.00 0.80 O ATOM 2180 CB LYS B 25 -5.460 8.708 8.344 1.00 0.79 C ATOM 2181 CG LYS B 25 -6.287 8.650 9.615 1.00 0.88 C ATOM 2182 CD LYS B 25 -6.347 7.241 10.179 1.00 1.17 C ATOM 2183 CE LYS B 25 -7.178 7.192 11.449 1.00 1.48 C ATOM 2184 NZ LYS B 25 -6.608 8.048 12.524 1.00 1.72 N ATOM 0 H LYS B 25 -4.267 8.326 6.213 1.00 0.74 H new ATOM 0 HA LYS B 25 -6.445 7.002 7.496 1.00 0.75 H new ATOM 0 HB2 LYS B 25 -4.479 8.274 8.539 1.00 0.79 H new ATOM 0 HB3 LYS B 25 -5.299 9.751 8.073 1.00 0.79 H new ATOM 0 HG2 LYS B 25 -5.860 9.322 10.359 1.00 0.88 H new ATOM 0 HG3 LYS B 25 -7.297 9.003 9.409 1.00 0.88 H new ATOM 0 HD2 LYS B 25 -6.774 6.567 9.436 1.00 1.17 H new ATOM 0 HD3 LYS B 25 -5.338 6.887 10.388 1.00 1.17 H new ATOM 0 HE2 LYS B 25 -8.195 7.516 11.229 1.00 1.48 H new ATOM 0 HE3 LYS B 25 -7.241 6.162 11.801 1.00 1.48 H new ATOM 0 HZ1 LYS B 25 -7.056 7.809 13.432 1.00 1.72 H new ATOM 0 HZ2 LYS B 25 -5.583 7.886 12.590 1.00 1.72 H new ATOM 0 HZ3 LYS B 25 -6.787 9.048 12.303 1.00 1.72 H new ATOM 2198 N LYS B 26 -7.050 9.630 5.672 1.00 0.80 N ATOM 2199 CA LYS B 26 -8.101 10.445 5.092 1.00 0.85 C ATOM 2200 C LYS B 26 -9.007 9.603 4.193 1.00 0.83 C ATOM 2201 O LYS B 26 -10.230 9.704 4.267 1.00 0.86 O ATOM 2202 CB LYS B 26 -7.486 11.595 4.294 1.00 0.91 C ATOM 2203 CG LYS B 26 -8.049 12.960 4.658 1.00 1.01 C ATOM 2204 CD LYS B 26 -9.359 13.226 3.939 1.00 1.13 C ATOM 2205 CE LYS B 26 -10.125 14.376 4.572 1.00 1.38 C ATOM 2206 NZ LYS B 26 -11.001 13.913 5.683 1.00 1.39 N ATOM 0 H LYS B 26 -6.126 9.782 5.267 1.00 0.80 H new ATOM 0 HA LYS B 26 -8.708 10.854 5.899 1.00 0.85 H new ATOM 0 HB2 LYS B 26 -6.408 11.602 4.455 1.00 0.91 H new ATOM 0 HB3 LYS B 26 -7.649 11.416 3.231 1.00 0.91 H new ATOM 0 HG2 LYS B 26 -8.205 13.016 5.735 1.00 1.01 H new ATOM 0 HG3 LYS B 26 -7.326 13.734 4.400 1.00 1.01 H new ATOM 0 HD2 LYS B 26 -9.159 13.454 2.892 1.00 1.13 H new ATOM 0 HD3 LYS B 26 -9.973 12.326 3.957 1.00 1.13 H new ATOM 0 HE2 LYS B 26 -9.421 15.117 4.950 1.00 1.38 H new ATOM 0 HE3 LYS B 26 -10.731 14.870 3.813 1.00 1.38 H new ATOM 0 HZ1 LYS B 26 -11.361 14.736 6.207 1.00 1.39 H new ATOM 0 HZ2 LYS B 26 -11.801 13.374 5.293 1.00 1.39 H new ATOM 0 HZ3 LYS B 26 -10.454 13.305 6.326 1.00 1.39 H new ATOM 2220 N ILE B 27 -8.399 8.758 3.365 1.00 0.80 N ATOM 2221 CA ILE B 27 -9.153 7.903 2.447 1.00 0.81 C ATOM 2222 C ILE B 27 -10.121 6.980 3.199 1.00 0.80 C ATOM 2223 O ILE B 27 -11.303 6.894 2.853 1.00 0.82 O ATOM 2224 CB ILE B 27 -8.204 7.050 1.570 1.00 0.81 C ATOM 2225 CG1 ILE B 27 -7.442 7.941 0.587 1.00 0.79 C ATOM 2226 CG2 ILE B 27 -8.976 5.967 0.820 1.00 0.90 C ATOM 2227 CD1 ILE B 27 -8.327 8.619 -0.441 1.00 1.04 C ATOM 0 H ILE B 27 -7.387 8.645 3.309 1.00 0.80 H new ATOM 0 HA ILE B 27 -9.733 8.566 1.805 1.00 0.81 H new ATOM 0 HB ILE B 27 -7.486 6.559 2.227 1.00 0.81 H new ATOM 0 HG12 ILE B 27 -6.902 8.704 1.147 1.00 0.79 H new ATOM 0 HG13 ILE B 27 -6.696 7.338 0.069 1.00 0.79 H new ATOM 0 HG21 ILE B 27 -8.285 5.383 0.212 1.00 0.90 H new ATOM 0 HG22 ILE B 27 -9.472 5.312 1.536 1.00 0.90 H new ATOM 0 HG23 ILE B 27 -9.722 6.432 0.176 1.00 0.90 H new ATOM 0 HD11 ILE B 27 -7.714 9.233 -1.101 1.00 1.04 H new ATOM 0 HD12 ILE B 27 -8.847 7.863 -1.028 1.00 1.04 H new ATOM 0 HD13 ILE B 27 -9.057 9.250 0.067 1.00 1.04 H new ATOM 2239 N ILE B 28 -9.622 6.300 4.233 1.00 0.78 N ATOM 2240 CA ILE B 28 -10.455 5.388 5.013 1.00 0.78 C ATOM 2241 C ILE B 28 -11.612 6.135 5.683 1.00 0.81 C ATOM 2242 O ILE B 28 -12.721 5.602 5.804 1.00 0.84 O ATOM 2243 CB ILE B 28 -9.637 4.614 6.080 1.00 0.77 C ATOM 2244 CG1 ILE B 28 -10.535 3.630 6.839 1.00 0.80 C ATOM 2245 CG2 ILE B 28 -8.952 5.561 7.058 1.00 0.82 C ATOM 2246 CD1 ILE B 28 -11.032 2.471 6.000 1.00 0.97 C ATOM 0 H ILE B 28 -8.653 6.364 4.546 1.00 0.78 H new ATOM 0 HA ILE B 28 -10.861 4.660 4.311 1.00 0.78 H new ATOM 0 HB ILE B 28 -8.862 4.055 5.556 1.00 0.77 H new ATOM 0 HG12 ILE B 28 -9.983 3.236 7.693 1.00 0.80 H new ATOM 0 HG13 ILE B 28 -11.394 4.171 7.236 1.00 0.80 H new ATOM 0 HG21 ILE B 28 -8.389 4.983 7.790 1.00 0.82 H new ATOM 0 HG22 ILE B 28 -8.273 6.217 6.514 1.00 0.82 H new ATOM 0 HG23 ILE B 28 -9.704 6.161 7.570 1.00 0.82 H new ATOM 0 HD11 ILE B 28 -11.660 1.822 6.611 1.00 0.97 H new ATOM 0 HD12 ILE B 28 -11.613 2.852 5.160 1.00 0.97 H new ATOM 0 HD13 ILE B 28 -10.181 1.903 5.624 1.00 0.97 H new ATOM 2258 N ALA B 29 -11.351 7.371 6.094 1.00 0.82 N ATOM 2259 CA ALA B 29 -12.356 8.188 6.749 1.00 0.87 C ATOM 2260 C ALA B 29 -13.522 8.486 5.807 1.00 0.90 C ATOM 2261 O ALA B 29 -14.683 8.296 6.168 1.00 0.93 O ATOM 2262 CB ALA B 29 -11.735 9.486 7.248 1.00 0.90 C ATOM 0 H ALA B 29 -10.446 7.828 5.983 1.00 0.82 H new ATOM 0 HA ALA B 29 -12.744 7.630 7.601 1.00 0.87 H new ATOM 0 HB1 ALA B 29 -12.499 10.090 7.737 1.00 0.90 H new ATOM 0 HB2 ALA B 29 -10.941 9.259 7.959 1.00 0.90 H new ATOM 0 HB3 ALA B 29 -11.320 10.039 6.405 1.00 0.90 H new ATOM 2268 N GLU B 30 -13.204 8.944 4.598 1.00 0.91 N ATOM 2269 CA GLU B 30 -14.229 9.275 3.606 1.00 0.95 C ATOM 2270 C GLU B 30 -15.068 8.048 3.242 1.00 0.95 C ATOM 2271 O GLU B 30 -16.294 8.134 3.142 1.00 0.96 O ATOM 2272 CB GLU B 30 -13.587 9.845 2.335 1.00 1.00 C ATOM 2273 CG GLU B 30 -12.534 10.911 2.598 1.00 1.02 C ATOM 2274 CD GLU B 30 -13.064 12.094 3.388 1.00 1.13 C ATOM 2275 OE1 GLU B 30 -13.803 12.920 2.814 1.00 1.38 O ATOM 2276 OE2 GLU B 30 -12.726 12.213 4.585 1.00 1.18 O ATOM 0 H GLU B 30 -12.247 9.095 4.280 1.00 0.91 H new ATOM 0 HA GLU B 30 -14.882 10.026 4.051 1.00 0.95 H new ATOM 0 HB2 GLU B 30 -13.131 9.030 1.773 1.00 1.00 H new ATOM 0 HB3 GLU B 30 -14.368 10.269 1.704 1.00 1.00 H new ATOM 0 HG2 GLU B 30 -11.701 10.464 3.141 1.00 1.02 H new ATOM 0 HG3 GLU B 30 -12.140 11.266 1.646 1.00 1.02 H new ATOM 2283 N PHE B 31 -14.402 6.912 3.057 1.00 0.96 N ATOM 2284 CA PHE B 31 -15.078 5.664 2.691 1.00 0.99 C ATOM 2285 C PHE B 31 -16.140 5.279 3.719 1.00 0.97 C ATOM 2286 O PHE B 31 -17.243 4.858 3.361 1.00 1.01 O ATOM 2287 CB PHE B 31 -14.062 4.527 2.538 1.00 1.01 C ATOM 2288 CG PHE B 31 -13.774 4.168 1.110 1.00 1.04 C ATOM 2289 CD1 PHE B 31 -12.999 4.996 0.317 1.00 1.50 C ATOM 2290 CD2 PHE B 31 -14.277 3.001 0.564 1.00 1.68 C ATOM 2291 CE1 PHE B 31 -12.734 4.668 -0.999 1.00 1.59 C ATOM 2292 CE2 PHE B 31 -14.014 2.666 -0.750 1.00 1.83 C ATOM 2293 CZ PHE B 31 -13.241 3.499 -1.533 1.00 1.37 C ATOM 0 H PHE B 31 -13.390 6.827 3.154 1.00 0.96 H new ATOM 0 HA PHE B 31 -15.576 5.830 1.736 1.00 0.99 H new ATOM 0 HB2 PHE B 31 -13.131 4.814 3.027 1.00 1.01 H new ATOM 0 HB3 PHE B 31 -14.435 3.645 3.058 1.00 1.01 H new ATOM 0 HD1 PHE B 31 -12.597 5.909 0.731 1.00 1.50 H new ATOM 0 HD2 PHE B 31 -14.882 2.344 1.172 1.00 1.68 H new ATOM 0 HE1 PHE B 31 -12.131 5.325 -1.609 1.00 1.59 H new ATOM 0 HE2 PHE B 31 -14.413 1.752 -1.165 1.00 1.83 H new ATOM 0 HZ PHE B 31 -13.033 3.238 -2.560 1.00 1.37 H new ATOM 2303 N ASP B 32 -15.811 5.446 4.993 1.00 0.94 N ATOM 2304 CA ASP B 32 -16.730 5.114 6.077 1.00 0.93 C ATOM 2305 C ASP B 32 -17.910 6.089 6.116 1.00 0.93 C ATOM 2306 O ASP B 32 -19.054 5.696 6.358 1.00 0.96 O ATOM 2307 