USER MOD reduce.3.24.130724 H: found=0, std=0, add=982, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 983 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 130 ASN : amide:sc= -2.7! C(o=-2.7!,f=-21!) USER MOD Set 1.2: A 133 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 56 ASN : amide:sc= -0.266 K(o=-0.04,f=-6.4!) USER MOD Set 2.2: A 122 THR OG1 : rot 119:sc= 0.226 USER MOD Set 3.1: A 83 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 85 TYR OH : rot -60:sc= 0.385 USER MOD Set 4.1: A 35 THR OG1 : rot 127:sc= 0.766 USER MOD Set 4.2: A 38 GLN : amide:sc= -9.91! C(o=-9.1!,f=-11!) USER MOD Single : A 9 LYS NZ :NH3+ -117:sc= -1.18 (180deg=-3.36!) USER MOD Single : A 11 LYS NZ :NH3+ -118:sc= 0 (180deg=-1.86) USER MOD Single : A 12 SER OG : rot 70:sc= 0.763 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -150:sc= -0.162 (180deg=-0.769) USER MOD Single : A 30 TYR OH : rot 30:sc= -2.86! USER MOD Single : A 40 ASN : amide:sc= -0.112 K(o=-0.11,f=-2!) USER MOD Single : A 44 SER OG : rot 180:sc= -0.0169 USER MOD Single : A 49 ASN : amide:sc= -1.35! X(o=-1.4!,f=-1.8) USER MOD Single : A 51 SER OG : rot -161:sc= -0.107 USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 SER OG : rot 180:sc= -0.46 USER MOD Single : A 62 HIS : no HD1:sc= -4.28! C(o=-4.3!,f=-6.2!) USER MOD Single : A 63 THR OG1 : rot 108:sc= 0.569 USER MOD Single : A 69 ASN : amide:sc= -1.61! K(o=-1.6!,f=-0.14) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -10.5! C(o=-11!,f=-22!) USER MOD Single : A 73 THR OG1 : rot 61:sc= 0.681 USER MOD Single : A 74 ASN : amide:sc= -4.28! C(o=-4.3!,f=-14!) USER MOD Single : A 76 LYS NZ :NH3+ 153:sc= 0 (180deg=-0.00495) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ -115:sc= -0.526 (180deg=-0.943) USER MOD Single : A 82 SER OG : rot -97:sc= -1.48 USER MOD Single : A 87 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.104) USER MOD Single : A 90 ASN : amide:sc= -1.32 X(o=-1.3,f=-1.6!) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -161:sc= -0.0356 (180deg=-0.359) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 154:sc= -0.105 (180deg=-0.788) USER MOD Single : A 97 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot -45:sc= 1 USER MOD Single : A 99 SER OG : rot 8:sc= 1.2 USER MOD Single : A 119 LYS NZ :NH3+ 151:sc= -0.355 (180deg=-0.535) USER MOD Single : A 120 GLN : amide:sc= -6.21! C(o=-6.2!,f=-8.6!) USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.574 USER MOD Single : A 126 CYS SG : rot -91:sc= -0.269 USER MOD Single : A 129 TYR OH : rot 145:sc= -0.633 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ -122:sc= -1.58 (180deg=-3.85!) USER MOD Single : A 140 LYS NZ :NH3+ -167:sc= -1.95 (180deg=-2.57!) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 100 N ILE A 7 12.748 10.434 0.017 1.00 0.00 N ATOM 101 CA ILE A 7 11.270 10.490 0.226 1.00 0.00 C ATOM 102 C ILE A 7 10.869 11.934 0.580 1.00 0.00 C ATOM 103 O ILE A 7 10.928 12.326 1.728 1.00 0.00 O ATOM 104 CB ILE A 7 10.881 9.575 1.395 1.00 0.00 C ATOM 105 CG1 ILE A 7 11.502 8.187 1.196 1.00 0.00 C ATOM 106 CG2 ILE A 7 9.354 9.445 1.460 1.00 0.00 C ATOM 107 CD1 ILE A 7 10.937 7.220 2.237 1.00 0.00 C ATOM 0 HA ILE A 7 10.763 10.166 -0.683 1.00 0.00 H new ATOM 0 HB ILE A 7 11.250 10.006 2.325 1.00 0.00 H new ATOM 0 HG12 ILE A 7 11.288 7.822 0.191 1.00 0.00 H new ATOM 0 HG13 ILE A 7 12.586 8.246 1.290 1.00 0.00 H new ATOM 0 HG21 ILE A 7 9.079 8.795 2.291 1.00 0.00 H new ATOM 0 HG22 ILE A 7 8.911 10.430 1.608 1.00 0.00 H new ATOM 0 HG23 ILE A 7 8.985 9.018 0.528 1.00 0.00 H new ATOM 0 HD11 ILE A 7 11.379 6.234 2.095 1.00 0.00 H new ATOM 0 HD12 ILE A 7 11.174 7.583 3.237 1.00 0.00 H new ATOM 0 HD13 ILE A 7 9.855 7.153 2.122 1.00 0.00 H new ATOM 119 N PRO A 8 10.462 12.724 -0.389 1.00 0.00 N ATOM 120 CA PRO A 8 10.047 14.140 -0.144 1.00 0.00 C ATOM 121 C PRO A 8 9.062 14.265 1.025 1.00 0.00 C ATOM 122 O PRO A 8 8.593 13.278 1.558 1.00 0.00 O ATOM 123 CB PRO A 8 9.388 14.556 -1.467 1.00 0.00 C ATOM 124 CG PRO A 8 10.054 13.708 -2.502 1.00 0.00 C ATOM 125 CD PRO A 8 10.354 12.371 -1.819 1.00 0.00 C ATOM 0 HA PRO A 8 10.890 14.771 0.136 1.00 0.00 H new ATOM 0 HB2 PRO A 8 8.312 14.384 -1.445 1.00 0.00 H new ATOM 0 HB3 PRO A 8 9.537 15.617 -1.668 1.00 0.00 H new ATOM 0 HG2 PRO A 8 9.407 13.568 -3.368 1.00 0.00 H new ATOM 0 HG3 PRO A 8 10.970 14.177 -2.861 1.00 0.00 H new ATOM 0 HD2 PRO A 8 9.560 11.645 -1.993 1.00 0.00 H new ATOM 0 HD3 PRO A 8 11.277 11.929 -2.193 1.00 0.00 H new ATOM 133 N LYS A 9 8.750 15.476 1.425 1.00 0.00 N ATOM 134 CA LYS A 9 7.796 15.692 2.562 1.00 0.00 C ATOM 135 C LYS A 9 6.564 16.446 2.059 1.00 0.00 C ATOM 136 O LYS A 9 5.669 16.765 2.817 1.00 0.00 O ATOM 137 CB LYS A 9 8.482 16.524 3.650 1.00 0.00 C ATOM 138 CG LYS A 9 9.160 17.741 3.014 1.00 0.00 C ATOM 139 CD LYS A 9 9.864 18.569 4.099 1.00 0.00 C ATOM 140 CE LYS A 9 8.835 19.165 5.075 1.00 0.00 C ATOM 141 NZ LYS A 9 8.570 18.194 6.174 1.00 0.00 N ATOM 0 H LYS A 9 9.118 16.331 1.009 1.00 0.00 H new ATOM 0 HA LYS A 9 7.495 14.727 2.970 1.00 0.00 H new ATOM 0 HB2 LYS A 9 7.750 16.848 4.390 1.00 0.00 H new ATOM 0 HB3 LYS A 9 9.219 15.917 4.175 1.00 0.00 H new ATOM 0 HG2 LYS A 9 9.882 17.416 2.265 1.00 0.00 H new ATOM 0 HG3 LYS A 9 8.420 18.353 2.499 1.00 0.00 H new ATOM 0 HD2 LYS A 9 10.569 17.941 4.644 1.00 0.00 H new ATOM 0 HD3 LYS A 9 10.441 19.370 3.636 1.00 0.00 H new ATOM 0 HE2 LYS A 9 9.209 20.103 5.486 1.00 0.00 H new ATOM 0 HE3 LYS A 9 7.909 19.395 4.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 7.573 17.901 6.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 9.180 17.360 6.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 8.773 18.643 7.090 1.00 0.00 H new ATOM 155 N ASP A 10 6.506 16.734 0.788 1.00 0.00 N ATOM 156 CA ASP A 10 5.327 17.466 0.246 1.00 0.00 C ATOM 157 C ASP A 10 4.151 16.498 0.106 1.00 0.00 C ATOM 158 O ASP A 10 4.113 15.671 -0.783 1.00 0.00 O ATOM 159 CB ASP A 10 5.672 18.056 -1.123 1.00 0.00 C ATOM 160 CG ASP A 10 4.528 18.955 -1.594 1.00 0.00 C ATOM 161 OD1 ASP A 10 3.562 19.085 -0.860 1.00 0.00 O ATOM 162 OD2 ASP A 10 4.637 19.496 -2.682 1.00 0.00 O ATOM 0 H ASP A 10 7.222 16.495 0.103 1.00 0.00 H new ATOM 0 HA ASP A 10 5.056 18.273 0.926 1.00 0.00 H new ATOM 0 HB2 ASP A 10 6.597 18.629 -1.061 1.00 0.00 H new ATOM 0 HB3 ASP A 10 5.840 17.256 -1.844 1.00 0.00 H new ATOM 167 N LYS A 11 3.195 16.592 0.986 1.00 0.00 N ATOM 168 CA LYS A 11 2.019 15.681 0.927 1.00 0.00 C ATOM 169 C LYS A 11 1.278 15.844 -0.405 1.00 0.00 C ATOM 170 O LYS A 11 0.245 15.240 -0.619 1.00 0.00 O ATOM 171 CB LYS A 11 1.077 16.016 2.086 1.00 0.00 C ATOM 172 CG LYS A 11 1.894 16.235 3.386 1.00 0.00 C ATOM 173 CD LYS A 11 1.185 15.578 4.575 1.00 0.00 C ATOM 174 CE LYS A 11 2.046 15.732 5.830 1.00 0.00 C ATOM 175 NZ LYS A 11 1.256 15.329 7.027 1.00 0.00 N ATOM 0 H LYS A 11 3.178 17.267 1.750 1.00 0.00 H new ATOM 0 HA LYS A 11 2.359 14.649 1.006 1.00 0.00 H new ATOM 0 HB2 LYS A 11 0.503 16.913 1.852 1.00 0.00 H new ATOM 0 HB3 LYS A 11 0.360 15.207 2.229 1.00 0.00 H new ATOM 0 HG2 LYS A 11 2.893 15.814 3.271 1.00 0.00 H new ATOM 0 HG3 LYS A 11 2.017 17.302 3.571 1.00 0.00 H new ATOM 0 HD2 LYS A 11 0.210 16.039 4.731 1.00 0.00 H new ATOM 0 HD3 LYS A 11 1.009 14.522 4.369 1.00 0.00 H new ATOM 0 HE2 LYS A 11 2.941 15.116 5.748 1.00 0.00 H new ATOM 0 HE3 LYS A 11 2.378 16.765 5.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 1.155 16.143 7.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 0.314 15.004 6.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 1.747 14.558 7.523 1.00 0.00 H new ATOM 189 N SER A 12 1.789 16.657 -1.299 1.00 0.00 N ATOM 190 CA SER A 12 1.111 16.865 -2.621 1.00 0.00 C ATOM 191 C SER A 12 2.119 16.674 -3.757 1.00 0.00 C ATOM 192 O SER A 12 2.106 17.394 -4.736 1.00 0.00 O ATOM 193 CB SER A 12 0.550 18.286 -2.681 1.00 0.00 C ATOM 194 OG SER A 12 1.606 19.196 -2.955 1.00 0.00 O ATOM 0 H SER A 12 2.650 17.188 -1.170 1.00 0.00 H new ATOM 0 HA SER A 12 0.303 16.141 -2.729 1.00 0.00 H new ATOM 0 HB2 SER A 12 -0.215 18.355 -3.454 1.00 0.00 H new ATOM 0 HB3 SER A 12 0.071 18.541 -1.735 1.00 0.00 H new ATOM 0 HG SER A 12 1.915 19.071 -3.876 1.00 0.00 H new ATOM 200 N LYS A 13 2.990 15.706 -3.641 1.00 0.00 N ATOM 201 CA LYS A 13 3.994 15.467 -4.722 1.00 0.00 C ATOM 202 C LYS A 13 4.356 13.980 -4.751 1.00 0.00 C ATOM 203 O LYS A 13 4.310 13.300 -3.745 1.00 0.00 O ATOM 204 CB LYS A 13 5.252 16.300 -4.455 1.00 0.00 C ATOM 205 CG LYS A 13 6.105 16.386 -5.728 1.00 0.00 C ATOM 206 CD LYS A 13 7.179 17.464 -5.556 1.00 0.00 C ATOM 207 CE LYS A 13 8.064 17.132 -4.352 1.00 0.00 C ATOM 208 NZ LYS A 13 9.338 17.899 -4.449 1.00 0.00 N ATOM 0 H LYS A 13 3.050 15.071 -2.845 1.00 0.00 H new ATOM 0 HA LYS A 13 3.572 15.760 -5.683 1.00 0.00 H new ATOM 0 HB2 LYS A 13 4.972 17.301 -4.127 1.00 0.00 H new ATOM 0 HB3 LYS A 13 5.832 15.850 -3.649 1.00 0.00 H new ATOM 0 HG2 LYS A 13 6.572 15.422 -5.930 1.00 0.00 H new ATOM 0 HG3 LYS A 13 5.474 16.621 -6.585 1.00 0.00 H new ATOM 0 HD2 LYS A 13 7.787 17.530 -6.458 1.00 0.00 H new ATOM 0 HD3 LYS A 13 6.710 18.438 -5.416 1.00 0.00 H new ATOM 0 HE2 LYS A 13 7.546 17.381 -3.426 1.00 0.00 H new ATOM 0 HE3 LYS A 13 8.272 16.062 -4.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 9.941 17.675 -3.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 9.833 17.640 -5.