CB ASP B 32 -15.978 5.131 7.410 1.00 0.94 C ATOM 2308 CG ASP B 32 -16.882 4.840 8.588 1.00 1.20 C ATOM 2309 OD1 ASP B 32 -17.585 3.808 8.569 1.00 1.64 O ATOM 2310 OD2 ASP B 32 -16.885 5.638 9.548 1.00 1.54 O ATOM 0 H ASP B 32 -14.911 5.811 5.303 1.00 0.94 H new ATOM 0 HA ASP B 32 -17.130 4.115 5.902 1.00 0.93 H new ATOM 0 HB2 ASP B 32 -15.176 4.394 7.381 1.00 0.94 H new ATOM 0 HB3 ASP B 32 -15.510 6.106 7.547 1.00 0.94 H new ATOM 2315 N VAL B 33 -17.625 7.358 5.847 1.00 0.92 N ATOM 2316 CA VAL B 33 -18.649 8.394 5.846 1.00 0.93 C ATOM 2317 C VAL B 33 -19.640 8.174 4.701 1.00 0.94 C ATOM 2318 O VAL B 33 -20.851 8.144 4.913 1.00 0.95 O ATOM 2319 CB VAL B 33 -18.024 9.803 5.730 1.00 0.94 C ATOM 2320 CG1 VAL B 33 -19.103 10.860 5.541 1.00 1.00 C ATOM 2321 CG2 VAL B 33 -17.182 10.119 6.958 1.00 0.92 C ATOM 0 H VAL B 33 -16.688 7.695 5.626 1.00 0.92 H new ATOM 0 HA VAL B 33 -19.180 8.329 6.796 1.00 0.93 H new ATOM 0 HB VAL B 33 -17.376 9.814 4.853 1.00 0.94 H new ATOM 0 HG11 VAL B 33 -18.639 11.843 5.462 1.00 1.00 H new ATOM 0 HG12 VAL B 33 -19.664 10.649 4.630 1.00 1.00 H new ATOM 0 HG13 VAL B 33 -19.780 10.846 6.395 1.00 1.00 H new ATOM 0 HG21 VAL B 33 -16.751 11.115 6.857 1.00 0.92 H new ATOM 0 HG22 VAL B 33 -17.810 10.084 7.848 1.00 0.92 H new ATOM 0 HG23 VAL B 33 -16.382 9.385 7.049 1.00 0.92 H new ATOM 2331 N VAL B 34 -19.113 7.992 3.492 1.00 0.96 N ATOM 2332 CA VAL B 34 -19.949 7.787 2.306 1.00 0.99 C ATOM 2333 C VAL B 34 -20.863 6.571 2.466 1.00 1.00 C ATOM 2334 O VAL B 34 -22.020 6.598 2.045 1.00 1.02 O ATOM 2335 CB VAL B 34 -19.090 7.622 1.032 1.00 1.02 C ATOM 2336 CG1 VAL B 34 -19.968 7.335 -0.180 1.00 1.21 C ATOM 2337 CG2 VAL B 34 -18.249 8.868 0.795 1.00 1.13 C ATOM 0 H VAL B 34 -18.110 7.982 3.305 1.00 0.96 H new ATOM 0 HA VAL B 34 -20.568 8.678 2.201 1.00 0.99 H new ATOM 0 HB VAL B 34 -18.423 6.773 1.178 1.00 1.02 H new ATOM 0 HG11 VAL B 34 -19.341 7.223 -1.065 1.00 1.21 H new ATOM 0 HG12 VAL B 34 -20.529 6.415 -0.013 1.00 1.21 H new ATOM 0 HG13 VAL B 34 -20.663 8.161 -0.330 1.00 1.21 H new ATOM 0 HG21 VAL B 34 -17.650 8.736 -0.106 1.00 1.13 H new ATOM 0 HG22 VAL B 34 -18.904 9.731 0.672 1.00 1.13 H new ATOM 0 HG23 VAL B 34 -17.591 9.030 1.648 1.00 1.13 H new ATOM 2347 N LYS B 35 -20.352 5.516 3.094 1.00 1.01 N ATOM 2348 CA LYS B 35 -21.131 4.302 3.299 1.00 1.05 C ATOM 2349 C LYS B 35 -22.376 4.583 4.136 1.00 1.03 C ATOM 2350 O LYS B 35 -23.466 4.112 3.818 1.00 1.05 O ATOM 2351 CB LYS B 35 -20.282 3.215 3.962 1.00 1.08 C ATOM 2352 CG LYS B 35 -20.940 1.842 3.948 1.00 1.13 C ATOM 2353 CD LYS B 35 -19.913 0.727 4.091 1.00 1.32 C ATOM 2354 CE LYS B 35 -19.292 0.697 5.483 1.00 1.51 C ATOM 2355 NZ LYS B 35 -20.299 0.417 6.541 1.00 1.86 N ATOM 0 H LYS B 35 -19.404 5.478 3.468 1.00 1.01 H new ATOM 0 HA LYS B 35 -21.450 3.944 2.320 1.00 1.05 H new ATOM 0 HB2 LYS B 35 -19.320 3.154 3.453 1.00 1.08 H new ATOM 0 HB3 LYS B 35 -20.079 3.502 4.994 1.00 1.08 H new ATOM 0 HG2 LYS B 35 -21.664 1.777 4.760 1.00 1.13 H new ATOM 0 HG3 LYS B 35 -21.492 1.712 3.017 1.00 1.13 H new ATOM 0 HD2 LYS B 35 -20.388 -0.232 3.885 1.00 1.32 H new ATOM 0 HD3 LYS B 35 -19.128 0.860 3.347 1.00 1.32 H new ATOM 0 HE2 LYS B 35 -18.513 -0.064 5.515 1.00 1.51 H new ATOM 0 HE3 LYS B 35 -18.811 1.654 5.685 1.00 1.51 H new ATOM 0 HZ1 LYS B 35 -19.813 0.139 7.418 1.00 1.86 H new ATOM 0 HZ2 LYS B 35 -20.866 1.271 6.715 1.00 1.86 H new ATOM 0 HZ3 LYS B 35 -20.923 -0.355 6.231 1.00 1.86 H new ATOM 2369 N GLU B 36 -22.213 5.353 5.203 1.00 1.00 N ATOM 2370 CA GLU B 36 -23.333 5.693 6.070 1.00 1.00 C ATOM 2371 C GLU B 36 -24.253 6.717 5.404 1.00 0.96 C ATOM 2372 O GLU B 36 -25.471 6.690 5.586 1.00 0.97 O ATOM 2373 CB GLU B 36 -22.824 6.225 7.410 1.00 1.01 C ATOM 2374 CG GLU B 36 -23.779 5.969 8.565 1.00 1.15 C ATOM 2375 CD GLU B 36 -24.302 4.545 8.580 1.00 1.29 C ATOM 2376 OE1 GLU B 36 -23.488 3.607 8.722 1.00 1.57 O ATOM 2377 OE2 GLU B 36 -25.526 4.354 8.436 1.00 1.40 O ATOM 0 H GLU B 36 -21.319 5.753 5.489 1.00 1.00 H new ATOM 0 HA GLU B 36 -23.911 4.786 6.248 1.00 1.00 H new ATOM 0 HB2 GLU B 36 -21.863 5.763 7.634 1.00 1.01 H new ATOM 0 HB3 GLU B 36 -22.650 7.297 7.324 1.00 1.01 H new ATOM 0 HG2 GLU B 36 -23.270 6.176 9.506 1.00 1.15 H new ATOM 0 HG3 GLU B 36 -24.619 6.661 8.498 1.00 1.15 H new ATOM 2384 N SER B 37 -23.671 7.609 4.619 1.00 0.00 N ATOM 2385 CA SER B 37 -24.413 8.652 3.917 1.00 0.00 C ATOM 2386 C SER B 37 -25.418 8.051 2.962 1.00 0.00 C ATOM 2387 O SER B 37 -26.583 8.459 2.928 1.00 0.00 O ATOM 2388 CB SER B 37 -23.447 9.622 3.191 1.00 0.00 C ATOM 2389 OG SER B 37 -22.647 10.390 4.096 1.00 0.00 O ATOM 0 H SER B 37 -22.666 7.633 4.448 1.00 0.00 H new ATOM 0 HA SER B 37 -24.969 9.231 4.655 1.00 0.00 H new ATOM 0 HB2 SER B 37 -22.794 9.051 2.531 1.00 0.00 H new ATOM 0 HB3 SER B 37 -24.024 10.298 2.561 1.00 0.00 H new ATOM 0 HG SER B 37 -21.952 9.818 4.484 1.00 0.00 H new ATOM 2395 N VAL B 38 -24.972 7.110 2.131 1.00 0.96 N ATOM 2396 CA VAL B 38 -25.850 6.467 1.152 1.00 1.00 C ATOM 2397 C VAL B 38 -26.906 5.619 1.845 1.00 1.02 C ATOM 2398 O VAL B 38 -28.001 5.426 1.323 1.00 1.04 O ATOM 2399 CB VAL B 38 -25.068 5.599 0.139 1.00 1.05 C ATOM 2400 CG1 VAL B 38 -24.102 6.452 -0.660 1.00 1.05 C ATOM 2401 CG2 VAL B 38 -24.325 4.463 0.829 1.00 1.07 C ATOM 0 H VAL B 38 -24.009 6.775 2.115 1.00 0.96 H new ATOM 0 HA VAL B 38 -26.336 7.270 0.598 1.00 1.00 H new ATOM 0 HB VAL B 38 -25.794 5.156 -0.543 1.00 1.05 H new ATOM 0 HG11 VAL B 38 -23.561 5.823 -1.367 1.00 1.05 H new ATOM 0 HG12 VAL B 38 -24.656 7.217 -1.204 1.00 1.05 H new ATOM 0 HG13 VAL B 38 -23.393 6.930 0.016 1.00 1.05 H new ATOM 0 HG21 VAL B 38 -23.787 3.875 0.085 1.00 1.07 H new ATOM 0 HG22 VAL B 38 -23.616 4.875 1.547 1.00 1.07 H new ATOM 0 HG23 VAL B 38 -25.039 3.824 1.349 1.00 1.07 H new ATOM 2411 N ASN B 39 -26.571 5.123 3.029 1.00 1.03 N ATOM 2412 CA ASN B 39 -27.492 4.308 3.807 1.00 1.07 C ATOM 2413 C ASN B 39 -28.709 5.146 4.203 1.00 1.05 C ATOM 2414 O ASN B 39 -29.856 4.773 3.936 1.00 1.08 O ATOM 2415 CB ASN B 39 -26.778 3.770 5.050 1.00 1.11 C ATOM 2416 CG ASN B 39 -27.645 2.849 5.888 1.00 1.20 C ATOM 2417 OD1 ASN B 39 -28.519 2.155 5.369 1.00 1.25 O ATOM 2418 ND2 ASN B 39 -27.393 2.825 7.189 1.00 1.25 N ATOM 0 H ASN B 39 -25.664 5.272 3.472 1.00 1.03 H new ATOM 0 HA ASN B 39 -27.831 3.463 3.208 1.00 1.07 H new ATOM 0 HB2 ASN B 39 -25.881 3.232 4.741 1.00 1.11 H new ATOM 0 HB3 ASN B 39 -26.451 4.609 5.665 1.00 1.11 H new ATOM 0 HD21 ASN B 39 -27.933 2.214 7.802 1.00 1.25 H new ATOM 0 HD22 ASN B 39 -26.659 3.417 7.577 1.00 1.25 H new ATOM 2425 N GLU B 40 -28.438 6.302 4.795 1.00 1.02 N ATOM 2426 CA GLU B 40 -29.490 7.214 5.224 1.00 1.02 C ATOM 2427 C GLU B 40 -30.244 7.782 4.026 1.00 0.98 C ATOM 2428 O GLU B 40 -31.465 7.933 4.065 1.00 1.01 O ATOM 2429 CB GLU B 40 -28.891 8.349 6.052 1.00 1.04 C ATOM 2430 CG GLU B 40 -29.116 8.193 7.547 1.00 1.24 C ATOM 2431 CD GLU B 40 -30.578 8.328 7.921 1.00 1.46 C ATOM 2432 OE1 GLU B 40 -31.093 9.467 7.922 1.00 2.04 O ATOM 2433 OE2 GLU B 40 -31.219 7.302 8.212 1.00 1.92 O ATOM 0 H GLU