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 9.130 18.918 -4.457 1.00 0.00 H new ATOM 222 N VAL A 14 4.707 13.469 -5.898 1.00 0.00 N ATOM 223 CA VAL A 14 5.063 12.026 -5.994 1.00 0.00 C ATOM 224 C VAL A 14 6.269 11.709 -5.108 1.00 0.00 C ATOM 225 O VAL A 14 7.072 12.563 -4.786 1.00 0.00 O ATOM 226 CB VAL A 14 5.407 11.670 -7.442 1.00 0.00 C ATOM 227 CG1 VAL A 14 5.886 10.215 -7.511 1.00 0.00 C ATOM 228 CG2 VAL A 14 4.168 11.834 -8.321 1.00 0.00 C ATOM 0 H VAL A 14 4.763 13.989 -6.774 1.00 0.00 H new ATOM 0 HA VAL A 14 4.207 11.441 -5.659 1.00 0.00 H new ATOM 0 HB VAL A 14 6.195 12.334 -7.797 1.00 0.00 H new ATOM 0 HG11 VAL A 14 6.131 9.961 -8.542 1.00 0.00 H new ATOM 0 HG12 VAL A 14 6.772 10.093 -6.887 1.00 0.00 H new ATOM 0 HG13 VAL A 14 5.096 9.555 -7.153 1.00 0.00 H new ATOM 0 HG21 VAL A 14 4.417 11.580 -9.351 1.00 0.00 H new ATOM 0 HG22 VAL A 14 3.379 11.172 -7.964 1.00 0.00 H new ATOM 0 HG23 VAL A 14 3.824 12.867 -8.275 1.00 0.00 H new ATOM 238 N ALA A 15 6.399 10.466 -4.741 1.00 0.00 N ATOM 239 CA ALA A 15 7.547 10.017 -3.902 1.00 0.00 C ATOM 240 C ALA A 15 7.937 8.608 -4.361 1.00 0.00 C ATOM 241 O ALA A 15 9.083 8.211 -4.289 1.00 0.00 O ATOM 242 CB ALA A 15 7.135 9.996 -2.423 1.00 0.00 C ATOM 0 H ALA A 15 5.744 9.725 -4.992 1.00 0.00 H new ATOM 0 HA ALA A 15 8.391 10.698 -4.011 1.00 0.00 H new ATOM 0 HB1 ALA A 15 7.978 9.667 -1.815 1.00 0.00 H new ATOM 0 HB2 ALA A 15 6.834 10.997 -2.115 1.00 0.00 H new ATOM 0 HB3 ALA A 15 6.300 9.309 -2.288 1.00 0.00 H new ATOM 248 N GLY A 16 6.982 7.855 -4.844 1.00 0.00 N ATOM 249 CA GLY A 16 7.274 6.477 -5.324 1.00 0.00 C ATOM 250 C GLY A 16 6.240 6.080 -6.379 1.00 0.00 C ATOM 251 O GLY A 16 5.372 6.854 -6.735 1.00 0.00 O ATOM 0 H GLY A 16 6.006 8.141 -4.926 1.00 0.00 H new ATOM 0 HA2 GLY A 16 8.278 6.432 -5.747 1.00 0.00 H new ATOM 0 HA3 GLY A 16 7.247 5.776 -4.490 1.00 0.00 H new ATOM 255 N TYR A 17 6.326 4.877 -6.885 1.00 0.00 N ATOM 256 CA TYR A 17 5.356 4.424 -7.925 1.00 0.00 C ATOM 257 C TYR A 17 5.130 2.918 -7.772 1.00 0.00 C ATOM 258 O TYR A 17 6.046 2.130 -7.895 1.00 0.00 O ATOM 259 CB TYR A 17 5.939 4.728 -9.327 1.00 0.00 C ATOM 260 CG TYR A 17 5.336 5.997 -9.902 1.00 0.00 C ATOM 261 CD1 TYR A 17 3.988 6.021 -10.274 1.00 0.00 C ATOM 262 CD2 TYR A 17 6.129 7.141 -10.075 1.00 0.00 C ATOM 263 CE1 TYR A 17 3.431 7.184 -10.818 1.00 0.00 C ATOM 264 CE2 TYR A 17 5.572 8.305 -10.618 1.00 0.00 C ATOM 265 CZ TYR A 17 4.222 8.325 -10.989 1.00 0.00 C ATOM 266 OH TYR A 17 3.672 9.471 -11.525 1.00 0.00 O ATOM 0 H TYR A 17 7.029 4.187 -6.621 1.00 0.00 H new ATOM 0 HA TYR A 17 4.407 4.947 -7.808 1.00 0.00 H new ATOM 0 HB2 TYR A 17 7.022 4.833 -9.260 1.00 0.00 H new ATOM 0 HB3 TYR A 17 5.741 3.891 -9.997 1.00 0.00 H new ATOM 0 HD1 TYR A 17 3.376 5.141 -10.141 1.00 0.00 H new ATOM 0 HD2 TYR A 17 7.170 7.124 -9.789 1.00 0.00 H new ATOM 0 HE1 TYR A 17 2.390 7.201 -11.106 1.00 0.00 H new ATOM 0 HE2 TYR A 17 6.183 9.186 -10.750 1.00 0.00 H new ATOM 0 HH TYR A 17 4.357 10.170 -11.574 1.00 0.00 H new ATOM 276 N ILE A 18 3.910 2.509 -7.527 1.00 0.00 N ATOM 277 CA ILE A 18 3.629 1.048 -7.393 1.00 0.00 C ATOM 278 C ILE A 18 3.176 0.539 -8.759 1.00 0.00 C ATOM 279 O ILE A 18 2.515 1.246 -9.491 1.00 0.00 O ATOM 280 CB ILE A 18 2.526 0.830 -6.350 1.00 0.00 C ATOM 281 CG1 ILE A 18 2.344 -0.672 -6.093 1.00 0.00 C ATOM 282 CG2 ILE A 18 1.209 1.419 -6.859 1.00 0.00 C ATOM 283 CD1 ILE A 18 3.597 -1.262 -5.427 1.00 0.00 C ATOM 0 H ILE A 18 3.101 3.120 -7.415 1.00 0.00 H new ATOM 0 HA ILE A 18 4.518 0.508 -7.066 1.00 0.00 H new ATOM 0 HB ILE A 18 2.812 1.326 -5.422 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.475 -0.835 -5.455 1.00 0.00 H new ATOM 0 HG13 ILE A 18 2.149 -1.187 -7.034 1.00 0.00 H new ATOM 0 HG21 ILE A 18 0.428 1.262 -6.115 1.00 0.00 H new ATOM 0 HG22 ILE A 18 1.332 2.488 -7.035 1.00 0.00 H new ATOM 0 HG23 ILE A 18 0.927 0.928 -7.790 1.00 0.00 H new ATOM 0 HD11 ILE A 18 3.449 -2.328 -5.253 1.00 0.00 H new ATOM 0 HD12 ILE A 18 4.458 -1.117 -6.079 1.00 0.00 H new ATOM 0 HD13 ILE A 18 3.774 -0.760 -4.476 1.00 0.00 H new ATOM 295 N GLU A 19 3.540 -0.661 -9.134 1.00 0.00 N ATOM 296 CA GLU A 19 3.133 -1.163 -10.484 1.00 0.00 C ATOM 297 C GLU A 19 2.908 -2.675 -10.459 1.00 0.00 C ATOM 298 O GLU A 19 3.719 -3.432 -9.964 1.00 0.00 O ATOM 299 CB GLU A 19 4.241 -0.842 -11.486 1.00 0.00 C ATOM 300 CG GLU A 19 3.805 -1.275 -12.887 1.00 0.00 C ATOM 301 CD GLU A 19 4.797 -0.737 -13.919 1.00 0.00 C ATOM 302 OE1 GLU A 19 5.836 -0.244 -13.512 1.00 0.00 O ATOM 303 OE2 GLU A 19 4.501 -0.827 -15.099 1.00 0.00 O ATOM 0 H GLU A 19 4.094 -1.308 -8.573 1.00 0.00 H new ATOM 0 HA GLU A 19 2.201 -0.677 -10.772 1.00 0.00 H new ATOM 0 HB2 GLU A 19 4.457 0.226 -11.475 1.00 0.00 H new ATOM 0 HB3 GLU A 19 5.160 -1.356 -11.205 1.00 0.00 H new ATOM 0 HG2 GLU A 19 3.758 -2.362 -12.945 1.00 0.00 H new ATOM 0 HG3 GLU A 19 2.804 -0.901 -13.100 1.00 0.00 H new ATOM 310 N ILE A 20 1.807 -3.114 -11.016 1.00 0.00 N ATOM 311 CA ILE A 20 1.497 -4.571 -11.067 1.00 0.00 C ATOM 312 C ILE A 20 0.749 -4.848 -12.390 1.00 0.00 C ATOM 313 O ILE A 20 -0.270 -4.238 -12.649 1.00 0.00 O ATOM 314 CB ILE A 20 0.602 -4.940 -9.869 1.00 0.00 C ATOM 315 CG1 ILE A 20 1.466 -5.036 -8.605 1.00 0.00 C ATOM 316 CG2 ILE A 20 -0.083 -6.291 -10.126 1.00 0.00 C ATOM 317 CD1 ILE A 20 0.584 -5.243 -7.371 1.00 0.00 C ATOM 0 H ILE A 20 1.101 -2.514 -11.443 1.00 0.00 H new ATOM 0 HA ILE A 20 2.409 -5.166 -11.020 1.00 0.00 H new ATOM 0 HB ILE A 20 -0.161 -4.173 -9.737 1.00 0.00 H new ATOM 0 HG12 ILE A 20 2.170 -5.863 -8.700 1.00 0.00 H new ATOM 0 HG13 ILE A 20 2.056 -4.127 -8.490 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.715 -6.546 -9.275 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -0.695 -6.223 -11.025 1.00 0.00 H new ATOM 0 HG23 ILE A 20 0.674 -7.063 -10.260 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.212 -5.309 -6.482 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -0.102 -4.402 -7.269 1.00 0.00 H new ATOM 0 HD13 ILE A 20 0.014 -6.165 -7.482 1.00 0.00 H new ATOM 329 N PRO A 21 1.229 -5.744 -13.230 1.00 0.00 N ATOM 330 CA PRO A 21 0.552 -6.049 -14.524 1.00 0.00 C ATOM 331 C PRO A 21 -0.672 -6.950 -14.330 1.00 0.00 C ATOM 332 O PRO A 21 -1.693 -6.774 -14.966 1.00 0.00 O ATOM 333 CB PRO A 21 1.640 -6.765 -15.331 1.00 0.00 C ATOM 334 CG PRO A 21 2.474 -7.459 -14.303 1.00 0.00 C ATOM 335 CD PRO A 21 2.448 -6.564 -13.056 1.00 0.00 C ATOM 0 HA PRO A 21 0.168 -5.155 -15.015 1.00 0.00 H new ATOM 0 HB2 PRO A 21 1.208 -7.475 -16.037 1.00 0.00 H new ATOM 0 HB3 PRO A 21 2.233 -6.058 -15.912 1.00 0.00 H new ATOM 0 HG2 PRO A 21 2.074 -8.448 -14.081 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.494 -7.600 -14.660 1.00 0.00 H new ATOM 0 HD2 PRO A 21 2.404 -7.155 -12.141 1.00 0.00 H new ATOM 0 HD3 PRO A 21 3.341 -5.943 -12.992 1.00 0.00 H new ATOM 343 N ASP A 22 -0.576 -7.911 -13.455 1.00 0.00 N ATOM 344 CA ASP A 22 -1.730 -8.820 -13.217 1.00 0.00 C ATOM 345 C ASP A 22 -2.985 -7.990 -12.945 1.00 0.00 C ATOM 346 O ASP A 22 -4.094 -8.450 -13.129 1.00 0.00 O ATOM 347 CB ASP A 22 -1.432 -9.713 -12.010 1.00 0.00 C ATOM 348 CG ASP A 22 -0.203 -10.575 -12.303 1.00 0.00 C ATOM 349 OD1 ASP A 22 0.880 -10.020 -12.384 1.00 0.00 O ATOM 350 OD2 ASP A 22 -0.367 -11.776 -12.441 1.00 0.00 O ATOM 0 H ASP A 22 0.253 -8.106 -12.894 1.00 0.00 H new ATOM 0 HA ASP A 22 -1.893 -9.442 -14.097 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -1.257 -9.100 -11.126 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -2.291 -10.348 -11.793 1.00 0.00 H new ATOM 355 N ALA A 23 -2.813 -6.768 -12.501 1.00 0.00 N ATOM 356 CA ALA A 23 -3.985 -5.885 -12.201 1.00 0.00 C ATOM 357 C ALA A 23 -3.821 -4.555 -12.937 1.00 0.00 C ATOM 358 O ALA A 23 -4.616 -3.650 -12.790 1.00 0.00 O ATOM 359 CB ALA A 23 -4.037 -5.637 -10.697 1.00 0.00 C ATOM 0 H ALA A 23 -1.902 -6.341 -12.332 1.00 0.00 H new ATOM 0 HA ALA A 23 -4.908 -6.363 -12.529 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -4.886 -4.995 -10.463 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -4.146 -6.588 -10.175 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -3.116 -5.151 -10.376 1.00 0.00 H new ATOM 365 N ASP A 24 -2.794 -4.446 -13.734 1.00 0.00 N ATOM 366 CA ASP A 24 -2.540 -3.195 -14.510 1.00 0.00 C ATOM 367 C ASP A 24 -2.538 -1.959 -13.595 1.00 0.00 C ATOM 368 O ASP A 24 -2.968 -0.892 -13.983 1.00 0.00 O ATOM 369 CB ASP A 24 -3.589 -3.045 -15.629 1.00 0.00 C ATOM 370 CG ASP A 24 -4.920 -2.522 -15.076 1.00 0.00 C ATOM 371 OD1 ASP A 24 -5.057 -1.317 -14.945 1.00 0.00 O ATOM 372 OD2 ASP A 24 -5.786 -3.339 -14.805 1.00 0.00 O ATOM 0 H ASP A 24 -2.106 -5.184 -13.884 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.551 -3.269 -14.962 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -3.216 -2.362 -16.392 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -3.747 -4.008 -16.114 1.00 0.00 H new ATOM 377 N ILE A 25 -2.014 -2.076 -12.398 1.00 0.00 N ATOM 378 CA ILE A 25 -1.946 -0.883 -11.495 1.00 0.00 C ATOM 379 C ILE A 25 -0.659 -0.118 -11.814 1.00 0.00 C ATOM 380 O ILE A 25 0.354 -0.689 -12.161 1.00 0.00 O ATOM 381 CB ILE A 25 -1.966 -1.326 -10.003 1.00 0.00 C ATOM 382 CG1 ILE A 25 -3.409 -1.337 -9.466 1.00 0.00 C ATOM 383 CG2 ILE A 25 -1.134 -0.378 -9.129 1.00 0.00 C ATOM 384 CD1 ILE A 25 -4.289 -2.277 -10.288 1.00 0.00 C ATOM 0 H ILE A 25 -1.633 -2.939 -12.009 1.00 0.00 H new ATOM 0 HA ILE A 25 -2.811 -0.240 -11.658 1.00 0.00 H new ATOM 0 HB ILE A 25 -1.538 -2.328 -9.958 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -3.411 -1.651 -8.422 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -3.820 -0.328 -9.496 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -1.168 -0.714 -8.093 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -0.101 -0.376 -9.476 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -1.541 0.631 -9.196 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -5.303 -2.267 -9.889 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -4.304 -1.946 -11.326 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -3.888 -3.289 -10.236 1.00 0.00 H new ATOM 396 N LYS A 26 -0.715 1.171 -11.699 1.00 0.00 N ATOM 397 CA LYS A 26 0.474 2.024 -11.980 1.00 0.00 C ATOM 398 C LYS A 26 0.169 3.413 -11.431 1.00 0.00 C ATOM 399 O LYS A 26 -0.297 4.278 -12.145 1.00 0.00 O ATOM 400 CB LYS A 26 0.718 2.093 -13.492 1.00 0.00 C ATOM 401 CG LYS A 26 -0.622 2.140 -14.228 1.00 0.00 C ATOM 402 CD LYS A 26 -0.391 2.543 -15.685 1.00 0.00 C ATOM 403 CE LYS A 26 -1.736 2.627 -16.410 1.00 0.00 C ATOM 404 NZ LYS A 26 -2.501 1.368 -16.185 1.00 0.00 N ATOM 0 H LYS A 26 -1.549 1.685 -11.417 1.00 0.00 H new ATOM 0 HA LYS A 26 1.370 1.614 -11.513 1.00 0.00 H new ATOM 0 HB2 LYS A 26 1.309 2.976 -13.735 1.00 0.00 H new ATOM 0 HB3 LYS A 26 1.293 1.226 -13.817 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.108 1.166 -14.182 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -1.290 2.853 -13.744 1.00 0.00 H new ATOM 0 HD2 LYS A 26 0.120 3.505 -15.731 1.00 0.00 H new ATOM 0 HD3 LYS A 26 0.255 1.815 -16.177 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -2.306 3.481 -16.044 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -1.577 2.783 -17.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -3.113 1.182 -17.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -1.838 0.576 -16.