B 40 -27.493 6.632 4.990 1.00 1.02 H new ATOM 0 HA GLU B 40 -30.197 6.656 5.837 1.00 1.02 H new ATOM 0 HB2 GLU B 40 -27.820 8.404 5.858 1.00 1.04 H new ATOM 0 HB3 GLU B 40 -29.323 9.294 5.724 1.00 1.04 H new ATOM 0 HG2 GLU B 40 -28.749 7.218 7.869 1.00 1.24 H new ATOM 0 HG3 GLU B 40 -28.535 8.945 8.081 1.00 1.24 H new ATOM 2440 N LEU B 41 -29.507 8.081 2.958 1.00 0.95 N ATOM 2441 CA LEU B 41 -30.091 8.633 1.743 1.00 0.94 C ATOM 2442 C LEU B 41 -31.077 7.652 1.124 1.00 0.95 C ATOM 2443 O LEU B 41 -32.074 8.052 0.534 1.00 0.97 O ATOM 2444 CB LEU B 41 -28.991 8.976 0.732 1.00 0.92 C ATOM 2445 CG LEU B 41 -29.469 9.704 -0.526 1.00 0.97 C ATOM 2446 CD1 LEU B 41 -29.917 11.118 -0.187 1.00 1.08 C ATOM 2447 CD2 LEU B 41 -28.373 9.730 -1.577 1.00 1.01 C ATOM 0 H LEU B 41 -28.497 7.948 2.913 1.00 0.95 H new ATOM 0 HA LEU B 41 -30.628 9.544 2.007 1.00 0.94 H new ATOM 0 HB2 LEU B 41 -28.243 9.594 1.228 1.00 0.92 H new ATOM 0 HB3 LEU B 41 -28.494 8.053 0.432 1.00 0.92 H new ATOM 0 HG LEU B 41 -30.322 9.161 -0.933 1.00 0.97 H new ATOM 0 HD11 LEU B 41 -30.254 11.620 -1.094 1.00 1.08 H new ATOM 0 HD12 LEU B 41 -30.736 11.078 0.531 1.00 1.08 H new ATOM 0 HD13 LEU B 41 -29.083 11.670 0.245 1.00 1.08 H new ATOM 0 HD21 LEU B 41 -28.732 10.252 -2.464 1.00 1.01 H new ATOM 0 HD22 LEU B 41 -27.500 10.248 -1.180 1.00 1.01 H new ATOM 0 HD23 LEU B 41 -28.099 8.709 -1.843 1.00 1.01 H new ATOM 2459 N SER B 42 -30.797 6.370 1.271 1.00 0.97 N ATOM 2460 CA SER B 42 -31.661 5.337 0.730 1.00 1.01 C ATOM 2461 C SER B 42 -33.017 5.348 1.439 1.00 1.02 C ATOM 2462 O SER B 42 -34.070 5.197 0.808 1.00 1.03 O ATOM 2463 CB SER B 42 -30.997 3.964 0.873 1.00 1.07 C ATOM 2464 OG SER B 42 -31.588 3.005 0.007 1.00 1.56 O ATOM 0 H SER B 42 -29.975 6.018 1.762 1.00 0.97 H new ATOM 0 HA SER B 42 -31.823 5.539 -0.329 1.00 1.01 H new ATOM 0 HB2 SER B 42 -29.933 4.049 0.651 1.00 1.07 H new ATOM 0 HB3 SER B 42 -31.081 3.624 1.905 1.00 1.07 H new ATOM 0 HG SER B 42 -31.140 2.141 0.122 1.00 1.56 H new ATOM 2470 N GLU B 43 -32.986 5.567 2.748 1.00 1.04 N ATOM 2471 CA GLU B 43 -34.203 5.593 3.547 1.00 1.07 C ATOM 2472 C GLU B 43 -34.987 6.881 3.310 1.00 1.05 C ATOM 2473 O GLU B 43 -36.215 6.869 3.242 1.00 1.10 O ATOM 2474 CB GLU B 43 -33.861 5.460 5.029 1.00 1.12 C ATOM 2475 CG GLU B 43 -35.057 5.101 5.888 1.00 1.24 C ATOM 2476 CD GLU B 43 -35.053 5.831 7.212 1.00 1.41 C ATOM 2477 OE1 GLU B 43 -35.139 7.077 7.207 1.00 1.56 O ATOM 2478 OE2 GLU B 43 -34.971 5.161 8.265 1.00 1.92 O ATOM 0 H GLU B 43 -32.130 5.729 3.278 1.00 1.04 H new ATOM 0 HA GLU B 43 -34.825 4.751 3.243 1.00 1.07 H new ATOM 0 HB2 GLU B 43 -33.092 4.697 5.151 1.00 1.12 H new ATOM 0 HB3 GLU B 43 -33.436 6.399 5.383 1.00 1.12 H new ATOM 0 HG2 GLU B 43 -35.974 5.338 5.348 1.00 1.24 H new ATOM 0 HG3 GLU B 43 -35.062 4.026 6.068 1.00 1.24 H new ATOM 2485 N LYS B 44 -34.268 7.987 3.151 1.00 1.00 N ATOM 2486 CA LYS B 44 -34.895 9.284 2.938 1.00 1.00 C ATOM 2487 C LYS B 44 -35.451 9.421 1.521 1.00 0.98 C ATOM 2488 O LYS B 44 -36.349 10.226 1.276 1.00 1.03 O ATOM 2489 CB LYS B 44 -33.899 10.410 3.230 1.00 1.01 C ATOM 2490 CG LYS B 44 -33.411 10.433 4.674 1.00 1.06 C ATOM 2491 CD LYS B 44 -34.566 10.528 5.663 1.00 1.17 C ATOM 2492 CE LYS B 44 -34.075 10.592 7.103 1.00 1.32 C ATOM 2493 NZ LYS B 44 -33.709 9.251 7.633 1.00 1.35 N ATOM 0 H LYS B 44 -33.248 8.010 3.166 1.00 1.00 H new ATOM 0 HA LYS B 44 -35.735 9.361 3.629 1.00 1.00 H new ATOM 0 HB2 LYS B 44 -33.040 10.306 2.567 1.00 1.01 H new ATOM 0 HB3 LYS B 44 -34.367 11.367 2.998 1.00 1.01 H new ATOM 0 HG2 LYS B 44 -32.833 9.531 4.876 1.00 1.06 H new ATOM 0 HG3 LYS B 44 -32.740 11.280 4.817 1.00 1.06 H new ATOM 0 HD2 LYS B 44 -35.161 11.414 5.442 1.00 1.17 H new ATOM 0 HD3 LYS B 44 -35.221 9.665 5.541 1.00 1.17 H new ATOM 0 HE2 LYS B 44 -33.209 11.252 7.161 1.00 1.32 H new ATOM 0 HE3 LYS B 44 -34.852 11.029 7.731 1.00 1.32 H new ATOM 0 HZ1 LYS B 44 -33.873 9.227 8.660 1.00 1.35 H new ATOM 0 HZ2 LYS B 44 -34.293 8.524 7.172 1.00 1.35 H new ATOM 0 HZ3 LYS B 44 -32.705 9.063 7.438 1.00 1.35 H new ATOM 2507 N ALA B 45 -34.915 8.648 0.588 1.00 0.98 N ATOM 2508 CA ALA B 45 -35.368 8.700 -0.796 1.00 0.99 C ATOM 2509 C ALA B 45 -36.467 7.676 -1.063 1.00 1.01 C ATOM 2510 O ALA B 45 -37.156 7.752 -2.075 1.00 1.03 O ATOM 2511 CB ALA B 45 -34.201 8.479 -1.748 1.00 1.01 C ATOM 0 H ALA B 45 -34.166 7.978 0.763 1.00 0.98 H new ATOM 0 HA ALA B 45 -35.784 9.692 -0.970 1.00 0.99 H new ATOM 0 HB1 ALA B 45 -34.558 8.521 -2.777 1.00 1.01 H new ATOM 0 HB2 ALA B 45 -33.452 9.255 -1.592 1.00 1.01 H new ATOM 0 HB3 ALA B 45 -33.756 7.502 -1.558 1.00 1.01 H new ATOM 2517 N LYS B 46 -36.641 6.735 -0.139 1.00 1.04 N ATOM 2518 CA LYS B 46 -37.650 5.687 -0.288 1.00 1.10 C ATOM 2519 C LYS B 46 -39.066 6.261 -0.243 1.00 1.12 C ATOM 2520 O LYS B 46 -40.022 5.625 -0.691 1.00 1.18 O ATOM 2521 CB LYS B 46 -37.474 4.637 0.811 1.00 1.18 C ATOM 2522 CG LYS B 46 -37.732 3.213 0.347 1.00 1.46 C ATOM 2523 CD LYS B 46 -36.464 2.376 0.388 1.00 1.98 C ATOM 2524 CE LYS B 46 -35.532 2.696 -0.772 1.00 2.66 C ATOM 2525 NZ LYS B 46 -34.256 1.938 -0.687 1.00 3.40 N ATOM 0 H LYS B 46 -36.097 6.676 0.722 1.00 1.04 H new ATOM 0 HA LYS B 46 -37.511 5.221 -1.263 1.00 1.10 H new ATOM 0 HB2 LYS B 46 -36.459 4.703 1.204 1.00 1.18 H new ATOM 0 HB3 LYS B 46 -38.150 4.869 1.634 1.00 1.18 H new ATOM 0 HG2 LYS B 46 -38.492 2.755 0.980 1.00 1.46 H new ATOM 0 HG3 LYS B 46 -38.128 3.226 -0.668 1.00 1.46 H new ATOM 0 HD2 LYS B 46 -35.944 2.551 1.330 1.00 1.98 H new ATOM 0 HD3 LYS B 46 -36.727 1.318 0.361 1.00 1.98 H new ATOM 0 HE2 LYS B 46 -36.031 2.462 -1.713 1.00 2.66 H new ATOM 0 HE3 LYS B 46 -35.319 3.765 -0.781 1.00 2.66 H new ATOM 0 HZ1 LYS B 46 -33.481 2.588 -0.444 1.00 3.40 H new ATOM 0 HZ2 LYS B 46 -34.336 1.205 0.047 1.00 3.40 H new ATOM 0 HZ3 LYS B 46 -34.057 1.490 -1.604 1.00 3.40 H new ATOM 2539 N THR B 47 -39.192 7.465 0.298 1.00 1.10 N ATOM 2540 CA THR B 47 -40.481 8.126 0.406 1.00 1.16 C ATOM 2541 C THR B 47 -40.940 8.679 -0.948 1.00 1.17 C ATOM 2542 O THR B 47 -42.088 9.105 -1.104 1.00 1.27 O ATOM 2543 CB THR B 47 -40.412 9.262 1.442 1.00 1.24 C ATOM 2544 OG1 THR B 47 -39.215 9.126 2.229 1.00 1.54 O ATOM 2545 CG2 THR B 47 -41.636 9.239 2.351 1.00 1.41 C ATOM 0 H THR B 47 -38.411 8.005 0.670 1.00 1.10 H new ATOM 0 HA THR B 47 -41.210 7.385 0.734 1.00 1.16 H new ATOM 0 HB THR B 47 -40.394 10.215 0.914 1.00 1.24 H new ATOM 0 HG1 THR B 47 -38.482 9.611 1.796 1.00 1.54 H new ATOM 0 HG21 THR B 47 -41.566 10.050 3.076 1.00 1.41 H new ATOM 0 HG22 THR B 47 -42.537 9.365 1.751 1.00 1.41 H new ATOM 0 HG23 THR B 47 -41.681 8.285 2.877 1.00 1.41 H new ATOM 2553 N ASP B 48 -40.046 8.654 -1.929 1.00 1.14 N ATOM 2554 CA ASP B 48 -40.355 9.147 -3.264 1.00 1.18 C ATOM 2555 C ASP B 48 -40.075 8.058 -4.295 1.00 1.14 C ATOM 2556 O ASP B 48 -38.976 7.517 -4.336 1.00 1.10 O ATOM 2557 CB ASP B 48 -39.527 10.397 -3.575 1.00 1.23 C ATOM 2558 CG ASP B 48 -39.994 11.111 -4.829 1.00 1.28 C ATOM 2559 OD1 ASP B 48 -39.732 10.608 -5.940 1.00 1.43 O ATOM 2560 OD2 ASP B 48 -40.618 12.188 -4.706 1.00 1.39 O ATOM 0 H ASP B 48 -39.097 8.296 -1.823 1.00 1.14 H new ATOM 0 HA ASP B 48 -41.411 9.413 -3.307 1.00 1.18 H new ATOM 0 HB2 ASP B 48 -39.581 11.083 -2.730 1.00 1.23 H new ATOM 0 HB3 ASP B 48 -38.480 10.115 -3.691 1.00 1.23 H new ATOM 2565 N PRO B 49 -41.062 7.728 -5.141 1.00 1.20 N ATOM 2566 CA PRO B 49 -40.916 6.679 -6.163 1.00 1.22 C ATOM 2567 C PRO B 49 -39.837 7.002 -7.193 1.00 1.24 C ATOM 2568 O PRO B 49 -39.158 6.107 -7.700 1.00 1.24 O ATOM 2569 CB PRO B 49 -42.293 6.632 -6.835 1.00 1.33 C ATOM 2570 CG PRO B 49 -42.916 7.952 -6.528 1.00 1.36 C ATOM 2571 CD PRO B 49 -42.395 8.349 -5.178 1.00 1.29 C ATOM 0 HA PRO B 49 -40.608 5.732 -5.719 1.00 1.22 H new ATOM 0 HB2 PRO B 49 -42.203 6.479 -7.910 1.00 1.33 H new ATOM 0 HB3 PRO B 49 -42.895 5.811 -6.445 1.00 1.33 H new ATOM 0 HG2 PRO B 49 -42.652 8.693 -7.282 1.00 1.36 H new ATOM 0 HG3 PRO B 49 -44.003 7.878 -6.521 1.00 1.36 H new ATOM 0 HD2 PRO B 49 -42.339 9.432 -5.070 1.00 1.29 H new ATOM 0 HD3 PRO B 49 -43.034 7.981 -4.375 1.00 1.29 H new ATOM 2579 N GLN B 50 -39.675 8.282 -7.491 1.00 1.28 N ATOM 2580 CA GLN B 50 -38.686 8.715 -8.465 1.00 1.33 C ATOM 2581 C GLN B 50 -37.295 8.685 -7.847 1.00 1.22 C ATOM 2582 O GLN B 50 -36.330 8.255 -8.478 1.00 1.22 O ATOM 2583 CB GLN B 50 -39.004 10.124 -8.965 1.00 1.45 C ATOM 2584 CG GLN B 50 -40.376 10.248 -9.608 1.00 1.58 C ATOM 2585 CD GLN B 50 -41.084 11.539 -9.235 1.00 1.65 C ATOM 2586 OE1 GLN B 50 -41.755 12.156 -10.062 1.00 1.81 O ATOM 2587 NE2 GLN B 50 -40.955 11.952 -7.981 1.00 1.66 N ATOM 0 H GLN B 50 -40.216 9.039 -7.072 1.00 1.28 H new ATOM 0 HA GLN B 50 -38.715 8.031 -9.313 1.00 1.33 H new ATOM 0 HB2 GLN B 50 -38.940 10.820 -8.129 1.00 1.45 H new ATOM 0 HB3 GLN B 50 -38.245 10.424 -9.688 1.00 1.45 H new ATOM 0 HG2 GLN B 50 -40.271 10.196 -10.692 1.00 1.58 H new ATOM 0 HG3 GLN B 50 -40.992 9.401 -9.307 1.00 1.58 H new ATOM 0 HE21 GLN B 50 -40.391 11.415 -7.323 1.00 1.66 H new ATOM 0 HE22 GLN B 50 -41.420 12.807 -7.675 1.00 1.66 H new ATOM 2596 N ALA B 51 -37.202 9.147 -6.605 1.00 1.15 N ATOM 2597 CA ALA B 51 -35.930 9.165 -5.892 1.00 1.08 C ATOM 2598 C ALA B 51 -35.479 7.744 -5.568 1.00 1.00 C ATOM 2599 O ALA B 51 -34.293 7.416 -5.668 1.00 0.98 O ATOM 2600 CB ALA B 51 -36.044 9.993 -4.625 1.00 1.09 C ATOM 0 H ALA B 51 -37.991 9.513 -6.072 1.00 1.15 H new ATOM 0 HA ALA B 51 -35.179 9.624 -6.535 1.00 1.08 H new ATOM 0 HB1 ALA B 51 -35.086 9.996 -4.105 1.00 1.09 H new ATOM 0 HB2 ALA B 51 -36.320 11.015 -4.882 1.00 1.09 H new ATOM 0 HB3 ALA B 51 -36.807 9.563 -3.977 1.00 1.09 H new ATOM 2606 N ALA B 52 -36.436 6.899 -5.191 1.00 0.99 N ATOM 2607 CA ALA B 52 -36.149 5.508 -4.874 1.00 0.98 C ATOM 2608 C ALA B 52 -35.641 4.782 -6.111 1.00 1.02 C ATOM 2609 O ALA B 52 -34.807 3.882 -6.019 1.00 1.03 O ATOM 2610 CB ALA B 52 -37.387 4.815 -4.327 1.00 1.03 C ATOM 0 H ALA B 52 -37.418 7.157 -5.098 1.00 0.99 H new ATOM 0 HA ALA B 52 -35.375 5.482 -4.107 1.00 0.98 H new ATOM 0 HB1 ALA B 52 -37.151 3.776 -4.097 1.00 1.03 H new ATOM 0 HB2 ALA B 52 -37.717 5.322 -3.420 1.00 1.03 H new ATOM 0 HB3 ALA B 52 -38.182 4.849 -5.072 1.00 1.03 H new ATOM 2616 N GLU B 53 -36.143 5.193 -7.270 1.00 1.09 N ATOM 2617 CA GLU B 53 -35.739 4.610 -8.539 1.00 1.18 C ATOM 2618 C GLU B 53 -34.278 4.952 -8.828 1.00 1.17 C ATOM 2619 O GLU B 53 -33.539 4.156 -9.417 1.00 1.23 O ATOM 2620 CB GLU B 53 -36.649 5.126 -9.661 1.00 1.28 C ATOM 2621 CG GLU B 53 -36.493 4.386 -10.981 1.00 1.45 C ATOM 2622 CD GLU B 53 -36.443 2.883 -10.809 1.00 1.51 C ATOM 2623 OE1 GLU B 53 -37.500 2.272 -10.550 1.00 1.66 O ATOM 2624 OE2 GLU B 53 -35.346 2.305 -10.944 1.00 1.58 O ATOM 0 H GLU B 53 -36.837 5.935 -7.354 1.00 1.09 H new ATOM 0 HA GLU B 53 -35.835 3.526 -8.485 1.00 1.18 H new ATOM 0 HB2 GLU B 53 -37.687 5.051 -9.336 1.00 1.28 H new ATOM 0 HB3 GLU B 53 -36.442 6.184 -9.824 1.00 1.28 H new ATOM 0 HG2 GLU B 53 -37.324 4.644 -11.637 1.00 1.45 H new ATOM 0 HG3 GLU B 53 -35.581 4.721 -11.474 1.00 1.45 H new ATOM 2631 N LYS B 54 -33.867 6.135 -8.391 1.00 1.13 N ATOM 2632 CA LYS B 54 -32.501 6.591 -8.582 1.00 1.14 C ATOM 2633 C LYS B 54 -31.551 5.786 -7.710 1.00 1.05 C ATOM 2634 O LYS B 54 -30.487 5.374 -8.160 1.00 1.09 O ATOM 2635 CB LYS B 54 -32.381 8.079 -8.247 1.00 1.16 C ATOM 2636 CG LYS B 54 -33.095 8.995 -9.231 1.00 1.32 C ATOM 2637 CD LYS B 54 -32.990 10.457 -8.822 1.00 1.48 C ATOM 2638 CE LYS B 54 -31.552 10.953 -8.875 1.00 1.68 C ATOM 2639 NZ LYS B 54 -31.435 12.380 -8.474 1.00 2.09 N ATOM 0 H LYS B 54 -34.466 6.798 -7.899 1.00 1.13 H new ATOM 0 HA LYS B 54 -32.233 6.445 -9.628 1.00 1.14 H new ATOM 0 HB2 LYS B 54 -32.785 8.250 -7.249 1.00 1.16 H new ATOM 0 HB3 LYS B 54 -31.326 8.350 -8.215 1.00 1.16 H new ATOM 0 HG2 LYS B 54 -32.667 8.864 -10.225 1.00 1.32 H new ATOM 0 HG3 LYS B 54 -34.145 8.710 -9.296 1.00 1.32 H new ATOM 0 HD2 LYS B 54 -33.609 11.065 -9.481 1.00 1.48 H new ATOM 0 HD3 LYS B 54 -33.381 10.582 -7.812 1.00 1.48 H new ATOM 0 HE2 LYS B 54 -30.934 10.341 -8.218 1.00 1.68 H new ATOM 0 HE3 LYS B 54 -31.163 10.828 -9.886 1.00 1.68 H new ATOM 0 HZ1 LYS B 54 -30.439 12.674 -8.525 1.00 2.09 H new ATOM 0 HZ2 LYS B 54 -32.003 12.969 -9.116 1.00 2.09 H new ATOM 0 HZ3 LYS B 54 -31.781 12.496 -7.500 1.00 2.09 H new ATOM 2653 N LEU B 55 -31.947 5.561 -6.464 1.00 0.98 N ATOM 2654 CA LEU B 55 -31.124 4.800 -5.530 1.00 0.95 C ATOM 2655 C LEU B 55 -31.036 3.339 -5.959 1.00 0.99 C ATOM 2656 O LEU B 55 -30.011 2.689 -5.772 1.00 0.99 O ATOM 2657 CB LEU B 55 -31.685 4.901 -4.105 1.00 0.94 C ATOM 2658 CG LEU B 55 -31.011 5.943 -3.205 1.00 1.02 C ATOM 2659 CD1 LEU B 55 -29.533 5.630 -3.017 1.00 1.13 C ATOM 2660 CD2 LEU B 55 -31.187 7.339 -3.778 1.00 1.09 C ATOM 0 H LEU B 55 -32.830 5.893 -6.076 1.00 0.98 H new ATOM 0 HA LEU B 55 -30.121 5.226 -5.538 1.00 0.95 H new ATOM 0 HB2 LEU B 55 -32.748 5.133 -4.167 1.00 0.94 H new ATOM 0 HB3 LEU B 55 -31.599 3.924 -3.629 1.00 0.94 H new ATOM 0 HG LEU B 55 -31.493 5.904 -2.228 1.00 1.02 H new ATOM 0 HD11 LEU B 55 -29.080 6.385 -2.375 1.00 1.13 H new ATOM 0 HD12 LEU B 55 -29.425 4.649 -2.555 1.00 1.13 H new ATOM 0 HD13 LEU B 55 -29.034 5.632 -3.986 1.00 1.13 H new ATOM 0 HD21 LEU B 55 -30.702 8.064 -3.125 1.00 1.09 H new ATOM 0 HD22 LEU B 55 -30.736 7.385 -4.769 1.00 1.09 H new ATOM 0 HD23 LEU B 55 -32.250 7.571 -3.851 1.00 1.09 H new ATOM 2672 N ASN B 56 -32.117 2.840 -6.546 1.00 1.06 N ATOM 2673 CA ASN B 56 -32.187 1.462 -7.020 1.00 1.16 C ATOM 2674 C ASN B 56 -31.056 1.166 -8.010 1.00 1.20 C ATOM 2675 O ASN B 56 -30.292 0.212 -7.837 1.00 1.26 O ATOM 2676 CB ASN B 56 -33.554 1.225 -7.680 1.00 1.26 C ATOM 2677 CG ASN B 56 -33.597 -0.016 -8.550 1.00 1.44 C ATOM 2678 OD1 ASN B 56 -33.132 -1.083 -8.156 1.00 1.49 O ATOM 2679 ND2 ASN B 56 -34.158 0.118 -9.743 1.00 1.58 N ATOM 0 H ASN B 56 -32.969 3.378 -6.707 1.00 1.06 H new ATOM 0 HA ASN B 56 -32.070 0.788 -6.172 1.00 1.16 H new ATOM 0 HB2 ASN B 56 -34.314 1.141 -6.903 1.00 1.26 H new ATOM 0 HB3 ASN B 56 -33.812 2.093 -8.286 1.00 1.26 H new ATOM 0 HD21 ASN B 56 -34.216 -0.683 -10.372 1.00 1.58 H new ATOM 0 HD22 ASN