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -3.087 1.466 -15.331 1.00 0.00 H new ATOM 418 N GLU A 27 0.368 3.618 -10.152 1.00 0.00 N ATOM 419 CA GLU A 27 0.019 4.932 -9.539 1.00 0.00 C ATOM 420 C GLU A 27 1.086 5.387 -8.523 1.00 0.00 C ATOM 421 O GLU A 27 1.811 4.580 -7.981 1.00 0.00 O ATOM 422 CB GLU A 27 -1.305 4.723 -8.809 1.00 0.00 C ATOM 423 CG GLU A 27 -2.475 4.550 -9.825 1.00 0.00 C ATOM 424 CD GLU A 27 -2.956 3.090 -9.849 1.00 0.00 C ATOM 425 OE1 GLU A 27 -3.044 2.496 -8.789 1.00 0.00 O ATOM 426 OE2 GLU A 27 -3.228 2.597 -10.931 1.00 0.00 O ATOM 0 H GLU A 27 0.758 2.930 -9.508 1.00 0.00 H new ATOM 0 HA GLU A 27 -0.043 5.700 -10.310 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -1.238 3.842 -8.170 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -1.505 5.574 -8.158 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -3.301 5.207 -9.553 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -2.147 4.847 -10.821 1.00 0.00 H new ATOM 433 N PRO A 28 1.176 6.682 -8.254 1.00 0.00 N ATOM 434 CA PRO A 28 2.160 7.240 -7.277 1.00 0.00 C ATOM 435 C PRO A 28 1.632 7.272 -5.832 1.00 0.00 C ATOM 436 O PRO A 28 0.447 7.161 -5.585 1.00 0.00 O ATOM 437 CB PRO A 28 2.350 8.663 -7.788 1.00 0.00 C ATOM 438 CG PRO A 28 0.989 9.054 -8.262 1.00 0.00 C ATOM 439 CD PRO A 28 0.367 7.776 -8.851 1.00 0.00 C ATOM 0 HA PRO A 28 3.067 6.638 -7.225 1.00 0.00 H new ATOM 0 HB2 PRO A 28 2.706 9.327 -7.000 1.00 0.00 H new ATOM 0 HB3 PRO A 28 3.082 8.704 -8.595 1.00 0.00 H new ATOM 0 HG2 PRO A 28 0.385 9.440 -7.441 1.00 0.00 H new ATOM 0 HG3 PRO A 28 1.048 9.842 -9.013 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.686 7.685 -8.586 1.00 0.00 H new ATOM 0 HD3 PRO A 28 0.424 7.768 -9.939 1.00 0.00 H new ATOM 447 N VAL A 29 2.520 7.446 -4.884 1.00 0.00 N ATOM 448 CA VAL A 29 2.119 7.519 -3.440 1.00 0.00 C ATOM 449 C VAL A 29 2.761 8.769 -2.815 1.00 0.00 C ATOM 450 O VAL A 29 3.945 8.999 -2.955 1.00 0.00 O ATOM 451 CB VAL A 29 2.621 6.265 -2.711 1.00 0.00 C ATOM 452 CG1 VAL A 29 1.679 5.092 -2.992 1.00 0.00 C ATOM 453 CG2 VAL A 29 4.026 5.914 -3.205 1.00 0.00 C ATOM 0 H VAL A 29 3.522 7.542 -5.050 1.00 0.00 H new ATOM 0 HA VAL A 29 1.034 7.576 -3.353 1.00 0.00 H new ATOM 0 HB VAL A 29 2.648 6.460 -1.639 1.00 0.00 H new ATOM 0 HG11 VAL A 29 2.039 4.204 -2.473 1.00 0.00 H new ATOM 0 HG12 VAL A 29 0.677 5.337 -2.640 1.00 0.00 H new ATOM 0 HG13 VAL A 29 1.649 4.898 -4.064 1.00 0.00 H new ATOM 0 HG21 VAL A 29 4.382 5.023 -2.687 1.00 0.00 H new ATOM 0 HG22 VAL A 29 3.997 5.723 -4.278 1.00 0.00 H new ATOM 0 HG23 VAL A 29 4.701 6.746 -3.003 1.00 0.00 H new ATOM 463 N TYR A 30 1.992 9.587 -2.137 1.00 0.00 N ATOM 464 CA TYR A 30 2.574 10.825 -1.522 1.00 0.00 C ATOM 465 C TYR A 30 3.121 10.513 -0.114 1.00 0.00 C ATOM 466 O TYR A 30 2.623 9.629 0.562 1.00 0.00 O ATOM 467 CB TYR A 30 1.482 11.907 -1.402 1.00 0.00 C ATOM 468 CG TYR A 30 0.497 11.781 -2.543 1.00 0.00 C ATOM 469 CD1 TYR A 30 0.946 11.863 -3.864 1.00 0.00 C ATOM 470 CD2 TYR A 30 -0.866 11.600 -2.275 1.00 0.00 C ATOM 471 CE1 TYR A 30 0.033 11.763 -4.918 1.00 0.00 C ATOM 472 CE2 TYR A 30 -1.780 11.498 -3.328 1.00 0.00 C ATOM 473 CZ TYR A 30 -1.331 11.580 -4.652 1.00 0.00 C ATOM 474 OH TYR A 30 -2.228 11.483 -5.695 1.00 0.00 O ATOM 0 H TYR A 30 0.993 9.454 -1.983 1.00 0.00 H new ATOM 0 HA TYR A 30 3.385 11.181 -2.157 1.00 0.00 H new ATOM 0 HB2 TYR A 30 0.962 11.805 -0.450 1.00 0.00 H new ATOM 0 HB3 TYR A 30 1.938 12.897 -1.412 1.00 0.00 H new ATOM 0 HD1 TYR A 30 1.997 12.003 -4.070 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -1.211 11.539 -1.253 1.00 0.00 H new ATOM 0 HE1 TYR A 30 0.379 11.827 -5.939 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -2.830 11.356 -3.121 1.00 0.00 H new ATOM 0 HH TYR A 30 -1.782 11.091 -6.475 1.00 0.00 H new ATOM 484 N PRO A 31 4.113 11.251 0.341 1.00 0.00 N ATOM 485 CA PRO A 31 4.697 11.062 1.702 1.00 0.00 C ATOM 486 C PRO A 31 3.814 11.690 2.781 1.00 0.00 C ATOM 487 O PRO A 31 3.867 12.881 3.021 1.00 0.00 O ATOM 488 CB PRO A 31 6.031 11.799 1.609 1.00 0.00 C ATOM 489 CG PRO A 31 5.759 12.918 0.666 1.00 0.00 C ATOM 490 CD PRO A 31 4.807 12.338 -0.382 1.00 0.00 C ATOM 0 HA PRO A 31 4.795 10.012 1.977 1.00 0.00 H new ATOM 0 HB2 PRO A 31 6.352 12.167 2.583 1.00 0.00 H new ATOM 0 HB3 PRO A 31 6.822 11.147 1.238 1.00 0.00 H new ATOM 0 HG2 PRO A 31 5.308 13.766 1.181 1.00 0.00 H new ATOM 0 HG3 PRO A 31 6.679 13.277 0.206 1.00 0.00 H new ATOM 0 HD2 PRO A 31 4.106 13.089 -0.746 1.00 0.00 H new ATOM 0 HD3 PRO A 31 5.348 11.961 -1.250 1.00 0.00 H new ATOM 498 N GLY A 32 2.998 10.911 3.429 1.00 0.00 N ATOM 499 CA GLY A 32 2.119 11.491 4.479 1.00 0.00 C ATOM 500 C GLY A 32 1.229 10.408 5.083 1.00 0.00 C ATOM 501 O GLY A 32 1.305 9.252 4.719 1.00 0.00 O ATOM 0 H GLY A 32 2.901 9.907 3.280 1.00 0.00 H new ATOM 0 HA2 GLY A 32 2.727 11.949 5.259 1.00 0.00 H new ATOM 0 HA3 GLY A 32 1.502 12.281 4.051 1.00 0.00 H new ATOM 505 N PRO A 33 0.380 10.794 5.998 1.00 0.00 N ATOM 506 CA PRO A 33 -0.560 9.862 6.669 1.00 0.00 C ATOM 507 C PRO A 33 -1.781 9.593 5.795 1.00 0.00 C ATOM 508 O PRO A 33 -2.522 10.493 5.467 1.00 0.00 O ATOM 509 CB PRO A 33 -0.946 10.613 7.946 1.00 0.00 C ATOM 510 CG PRO A 33 -0.867 12.062 7.574 1.00 0.00 C ATOM 511 CD PRO A 33 0.222 12.175 6.492 1.00 0.00 C ATOM 0 HA PRO A 33 -0.124 8.883 6.867 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -1.949 10.343 8.276 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -0.267 10.377 8.765 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -1.826 12.419 7.198 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -0.617 12.673 8.442 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -0.078 12.853 5.693 1.00 0.00 H new ATOM 0 HD3 PRO A 33 1.155 12.561 6.903 1.00 0.00 H new ATOM 519 N ALA A 34 -1.978 8.365 5.403 1.00 0.00 N ATOM 520 CA ALA A 34 -3.147 8.033 4.529 1.00 0.00 C ATOM 521 C ALA A 34 -4.411 8.737 5.037 1.00 0.00 C ATOM 522 O ALA A 34 -5.165 8.193 5.819 1.00 0.00 O ATOM 523 CB ALA A 34 -3.375 6.521 4.524 1.00 0.00 C ATOM 0 H ALA A 34 -1.382 7.574 5.648 1.00 0.00 H new ATOM 0 HA ALA A 34 -2.933 8.375 3.516 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -4.227 6.284 3.887 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -2.485 6.020 4.142 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -3.576 6.180 5.540 1.00 0.00 H new ATOM 529 N THR A 35 -4.641 9.944 4.587 1.00 0.00 N ATOM 530 CA THR A 35 -5.851 10.713 5.016 1.00 0.00 C ATOM 531 C THR A 35 -6.837 10.772 3.839 1.00 0.00 C ATOM 532 O THR A 35 -6.438 10.691 2.695 1.00 0.00 O ATOM 533 CB THR A 35 -5.422 12.135 5.406 1.00 0.00 C ATOM 534 OG1 THR A 35 -4.405 12.576 4.516 1.00 0.00 O ATOM 535 CG2 THR A 35 -4.880 12.141 6.838 1.00 0.00 C ATOM 0 H THR A 35 -4.034 10.437 3.932 1.00 0.00 H new ATOM 0 HA THR A 35 -6.328 10.231 5.870 1.00 0.00 H new ATOM 0 HB THR A 35 -6.282 12.801 5.346 1.00 0.00 H new ATOM 0 HG1 THR A 35 -4.659 13.441 4.131 1.00 0.00 H new ATOM 0 HG21 THR A 35 -4.577 13.153 7.108 1.00 0.00 H new ATOM 0 HG22 THR A 35 -5.657 11.799 7.522 1.00 0.00 H new ATOM 0 HG23 THR A 35 -4.020 11.475 6.904 1.00 0.00 H new ATOM 543 N PRO A 36 -8.115 10.909 4.107 1.00 0.00 N ATOM 544 CA PRO A 36 -9.152 10.971 3.032 1.00 0.00 C ATOM 545 C PRO A 36 -9.027 12.238 2.170 1.00 0.00 C ATOM 546 O PRO A 36 -9.166 12.190 0.964 1.00 0.00 O ATOM 547 CB PRO A 36 -10.485 10.954 3.804 1.00 0.00 C ATOM 548 CG PRO A 36 -10.148 11.471 5.166 1.00 0.00 C ATOM 549 CD PRO A 36 -8.717 11.014 5.449 1.00 0.00 C ATOM 0 HA PRO A 36 -9.055 10.146 2.327 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -11.232 11.581 3.317 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -10.899 9.947 3.855 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -10.224 12.558 5.201 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -10.838 11.079 5.914 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -8.183 11.731 6.073 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -8.697 10.058 5.973 1.00 0.00 H new ATOM 557 N GLU A 37 -8.768 13.365 2.775 1.00 0.00 N ATOM 558 CA GLU A 37 -8.640 14.621 1.978 1.00 0.00 C ATOM 559 C GLU A 37 -7.448 14.507 1.024 1.00 0.00 C ATOM 560 O GLU A 37 -7.378 15.191 0.021 1.00 0.00 O ATOM 561 CB GLU A 37 -8.448 15.823 2.912 1.00 0.00 C ATOM 562 CG GLU A 37 -7.281 15.569 3.869 1.00 0.00 C ATOM 563 CD GLU A 37 -5.954 15.755 3.130 1.00 0.00 C ATOM 564 OE1 GLU A 37 -5.890 16.625 2.277 1.00 0.00 O ATOM 565 OE2 GLU A 37 -5.024 15.025 3.431 1.00 0.00 O ATOM 0 H GLU A 37 -8.640 13.472 3.781 1.00 0.00 H new ATOM 0 HA GLU A 37 -9.552 14.768 1.399 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -8.257 16.722 2.325 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -9.361 16.001 3.480 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -7.336 16.255 4.714 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -7.344 14.559 4.274 1.00 0.00 H new ATOM 572 N GLN A 38 -6.513 13.644 1.323 1.00 0.00 N ATOM 573 CA GLN A 38 -5.325 13.474 0.434 1.00 0.00 C ATOM 574 C GLN A 38 -5.587 12.288 -0.504 1.00 0.00 C ATOM 575 O GLN A 38 -5.500 12.404 -1.709 1.00 0.00 O ATOM 576 CB GLN A 38 -4.084 13.221 1.312 1.00 0.00 C ATOM 577 CG GLN A 38 -2.975 12.515 0.510 1.00 0.00 C ATOM 578 CD GLN A 38 -3.204 11.003 0.545 1.00 0.00 C ATOM 579 OE1 GLN A 38 -3.458 10.444 1.593 1.00 0.00 O ATOM 580 NE2 GLN A 38 -3.127 10.315 -0.560 1.00 0.00 N ATOM 0 H GLN A 38 -6.521 13.046 2.149 1.00 0.00 H new ATOM 0 HA GLN A 38 -5.151 14.367 -0.167 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -3.710 14.168 1.701 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -4.361 12.611 2.172 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -2.975 12.870 -0.521 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -1.998 12.755 0.930 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -2.914 10.785 -1.440 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -3.280 9.307 -0.545 1.00 0.00 H new ATOM 589 N LEU A 39 -5.918 11.154 0.048 1.00 0.00 N ATOM 590 CA LEU A 39 -6.206 9.953 -0.790 1.00 0.00 C ATOM 591 C LEU A 39 -7.104 10.345 -1.961 1.00 0.00 C ATOM 592 O LEU A 39 -7.125 9.691 -2.983 1.00 0.00 O ATOM 593 CB LEU A 39 -6.917 8.908 0.070 1.00 0.00 C ATOM 594 CG LEU A 39 -5.904 8.204 0.986 1.00 0.00 C ATOM 595 CD1 LEU A 39 -6.649 7.480 2.116 1.00 0.00 C ATOM 596 CD2 LEU A 39 -5.058 7.193 0.183 1.00 0.00 C ATOM 0 H LEU A 39 -6.002 11.005 1.054 1.00 0.00 H new ATOM 0 HA LEU A 39 -5.273 9.543 -1.177 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.692 9.385 0.670 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -7.413 8.176 -0.568 1.00 0.00 H new ATOM 0 HG LEU A 39 -5.236 8.953 1.412 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -5.929 6.981 2.765 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -7.221 8.204 2.697 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -7.327 6.740 1.690 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -4.346 6.704 0.849 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -5.712 6.443 -0.262 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -4.517 7.716 -0.605 1.00 0.00 H new ATOM 608 N ASN A 40 -7.837 11.411 -1.827 1.00 0.00 N ATOM 609 CA ASN A 40 -8.716 11.838 -2.944 1.00 0.00 C ATOM 610 C ASN A 40 -7.824 12.205 -4.127 1.00 0.00 C ATOM 611 O ASN A 40 -8.222 12.139 -5.273 1.00 0.00 O ATOM 612 CB ASN A 40 -9.529 13.066 -2.507 1.00 0.00 C ATOM 613 CG ASN A 40 -10.847 12.626 -1.858 1.00 0.00 C ATOM 614 OD1 ASN A 40 -11.069 11.452 -1.640 1.00 0.00 O ATOM 615 ND2 ASN A 40 -11.735 13.528 -1.537 1.00 0.00 N ATOM 0 H ASN A 40 -7.865 12.002 -0.996 1.00 0.00 H new ATOM 0 HA ASN A 40 -9.404 11.039 -3.222 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -8.950 13.663 -1.802 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -9.734 13.701 -3.369 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -12.614 13.246 -1.103 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -11.549 14.514 -1.720 1.00 0.00 H new ATOM 622 N ARG A 41 -6.612 12.585 -3.846 1.00 0.00 N ATOM 623 CA ARG A 41 -5.667 12.956 -4.933 1.00 0.00 C ATOM 624 C ARG A 41 -5.006 11.689 -5.471 1.00 0.00 C ATOM 625 O ARG A 41 -4.429 11.684 -6.540 1.00 0.00 O ATOM 626 CB ARG A 41 -4.596 13.898 -4.379 1.00 0.00 C ATOM 627 CG ARG A 41 -5.239 15.233 -3.998 1.00 0.00 C ATOM 628 CD ARG A 41 -4.282 16.032 -3.110 1.00 0.00 C ATOM 629 NE ARG A 41 -4.712 17.459 -3.079 1.00 0.00 N ATOM 630 CZ ARG A 41 -4.240 18.265 -2.168 1.00 0.00 C ATOM 631 NH1 ARG A 41 -3.386 17.825 -1.285 1.00 0.00 N ATOM 632 NH2 ARG A 41 -4.623 19.513 -2.140 1.00 0.00 N ATOM 0 H ARG A 41 -6.232 12.655 -2.902 1.00 0.00 H new ATOM 0 HA ARG A 41 -6.206 13.459 -5.736 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -4.118 13.450 -3.508 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -3.816 14.057 -5.124 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -5.478 15.802 -4.896 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -6.178 15.059 -3.473 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -4.275 15.620 -2.101 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -3.264 15.955 -3.492 1.00 0.00 H new ATOM 0 HE ARG A 41 -5.376 17.806 -3.771 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -3.087 16.850 -1.307 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -3.018 18.456 -0.573 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -5.291 19.857 -2.830 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -4.254 20.144 -1.428 1.00 0.00 H new ATOM 646 N GLY A 42 -5.093 10.606 -4.742 1.00 0.00 N ATOM 647 CA GLY A 42 -4.472 9.335 -5.227 1.00 0.00 C ATOM 648 C GLY A 42 -4.135 8.409 -4.049 1.00 0.00 C ATOM 649 O GLY A 42 -4.895 8.273 -3.110 1.00 0.00 O ATOM 0 H GLY A 42 -5.563 10.546 -3.839 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -5.154 8.829 -5.910 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -3.566 9.559 -5.790 1.00 0.00 H new ATOM 653 N VAL A 43 -2.997 7.760 -4.108 1.00 0.00 N ATOM 654 CA VAL A 43 -2.584 6.819 -3.016 1.00 0.00 C ATOM 655 C VAL A 43 -1.585 7.515 -2.080 1.00 0.00 C ATOM 656 O VAL A 43 -0.942 8.479 -2.445 1.00 0.00 O ATOM 657 CB VAL A 43 -1.911 5.592 -3.652 1.00 0.00 C ATOM 658 CG1 VAL A 43 -1.849 4.425 -2.660 1.00 0.00 C ATOM 659 CG2 VAL A 43 -2.702 5.167 -4.883 1.00 0.00 C ATOM 0 H VAL A 43 -2.329 7.842 -4.874 1.00 0.00 H new ATOM 0 HA VAL A 43 -3.460 6.515 -2.442 1.00 0.00 H new ATOM 0 HB VAL A 43 -0.893 5.861 -3.933 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -1.369 3.569 -3.134 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.275 4.723 -1.783 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -2.860 4.151 -2.356 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -2.228 4.297 -5.337 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -3.721 4.914 -4.591 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.723 5.986 -5.602 1.00 0.00 H new ATOM 669 N SER A 44 -1.443 7.016 -0.881 1.00 0.00 N ATOM 670 CA SER A 44 -0.479 7.620 0.085 1.00 0.00 C ATOM 671 C SER A 44 -0.074 6.548 1.097 1.00 0.00 C ATOM 672 O SER A 44 -0.816 5.623 1.358 1.00 0.00 O ATOM 673 CB SER A 44 -1.141 8.788 0.815 1.00 0.00 C ATOM 674 OG SER A 44 -0.590 8.901 2.121 1.00 0.00 O ATOM 0 H SER A 44 -1.957 6.210 -0.527 1.00 0.00 H new ATOM 0 HA SER A 44 0.399 7.988 -0.446 1.00 0.00 H new ATOM 0 HB2 SER A 44 -0.984 9.713 0.261 1.00 0.00 H new ATOM 0 HB3 SER A 44 -2.218 8.631 0.875 1.00 0.00 H new ATOM 0 HG SER A 44 -1.012 9.650 2.591 1.00 0.00 H new ATOM 680 N PHE A 45 1.094 6.653 1.668 1.00 0.00 N ATOM 681 CA PHE A 45 1.517 5.619 2.655 1.00 0.00 C ATOM 682 C PHE A 45 0.509 5.566 3.803 1.00 0.00 C ATOM 683 O PHE A 45 -0.243 6.494 4.027 1.00 0.00 O ATOM 684 CB PHE A 45 2.900 5.957 3.207 1.00 0.00 C ATOM 685 CG PHE A 45 3.945 5.697 2.145 1.00 0.00 C ATOM 686 CD1 PHE A 45 4.188 4.390 1.703 1.00 0.00 C ATOM 687 CD2 PHE A 45 4.673 6.762 1.603 1.00 0.00 C ATOM 688 CE1 PHE A 45 5.157 4.152 0.721 1.00 0.00 C ATOM 689 CE2 PHE A 45 5.640 6.526 0.623 1.00 0.00 C ATOM 690 CZ PHE A 45 5.884 5.221 0.180 1.00 0.00 C ATOM 0 H PHE A 45 1.767 7.400 1.497 1.00 0.00 H new ATOM 0 HA PHE A 45 1.558 4.649 2.159 1.00 0.00 H new ATOM 0 HB2 PHE A 45 2.934 7.001 3.518 1.00 0.00 H new ATOM 0 HB3 PHE A 45 3.107 5.355 4.091 1.00 0.00 H new ATOM 0 HD1 PHE A 45 3.628 3.566 2.120 1.00 0.00 H new ATOM 0 HD2 PHE A 45 4.487 7.770 1.944 1.00 0.00 H new ATOM 0 HE1 PHE A 45 5.344 3.144 0.380 1.00 0.00 H new ATOM 0 HE2 PHE A 45 6.200 7.351 0.207 1.00 0.00 H new ATOM 0 HZ PHE A 45 6.632 5.038 -0.578 1.00 0.00 H new ATOM 700 N ALA A 46 0.486 4.486 4.538 1.00 0.00 N ATOM 701 CA ALA A 46 -0.472 4.381 5.671 1.00 0.00 C ATOM 702 C ALA A 46 0.022 5.237 6.834 1.00 0.00 C ATOM 703 O ALA A 46 -0.653 5.390 7.832 1.00 0.00 O ATOM 704 CB ALA A 46 -0.579 2.924 6.122 1.00 0.00 C ATOM 0 H ALA A 46 1.089 3.675 4.401 1.00 0.00 H new ATOM 0 HA ALA A 46 -1.452 4.732 5.349 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.282 2.851 6.952 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -0.932 2.311 5.293 1.00 0.00 H new ATOM 0 HB3 ALA A 46 0.400 2.570 6.443 1.00 0.00 H new ATOM 710 N GLU A 47 1.199 5.793 6.719 1.00 0.00 N ATOM 711 CA GLU A 47 1.734 6.636 7.830 1.00 0.00 C ATOM 712 C GLU A 47 2.742 7.655 7.283 1.00 0.00 C ATOM 713 O GLU A 47 3.416 7.417 6.300 1.00 0.00 O ATOM 714 CB GLU A 47 2.427 5.743 8.855 1.00 0.00 C ATOM 715 CG GLU A 47 1.395 4.862 9.567 1.00 0.00 C ATOM 716 CD GLU A 47 2.024 4.254 10.822 1.00 0.00 C ATOM 717 OE1 GLU A 47 2.729 4.970 11.514 1.00 0.00 O ATOM 718 OE2 GLU A 47 1.791 3.082 11.070 1.00 0.00 O ATOM 0 H GLU A 47 1.811 5.701 5.908 1.00 0.00 H new ATOM 0 HA GLU A 47 0.908 7.169 8.300 1.00 0.00 H new ATOM 0 HB2 GLU A 47 3.171 5.118 8.361 1.00 0.00 H new ATOM 0 HB3 GLU A 47 2.958 6.356 9.583 1.00 0.00 H new ATOM 0 HG2 GLU A 47 0.520 5.453 9.836 1.00 0.00 H new ATOM 0 HG3 GLU A 47 1.053 4.072 8.899 1.00 0.00 H new ATOM 725 N GLU A 48 2.833 8.792 7.916 1.00 0.00 N ATOM 726 CA GLU A 48 3.774 9.855 7.457 1.00 0.00 C ATOM 727 C GLU A 48 5.236 9.390 7.538 1.00 0.00 C ATOM 728 O GLU A 48 6.056 9.765 6.724 1.00 0.00 O ATOM 729 CB GLU A 48 3.581 11.108 8.322 1.00 0.00 C ATOM 730 CG GLU A 48 4.093 10.867 9.747 1.00 0.00 C ATOM 731 CD GLU A 48 3.378 9.661 10.360 1.00 0.00 C ATOM 732 OE1 GLU A 48 2.291 9.844 10.882 1.00 0.00 O ATOM 733 OE2 GLU A 48 3.929 8.575 10.298 1.00 0.00 O ATOM 0 H GLU A 48 2.288 9.034 8.744 1.00 0.00 H new ATOM 0 HA GLU A 48 3.554 10.079 6.413 1.00 0.00 H new ATOM 0 HB2 GLU A 48 4.113 11.949 7.877 1.00 0.00 H new ATOM 0 HB3 GLU A 48 2.525 11.377 8.350 1.00 0.00 H new ATOM 0 HG2 GLU A 48 5.169 10.694 9.732 1.00 0.00 H new ATOM 0 HG3 GLU A 48 3.921 11.752 10.359 1.00 0.00 H new ATOM 740 N ASN A 49 5.583 8.612 8.530 1.00 0.00 N ATOM 741 CA ASN A 49 7.007 8.170 8.671 1.00 0.00 C ATOM 742 C ASN A 49 7.264 6.888 7.876 1.00 0.00 C ATOM 743 O ASN A 49 8.263 6.225 8.068 1.00 0.00 O ATOM 744 CB ASN A 49 7.310 7.914 10.149 1.00 0.00 C ATOM 745 CG ASN A 49 6.484 6.725 10.644 1.00 0.00 C ATOM 746 OD1 ASN A 49 6.822 5.588 10.387 1.00 0.00 O ATOM 747 ND2 ASN A 49 5.408 6.943 11.349 1.00 0.00 N ATOM 0 H ASN A 49 4.947 8.264 9.247 1.00 0.00 H new ATOM 0 HA ASN A 49 7.654 8.956 8.281 1.00 0.00 H new ATOM 0 HB2 ASN A 49 8.373 7.712 10.283 1.00 0.00 H new ATOM 0 HB3 ASN A 49 7.077 8.802 10.737 1.00 0.00 H new ATOM 0 HD21 ASN A 49 4.850 6.158 11.685 1.00 0.00 H new ATOM 0 HD22 ASN A 49 5.125 7.899 11.565 1.00 0.00 H new ATOM 754 N GLU A 50 6.388 6.536 6.980 1.00 0.00 N ATOM 755 CA GLU A 50 6.616 5.302 6.178 1.00 0.00 C ATOM 756 C GLU A 50 7.855 5.494 5.310 1.00 0.00 C ATOM 757 O GLU A 50 8.137 6.576 4.833 1.00 0.00 O ATOM 758 CB GLU A 50 5.394 5.029 5.299 1.00 0.00 C ATOM 759 CG GLU A 50 5.480 3.618 4.701 1.00 0.00 C ATOM 760 CD GLU A 50 6.549 3.589 3.607 1.00 0.00 C ATOM 761 OE1 GLU A 50 6.631 4.551 2.860 1.00 0.00 O ATOM 762 OE2 GLU A 50 7.268 2.606 3.535 1.00 0.00 O ATOM 0 H GLU A 50 5.529 7.044 6.768 1.00 0.00 H new ATOM 0 HA GLU A 50 6.769 4.451 6.842 1.00 0.00 H new ATOM 0 HB2 GLU A 50 4.483 5.128 5.889 1.00 0.00 H new ATOM 0 HB3 GLU A 50 5.338 5.768 4.500 1.00 0.00 H new ATOM 0 HG2 GLU A 50 5.723 2.896 5.480 1.00 0.00 H new ATOM 0 HG3 GLU A 50 4.514 3.328 4.288 1.00 0.00 H new ATOM 769 N SER A 51 8.599 4.448 5.107 1.00 0.00 N ATOM 770 CA SER A 51 9.830 4.536 4.277 1.00 0.00 C ATOM 771 C SER A 51 10.042 3.198 3.574 1.00 0.00 C ATOM 772 O SER A 51 9.628 2.164 4.059 1.00 0.00 O ATOM 773 CB SER A 51 11.027 4.838 5.182 1.00 0.00 C ATOM 774 OG SER A 51 11.528 3.622 5.721 1.00 0.00 O ATOM 0 H SER A 51 8.405 3.521 5.486 1.00 0.00 H new ATOM 0 HA SER A 51 9.730 5.330 3.537 1.00 0.00 H new ATOM 0 HB2 SER A 51 11.807 5.346 4.615 1.00 0.00 H new ATOM 0 HB3 SER A 51 10.729 5.510 5.987 1.00 0.00 H new ATOM 0 HG SER A 51 12.075 3.815 6.511 1.00 0.00 H new ATOM 780 N LEU A 52 10.698 3.195 2.447 1.00 0.00 N ATOM 781 CA LEU A 52 10.936 1.905 1.754 1.00 0.00 C ATOM 782 C LEU A 52 11.884 1.095 2.632 1.00 0.00 C ATOM 783 O LEU A 52 12.189 -0.050 2.362 1.00 0.00 O ATOM 784 CB LEU A 52 11.560 2.143 0.357 1.00 0.00 C ATOM 785 CG LEU A 52 12.337 3.481 0.330 1.00 0.00 C ATOM 786 CD1 LEU A 52 13.490 3.394 -0.675 1.00 0.00 C ATOM 787 CD2 LEU A 52 11.403 4.625 -0.091 1.00 0.00 C ATOM 0 H LEU A 52 11.075 4.021 1.983 1.00 0.00 H new ATOM 0 HA LEU A 52 9.998 1.371 1.601 1.00 0.00 H new ATOM 0 HB2 LEU A 52 12.231 1.321 0.107 1.00 0.00 H new ATOM 0 HB3 LEU A 52 10.776 2.156 -0.400 1.00 0.00 H new ATOM 0 HG LEU A 52 12.728 3.674 1.329 1.00 0.00 H new ATOM 0 HD11 LEU A 52 14.033 4.339 -0.689 1.00 0.00 H new ATOM 0 HD12 LEU A 52 14.167 2.591 -0.383 1.00 0.00 H new ATOM 0 HD13 LEU A 52 13.092 3.190 -1.669 1.00 0.00 H new ATOM 0 HD21 LEU A 52 11.960 5.562 -0.107 1.00 0.00 H new ATOM 0 HD22 LEU A 52 11.005 4.423 -1.085 1.00 0.00 H new ATOM 0 HD23 LEU A 52 10.580 4.704 0.620 1.00 0.00 H new ATOM 799 N ASP A 53 12.345 1.697 3.697 1.00 0.00 N ATOM 800 CA ASP A 53 13.271 0.995 4.628 1.00 0.00 C ATOM 801 C ASP A 53 12.464 0.382 5.775 1.00 0.00 C ATOM 802 O ASP A 53 12.937 -0.492 6.475 1.00 0.00 O ATOM 803 CB ASP A 53 14.283 1.993 5.196 1.00 0.00 C ATOM 804 CG ASP A 53 15.306 2.352 4.117 1.00 0.00 C ATOM 805 OD1 ASP A 53 15.099 1.965 2.979 1.00 0.00 O ATOM 806 OD2 ASP A 53 16.281 3.006 4.448 1.00 0.00 O ATOM 0 H ASP A 53 12.116 2.655 3.962 1.00 0.00 H new