B 56 -34.532 1.022 -10.032 1.00 1.58 H new ATOM 2686 N LYS B 57 -30.944 2.002 -9.032 1.00 1.21 N ATOM 2687 CA LYS B 57 -29.910 1.838 -10.049 1.00 1.29 C ATOM 2688 C LYS B 57 -28.539 2.251 -9.517 1.00 1.21 C ATOM 2689 O LYS B 57 -27.516 1.729 -9.949 1.00 1.26 O ATOM 2690 CB LYS B 57 -30.249 2.634 -11.312 1.00 1.39 C ATOM 2691 CG LYS B 57 -30.743 4.050 -11.050 1.00 1.52 C ATOM 2692 CD LYS B 57 -31.115 4.765 -12.345 1.00 1.62 C ATOM 2693 CE LYS B 57 -32.244 4.057 -13.082 1.00 1.73 C ATOM 2694 NZ LYS B 57 -33.509 4.055 -12.306 1.00 1.81 N ATOM 0 H LYS B 57 -31.557 2.803 -9.181 1.00 1.21 H new ATOM 0 HA LYS B 57 -29.872 0.780 -10.307 1.00 1.29 H new ATOM 0 HB2 LYS B 57 -29.363 2.683 -11.945 1.00 1.39 H new ATOM 0 HB3 LYS B 57 -31.012 2.094 -11.873 1.00 1.39 H new ATOM 0 HG2 LYS B 57 -31.610 4.017 -10.390 1.00 1.52 H new ATOM 0 HG3 LYS B 57 -29.969 4.616 -10.531 1.00 1.52 H new ATOM 0 HD2 LYS B 57 -31.414 5.789 -12.121 1.00 1.62 H new ATOM 0 HD3 LYS B 57 -30.240 4.823 -12.992 1.00 1.62 H new ATOM 0 HE2 LYS B 57 -32.410 4.545 -14.042 1.00 1.73 H new ATOM 0 HE3 LYS B 57 -31.949 3.029 -13.294 1.00 1.73 H new ATOM 0 HZ1 LYS B 57 -33.820 3.075 -12.152 1.00 1.81 H new ATOM 0 HZ2 LYS B 57 -33.353 4.517 -11.387 1.00 1.81 H new ATOM 0 HZ3 LYS B 57 -34.241 4.572 -12.834 1.00 1.81 H new ATOM 2708 N LEU B 58 -28.531 3.201 -8.590 1.00 1.12 N ATOM 2709 CA LEU B 58 -27.290 3.702 -8.001 1.00 1.09 C ATOM 2710 C LEU B 58 -26.530 2.591 -7.276 1.00 1.08 C ATOM 2711 O LEU B 58 -25.355 2.349 -7.557 1.00 1.11 O ATOM 2712 CB LEU B 58 -27.587 4.854 -7.030 1.00 1.06 C ATOM 2713 CG LEU B 58 -26.569 6.001 -7.014 1.00 1.21 C ATOM 2714 CD1 LEU B 58 -25.303 5.594 -6.281 1.00 1.37 C ATOM 2715 CD2 LEU B 58 -26.241 6.460 -8.430 1.00 1.40 C ATOM 0 H LEU B 58 -29.375 3.644 -8.226 1.00 1.12 H new ATOM 0 HA LEU B 58 -26.662 4.070 -8.812 1.00 1.09 H new ATOM 0 HB2 LEU B 58 -28.565 5.267 -7.276 1.00 1.06 H new ATOM 0 HB3 LEU B 58 -27.658 4.444 -6.023 1.00 1.06 H new ATOM 0 HG LEU B 58 -27.020 6.837 -6.480 1.00 1.21 H new ATOM 0 HD11 LEU B 58 -24.598 6.425 -6.284 1.00 1.37 H new ATOM 0 HD12 LEU B 58 -25.547 5.329 -5.252 1.00 1.37 H new ATOM 0 HD13 LEU B 58 -24.854 4.735 -6.780 1.00 1.37 H new ATOM 0 HD21 LEU B 58 -25.517 7.274 -8.390 1.00 1.40 H new ATOM 0 HD22 LEU B 58 -25.820 5.628 -8.994 1.00 1.40 H new ATOM 0 HD23 LEU B 58 -27.151 6.807 -8.920 1.00 1.40 H new ATOM 2727 N ILE B 59 -27.203 1.904 -6.355 1.00 1.08 N ATOM 2728 CA ILE B 59 -26.570 0.830 -5.596 1.00 1.15 C ATOM 2729 C ILE B 59 -26.174 -0.330 -6.510 1.00 1.25 C ATOM 2730 O ILE B 59 -25.134 -0.965 -6.301 1.00 1.32 O ATOM 2731 CB ILE B 59 -27.471 0.321 -4.445 1.00 1.20 C ATOM 2732 CG1 ILE B 59 -26.712 -0.693 -3.585 1.00 1.33 C ATOM 2733 CG2 ILE B 59 -28.760 -0.295 -4.981 1.00 1.22 C ATOM 2734 CD1 ILE B 59 -25.571 -0.099 -2.781 1.00 1.37 C ATOM 0 H ILE B 59 -28.181 2.071 -6.118 1.00 1.08 H new ATOM 0 HA ILE B 59 -25.668 1.249 -5.150 1.00 1.15 H new ATOM 0 HB ILE B 59 -27.742 1.177 -3.826 1.00 1.20 H new ATOM 0 HG12 ILE B 59 -27.414 -1.169 -2.901 1.00 1.33 H new ATOM 0 HG13 ILE B 59 -26.316 -1.476 -4.232 1.00 1.33 H new ATOM 0 HG21 ILE B 59 -29.371 -0.643 -4.148 1.00 1.22 H new ATOM 0 HG22 ILE B 59 -29.313 0.454 -5.548 1.00 1.22 H new ATOM 0 HG23 ILE B 59 -28.519 -1.137 -5.630 1.00 1.22 H new ATOM 0 HD11 ILE B 59 -25.087 -0.885 -2.201 1.00 1.37 H new ATOM 0 HD12 ILE B 59 -24.845 0.352 -3.458 1.00 1.37 H new ATOM 0 HD13 ILE B 59 -25.960 0.663 -2.106 1.00 1.37 H new ATOM 2746 N GLU B 60 -26.989 -0.590 -7.532 1.00 1.29 N ATOM 2747 CA GLU B 60 -26.704 -1.657 -8.480 1.00 1.44 C ATOM 2748 C GLU B 60 -25.431 -1.325 -9.258 1.00 1.40 C ATOM 2749 O GLU B 60 -24.624 -2.204 -9.565 1.00 1.51 O ATOM 2750 CB GLU B 60 -27.875 -1.842 -9.447 1.00 1.54 C ATOM 2751 CG GLU B 60 -27.827 -3.147 -10.220 1.00 1.75 C ATOM 2752 CD GLU B 60 -28.458 -3.019 -11.586 1.00 1.96 C ATOM 2753 OE1 GLU B 60 -27.748 -2.624 -12.535 1.00 2.17 O ATOM 2754 OE2 GLU B 60 -29.667 -3.290 -11.718 1.00 2.28 O ATOM 0 H GLU B 60 -27.849 -0.075 -7.721 1.00 1.29 H new ATOM 0 HA GLU B 60 -26.560 -2.587 -7.931 1.00 1.44 H new ATOM 0 HB2 GLU B 60 -28.809 -1.796 -8.886 1.00 1.54 H new ATOM 0 HB3 GLU B 60 -27.886 -1.012 -10.153 1.00 1.54 H new ATOM 0 HG2 GLU B 60 -26.790 -3.466 -10.328 1.00 1.75 H new ATOM 0 HG3 GLU B 60 -28.342 -3.923 -9.654 1.00 1.75 H new ATOM 2761 N GLY B 61 -25.266 -0.046 -9.576 1.00 1.29 N ATOM 2762 CA GLY B 61 -24.095 0.407 -10.300 1.00 1.28 C ATOM 2763 C GLY B 61 -22.848 0.389 -9.441 1.00 1.21 C ATOM 2764 O GLY B 61 -21.739 0.286 -9.954 1.00 1.23 O ATOM 0 H GLY B 61 -25.931 0.691 -9.342 1.00 1.29 H new ATOM 0 HA2 GLY B 61 -23.942 -0.228 -11.173 1.00 1.28 H new ATOM 0 HA3 GLY B 61 -24.266 1.419 -10.668 1.00 1.28 H new ATOM 2768 N TYR B 62 -23.039 0.527 -8.135 1.00 1.19 N ATOM 2769 CA TYR B 62 -21.930 0.506 -7.183 1.00 1.23 C ATOM 2770 C TYR B 62 -21.367 -0.903 -7.019 1.00 1.35 C ATOM 2771 O TYR B 62 -20.168 -1.134 -7.193 1.00 1.37 O ATOM 2772 CB TYR B 62 -22.389 1.043 -5.820 1.00 1.28 C ATOM 2773 CG TYR B 62 -21.326 0.961 -4.744 1.00 1.60 C ATOM 2774 CD1 TYR B 62 -20.380 1.971 -4.595 1.00 2.25 C ATOM 2775 CD2 TYR B 62 -21.266 -0.128 -3.882 1.00 2.11 C ATOM 2776 CE1 TYR B 62 -19.403 1.896 -3.618 1.00 2.90 C ATOM 2777 CE2 TYR B 62 -20.295 -0.211 -2.904 1.00 2.72 C ATOM 2778 CZ TYR B 62 -19.365 0.803 -2.777 1.00 2.96 C ATOM 2779 OH TYR B 62 -18.396 0.723 -1.802 1.00 3.75 O ATOM 0 H TYR B 62 -23.956 0.655 -7.707 1.00 1.19 H new ATOM 0 HA TYR B 62 -21.141 1.146 -7.577 1.00 1.23 H new ATOM 0 HB2 TYR B 62 -22.698 2.082 -5.934 1.00 1.28 H new ATOM 0 HB3 TYR B 62 -23.266 0.483 -5.495 1.00 1.28 H new ATOM 0 HD1 TYR B 62 -20.409 2.827 -5.253 1.00 2.25 H new ATOM 0 HD2 TYR B 62 -21.991 -0.922 -3.979 1.00 2.11 H new ATOM 0 HE1 TYR B 62 -18.675 2.687 -3.515 1.00 2.90 H new ATOM 0 HE2 TYR B 62 -20.263 -1.064 -2.242 1.00 2.72 H new ATOM 0 HH TYR B 62 -18.643 0.033 -1.152 1.00 3.75 H new ATOM 2789 N THR B 63 -22.251 -1.839 -6.690 1.00 1.51 N ATOM 2790 CA THR B 63 -21.865 -3.229 -6.465 1.00 1.71 C ATOM 2791 C THR B 63 -21.208 -3.841 -7.695 1.00 1.67 C ATOM 2792 O THR B 63 -20.218 -4.568 -7.590 1.00 1.80 O ATOM 2793 CB THR B 63 -23.078 -4.085 -6.054 1.00 1.94 C ATOM 2794 OG1 THR B 63 -24.282 -3.506 -6.571 1.00 2.00 O ATOM 2795 CG2 THR B 63 -23.176 -4.191 -4.546 1.00 2.31 C ATOM 0 H THR B 63 -23.248 -1.659 -6.572 1.00 1.51 H new ATOM 0 HA THR B 63 -21.139 -3.223 -5.652 1.00 1.71 H new ATOM 0 HB THR B 63 -22.946 -5.085 -6.467 1.00 1.94 H new ATOM 0 HG1 THR B 63 -24.528 -2.726 -6.031 1.00 2.00 H new ATOM 0 HG21 THR B 63 -24.040 -4.800 -4.279 1.00 2.31 H new ATOM 0 HG22 THR B 63 -22.271 -4.654 -4.154 1.00 2.31 H new ATOM 0 HG23 THR B 63 -23.288 -3.195 -4.118 1.00 2.31 H new ATOM 2803 N TYR B 64 -21.761 -3.541 -8.859 1.00 1.57 N ATOM 2804 CA TYR B 64 -21.236 -4.057 -10.108 1.00 1.63 C ATOM 2805 C TYR B 64 -20.502 -2.959 -10.863 1.00 1.37 C ATOM 2806 O TYR B 64 -20.465 -2.950 -12.096 1.00 1.46 O ATOM 2807 CB TYR B 64 -22.372 -4.636 -10.949 1.00 1.90 C ATOM 2808 CG TYR B 64 -23.153 -5.700 -10.208 