ATOM 0 HA ASP A 53 13.801 0.209 4.090 1.00 0.00 H new ATOM 0 HB2 ASP A 53 13.770 2.891 5.539 1.00 0.00 H new ATOM 0 HB3 ASP A 53 14.787 1.563 6.062 1.00 0.00 H new ATOM 811 N ASP A 54 11.247 0.823 5.978 1.00 0.00 N ATOM 812 CA ASP A 54 10.434 0.247 7.082 1.00 0.00 C ATOM 813 C ASP A 54 10.284 -1.258 6.852 1.00 0.00 C ATOM 814 O ASP A 54 9.689 -1.689 5.884 1.00 0.00 O ATOM 815 CB ASP A 54 9.053 0.903 7.095 1.00 0.00 C ATOM 816 CG ASP A 54 8.295 0.469 8.351 1.00 0.00 C ATOM 817 OD1 ASP A 54 8.082 -0.722 8.507 1.00 0.00 O ATOM 818 OD2 ASP A 54 7.940 1.335 9.133 1.00 0.00 O ATOM 0 H ASP A 54 10.788 1.551 5.430 1.00 0.00 H new ATOM 0 HA ASP A 54 10.925 0.428 8.038 1.00 0.00 H new ATOM 0 HB2 ASP A 54 9.154 1.988 7.075 1.00 0.00 H new ATOM 0 HB3 ASP A 54 8.495 0.618 6.203 1.00 0.00 H new ATOM 823 N GLN A 55 10.823 -2.063 7.730 1.00 0.00 N ATOM 824 CA GLN A 55 10.716 -3.542 7.557 1.00 0.00 C ATOM 825 C GLN A 55 9.276 -3.914 7.196 1.00 0.00 C ATOM 826 O GLN A 55 9.010 -4.977 6.662 1.00 0.00 O ATOM 827 CB GLN A 55 11.112 -4.237 8.862 1.00 0.00 C ATOM 828 CG GLN A 55 11.383 -5.719 8.589 1.00 0.00 C ATOM 829 CD GLN A 55 11.427 -6.483 9.913 1.00 0.00 C ATOM 830 OE1 GLN A 55 12.487 -6.719 10.456 1.00 0.00 O ATOM 831 NE2 GLN A 55 10.311 -6.884 10.458 1.00 0.00 N ATOM 0 H GLN A 55 11.333 -1.760 8.560 1.00 0.00 H new ATOM 0 HA GLN A 55 11.383 -3.863 6.757 1.00 0.00 H new ATOM 0 HB2 GLN A 55 12.000 -3.765 9.283 1.00 0.00 H new ATOM 0 HB3 GLN A 55 10.316 -4.132 9.599 1.00 0.00 H new ATOM 0 HG2 GLN A 55 10.604 -6.129 7.946 1.00 0.00 H new ATOM 0 HG3 GLN A 55 12.328 -5.835 8.059 1.00 0.00 H new ATOM 0 HE21 GLN A 55 9.421 -6.686 10.002 1.00 0.00 H new ATOM 0 HE22 GLN A 55 10.329 -7.396 11.340 1.00 0.00 H new ATOM 840 N ASN A 56 8.346 -3.040 7.484 1.00 0.00 N ATOM 841 CA ASN A 56 6.911 -3.314 7.171 1.00 0.00 C ATOM 842 C ASN A 56 6.305 -2.104 6.468 1.00 0.00 C ATOM 843 O ASN A 56 6.155 -1.047 7.048 1.00 0.00 O ATOM 844 CB ASN A 56 6.151 -3.566 8.474 1.00 0.00 C ATOM 845 CG ASN A 56 4.739 -4.061 8.158 1.00 0.00 C ATOM 846 OD1 ASN A 56 4.295 -3.988 7.030 1.00 0.00 O ATOM 847 ND2 ASN A 56 4.012 -4.566 9.116 1.00 0.00 N ATOM 0 H ASN A 56 8.522 -2.138 7.927 1.00 0.00 H new ATOM 0 HA ASN A 56 6.840 -4.189 6.524 1.00 0.00 H new ATOM 0 HB2 ASN A 56 6.679 -4.304 9.078 1.00 0.00 H new ATOM 0 HB3 ASN A 56 6.103 -2.649 9.062 1.00 0.00 H new ATOM 0 HD21 ASN A 56 3.069 -4.900 8.918 1.00 0.00 H new ATOM 0 HD22 ASN A 56 4.387 -4.627 10.063 1.00 0.00 H new ATOM 854 N ILE A 57 5.943 -2.251 5.222 1.00 0.00 N ATOM 855 CA ILE A 57 5.333 -1.112 4.476 1.00 0.00 C ATOM 856 C ILE A 57 3.812 -1.255 4.525 1.00 0.00 C ATOM 857 O ILE A 57 3.282 -2.347 4.504 1.00 0.00 O ATOM 858 CB ILE A 57 5.803 -1.143 3.018 1.00 0.00 C ATOM 859 CG1 ILE A 57 7.292 -0.787 2.956 1.00 0.00 C ATOM 860 CG2 ILE A 57 5.005 -0.128 2.192 1.00 0.00 C ATOM 861 CD1 ILE A 57 7.833 -1.107 1.562 1.00 0.00 C ATOM 0 H ILE A 57 6.044 -3.113 4.687 1.00 0.00 H new ATOM 0 HA ILE A 57 5.634 -0.167 4.928 1.00 0.00 H new ATOM 0 HB ILE A 57 5.645 -2.142 2.612 1.00 0.00 H new ATOM 0 HG12 ILE A 57 7.434 0.270 3.179 1.00 0.00 H new ATOM 0 HG13 ILE A 57 7.843 -1.349 3.710 1.00 0.00 H new ATOM 0 HG21 ILE A 57 5.344 -0.155 1.156 1.00 0.00 H new ATOM 0 HG22 ILE A 57 3.945 -0.378 2.234 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.158 0.872 2.598 1.00 0.00 H new ATOM 0 HD11 ILE A 57 8.892 -0.854 1.516 1.00 0.00 H new ATOM 0 HD12 ILE A 57 7.704 -2.170 1.357 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.289 -0.525 0.818 1.00 0.00 H new ATOM 873 N SER A 58 3.108 -0.159 4.589 1.00 0.00 N ATOM 874 CA SER A 58 1.617 -0.217 4.637 1.00 0.00 C ATOM 875 C SER A 58 1.055 0.929 3.797 1.00 0.00 C ATOM 876 O SER A 58 1.078 2.075 4.198 1.00 0.00 O ATOM 877 CB SER A 58 1.151 -0.082 6.091 1.00 0.00 C ATOM 878 OG SER A 58 1.973 0.863 6.761 1.00 0.00 O ATOM 0 H SER A 58 3.503 0.781 4.610 1.00 0.00 H new ATOM 0 HA SER A 58 1.262 -1.168 4.239 1.00 0.00 H new ATOM 0 HB2 SER A 58 0.109 0.237 6.123 1.00 0.00 H new ATOM 0 HB3 SER A 58 1.204 -1.048 6.593 1.00 0.00 H new ATOM 0 HG SER A 58 1.677 0.953 7.691 1.00 0.00 H new ATOM 884 N ILE A 59 0.563 0.623 2.625 1.00 0.00 N ATOM 885 CA ILE A 59 0.006 1.685 1.733 1.00 0.00 C ATOM 886 C ILE A 59 -1.521 1.650 1.775 1.00 0.00 C ATOM 887 O ILE A 59 -2.125 0.651 2.117 1.00 0.00 O ATOM 888 CB ILE A 59 0.470 1.428 0.299 1.00 0.00 C ATOM 889 CG1 ILE A 59 1.996 1.528 0.229 1.00 0.00 C ATOM 890 CG2 ILE A 59 -0.153 2.469 -0.634 1.00 0.00 C ATOM 891 CD1 ILE A 59 2.477 1.013 -1.129 1.00 0.00 C ATOM 0 H ILE A 59 0.523 -0.323 2.244 1.00 0.00 H new ATOM 0 HA ILE A 59 0.356 2.660 2.072 1.00 0.00 H new ATOM 0 HB ILE A 59 0.157 0.430 -0.010 1.00 0.00 H new ATOM 0 HG12 ILE A 59 2.311 2.562 0.370 1.00 0.00 H new ATOM 0 HG13 ILE A 59 2.447 0.945 1.032 1.00 0.00 H new ATOM 0 HG21 ILE A 59 0.178 2.286 -1.656 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -1.240 2.397 -0.586 1.00 0.00 H new ATOM 0 HG23 ILE A 59 0.158 3.467 -0.325 1.00 0.00 H new ATOM 0 HD11 ILE A 59 3.563 1.083 -1.181 1.00 0.00 H new ATOM 0 HD12 ILE A 59 2.175 -0.027 -1.252 1.00 0.00 H new ATOM 0 HD13 ILE A 59 2.036 1.615 -1.923 1.00 0.00 H new ATOM 903 N ALA A 60 -2.145 2.739 1.412 1.00 0.00 N ATOM 904 CA ALA A 60 -3.640 2.813 1.399 1.00 0.00 C ATOM 905 C ALA A 60 -4.086 3.289 0.015 1.00 0.00 C ATOM 906 O ALA A 60 -3.588 4.277 -0.487 1.00 0.00 O ATOM 907 CB ALA A 60 -4.104 3.813 2.460 1.00 0.00 C ATOM 0 H ALA A 60 -1.676 3.596 1.119 1.00 0.00 H new ATOM 0 HA ALA A 60 -4.071 1.836 1.615 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -5.192 3.871 2.454 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -3.763 3.486 3.442 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.688 4.796 2.240 1.00 0.00 H new ATOM 913 N GLY A 61 -5.005 2.593 -0.619 1.00 0.00 N ATOM 914 CA GLY A 61 -5.449 3.016 -1.993 1.00 0.00 C ATOM 915 C GLY A 61 -6.963 2.855 -2.152 1.00 0.00 C ATOM 916 O GLY A 61 -7.577 1.988 -1.562 1.00 0.00 O ATOM 0 H GLY A 61 -5.463 1.759 -0.251 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -5.170 4.055 -2.166 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -4.935 2.418 -2.746 1.00 0.00 H new ATOM 920 N HIS A 62 -7.564 3.696 -2.954 1.00 0.00 N ATOM 921 CA HIS A 62 -9.047 3.613 -3.174 1.00 0.00 C ATOM 922 C HIS A 62 -9.381 2.407 -4.075 1.00 0.00 C ATOM 923 O HIS A 62 -8.576 1.517 -4.262 1.00 0.00 O ATOM 924 CB HIS A 62 -9.541 4.921 -3.829 1.00 0.00 C ATOM 925 CG HIS A 62 -9.832 5.952 -2.771 1.00 0.00 C ATOM 926 ND1 HIS A 62 -11.059 6.021 -2.129 1.00 0.00 N ATOM 927 CD2 HIS A 62 -9.073 6.963 -2.238 1.00 0.00 C ATOM 928 CE1 HIS A 62 -11.003 7.041 -1.256 1.00 0.00 C ATOM 929 NE2 HIS A 62 -9.814 7.650 -1.280 1.00 0.00 N ATOM 0 H HIS A 62 -7.094 4.440 -3.469 1.00 0.00 H new ATOM 0 HA HIS A 62 -9.549 3.479 -2.216 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -8.786 5.299 -4.518 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -10.439 4.727 -4.415 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -8.055 7.191 -2.519 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -11.820 7.333 -0.613 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -9.514 8.446 -0.718 1.00 0.00 H new ATOM 937 N THR A 63 -10.570 2.380 -4.631 1.00 0.00 N ATOM 938 CA THR A 63 -10.978 1.253 -5.514 1.00 0.00 C ATOM 939 C THR A 63 -12.220 1.674 -6.311 1.00 0.00 C ATOM 940 O THR A 63 -13.336 1.344 -5.968 1.00 0.00 O ATOM 941 CB THR A 63 -11.299 0.021 -4.650 1.00 0.00 C ATOM 942 OG1 THR A 63 -11.599 -1.082 -5.489 1.00 0.00 O ATOM 943 CG2 THR A 63 -12.506 0.292 -3.732 1.00 0.00 C ATOM 0 H THR A 63 -11.279 3.102 -4.506 1.00 0.00 H new ATOM 0 HA THR A 63 -10.171 1.003 -6.203 1.00 0.00 H new ATOM 0 HB THR A 63 -10.428 -0.199 -4.033 1.00 0.00 H new ATOM 0 HG1 THR A 63 -10.860 -1.725 -5.460 1.00 0.00 H new ATOM 0 HG21 THR A 63 -12.713 -0.594 -3.132 1.00 0.00 H new ATOM 0 HG22 THR A 63 -12.282 1.132 -3.074 1.00 0.00 H new ATOM 0 HG23 THR A 63 -13.379 0.530 -4.340 1.00 0.00 H new ATOM 951 N PHE A 64 -12.038 2.417 -7.370 1.00 0.00 N ATOM 952 CA PHE A 64 -13.211 2.870 -8.177 1.00 0.00 C ATOM 953 C PHE A 64 -13.541 1.802 -9.226 1.00 0.00 C ATOM 954 O PHE A 64 -12.825 1.621 -10.189 1.00 0.00 O ATOM 955 CB PHE A 64 -12.863 4.201 -8.870 1.00 0.00 C ATOM 956 CG PHE A 64 -13.196 5.374 -7.965 1.00 0.00 C ATOM 957 CD1 PHE A 64 -12.846 5.340 -6.609 1.00 0.00 C ATOM 958 CD2 PHE A 64 -13.856 6.494 -8.488 1.00 0.00 C ATOM 959 CE1 PHE A 64 -13.154 6.425 -5.778 1.00 0.00 C ATOM 960 CE2 PHE A 64 -14.163 7.578 -7.657 1.00 0.00 C ATOM 961 CZ PHE A 64 -13.813 7.543 -6.303 1.00 0.00 C ATOM 0 H PHE A 64 -11.129 2.730 -7.712 1.00 0.00 H new ATOM 0 HA PHE A 64 -14.076 3.018 -7.531 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -11.803 4.219 -9.124 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -13.417 4.287 -9.805 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -12.338 4.477 -6.204 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -14.128 6.521 -9.533 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -12.883 6.399 -4.733 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -14.670 8.442 -8.061 1.00 0.00 H new ATOM 0 HZ PHE A 64 -14.051 8.379 -5.662 1.00 0.00 H new ATOM 971 N ILE A 65 -14.621 1.096 -9.041 1.00 0.00 N ATOM 972 CA ILE A 65 -15.003 0.034 -10.019 1.00 0.00 C ATOM 973 C ILE A 65 -15.210 0.649 -11.399 1.00 0.00 C ATOM 974 O ILE A 65 -15.028 0.006 -12.414 1.00 0.00 O ATOM 975 CB ILE A 65 -16.323 -0.619 -9.594 1.00 0.00 C ATOM 976 CG1 ILE A 65 -16.329 -0.867 -8.087 1.00 0.00 C ATOM 977 CG2 ILE A 65 -16.494 -1.946 -10.332 1.00 0.00 C ATOM 978 CD1 ILE A 65 -17.605 -1.619 -7.713 1.00 0.00 C ATOM 0 H ILE A 65 -15.259 1.207 -8.253 1.00 0.00 H new ATOM 0 HA ILE A 65 -14.205 -0.708 -10.048 1.00 0.00 H new ATOM 0 HB ILE A 65 -17.147 0.049 -9.844 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -15.452 -1.446 -7.797 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -16.278 0.080 -7.549 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -17.432 -2.412 -10.031 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -16.507 -1.765 -11.407 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -15.665 -2.609 -10.086 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -17.618 -1.801 -6.638 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -18.474 -1.022 -7.991 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -17.635 -2.571 -8.242 1.00 0.00 H new ATOM 990 N ASP A 66 -15.624 1.881 -11.442 1.00 0.00 N ATOM 991 CA ASP A 66 -15.885 2.532 -12.748 1.00 0.00 C ATOM 992 C ASP A 66 -14.574 3.046 -13.328 1.00 0.00 C ATOM 993 O ASP A 66 -14.547 3.797 -14.282 1.00 0.00 O ATOM 994 CB ASP A 66 -16.870 3.687 -12.543 1.00 0.00 C ATOM 995 CG ASP A 66 -16.175 4.850 -11.826 1.00 0.00 C ATOM 996 OD1 ASP A 66 -15.727 4.650 -10.709 1.00 0.00 O ATOM 997 OD2 ASP A 66 -16.102 5.919 -12.409 1.00 0.00 O ATOM 0 H ASP A 66 -15.793 2.467 -10.624 1.00 0.00 H new ATOM 0 HA ASP A 66 -16.318 1.815 -13.445 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -17.256 4.022 -13.506 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -17.725 3.347 -11.958 1.00 0.00 H new ATOM 1002 N ARG A 67 -13.483 2.630 -12.754 1.00 0.00 N ATOM 1003 CA ARG A 67 -12.148 3.065 -13.254 1.00 0.00 C ATOM 1004 C ARG A 67 -11.153 1.916 -13.064 1.00 0.00 C ATOM 1005 O ARG A 67 -10.337 1.946 -12.168 1.00 0.00 O ATOM 1006 CB ARG A 67 -11.658 4.284 -12.462 1.00 0.00 C ATOM 1007 CG ARG A 67 -12.496 5.525 -12.810 1.00 0.00 C ATOM 1008 CD ARG A 67 -12.289 5.927 -14.288 1.00 0.00 C ATOM 1009 NE ARG A 67 -12.118 7.412 -14.394 1.00 0.00 N ATOM 1010 CZ ARG A 67 -12.927 8.235 -13.779 1.00 0.00 C ATOM 1011 NH1 ARG A 67 -13.974 7.787 -13.145 1.00 0.00 N ATOM 1012 NH2 ARG A 67 -12.702 9.520 -13.828 1.00 0.00 N ATOM 0 H ARG A 67 -13.457 2.001 -11.952 1.00 0.00 H new ATOM 0 HA ARG A 67 -12.227 3.332 -14.308 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -11.724 4.081 -11.393 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -10.608 4.472 -12.686 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -13.551 5.320 -12.628 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -12.215 6.354 -12.160 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -11.412 5.422 -14.692 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -13.144 5.607 -14.884 1.00 0.00 H new ATOM 0 HE ARG A 67 -11.355 7.788 -14.957 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -14.169 6.786 -13.125 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -14.599 8.437 -12.668 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -11.898 9.878 -14.344 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -13.330 10.166 -13.350 1.00 0.00 H new ATOM 1026 N PRO A 68 -11.237 0.910 -13.902 1.00 0.00 N ATOM 1027 CA PRO A 68 -10.343 -0.298 -13.845 1.00 0.00 C ATOM 1028 C PRO A 68 -8.845 0.037 -13.725 1.00 0.00 C ATOM 1029 O PRO A 68 -8.002 -0.834 -13.806 1.00 0.00 O ATOM 1030 CB PRO A 68 -10.636 -1.013 -15.168 1.00 0.00 C ATOM 1031 CG PRO A 68 -12.043 -0.637 -15.487 1.00 0.00 C ATOM 1032 CD PRO A 68 -12.206 0.805 -15.006 1.00 0.00 C ATOM 0 HA PRO A 68 -10.545 -0.896 -12.956 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -9.951 -0.693 -15.953 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -10.526 -2.093 -15.069 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -12.237 -0.717 -16.557 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -12.748 -1.299 -14.985 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -11.989 1.520 -15.800 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -13.223 1.003 -14.668 1.00 0.00 H new ATOM 1040 N ASN A 69 -8.508 1.280 -13.520 1.00 0.00 N ATOM 1041 CA ASN A 69 -7.074 1.668 -13.379 1.00 0.00 C ATOM 1042 C ASN A 69 -6.982 2.768 -12.323 1.00 0.00 C ATOM 1043 O ASN A 69 -6.540 3.867 -12.591 1.00 0.00 O ATOM 1044 CB ASN A 69 -6.550 2.196 -14.716 1.00 0.00 C ATOM 1045 CG ASN A 69 -7.493 3.281 -15.243 1.00 0.00 C ATOM 1046 OD1 ASN A 69 -7.564 4.361 -14.688 1.00 0.00 O ATOM 1047 ND2 ASN A 69 -8.222 3.039 -16.296 1.00 0.00 N ATOM 0 H ASN A 69 -9.170 2.052 -13.443 1.00 0.00 H new ATOM 0 HA ASN A 69 -6.476 0.806 -13.082 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -5.546 2.602 -14.590 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -6.477 1.382 -15.437 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -8.853 3.756 -16.655 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -8.162 2.133 -16.761 1.00 0.00 H new ATOM 1054 N TYR A 70 -7.417 2.482 -11.120 1.00 0.00 N ATOM 1055 CA TYR A 70 -7.377 3.512 -10.038 1.00 0.00 C ATOM 1056 C TYR A 70 -7.041 2.855 -8.695 1.00 0.00 C ATOM 1057 O TYR A 70 -7.880 2.253 -8.056 1.00 0.00 O ATOM 1058 CB TYR A 70 -8.750 4.191 -9.947 1.00 0.00 C ATOM 1059 CG TYR A 70 -8.647 5.461 -9.129 1.00 0.00 C ATOM 1060 CD1 TYR A 70 -7.869 6.531 -9.590 1.00 0.00 C ATOM 1061 CD2 TYR A 70 -9.332 5.571 -7.909 1.00 0.00 C ATOM 1062 CE1 TYR A 70 -7.774 7.706 -8.835 1.00 0.00 C ATOM 1063 CE2 TYR A 70 -9.235 6.747 -7.153 1.00 0.00 C ATOM 1064 CZ TYR A 70 -8.455 7.813 -7.617 1.00 0.00 C ATOM 1065 OH TYR A 70 -8.359 8.971 -6.873 1.00 0.00 O ATOM 0 H TYR A 70 -7.798 1.578 -10.841 1.00 0.00 H new ATOM 0 HA TYR A 70 -6.609 4.250 -10.269 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -9.118 4.422 -10.947 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -9.471 3.512 -9.491 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -7.342 6.449 -10.529 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -9.934 4.749 -7.552 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -7.175 8.530 -9.193 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -9.761 6.831 -6.214 1.00 0.00 H new ATOM 0 HH TYR A 70 -8.893 8.880 -6.056 1.00 0.00 H new ATOM 1075 N GLN A 71 -5.821 2.995 -8.254 1.00 0.00 N ATOM 1076 CA GLN A 71 -5.413 2.413 -6.940 1.00 0.00 C ATOM 1077 C GLN A 71 -5.795 0.921 -6.861 1.00 0.00 C ATOM 1078 O GLN A 71 -5.533 0.153 -7.766 1.00 0.00 O ATOM 1079 CB GLN A 71 -6.096 3.208 -5.803 1.00 0.00 C ATOM 1080 CG GLN A 71 -6.318 4.676 -6.208 1.00 0.00 C ATOM 1081 CD GLN A 71 -5.047 5.309 -6.778 1.00 0.00 C ATOM 1082 OE1 GLN A 71 -4.313 4.696 -7.518 1.00 0.00 O ATOM 1083 NE2 GLN A 71 -4.757 6.537 -6.452 1.00 0.00 N ATOM 0 H GLN A 71 -5.082 3.492 -8.751 1.00 0.00 H new ATOM 0 HA GLN A 71 -4.330 2.485 -6.835 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -7.053 2.747 -5.557 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -5.481 3.165 -4.904 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -7.115 4.732 -6.949 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -6.650 5.246 -5.340 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -5.373 7.058 -5.828 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -3.914 6.977 -6.821 1.00 0.00 H new ATOM 1092 N PHE A 72 -6.396 0.512 -5.773 1.00 0.00 N ATOM 1093 CA PHE A 72 -6.787 -0.917 -5.590 1.00 0.00 C ATOM 1094 C PHE A 72 -8.188 -1.129 -6.194 1.00 0.00 C ATOM 1095 O PHE A 72 -9.146 -1.467 -5.532 1.00 0.00 O ATOM 1096 CB PHE A 72 -6.727 -1.231 -4.065 1.00 0.00 C ATOM 1097 CG PHE A 72 -7.780 -2.240 -3.637 1.00 0.00 C ATOM 1098 CD1 PHE A 72 -7.704 -3.562 -4.081 1.00 0.00 C ATOM 1099 CD2 PHE A 72 -8.835 -1.845 -2.803 1.00 0.00 C ATOM 1100 CE1 PHE A 72 -8.679 -4.489 -3.697 1.00 0.00 C ATOM 1101 CE2 PHE A 72 -9.811 -2.774 -2.420 1.00 0.00 C ATOM 1102 CZ PHE A 72 -9.734 -4.094 -2.869 1.00 0.00 C ATOM 0 H PHE A 72 -6.636 1.120 -4.990 1.00 0.00 H new ATOM 0 HA PHE A 72 -6.112 -1.602 -6.104 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -5.738 -1.615 -3.815 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -6.863 -0.308 -3.502 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -6.891 -3.869 -4.722 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -8.895 -0.824 -2.456 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -8.617 -5.511 -4.041 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -10.623 -2.469 -1.777 1.00 0.00 H new ATOM 0 HZ PHE A 72 -10.489 -4.809 -2.577 1.00 0.00 H new ATOM 1112 N THR A 73 -8.301 -0.941 -7.479 1.00 0.00 N ATOM 1113 CA THR A 73 -9.612 -1.150 -8.154 1.00 0.00 C ATOM 1114 C THR A 73 -9.698 -2.612 -8.599 1.00 0.00 C ATOM 1115 O THR A 73 -10.760 -3.200 -8.633 1.00 0.00 O ATOM 1116 CB THR A 73 -9.717 -0.242 -9.384 1.00 0.00 C ATOM 1117 OG1 THR A 73 -9.722 1.116 -8.969 1.00 0.00 O ATOM 1118 CG2 THR A 73 -11.015 -0.548 -10.138 1.00 0.00 C ATOM 0 H THR A 73 -7.540 -0.651 -8.093 1.00 0.00 H new ATOM 0 HA THR A 73 -10.423 -0.911 -7.467 1.00 0.00 H new ATOM 0 HB THR A 73 -8.865 -0.421 -10.040 1.00 0.00 H new ATOM 0 HG1 THR A 73 -8.889 1.316 -8.493 1.00 0.00 H new ATOM 0 HG21 THR A 73 -11.089 0.098 -11.013 1.00 0.00 H new ATOM 0 HG22 THR A 73 -11.014 -1.591 -10.456 1.00 0.00 H new ATOM 0 HG23 THR A 73 -11.867 -0.370 -9.482 1.00 0.00 H new ATOM 1126 N ASN A 74 -8.578 -3.200 -8.953 1.00 0.00 N ATOM 1127 CA ASN A 74 -8.578 -4.623 -9.414 1.00 0.00 C ATOM 1128 C ASN A 74 -7.361 -5.365 -8.853 1.00 0.00 C ATOM 1129 O ASN A 74 -7.090 -6.487 -9.233 1.00 0.00 O ATOM 1130 CB ASN A 74 -8.553 -4.668 -10.950 1.00 0.00 C ATOM 1131 CG ASN A 74 -7.616 -3.586 -11.492 1.00 0.00 C ATOM 1132 OD1 ASN A 74 -7.029 -2.837 -10.739 1.00 0.00 O ATOM 1133 ND2 ASN A 74 -7.452 -3.472 -12.781 1.00 0.00 N ATOM 0 H ASN A 74 -7.662 -2.752 -8.942 1.00 0.00 H new ATOM 0 HA ASN A 74 -9.483 -5.111 -9.051 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -8.221 -5.650 -11.288 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -9.559 -4.519 -11.342 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -6.831 -2.754 -13.155 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -7.945 -4.101 -13.415 1.00 0.00 H new ATOM 1140 N LEU A 75 -6.633 -4.779 -7.935 1.00 0.00 N ATOM 1141 CA LEU A 75 -5.466 -5.514 -7.361 1.00 0.00 C ATOM 1142 C LEU A 75 -5.992 -6.845 -6.812 1.00 0.00 C ATOM 1143 O LEU A 75 -5.243 -7.739 -6.471 1.00 0.00 O ATOM 1144 CB LEU A 75 -4.808 -4.676 -6.235 1.00 0.00 C ATOM 1145 CG LEU A 75 -3.283 -4.649 -6.401 1.00 0.00 C ATOM 1146 CD1 LEU A 75 -2.677 -3.698 -5.365 1.00 0.00 C ATOM 1147 CD2 LEU A 75 -2.716 -6.059 -6.194 1.00 0.00 C ATOM 0 H LEU A 75 -6.792 -3.842 -7.564 1.00 0.00 H new ATOM 0 HA LEU A 75 -4.706 -5.692 -8.122 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -5.199 -3.659 -6.256 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -5.066 -5.097 -5.263 1.00 0.00 H new ATOM 0 HG LEU A 75 -3.034 -4.304 -7.405 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.593 -3.677 -5.481 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -3.077 -2.695 -5.514 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -2.928 -4.044 -4.362 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.633 -6.037 -6.313 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.964 -6.407 -5.191 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -3.148 -6.737 -6.931 1.00 0.00 H new ATOM 1159 N LYS A 76 -7.291 -6.970 -6.751 1.00 0.00 N ATOM 1160 CA LYS A 76 -7.917 -8.225 -6.258 1.00 0.00 C ATOM 1161 C LYS A 76 -8.018 -9.187 -7.437 1.00 0.00 C ATOM 1162 O LYS A 76 -8.066 -10.391 -7.276 1.00 0.00 O ATOM 1163 CB LYS A 76 -9.321 -7.912 -5.709 1.00 0.00 C ATOM 1164 CG LYS A 76 -9.929 -6.734 -6.489 1.00 0.00 C ATOM 1165 CD LYS A 76 -11.439 -6.627 -6.198 1.00 0.00 C ATOM 1166 CE LYS A 76 -12.231 -7.522 -7.162 1.00 0.00 C ATOM 1167 NZ LYS A 76 -12.378 -6.832 -8.474 1.00 0.00 N ATOM 0 H LYS A 76 -7.952 -6.243 -7.027 1.00 0.00 H new ATOM 0 HA LYS A 76 -7.323 -8.670 -5.460 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -9.961 -8.790 -5.798 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -9.262 -7.667 -4.649 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -9.430 -5.806 -6.208 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -9.766 -6.873 -7.558 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -11.640 -6.923 -5.168 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -11.764 -5.592 -6.302 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -11.718 -8.474 -7.296 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -13.213 -7.745 -6.