1.00 2.42 C ATOM 2809 CD1 TYR B 64 -22.600 -6.951 -9.978 1.00 3.10 C ATOM 2810 CD2 TYR B 64 -24.427 -5.444 -9.714 1.00 2.81 C ATOM 2811 CE1 TYR B 64 -23.293 -7.918 -9.281 1.00 3.76 C ATOM 2812 CE2 TYR B 64 -25.123 -6.406 -9.009 1.00 3.50 C ATOM 2813 CZ TYR B 64 -24.550 -7.642 -8.798 1.00 3.84 C ATOM 2814 OH TYR B 64 -25.235 -8.603 -8.092 1.00 4.62 O ATOM 0 H TYR B 64 -22.578 -2.939 -8.963 1.00 1.57 H new ATOM 0 HA TYR B 64 -20.524 -4.855 -9.896 1.00 1.63 H new ATOM 0 HB2 TYR B 64 -23.047 -3.833 -11.245 1.00 1.90 H new ATOM 0 HB3 TYR B 64 -21.962 -5.062 -11.865 1.00 1.90 H new ATOM 0 HD1 TYR B 64 -21.611 -7.171 -10.351 1.00 3.10 H new ATOM 0 HD2 TYR B 64 -24.879 -4.478 -9.884 1.00 2.81 H new ATOM 0 HE1 TYR B 64 -22.850 -8.889 -9.115 1.00 3.76 H new ATOM 0 HE2 TYR B 64 -26.110 -6.192 -8.626 1.00 3.50 H new ATOM 0 HH TYR B 64 -26.108 -8.249 -7.820 1.00 4.62 H new ATOM 2824 N GLY B 65 -19.906 -2.045 -10.108 1.00 1.20 N ATOM 2825 CA GLY B 65 -19.186 -0.944 -10.708 1.00 1.11 C ATOM 2826 C GLY B 65 -17.727 -1.250 -10.934 1.00 1.04 C ATOM 2827 O GLY B 65 -17.064 -1.845 -10.081 1.00 1.03 O ATOM 0 H GLY B 65 -19.910 -2.049 -9.088 1.00 1.20 H new ATOM 0 HA2 GLY B 65 -19.650 -0.689 -11.661 1.00 1.11 H new ATOM 0 HA3 GLY B 65 -19.273 -0.067 -10.066 1.00 1.11 H new ATOM 2831 N GLU B 66 -17.225 -0.843 -12.088 1.00 1.04 N ATOM 2832 CA GLU B 66 -15.835 -1.066 -12.443 1.00 1.02 C ATOM 2833 C GLU B 66 -14.929 -0.119 -11.668 1.00 0.98 C ATOM 2834 O GLU B 66 -13.773 -0.437 -11.390 1.00 0.95 O ATOM 2835 CB GLU B 66 -15.639 -0.882 -13.948 1.00 1.10 C ATOM 2836 CG GLU B 66 -16.243 -2.002 -14.774 1.00 1.36 C ATOM 2837 CD GLU B 66 -15.484 -3.303 -14.629 1.00 1.66 C ATOM 2838 OE1 GLU B 66 -15.448 -3.862 -13.514 1.00 2.08 O ATOM 2839 OE2 GLU B 66 -14.921 -3.784 -15.633 1.00 2.08 O ATOM 0 H GLU B 66 -17.766 -0.352 -12.800 1.00 1.04 H new ATOM 0 HA GLU B 66 -15.568 -2.089 -12.179 1.00 1.02 H new ATOM 0 HB2 GLU B 66 -16.085 0.065 -14.252 1.00 1.10 H new ATOM 0 HB3 GLU B 66 -14.572 -0.816 -14.163 1.00 1.10 H new ATOM 0 HG2 GLU B 66 -17.279 -2.154 -14.472 1.00 1.36 H new ATOM 0 HG3 GLU B 66 -16.257 -1.708 -15.824 1.00 1.36 H new ATOM 2846 N GLU B 67 -15.465 1.040 -11.307 1.00 1.00 N ATOM 2847 CA GLU B 67 -14.704 2.033 -10.550 1.00 1.01 C ATOM 2848 C GLU B 67 -14.354 1.502 -9.164 1.00 0.97 C ATOM 2849 O GLU B 67 -13.235 1.682 -8.680 1.00 0.95 O ATOM 2850 CB GLU B 67 -15.500 3.329 -10.412 1.00 1.10 C ATOM 2851 CG GLU B 67 -14.629 4.570 -10.307 1.00 1.53 C ATOM 2852 CD GLU B 67 -14.288 5.155 -11.662 1.00 1.81 C ATOM 2853 OE1 GLU B 67 -13.376 4.634 -12.335 1.00 2.44 O ATOM 2854 OE2 GLU B 67 -14.942 6.142 -12.068 1.00 2.28 O ATOM 0 H GLU B 67 -16.422 1.318 -11.524 1.00 1.00 H new ATOM 0 HA GLU B 67 -13.783 2.236 -11.096 1.00 1.01 H new ATOM 0 HB2 GLU B 67 -16.162 3.432 -11.271 1.00 1.10 H new ATOM 0 HB3 GLU B 67 -16.133 3.264 -9.527 1.00 1.10 H new ATOM 0 HG2 GLU B 67 -15.144 5.322 -9.709 1.00 1.53 H new ATOM 0 HG3 GLU B 67 -13.708 4.320 -9.780 1.00 1.53 H new ATOM 2861 N ARG B 68 -15.317 0.839 -8.533 1.00 0.98 N ATOM 2862 CA ARG B 68 -15.111 0.265 -7.210 1.00 0.99 C ATOM 2863 C ARG B 68 -14.046 -0.821 -7.289 1.00 0.95 C ATOM 2864 O ARG B 68 -13.216 -0.968 -6.390 1.00 0.95 O ATOM 2865 CB ARG B 68 -16.426 -0.307 -6.667 1.00 1.04 C ATOM 2866 CG ARG B 68 -16.637 -0.067 -5.174 1.00 1.10 C ATOM 2867 CD ARG B 68 -15.862 -1.059 -4.314 1.00 1.41 C ATOM 2868 NE ARG B 68 -16.301 -1.043 -2.916 1.00 1.59 N ATOM 2869 CZ ARG B 68 -15.845 -1.881 -1.982 1.00 1.88 C ATOM 2870 NH1 ARG B 68 -14.938 -2.803 -2.292 1.00 2.30 N ATOM 2871 NH2 ARG B 68 -16.300 -1.799 -0.741 1.00 2.17 N ATOM 0 H ARG B 68 -16.249 0.686 -8.918 1.00 0.98 H new ATOM 0 HA ARG B 68 -14.773 1.045 -6.527 1.00 0.99 H new ATOM 0 HB2 ARG B 68 -17.257 0.135 -7.217 1.00 1.04 H new ATOM 0 HB3 ARG B 68 -16.451 -1.380 -6.859 1.00 1.04 H new ATOM 0 HG2 ARG B 68 -16.327 0.947 -4.924 1.00 1.10 H new ATOM 0 HG3 ARG B 68 -17.700 -0.141 -4.943 1.00 1.10 H new ATOM 0 HD2 ARG B 68 -15.986 -2.063 -4.720 1.00 1.41 H new ATOM 0 HD3 ARG B 68 -14.799 -0.825 -4.361 1.00 1.41 H new ATOM 0 HE ARG B 68 -16.997 -0.350 -2.640 1.00 1.59 H new ATOM 0 HH11 ARG B 68 -14.587 -2.872 -3.247 1.00 2.30 H new ATOM 0 HH12 ARG B 68 -14.593 -3.441 -1.574 1.00 2.30 H new ATOM 0 HH21 ARG B 68 -16.998 -1.096 -0.499 1.00 2.17 H new ATOM 0 HH22 ARG B 68 -15.952 -2.439 -0.027 1.00 2.17 H new ATOM 2885 N LYS B 69 -14.070 -1.566 -8.389 1.00 0.94 N ATOM 2886 CA LYS B 69 -13.104 -2.629 -8.611 1.00 0.94 C ATOM 2887 C LYS B 69 -11.705 -2.043 -8.800 1.00 0.89 C ATOM 2888 O LYS B 69 -10.710 -2.653 -8.416 1.00 0.88 O ATOM 2889 CB LYS B 69 -13.501 -3.456 -9.834 1.00 1.00 C ATOM 2890 CG LYS B 69 -12.669 -4.716 -10.016 1.00 1.28 C ATOM 2891 CD LYS B 69 -12.985 -5.409 -11.329 1.00 1.46 C ATOM 2892 CE LYS B 69 -12.391 -4.661 -12.514 1.00 1.55 C ATOM 2893 NZ LYS B 69 -12.993 -5.093 -13.801 1.00 1.70 N ATOM 0 H LYS B 69 -14.750 -1.451 -9.140 1.00 0.94 H new ATOM 0 HA LYS B 69 -13.094 -3.280 -7.737 1.00 0.94 H new ATOM 0 HB2 LYS B 69 -14.551 -3.734 -9.748 1.00 1.00 H new ATOM 0 HB3 LYS B 69 -13.407 -2.837 -10.726 1.00 1.00 H new ATOM 0 HG2 LYS B 69 -11.610 -4.461 -9.984 1.00 1.28 H new ATOM 0 HG3 LYS B 69 -12.857 -5.400 -9.188 1.00 1.28 H new ATOM 0 HD2 LYS B 69 -12.595 -6.426 -11.307 1.00 1.46 H new ATOM 0 HD3 LYS B 69 -14.066 -5.485 -11.450 1.00 1.46 H new ATOM 0 HE2 LYS B 69 -12.546 -3.590 -12.382 1.00 1.55 H new ATOM 0 HE3 LYS B 69 -11.314 -4.825 -12.544 1.00 1.55 H new ATOM 0 HZ1 LYS B 69 -12.636 -4.491 -14.570 1.00 1.70 H new ATOM 0 HZ2 LYS B 69 -12.737 -6.083 -13.989 1.00 1.70 H new ATOM 0 HZ3 LYS B 69 -14.028 -5.008 -13.746 1.00 1.70 H new ATOM 2907 N LEU B 70 -11.641 -0.851 -9.391 1.00 0.89 N ATOM 2908 CA LEU B 70 -10.371 -0.168 -9.626 1.00 0.87 C ATOM 2909 C LEU B 70 -9.705 0.170 -8.300 1.00 0.83 C ATOM 2910 O LEU B 70 -8.496 0.019 -8.146 1.00 0.82 O ATOM 2911 CB LEU B 70 -10.599 1.110 -10.434 1.00 0.91 C ATOM 2912 CG LEU B 70 -9.344 1.944 -10.707 1.00 0.96 C ATOM 2913 CD1 LEU B 70 -8.523 1.331 -11.833 1.00 1.04 C ATOM 2914 CD2 LEU B 70 -9.721 3.382 -11.046 1.00 1.04 C ATOM 0 H LEU B 70 -12.459 -0.336 -9.717 1.00 0.89 H new ATOM 0 HA LEU B 70 -9.718 -0.832 -10.192 1.00 0.87 H new ATOM 0 HB2 LEU B 70 -11.051 0.841 -11.389 1.00 0.91 H new ATOM 0 HB3 LEU B 70 -11.320 1.732 -9.904 1.00 0.91 H new ATOM 0 HG LEU B 70 -8.735 1.949 -9.803 1.00 0.96 H new ATOM 0 HD11 LEU B 70 -7.636 1.940 -12.010 1.00 1.04 H new ATOM 0 HD12 LEU B 70 -8.220 0.321 -11.555 1.00 1.04 H new ATOM 0 HD13 LEU B 70 -9.124 1.292 -12.742 1.00 1.04 H new ATOM 0 HD21 LEU B 70 -8.817 3.960 -11.237 1.00 1.04 H new ATOM 0 HD22 LEU B 70 -10.353 3.393 -11.934 1.00 1.04 H new ATOM 0 HD23 LEU B 70 -10.263 3.823 -10.210 1.00 1.04 H new ATOM 2926 N TYR B 71 -10.510 0.609 -7.339 1.00 0.84 N ATOM 2927 CA TYR B 71 -10.004 0.960 -6.016 1.00 0.84 C ATOM 2928 C TYR B 71 -9.468 -0.281 -5.312 1.00 0.83 C ATOM 2929 O TYR B 71 -8.421 -0.242 -4.666 1.00 0.82 O ATOM 2930 CB TYR B 71 -11.104 1.605 -5.167 1.00 0.91 C ATOM 2931 CG TYR B 71 -11.740 2.819 -5.805 1.00 0.92 C ATOM 2932 CD1 TYR B 71 -10.977 3.737 -6.521 1.00 0.93 C ATOM 2933 CD2 TYR B 71 -13.107 3.047 -5.694 1.00 1.01 C ATOM 2934 CE1 TYR B 71 -11.557 4.844 -7.106 1.00 1.00 C ATOM 2935 CE2 TYR B 71 -13.694 4.154 -6.276 1.00 1.09 C ATOM 2936 CZ TYR B 71 -12.914 5.047 -6.982 1.00 1.07 C ATOM 2937 OH TYR B 71 -13.495 6.144 -7.571 1.00 1.19 O ATOM 0 H TYR B 71 -11.517 0.731 -7.451 1.00 0.84 H new ATOM 0 HA TYR B 71 -9.195 1.679 -6.140 1.00 0.84 H new ATOM 0 HB2 TYR B 71 -11.878 0.864 -4.969 1.00 0.91 H new ATOM 0 HB3 TYR B 71 -10.684 1.892 -4.203 1.00 0.91 H new ATOM 0 HD1 TYR B 71 -9.913 3.580 -6.620 1.00 0.93 H new ATOM 0 HD2 TYR B 71 -13.720 2.348 -5.144 1.00 1.01 H new ATOM 0 HE1 TYR B 71 -10.951 5.547 -7.658 1.00 1.00 H new ATOM 0 HE2 TYR B 71 -14.757 4.319 -6.179 1.00 1.09 H new ATOM 0 HH TYR B 71 -14.458 6.140 -7.391 1.00 1.19 H new ATOM 2947 N ASP B 72 -10.185 -1.388 -5.458 1.00 0.86 N ATOM 2948 CA ASP B 72 -9.776 -2.647 -4.848 1.00 0.88 C ATOM 2949 C ASP B 72 -8.459 -3.119 -5.452 1.00 0.85 C ATOM 2950 O ASP B 72 -7.582 -3.639 -4.756 1.00 0.85 O ATOM 2951 CB ASP B 72 -10.853 -3.712 -5.054 1.00 0.95 C ATOM 2952 CG ASP B 72 -10.523 -5.010 -4.346 1.00 1.07 C ATOM 2953 OD1 ASP B 72 -10.684 -5.078 -3.110 1.00 1.31 O ATOM 2954 OD2 ASP B 72 -10.100 -5.972 -5.019 1.00 1.32 O ATOM 0 H ASP B 72 -11.052 -1.440 -5.993 1.00 0.86 H new ATOM 0 HA ASP B 72 -9.640 -2.486 -3.779 1.00 0.88 H new ATOM 0 HB2 ASP B 72 -11.808 -3.335 -4.689 1.00 0.95 H new ATOM 0 HB3 ASP B 72 -10.972 -3.903 -6.120 1.00 0.95 H new ATOM 2959 N SER B 73 -8.318 -2.911 -6.756 1.00 0.84 N ATOM 2960 CA SER B 73 -7.113 -3.294 -7.475 1.00 0.83 C ATOM 2961 C SER B 73 -5.927 -2.441 -7.030 1.00 0.79 C ATOM 2962 O SER B 73 -4.783 -2.895 -7.049 1.00 0.78 O ATOM 2963 CB SER B 73 -7.331 -3.161 -8.984 1.00 0.86 C ATOM 2964 OG SER B 73 -8.477 -3.889 -9.399 1.00 0.91 O ATOM 0 H SER B 73 -9.032 -2.475 -7.340 1.00 0.84 H new ATOM 0 HA SER B 73 -6.890 -4.336 -7.245 1.00 0.83 H new ATOM 0 HB2 SER B 73 -7.449 -2.110 -9.247 1.00 0.86 H new ATOM 0 HB3 SER B 73 -6.452 -3.526 -9.515 1.00 0.86 H new ATOM 0 HG SER B 73 -9.283 -3.465 -9.037 1.00 0.91 H new ATOM 2970 N ALA B 74 -6.215 -1.209 -6.628 1.00 0.79 N ATOM 2971 CA ALA B 74 -5.188 -0.288 -6.163 1.00 0.78 C ATOM 2972 C ALA B 74 -4.614 -0.758 -4.836 1.00 0.74 C ATOM 2973 O ALA B 74 -3.396 -0.781 -4.650 1.00 0.72 O ATOM 2974 CB ALA B 74 -5.752 1.121 -6.033 1.00 0.81 C ATOM 0 H ALA B 74 -7.159 -0.824 -6.615 1.00 0.79 H new ATOM 0 HA ALA B 74 -4.384 -0.269 -6.899 1.00 0.78 H new ATOM 0 HB1 ALA B 74 -4.970 1.795 -5.684 1.00 0.81 H new ATOM 0 HB2 ALA B 74 -6.116 1.458 -7.004 1.00 0.81 H new ATOM 0 HB3 ALA B 74 -6.575 1.119 -5.318 1.00 0.81 H new ATOM 2980 N LEU B 75 -5.494 -1.150 -3.918 1.00 0.76 N ATOM 2981 CA LEU B 75 -5.063 -1.635 -2.612 1.00 0.76 C ATOM 2982 C LEU B 75 -4.286 -2.937 -2.771 1.00 0.73 C ATOM 2983 O LEU B 75 -3.366 -3.222 -2.003 1.00 0.71 O ATOM 2984 CB LEU B 75 -6.268 -1.844 -1.687 1.00 0.81 C ATOM 2985 CG LEU B 75 -6.154 -1.206 -0.298 1.00 0.89 C ATOM 2986 CD1 LEU B 75 -5.027 -1.846 0.502 1.00 1.13 C ATOM 2987 CD2 LEU B 75 -5.942 0.298 -0.420 1.00 1.14 C ATOM 0 H LEU B 75 -6.505 -1.141 -4.054 1.00 0.76 H new ATOM 0 HA LEU B 75 -4.412 -0.886 -2.160 1.00 0.76 H new ATOM 0 HB2 LEU B 75 -7.155 -1.445 -2.179 1.00 0.81 H new ATOM 0 HB3 LEU B 75 -6.427 -2.915 -1.563 1.00 0.81 H new ATOM 0 HG LEU B 75 -7.088 -1.381 0.237 1.00 0.89 H new ATOM 0 HD11 LEU B 75 -4.966 -1.377 1.484 1.00 1.13 H new ATOM 0 HD12 LEU B 75 -5.225 -2.911 0.621 1.00 1.13 H new ATOM 0 HD13 LEU B 75 -4.083 -1.709 -0.025 1.00 1.13 H new ATOM 0 HD21 LEU B 75 -5.863 0.736 0.575 1.00 1.14 H new ATOM 0 HD22 LEU B 75 -5.025 0.492 -0.976 1.00 1.14 H new ATOM 0 HD23 LEU B 75 -6.786 0.743 -0.946 1.00 1.14 H new ATOM 2999 N SER B 76 -4.652 -3.716 -3.783 1.00 0.75 N ATOM 3000 CA SER B 76 -3.977 -4.979 -4.056 1.00 0.75 C ATOM 3001 C SER B 76 -2.522 -4.720 -4.458 1.00 0.72 C ATOM 3002 O SER B 76 -1.628 -5.521 -4.173 1.00 0.72 O ATOM 3003 CB SER B 76 -4.717 -5.745 -5.159 1.00 0.81 C ATOM 3004 OG SER B 76 -6.091 -5.925 -4.830 1.00 0.91 O ATOM 0 H SER B 76 -5.412 -3.495 -4.427 1.00 0.75 H new ATOM 0 HA SER B 76 -3.982 -5.588 -3.152 1.00 0.75 H new ATOM 0 HB2 SER B 76 -4.634 -5.202 -6.100 1.00 0.81 H new ATOM 0 HB3 SER B 76 -4.246 -6.717 -5.309 1.00 0.81 H new ATOM 0 HG SER B 76 -6.563 -5.071 -4.919 1.00 0.91 H new ATOM 3010 N LYS B 77 -2.296 -3.580 -5.112 1.00 0.72 N ATOM 3011 CA LYS B 77 -0.957 -3.188 -5.536 1.00 0.71 C ATOM 3012 C LYS B 77 -0.119 -2.822 -4.319 1.00 0.67 C ATOM 3013 O LYS B 77 1.084 -3.080 -4.277 1.00 0.66 O ATOM 3014 CB LYS B 77 -1.015 -2.011 -6.519 1.00 0.75 C ATOM 3015 CG LYS B 77 -1.564 -2.398 -7.882 1.00 0.93 C ATOM 3016 CD LYS B 77 -1.880 -1.178 -8.738 1.00 1.09 C ATOM 3017 CE LYS B 77 -0.627 -0.385 -9.091 1.00 1.34 C ATOM 3018 NZ LYS B 77 -0.896 0.656 -10.122 1.00 1.68 N ATOM 0 H LYS B 77 -3.027 -2.912 -5.359 1.00 0.72 H new ATOM 0 HA LYS B 77 -0.494 -4.031 -6.049 1.00 0.71 H new ATOM 0 HB2 LYS B 77 -1.636 -1.222 -6.095 1.00 0.75 H new ATOM 0 HB3 LYS B 77 -0.014 -1.598 -6.641 1.00 0.75 H new ATOM 0 HG2 LYS B 77 -0.839 -3.026 -8.400 1.00 0.93 H new ATOM 0 HG3 LYS B 77 -2.467 -2.994 -7.753 1.00 0.93 H new ATOM 0 HD2 LYS B 77 -2.376 -1.497 -9.654 1.00 1.09 H new ATOM 0 HD3 LYS B 77 -2.579 -0.533 -8.205 1.00 1.09 H new ATOM 0 HE2 LYS B 77 -0.233 0.089 -8.192 1.00 1.34 H new ATOM 0 HE3 LYS B 77 0.142 -1.066 -9.456 1.00 1.34 H new ATOM 0 HZ1 LYS B 77 -0.018 1.171 -10.332 1.00 1.68 H new ATOM 0 HZ2 LYS B 77 -1.248 0.203 -10.989 1.00 1.68 H new ATOM 0 HZ3 LYS B 77 -1.611 1.322 -9.765 1.00 1.68 H new ATOM 3032 N ILE B 78 -0.780 -2.234 -3.325 1.00 0.66 N ATOM 3033 CA ILE B 78 -0.135 -1.843 -2.082 1.00 0.64 C ATOM 3034 C ILE B 78 0.330 -3.089 -1.331 1.00 0.63 C ATOM 3035 O ILE B 78 1.459 -3.147 -0.842 1.00 0.64 O ATOM 3036 CB ILE B 78 -1.099 -1.023 -1.186 1.00 0.67 C ATOM 3037 CG1 ILE B 78 -1.419 0.333 -1.836 1.00 0.90 C ATOM 3038 CG2 ILE B 78 -0.514 -0.830 0.209 1.00 0.79 C ATOM 3039 CD1 ILE B 78 -0.257 1.307 -1.825 1.00 1.15 C ATOM 0 H ILE B 78 -1.776 -2.017 -3.362 1.00 0.66 H new ATOM 0 HA ILE B 78 0.723 -1.216 -2.324 1.00 0.64 H new ATOM 0 HB ILE B 78 -2.029 -1.583 -1.086 1.00 0.67 H new ATOM 0 HG12 ILE B 78 -1.731 0.166 -2.867 1.00 0.90 H new ATOM 0 HG13 ILE B 78 -2.264 0.784 -1.316 1.00 0.90 H new ATOM 0 HG21 ILE B 78 -1.209 -0.252 0.818 1.00 0.79 H new ATOM 0 HG22 ILE B 78 -0.348 -1.803 0.672 1.00 0.79 H new ATOM 0 HG23 ILE B 78 0.434 -0.297 0.135 1.00 0.79 H new ATOM 0 HD11 ILE B 78 -0.560 2.240 -2.301 1.00 1.15 H new ATOM 0 HD12 ILE B 78 0.042 1.505 -0.796 1.00 1.15 H new ATOM 0 HD13 ILE B 78 0.583 0.877 -2.371 1.00 1.15 H new ATOM 3051 N GLU B 79 -0.540 -4.094 -1.282 1.00 0.65 N ATOM 3052 CA GLU B 79 -0.234 -5.353 -0.608 1.00 0.67 C ATOM 3053 C GLU B 79 1.013 -5.992 -1.220 1.00 0.67 C ATOM 3054 O GLU B 79 1.887 -6.487 -0.510 1.00 0.70 O ATOM 3055 CB GLU B 79 -1.419 -6.314 -0.714 1.00 0.71 C ATOM 3056 CG GLU B 79 -1.207 -7.628 0.020 1.00 0.77 C ATOM 3057 CD GLU B 79 -2.218 -8.680 -0.377 1.00 1.10 C ATOM 3058 OE1 GLU B 79 -2.225 -9.087 -1.559 1.00 1.59 O ATOM 3059 OE2 GLU B 79 -3.006 -9.108 0.486 1.00 1.74 O ATOM 0 H GLU B 79 -1.468 -4.060 -1.704 1.00 0.65 H new ATOM 0 HA GLU B 79 -0.043 -5.145 0.445 1.00 0.67 H new ATOM 0 HB2 GLU B 79 -2.309 -5.825 -0.316 1.00 0.71 H new ATOM 0 HB3 GLU B 79 -1.613 -6.523 -1.766 1.00 0.71 H new ATOM 0 HG2 GLU B 79 -0.202 -7.998 -0.185 1.00 0.77 H new ATOM 0 HG3 GLU B 79 -1.270 -7.455 1.094 1.00 0.77 H new ATOM 3066 N LYS B 80 1.098 -5.950 -2.545 1.00 0.67 N ATOM 3067 CA LYS B 80 2.235 -6.516 -3.260 1.00 0.69 C ATOM 3068 C LYS B 80 3.526 -5.788 -2.900 1.00 0.68 C ATOM 3069 O LYS B 80 4.581 -6.408 -2.767 1.00 0.72 O ATOM 3070 CB LYS B 80 2.000 -6.455 -4.766 1.00 0.72 C ATOM 3071 CG LYS B 80 1.399 -7.729 -5.334 1.00 0.79 C ATOM 3072 CD LYS B 80 0.989 -7.550 -6.788 1.00 1.18 C ATOM 3073 CE LYS B 80 0.526 -8.857 -7.408 1.00 1.78 C ATOM 3074 NZ LYS B 80 -0.622 -9.453 -6.675 1.00 2.05 N ATOM 0 H LYS B 80 0.391 -5.528 -3.147 1.00 0.67 H new ATOM 0 HA LYS B 80 2.336 -7.559 -2.960 1.00 0.69 H new ATOM 0 HB2 LYS B 80 1.338 -5.618 -4.989 1.00 0.72 H new ATOM 0 HB3 LYS B 80 2.947 -6.254 -5.266 1.00 0.72 H new ATOM 0 HG2 LYS B 80 2.122 -8.541 -5.256 1.00 0.79 H new ATOM 0 HG3 LYS B 80 0.530 -8.018 -4.743 1.00 0.79 H new ATOM 0 HD2 LYS B 80 0.188 -6.813 -6.852 1.00 1.18 H new ATOM 0 HD3 LYS B 80 1.831 -7.156 -7.357 1.00 1.18 H new ATOM 0 HE2 LYS B 80 0.241 -8.684 -8.446 1.00 1.78 H new ATOM 0 HE3 LYS B 80 1.355 -9.565 -7.419 1.00 1.78 H new ATOM 0 HZ1 LYS B 80 -0.979 -10.277 -7.200 1.00 2.05 H new ATOM 0 HZ2 LYS B 80 -0.312 -9.753 -5.729 1.00 2.05 H new ATOM 0 HZ3 LYS B 80 -1.380 -8.747 -6.583 1.00 2.05 H new ATOM 3088 N LEU B 81 3.430 -4.472 -2.730 1.00 0.65 N ATOM 3089 CA LEU B 81 4.585 -3.658 -2.369 1.00 0.67 C ATOM 3090 C LEU B 81 5.108 -4.093 -1.004 1.00 0.68 C ATOM 3091 O LEU B 81 6.316 -4.213 -0.798 1.00 0.72 O ATOM 3092 CB LEU B 81 4.210 -2.173 -2.340 1.00 0.67 C ATOM 3093 CG LEU B 81 5.141 -1.233 -3.122 1.00 0.78 C ATOM 3094 CD1 LEU B 81 6.590 -1.419 -2.693 1.00 1.02 C ATOM 3095 CD2 LEU B 81 5.000 -1.456 -4.620 1.00 0.97 C ATOM 0 H LEU B 81 2.562 -3.947 -2.837 1.00 0.65 H new ATOM 0 HA LEU B 81 5.364 -3.800 -3.118 1.00 0.67 H new ATOM 0 HB2 LEU B 81 3.200 -2.065 -2.735 1.00 0.67 H new ATOM 0 HB3 LEU B 81 4.182 -1.845 -1.301 1.00 0.67 H new ATOM 0 HG LEU B 81 4.846 -0.208 -2.896 1.00 0.78 H new ATOM 0 HD11 LEU B 81 7.228 -0.742 -3.262 1.00 1.02 H new ATOM 0 HD12 LEU B 81 6.686 -1.200 -1.630 1.00 1.02 H new ATOM 0 HD13 LEU B 81 6.896 -2.448 -2.880 1.00 1.02 H new ATOM 0 HD21 LEU B 81 5.668 -0.780 -5.153 1.00 0.97 H new ATOM 0 HD22 LEU B 81 5.260 -2.487 -4.860 1.00 0.97 H new ATOM 0 HD23 LEU B 81 3.971 -1.261 -4.922 1.00 0.97 H new ATOM 3107 N ILE B 82 4.183 -4.346 -0.085 1.00 0.68 N ATOM 3108 CA ILE B 82 4.535 -4.787 1.258 1.00 0.72 C ATOM 3109 C ILE B 82 5.232 -6.144 1.200 1.00 0.77 C ATOM 3110 O ILE B 82 6.205 -6.385 1.911 1.00 0.81 O ATOM 3111 CB ILE B 82 3.286 -4.873 2.167 1.00 0.72 C ATOM 3112 CG1 ILE B 82 2.539 -3.533 2.154 1.00 0.70 C ATOM 3113 CG2 ILE B 82 3.685 -5.258 3.586 1.00 0.78 C ATOM 3114 CD1 ILE B 82 1.401 -3.437 3.152 1.00 0.72 C ATOM 0 H ILE B 82 3.180 -4.253 -0.247 1.00 0.68 H new ATOM 0 HA ILE B 82 5.215 -4.050 1.686 1.00 0.72 H new ATOM 0 HB ILE B 82 2.620 -5.646 1.784 1.00 0.72 H new ATOM 0 HG12 ILE B 82 3.251 -2.733 2.356 1.00 0.70 H new ATOM 0 HG13 ILE B 82 2.143 -3.362 1.153 1.00 0.70 H new ATOM 0 HG21 ILE B 82 2.794 -5.314 4.212 1.00 0.78 H new ATOM 0 HG22 ILE B 82 4.181 -6.228 3.574 1.00 0.78 H new ATOM 0 HG23 ILE B 82 4.365 -4.508 3.989 1.00 0.78 H new ATOM 0 HD11 ILE B 82 0.930 -2.457 3.073 1.00 0.72 H new ATOM 0 HD12 ILE B 82 0.664 -4.212 2.940 1.00 0.72 H new ATOM 0 HD13 ILE B 82 1.790 -3.573 4.161 1.00 0.72 H new ATOM 3126 N GLU B 83 4.737 -7.017 0.326 1.00 0.78 N ATOM 3127 CA GLU B 83 5.316 -8.342 0.152 1.00 0.85 C ATOM 3128 C GLU B 83 6.709 -8.243 -0.473 1.00 0.87 C ATOM 3129 O GLU B 83 7.562 -9.106 -0.265 1.00 0.94 O ATOM 3130 CB GLU B 83 4.408 -9.210 -0.721 1.00 0.88 C ATOM 3131 CG GLU B 83 4.831 -10.669 -0.773 1.00 1.11 C ATOM 3132 CD GLU B 83 4.652 -11.381 0.555 1.00 1.73 C ATOM 3133 OE1 GLU B 83 5.587 -11.361 1.383 1.00 2.41 O ATOM 3134 OE2 GLU B 83 3.575 -11.979 0.772 1.00 2.25 O ATOM 0 H GLU B 83 3.934 -6.828 -0.273 1.00 0.78 H new ATOM 0 HA GLU B 83 5.408 -8.807 1.134 1.00 0.85 H new ATOM 0 HB2 GLU B 83 3.388 -9.149 -0.343 1.00 0.88 H new ATOM 0 HB3 GLU B 83 4.397 -8.807 -1.734 1.00 0.88 H new ATOM 0 HG2 GLU B 83 4.249 -11.184 -1.537 1.00 1.11 H new ATOM 0 HG3 GLU B 83 5.877 -10.729 -1.074 1.00 1.11 H new ATOM 3141 N THR B 84 6.938 -7.178 -1.233 1.00 0.83 N ATOM 3142 CA THR B 84 8.227 -6.958 -1.873 1.00 0.87 C ATOM 3143 C THR B 84 9.279 -6.604 -0.819 1.00 0.91 C ATOM 3144 O THR B 84 10.431 -7.044 -0.886 1.00 0.98 O ATOM 3145 CB THR B 84 8.140 -5.839 -2.932 1.00 0.84 C ATOM 3146 OG1 THR B 84 7.020 -6.075 -3.804 1.00 0.84 O ATOM 3147 CG2 THR B 84 9.415 -5.765 -3.761 1.00 0.87 C ATOM 0 H THR B 84 6.246 -6.453 -1.420 1.00 0.83 H new ATOM 0 HA THR B 84 8.518 -7.879 -2.378 1.00 0.87 H new ATOM 0 HB THR B 84 8.010 -4.892 -2.409 1.00 0.84 H new ATOM 0 HG1 THR B 84 6.186 -5.971 -3.301 1.00 0.84 H new ATOM 0 HG21 THR B 84 9.324 -4.968 -4.498 1.00 0.87 H new ATOM 0 HG22 THR B 84 10.263 -5.559 -3.107 1.00 0.87 H new ATOM 0 HG23 THR B 84 9.573 -6.715 -4.272 1.00 0.87 H new ATOM 3155 N LEU B 85 8.863 -5.815 0.169 1.00 0.90 N ATOM 3156 CA LEU B 85 9.747 -5.414 1.257 1.00 0.98 C ATOM 3157 C LEU B 85 9.943 -6.580 2.221 1.00 1.07 C ATOM 3158 O LEU B 85 10.892 -6.611 2.997 1.00 1.22 O ATOM 3159 CB LEU B 85 9.171 -4.203 1.997 1.00 0.97 C ATOM 3160 CG LEU B 85 9.441 -2.850 1.332 1.00 0.91 C ATOM 3161 CD1 LEU B 85 8.456 -1.804 1.832 1.00 1.03 C ATOM 3162 CD2 LEU B 85 10.875 -2.405 1.603 1.00 1.01 C ATOM 0 H LEU B 85 7.917 -5.441 0.237 1.00 0.90 H new ATOM 0 HA LEU B 85 10.714 -5.132 0.839 1.00 0.98 H new ATOM 0 HB2 LEU B 85 8.093 -4.334 2.094 1.00 0.97 H new ATOM 0 HB3 LEU B 85 9.582 -4.183 3.006 1.00 0.97 H new ATOM 0 HG LEU B 85 9.308 -2.960 0.256 1.00 0.91 H new ATOM 0 HD11 LEU B 85 8.663 -0.849 1.349 1.00 1.03 H new ATOM 0 HD12 LEU B 85 7.440 -2.118 1.594 1.00 1.03 H new ATOM 0 HD13 LEU B 85 8.559 -1.694 2.912 1.00 1.03 H new ATOM 0 HD21 LEU B 85 11.054 -1.442 1.125 1.00 1.01 H new ATOM 0 HD22 LEU B 85 11.030 -2.311 2.678 1.00 1.01 H new ATOM 0 HD23 LEU B 85 11.568 -3.144 1.200 1.00 1.01 H new ATOM 3174 N SER B 86 9.024 -7.533 2.166 1.00 1.08 N ATOM 3175 CA SER B 86 9.082 -8.711 3.010 1.00 1.20 C ATOM 3176 C SER B 86 10.120 -9.691 2.467 1.00 1.59 C ATOM 3177 O SER B 86 10.219 -9.898 1.253 1.00 2.11 O ATOM 3178 CB SER B 86 7.690 -9.358 3.092 1.00 1.48 C ATOM 3179 OG SER B 86 7.746 -10.773 3.002 1.00 1.78 O ATOM 0 H SER B 86 8.221 -7.509 1.537 1.00 1.08 H new ATOM 0 HA SER B 86 9.385 -8.426 4.017 1.00 1.20 H new ATOM 0 HB2 SER B 86 7.215 -9.075 4.031 1.00 1.48 H new ATOM 0 HB3 SER B 86 7.064 -8.970 2.289 1.00 1.48 H new ATOM 0 HG SER B 86 7.010 -11.094 2.440 1.00 1.78 H new