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -12.480 -7.540 -9.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -13.221 -6.224 -8.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -11.536 -6.250 -8.657 1.00 0.00 H new ATOM 1181 N ALA A 77 -8.027 -8.656 -8.629 1.00 0.00 N ATOM 1182 CA ALA A 77 -8.096 -9.523 -9.829 1.00 0.00 C ATOM 1183 C ALA A 77 -6.789 -10.298 -9.902 1.00 0.00 C ATOM 1184 O ALA A 77 -6.726 -11.409 -10.392 1.00 0.00 O ATOM 1185 CB ALA A 77 -8.258 -8.651 -11.073 1.00 0.00 C ATOM 0 H ALA A 77 -7.989 -7.655 -8.820 1.00 0.00 H new ATOM 0 HA ALA A 77 -8.943 -10.207 -9.773 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -8.309 -9.285 -11.958 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -9.175 -8.067 -10.991 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -7.406 -7.977 -11.158 1.00 0.00 H new ATOM 1191 N ALA A 78 -5.745 -9.709 -9.391 1.00 0.00 N ATOM 1192 CA ALA A 78 -4.422 -10.386 -9.391 1.00 0.00 C ATOM 1193 C ALA A 78 -4.536 -11.691 -8.594 1.00 0.00 C ATOM 1194 O ALA A 78 -5.612 -12.231 -8.431 1.00 0.00 O ATOM 1195 CB ALA A 78 -3.394 -9.468 -8.729 1.00 0.00 C ATOM 0 H ALA A 78 -5.753 -8.780 -8.970 1.00 0.00 H new ATOM 0 HA ALA A 78 -4.109 -10.605 -10.412 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.420 -9.957 -8.724 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -3.329 -8.533 -9.286 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -3.700 -9.259 -7.704 1.00 0.00 H new ATOM 1201 N LYS A 79 -3.443 -12.199 -8.088 1.00 0.00 N ATOM 1202 CA LYS A 79 -3.510 -13.464 -7.297 1.00 0.00 C ATOM 1203 C LYS A 79 -2.156 -13.733 -6.636 1.00 0.00 C ATOM 1204 O LYS A 79 -1.145 -13.182 -7.021 1.00 0.00 O ATOM 1205 CB LYS A 79 -3.865 -14.630 -8.223 1.00 0.00 C ATOM 1206 CG LYS A 79 -2.730 -14.855 -9.223 1.00 0.00 C ATOM 1207 CD LYS A 79 -3.199 -15.811 -10.322 1.00 0.00 C ATOM 1208 CE LYS A 79 -3.489 -17.192 -9.723 1.00 0.00 C ATOM 1209 NZ LYS A 79 -3.509 -18.210 -10.811 1.00 0.00 N ATOM 0 H LYS A 79 -2.511 -11.796 -8.187 1.00 0.00 H new ATOM 0 HA LYS A 79 -4.275 -13.365 -6.527 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -4.032 -15.534 -7.638 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -4.793 -14.417 -8.753 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -2.422 -13.905 -9.660 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -1.859 -15.268 -8.714 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -4.096 -15.417 -10.801 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -2.435 -15.893 -11.095 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -2.728 -17.447 -8.985 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -4.447 -17.181 -9.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -3.706 -19.147 -10.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -4.250 -17.968 -11.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -2.585 -18.226 -11.288 1.00 0.00 H new ATOM 1223 N LYS A 80 -2.130 -14.583 -5.643 1.00 0.00 N ATOM 1224 CA LYS A 80 -0.842 -14.891 -4.958 1.00 0.00 C ATOM 1225 C LYS A 80 0.199 -15.298 -6.001 1.00 0.00 C ATOM 1226 O LYS A 80 0.277 -16.442 -6.405 1.00 0.00 O ATOM 1227 CB LYS A 80 -1.045 -16.033 -3.959 1.00 0.00 C ATOM 1228 CG LYS A 80 -1.910 -15.551 -2.789 1.00 0.00 C ATOM 1229 CD LYS A 80 -1.806 -16.547 -1.630 1.00 0.00 C ATOM 1230 CE LYS A 80 -2.883 -16.235 -0.589 1.00 0.00 C ATOM 1231 NZ LYS A 80 -4.233 -16.428 -1.194 1.00 0.00 N ATOM 0 H LYS A 80 -2.945 -15.076 -5.278 1.00 0.00 H new ATOM 0 HA LYS A 80 -0.496 -14.007 -4.422 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -1.523 -16.879 -4.452 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -0.080 -16.382 -3.591 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -1.583 -14.563 -2.464 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -2.948 -15.454 -3.107 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -1.927 -17.565 -2.000 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -0.817 -16.489 -1.174 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -2.765 -16.886 0.278 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -2.775 -15.210 -0.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -4.728 -15.515 -1.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -4.131 -16.811 -2.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -4.782 -17.093 -0.613 1.00 0.00 H new ATOM 1245 N GLY A 81 0.999 -14.367 -6.438 1.00 0.00 N ATOM 1246 CA GLY A 81 2.040 -14.679 -7.458 1.00 0.00 C ATOM 1247 C GLY A 81 2.336 -13.414 -8.261 1.00 0.00 C ATOM 1248 O GLY A 81 3.409 -13.242 -8.805 1.00 0.00 O ATOM 0 H GLY A 81 0.977 -13.395 -6.130 1.00 0.00 H new ATOM 0 HA2 GLY A 81 2.947 -15.039 -6.973 1.00 0.00 H new ATOM 0 HA3 GLY A 81 1.695 -15.474 -8.119 1.00 0.00 H new ATOM 1252 N SER A 82 1.391 -12.516 -8.322 1.00 0.00 N ATOM 1253 CA SER A 82 1.608 -11.252 -9.065 1.00 0.00 C ATOM 1254 C SER A 82 2.732 -10.491 -8.379 1.00 0.00 C ATOM 1255 O SER A 82 2.605 -10.066 -7.247 1.00 0.00 O ATOM 1256 CB SER A 82 0.328 -10.415 -9.044 1.00 0.00 C ATOM 1257 OG SER A 82 0.609 -9.116 -9.542 1.00 0.00 O ATOM 0 H SER A 82 0.474 -12.608 -7.885 1.00 0.00 H new ATOM 0 HA SER A 82 1.870 -11.461 -10.102 1.00 0.00 H new ATOM 0 HB2 SER A 82 -0.442 -10.891 -9.651 1.00 0.00 H new ATOM 0 HB3 SER A 82 -0.062 -10.351 -8.028 1.00 0.00 H new ATOM 0 HG SER A 82 0.763 -8.504 -8.792 1.00 0.00 H new ATOM 1263 N MET A 83 3.841 -10.333 -9.032 1.00 0.00 N ATOM 1264 CA MET A 83 4.962 -9.619 -8.379 1.00 0.00 C ATOM 1265 C MET A 83 4.554 -8.174 -8.091 1.00 0.00 C ATOM 1266 O MET A 83 3.435 -7.777 -8.341 1.00 0.00 O ATOM 1267 CB MET A 83 6.192 -9.640 -9.289 1.00 0.00 C ATOM 1268 CG MET A 83 6.739 -11.067 -9.375 1.00 0.00 C ATOM 1269 SD MET A 83 7.938 -11.171 -10.726 1.00 0.00 S ATOM 1270 CE MET A 83 9.384 -10.615 -9.790 1.00 0.00 C ATOM 0 H MET A 83 4.020 -10.663 -9.980 1.00 0.00 H new ATOM 0 HA MET A 83 5.206 -10.117 -7.440 1.00 0.00 H new ATOM 0 HB2 MET A 83 5.928 -9.280 -10.283 1.00 0.00 H new ATOM 0 HB3 MET A 83 6.957 -8.969 -8.899 1.00 0.00 H new ATOM 0 HG2 MET A 83 7.211 -11.344 -8.433 1.00 0.00 H new ATOM 0 HG3 MET A 83 5.924 -11.771 -9.542 1.00 0.00 H new ATOM 0 HE1 MET A 83 10.257 -10.603 -10.442 1.00 0.00 H new ATOM 0 HE2 MET A 83 9.204 -9.611 -9.405 1.00 0.00 H new ATOM 0 HE3 MET A 83 9.563 -11.296 -8.958 1.00 0.00 H new ATOM 1280 N VAL A 84 5.453 -7.388 -7.558 1.00 0.00 N ATOM 1281 CA VAL A 84 5.121 -5.965 -7.243 1.00 0.00 C ATOM 1282 C VAL A 84 6.356 -5.096 -7.484 1.00 0.00 C ATOM 1283 O VAL A 84 7.302 -5.119 -6.722 1.00 0.00 O ATOM 1284 CB VAL A 84 4.705 -5.855 -5.776 1.00 0.00 C ATOM 1285 CG1 VAL A 84 4.221 -4.435 -5.487 1.00 0.00 C ATOM 1286 CG2 VAL A 84 3.571 -6.845 -5.493 1.00 0.00 C ATOM 0 H VAL A 84 6.405 -7.670 -7.326 1.00 0.00 H new ATOM 0 HA VAL A 84 4.304 -5.629 -7.881 1.00 0.00 H new ATOM 0 HB VAL A 84 5.559 -6.085 -5.139 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.925 -4.357 -4.441 1.00 0.00 H new ATOM 0 HG12 VAL A 84 5.026 -3.728 -5.690 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.367 -4.205 -6.124 1.00 0.00 H new ATOM 0 HG21 VAL A 84 3.273 -6.768 -4.447 1.00 0.00 H new ATOM 0 HG22 VAL A 84 2.718 -6.614 -6.131 1.00 0.00 H new ATOM 0 HG23 VAL A 84 3.914 -7.859 -5.699 1.00 0.00 H new ATOM 1296 N TYR A 85 6.360 -4.331 -8.546 1.00 0.00 N ATOM 1297 CA TYR A 85 7.539 -3.464 -8.839 1.00 0.00 C ATOM 1298 C TYR A 85 7.325 -2.073 -8.240 1.00 0.00 C ATOM 1299 O TYR A 85 6.611 -1.253 -8.784 1.00 0.00 O ATOM 1300 CB TYR A 85 7.709 -3.343 -10.356 1.00 0.00 C ATOM 1301 CG TYR A 85 8.064 -4.694 -10.930 1.00 0.00 C ATOM 1302 CD1 TYR A 85 7.049 -5.593 -11.281 1.00 0.00 C ATOM 1303 CD2 TYR A 85 9.406 -5.048 -11.110 1.00 0.00 C ATOM 1304 CE1 TYR A 85 7.377 -6.847 -11.811 1.00 0.00 C ATOM 1305 CE2 TYR A 85 9.734 -6.302 -11.641 1.00 0.00 C ATOM 1306 CZ TYR A 85 8.720 -7.201 -11.991 1.00 0.00 C ATOM 1307 OH TYR A 85 9.043 -8.437 -12.514 1.00 0.00 O ATOM 0 H TYR A 85 5.598 -4.270 -9.222 1.00 0.00 H new ATOM 0 HA TYR A 85 8.432 -3.908 -8.400 1.00 0.00 H new ATOM 0 HB2 TYR A 85 6.788 -2.974 -10.808 1.00 0.00 H new ATOM 0 HB3 TYR A 85 8.491 -2.620 -10.589 1.00 0.00 H new ATOM 0 HD1 TYR A 85 6.013 -5.319 -11.143 1.00 0.00 H new ATOM 0 HD2 TYR A 85 10.189 -4.354 -10.840 1.00 0.00 H new ATOM 0 HE1 TYR A 85 6.595 -7.541 -12.081 1.00 0.00 H new ATOM 0 HE2 TYR A 85 10.770 -6.575 -11.780 1.00 0.00 H new ATOM 0 HH TYR A 85 8.686 -9.141 -11.934 1.00 0.00 H new ATOM 1317 N PHE A 86 7.954 -1.795 -7.127 1.00 0.00 N ATOM 1318 CA PHE A 86 7.814 -0.452 -6.489 1.00 0.00 C ATOM 1319 C PHE A 86 8.995 0.413 -6.929 1.00 0.00 C ATOM 1320 O PHE A 86 10.134 0.109 -6.631 1.00 0.00 O ATOM 1321 CB PHE A 86 7.827 -0.609 -4.965 1.00 0.00 C ATOM 1322 CG PHE A 86 7.722 0.751 -4.310 1.00 0.00 C ATOM 1323 CD1 PHE A 86 6.571 1.529 -4.494 1.00 0.00 C ATOM 1324 CD2 PHE A 86 8.773 1.236 -3.516 1.00 0.00 C ATOM 1325 CE1 PHE A 86 6.471 2.786 -3.888 1.00 0.00 C ATOM 1326 CE2 PHE A 86 8.670 2.494 -2.910 1.00 0.00 C ATOM 1327 CZ PHE A 86 7.520 3.268 -3.096 1.00 0.00 C ATOM 0 H PHE A 86 8.563 -2.445 -6.630 1.00 0.00 H new ATOM 0 HA PHE A 86 6.876 0.015 -6.789 1.00 0.00 H new ATOM 0 HB2 PHE A 86 6.997 -1.241 -4.648 1.00 0.00 H new ATOM 0 HB3 PHE A 86 8.744 -1.105 -4.649 1.00 0.00 H new ATOM 0 HD1 PHE A 86 5.761 1.158 -5.104 1.00 0.00 H new ATOM 0 HD2 PHE A 86 9.661 0.639 -3.372 1.00 0.00 H new ATOM 0 HE1 PHE A 86 5.584 3.385 -4.031 1.00 0.00 H new ATOM 0 HE2 PHE A 86 9.479 2.867 -2.299 1.00 0.00 H new ATOM 0 HZ PHE A 86 7.441 4.238 -2.628 1.00 0.00 H new ATOM 1337 N LYS A 87 8.741 1.477 -7.648 1.00 0.00 N ATOM 1338 CA LYS A 87 9.862 2.351 -8.124 1.00 0.00 C ATOM 1339 C LYS A 87 9.940 3.613 -7.267 1.00 0.00 C ATOM 1340 O LYS A 87 8.939 4.151 -6.837 1.00 0.00 O ATOM 1341 CB LYS A 87 9.615 2.744 -9.582 1.00 0.00 C ATOM 1342 CG LYS A 87 10.895 3.331 -10.180 1.00 0.00 C ATOM 1343 CD LYS A 87 10.670 3.643 -11.662 1.00 0.00 C ATOM 1344 CE LYS A 87 12.006 3.999 -12.319 1.00 0.00 C ATOM 1345 NZ LYS A 87 12.495 5.300 -11.780 1.00 0.00 N ATOM 0 H LYS A 87 7.808 1.780 -7.927 1.00 0.00 H new ATOM 0 HA LYS A 87 10.801 1.804 -8.043 1.00 0.00 H new ATOM 0 HB2 LYS A 87 9.300 1.872 -10.156 1.00 0.00 H new ATOM 0 HB3 LYS A 87 8.807 3.473 -9.641 1.00 0.00 H new ATOM 0 HG2 LYS A 87 11.176 4.238 -9.645 1.00 0.00 H new ATOM 0 HG3 LYS A 87 11.719 2.626 -10.067 1.00 0.00 H new ATOM 0 HD2 LYS A 87 10.225 2.783 -12.162 1.00 0.00 H new ATOM 0 HD3 LYS A 87 9.969 4.471 -11.768 1.00 0.00 H new ATOM 0 HE2 LYS A 87 12.738 3.215 -12.126 1.00 0.00 H new ATOM 0 HE3 LYS A 87 11.886 4.064 -13.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 13.318 5.617 -12.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 11.739 6.010 -11.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 12.770 5.182 -10.784 1.00 0.00 H new ATOM 1359 N VAL A 88 11.129 4.089 -7.016 1.00 0.00 N ATOM 1360 CA VAL A 88 11.285 5.317 -6.189 1.00 0.00 C ATOM 1361 C VAL A 88 12.737 5.800 -6.277 1.00 0.00 C ATOM 1362 O VAL A 88 13.664 5.015 -6.274 1.00 0.00 O ATOM 1363 CB VAL A 88 10.921 4.995 -4.734 1.00 0.00 C ATOM 1364 CG1 VAL A 88 11.612 3.696 -4.313 1.00 0.00 C ATOM 1365 CG2 VAL A 88 11.367 6.140 -3.815 1.00 0.00 C ATOM 0 H VAL A 88 12.001 3.678 -7.350 1.00 0.00 H new ATOM 0 HA VAL A 88 10.624 6.103 -6.555 1.00 0.00 H new ATOM 0 HB VAL A 88 9.841 4.877 -4.652 1.00 0.00 H new ATOM 0 HG11 VAL A 88 11.355 3.465 -3.279 1.00 0.00 H new ATOM 0 HG12 VAL A 88 11.282 2.882 -4.959 1.00 0.00 H new ATOM 0 HG13 VAL A 88 12.692 3.814 -4.400 1.00 0.00 H new ATOM 0 HG21 VAL A 88 11.104 5.902 -2.784 1.00 0.00 H new ATOM 0 HG22 VAL A 88 12.446 6.270 -3.894 1.00 0.00 H new ATOM 0 HG23 VAL A 88 10.868 7.062 -4.113 1.00 0.00 H new ATOM 1375 N GLY A 89 12.939 7.086 -6.356 1.00 0.00 N ATOM 1376 CA GLY A 89 14.328 7.619 -6.446 1.00 0.00 C ATOM 1377 C GLY A 89 15.000 7.094 -7.715 1.00 0.00 C ATOM 1378 O GLY A 89 14.812 7.624 -8.793 1.00 0.00 O ATOM 0 H GLY A 89 12.202 7.791 -6.362 1.00 0.00 H new ATOM 0 HA2 GLY A 89 14.310 8.709 -6.457 1.00 0.00 H new ATOM 0 HA3 GLY A 89 14.901 7.319 -5.569 1.00 0.00 H new ATOM 1382 N ASN A 90 15.782 6.054 -7.598 1.00 0.00 N ATOM 1383 CA ASN A 90 16.468 5.490 -8.799 1.00 0.00 C ATOM 1384 C ASN A 90 16.666 3.985 -8.608 1.00 0.00 C ATOM 1385 O ASN A 90 17.477 3.366 -9.270 1.00 0.00 O ATOM 1386 CB ASN A 90 17.830 6.166 -8.974 1.00 0.00 C ATOM 1387 CG ASN A 90 18.424 5.776 -10.329 1.00 0.00 C ATOM 1388 OD1 ASN A 90 19.074 4.757 -10.450 1.00 0.00 O ATOM 1389 ND2 ASN A 90 18.226 6.550 -11.362 1.00 0.00 N ATOM 0 H ASN A 90 15.976 5.569 -6.722 1.00 0.00 H new ATOM 0 HA ASN A 90 15.859 5.669 -9.685 1.00 0.00 H new ATOM 0 HB2 ASN A 90 17.721 7.249 -8.911 1.00 0.00 H new ATOM 0 HB3 ASN A 90 18.503 5.866 -8.170 1.00 0.00 H new ATOM 0 HD21 ASN A 90 18.617 6.299 -12.270 1.00 0.00 H new ATOM 0 HD22 ASN A 90 17.680 7.406 -11.261 1.00 0.00 H new ATOM 1396 N GLU A 91 15.923 3.392 -7.708 1.00 0.00 N ATOM 1397 CA GLU A 91 16.043 1.919 -7.457 1.00 0.00 C ATOM 1398 C GLU A 91 14.640 1.314 -7.423 1.00 0.00 C ATOM 1399 O GLU A 91 13.716 1.903 -6.894 1.00 0.00 O ATOM 1400 CB GLU A 91 16.735 1.681 -6.110 1.00 0.00 C ATOM 1401 CG GLU A 91 18.236 1.960 -6.239 1.00 0.00 C ATOM 1402 CD GLU A 91 18.464 3.460 -6.431 1.00 0.00 C ATOM 1403 OE1 GLU A 91 17.659 4.230 -5.936 1.00 0.00 O ATOM 1404 OE2 GLU A 91 19.442 3.814 -7.069 1.00 0.00 O ATOM 0 H GLU A 91 15.231 3.868 -7.130 1.00 0.00 H new ATOM 0 HA GLU A 91 16.632 1.454 -8.247 1.00 0.00 H new ATOM 0 HB2 GLU A 91 16.300 2.328 -5.348 1.00 0.00 H new ATOM 0 HB3 GLU A 91 16.574 0.653 -5.785 1.00 0.00 H new ATOM 0 HG2 GLU A 91 18.759 1.614 -5.347 1.00 0.00 H new ATOM 0 HG3 GLU A 91 18.647 1.408 -7.084 1.00 0.00 H new ATOM 1411 N THR A 92 14.468 0.147 -7.999 1.00 0.00 N ATOM 1412 CA THR A 92 13.118 -0.505 -8.021 1.00 0.00 C ATOM 1413 C THR A 92 13.125 -1.766 -7.160 1.00 0.00 C ATOM 1414 O THR A 92 14.006 -2.597 -7.256 1.00 0.00 O ATOM 1415 CB THR A 92 12.764 -0.878 -9.462 1.00 0.00 C ATOM 1416 OG1 THR A 92 11.433 -1.372 -9.508 1.00 0.00 O ATOM 1417 CG2 THR A 92 13.727 -1.954 -9.969 1.00 0.00 C ATOM 0 H THR A 92 15.208 -0.385 -8.457 1.00 0.00 H new ATOM 0 HA THR A 92 12.380 0.191 -7.623 1.00 0.00 H new ATOM 0 HB THR A 92 12.848 0.005 -10.095 1.00 0.00 H new ATOM 0 HG1 THR A 92 11.204 -1.610 -10.431 1.00 0.00 H new ATOM 0 HG21 THR A 92 13.471 -2.217 -10.996 1.00 0.00 H new ATOM 0 HG22 THR A 92 14.748 -1.574 -9.935 1.00 0.00 H new ATOM 0 HG23 THR A 92 13.649 -2.839 -9.338 1.00 0.00 H new ATOM 1425 N ARG A 93 12.134 -1.908 -6.319 1.00 0.00 N ATOM 1426 CA ARG A 93 12.051 -3.113 -5.440 1.00 0.00 C ATOM 1427 C ARG A 93 11.196 -4.178 -6.135 1.00 0.00 C ATOM 1428 O ARG A 93 10.526 -3.903 -7.110 1.00 0.00 O ATOM 1429 CB ARG A 93 11.402 -2.725 -4.103 1.00 0.00 C ATOM 1430 CG ARG A 93 11.843 -1.315 -3.695 1.00 0.00 C ATOM 1431 CD ARG A 93 13.370 -1.218 -3.686 1.00 0.00 C ATOM 1432 NE ARG A 93 13.960 -2.425 -3.016 1.00 0.00 N ATOM 1433 CZ ARG A 93 13.641 -2.754 -1.791 1.00 0.00 C ATOM 1434 NH1 ARG A 93 12.934 -1.946 -1.052 1.00 0.00 N ATOM 1435 NH2 ARG A 93 14.078 -3.877 -1.289 1.00 0.00 N ATOM 0 H ARG A 93 11.374 -1.237 -6.202 1.00 0.00 H new ATOM 0 HA ARG A 93 13.050 -3.507 -5.255 1.00 0.00 H new ATOM 0 HB2 ARG A 93 10.316 -2.764 -4.192 1.00 0.00 H new ATOM 0 HB3 ARG A 93 11.685 -3.441 -3.331 1.00 0.00 H new ATOM 0 HG2 ARG A 93 11.429 -0.582 -4.388 1.00 0.00 H new ATOM 0 HG3 ARG A 93 11.451 -1.076 -2.707 1.00 0.00 H new ATOM 0 HD2 ARG A 93 13.743 -1.141 -4.707 1.00 0.00 H new ATOM 0 HD3 ARG A 93 13.682 -0.314 -3.163 1.00 0.00 H new ATOM 0 HE ARG A 93 14.626 -3.003 -3.529 1.00 0.00 H new ATOM 0 HH11 ARG A 93 12.625 -1.050 -1.428 1.00 0.00 H new ATOM 0 HH12 ARG A 93 12.689 -2.210 -0.098 1.00 0.00 H new ATOM 0 HH21 ARG A 93 14.665 -4.493 -1.852 1.00 0.00 H new ATOM 0 HH22 ARG A 93 13.832 -4.139 -0.334 1.00 0.00 H new ATOM 1449 N LYS A 94 11.205 -5.393 -5.646 1.00 0.00 N ATOM 1450 CA LYS A 94 10.381 -6.458 -6.295 1.00 0.00 C ATOM 1451 C LYS A 94 9.900 -7.477 -5.251 1.00 0.00 C ATOM 1452 O LYS A 94 10.571 -8.450 -4.968 1.00 0.00 O ATOM 1453 CB LYS A 94 11.227 -7.167 -7.360 1.00 0.00 C ATOM 1454 CG LYS A 94 12.659 -7.341 -6.848 1.00 0.00 C ATOM 1455 CD LYS A 94 13.436 -8.249 -7.803 1.00 0.00 C ATOM 1456 CE LYS A 94 14.903 -8.307 -7.375 1.00 0.00 C ATOM 1457 NZ LYS A 94 15.554 -6.996 -7.658 1.00 0.00 N ATOM 0 H LYS A 94 11.743 -5.692 -4.832 1.00 0.00 H new ATOM 0 HA LYS A 94 9.507 -6.001 -6.759 1.00 0.00 H new ATOM 0 HB2 LYS A 94 10.794 -8.139 -7.595 1.00 0.00 H new ATOM 0 HB3 LYS A 94 11.228 -6.587 -8.283 1.00 0.00 H new ATOM 0 HG2 LYS A 94 13.150 -6.371 -6.772 1.00 0.00 H new ATOM 0 HG3 LYS A 94 12.649 -7.772 -5.847 1.00 0.00 H new ATOM 0 HD2 LYS A 94 13.006 -9.250 -7.800 1.00 0.00 H new ATOM 0 HD3 LYS A 94 13.359 -7.872 -8.823 1.00 0.00 H new ATOM 0 HE2 LYS A 94 14.974 -8.539 -6.312 1.00 0.00 H new ATOM 0 HE3 LYS A 94 15.418 -9.104 -7.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 16.587 -7.118 -7.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 15.230 -6.639 -8.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 15.300 -6.315 -6.914 1.00 0.00 H new ATOM 1471 N TYR A 95 8.728 -7.282 -4.698 1.00 0.00 N ATOM 1472 CA TYR A 95 8.200 -8.266 -3.701 1.00 0.00 C ATOM 1473 C TYR A 95 7.448 -9.362 -4.463 1.00 0.00 C ATOM 1474 O TYR A 95 7.386 -9.344 -5.677 1.00 0.00 O ATOM 1475 CB TYR A 95 7.234 -7.577 -2.728 1.00 0.00 C ATOM 1476 CG TYR A 95 7.867 -6.332 -2.149 1.00 0.00 C ATOM 1477 CD1 TYR A 95 7.868 -5.143 -2.888 1.00 0.00 C ATOM 1478 CD2 TYR A 95 8.448 -6.362 -0.870 1.00 0.00 C ATOM 1479 CE1 TYR A 95 8.448 -3.986 -2.353 1.00 0.00 C ATOM 1480 CE2 TYR A 95 9.026 -5.204 -0.338 1.00 0.00 C ATOM 1481 CZ TYR A 95 9.026 -4.017 -1.078 1.00 0.00 C ATOM 1482 OH TYR A 95 9.597 -2.876 -0.552 1.00 0.00 O ATOM 0 H TYR A 95 8.117 -6.489 -4.892 1.00 0.00 H new ATOM 0 HA TYR A 95 9.028 -8.687 -3.130 1.00 0.00 H new ATOM 0 HB2 TYR A 95 6.311 -7.316 -3.246 1.00 0.00 H new ATOM 0 HB3 TYR A 95 6.966 -8.263 -1.925 1.00 0.00 H new ATOM 0 HD1 TYR A 95 7.421 -5.118 -3.871 1.00 0.00 H new ATOM 0 HD2 TYR A 95 8.448 -7.278 -0.298 1.00 0.00 H new ATOM 0 HE1 TYR A 95 8.449 -3.069 -2.924 1.00 0.00 H new ATOM 0 HE2 TYR A 95 9.473 -5.227 0.645 1.00 0.00 H new ATOM 0 HH TYR A 95 9.951 -3.069 0.341 1.00 0.00 H new ATOM 1492 N LYS A 96 6.871 -10.312 -3.766 1.00 0.00 N ATOM 1493 CA LYS A 96 6.118 -11.408 -4.460 1.00 0.00 C ATOM 1494 C LYS A 96 4.825 -11.709 -3.700 1.00 0.00 C ATOM 1495 O LYS A 96 4.835 -12.328 -2.654 1.00 0.00 O ATOM 1496 CB LYS A 96 6.983 -12.673 -4.519 1.00 0.00 C ATOM 1497 CG LYS A 96 6.407 -13.638 -5.559 1.00 0.00 C ATOM 1498 CD LYS A 96 7.297 -14.877 -5.659 1.00 0.00 C ATOM 1499 CE LYS A 96 6.836 -15.741 -6.836 1.00 0.00 C ATOM 1500 NZ LYS A 96 7.031 -14.991 -8.110 1.00 0.00 N ATOM 0 H LYS A 96 6.888 -10.377 -2.748 1.00 0.00 H new ATOM 0 HA LYS A 96 5.875 -11.088 -5.473 1.00 0.00 H new ATOM 0 HB2 LYS A 96 8.009 -12.413 -4.778 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.013 -13.152 -3.540 1.00 0.00 H new ATOM 0 HG2 LYS A 96 5.394 -13.927 -5.279 1.00 0.00 H new ATOM 0 HG3 LYS A 96 6.342 -13.146 -6.529 1.00 0.00 H new ATOM 0 HD2 LYS A 96 8.337 -14.581 -5.796 1.00 0.00 H new ATOM 0 HD3 LYS A 96 7.248 -15.449 -4.733 1.00 0.00 H new ATOM 0 HE2 LYS A 96 7.401 -16.673 -6.860 1.00 0.00 H new ATOM 0 HE3 LYS A 96 5.786 -16.008 -6.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 7.150 -15.664 -8.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 6.200 -14.392 -8.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 7.879 -14.393 -8.035 1.00 0.00 H new ATOM 1514 N MET A 97 3.708 -11.281 -4.226 1.00 0.00 N ATOM 1515 CA MET A 97 2.407 -11.545 -3.547 1.00 0.00 C ATOM 1516 C MET A 97 2.306 -13.032 -3.196 1.00 0.00 C ATOM 1517 O MET A 97 2.258 -13.879 -4.066 1.00 0.00 O ATOM 1518 CB MET A 97 1.262 -11.160 -4.486 1.00 0.00 C ATOM 1519 CG MET A 97 -0.058 -11.168 -3.715 1.00 0.00 C ATOM 1520 SD MET A 97 -1.439 -11.078 -4.882 1.00 0.00 S ATOM 1521 CE MET A 97 -1.474 -9.276 -5.048 1.00 0.00 C ATOM 0 H MET A 97 3.641 -10.758 -5.099 1.00 0.00 H new ATOM 0 HA MET A 97 2.344 -10.955 -2.633 1.00 0.00 H new ATOM 0 HB2 MET A 97 1.442 -10.172 -4.909 1.00 0.00 H new ATOM 0 HB3 MET A 97 1.212 -11.859 -5.320 1.00 0.00 H new ATOM 0 HG2 MET A 97 -0.135 -12.074 -3.114 1.00 0.00 H new ATOM 0 HG3 MET A 97 -0.094 -10.324 -3.026 1.00 0.00 H new ATOM 0 HE1 MET A 97 -2.268 -8.989 -5.737 1.00 0.00 H new ATOM 0 HE2 MET A 97 -1.659 -8.824 -4.073 1.00 0.00 H new ATOM 0 HE3 MET A 97 -0.516 -8.927 -5.434 1.00 0.00 H new ATOM 1531 N THR A 98 2.269 -13.360 -1.930 1.00 0.00 N ATOM 1532 CA THR A 98 2.168 -14.798 -1.537 1.00 0.00 C ATOM 1533 C THR A 98 1.593 -14.910 -0.122 1.00 0.00 C ATOM 1534 O THR A 98 1.812 -15.884 0.570 1.00 0.00 O ATOM 1535 CB THR A 98 3.556 -15.440 -1.576 1.00 0.00 C ATOM 1536 OG1 THR A 98 3.444 -16.824 -1.274 1.00 0.00 O ATOM 1537 CG2 THR A 98 4.466 -14.763 -0.550 1.00 0.00 C ATOM 0 H THR A 98 2.304 -12.698 -1.155 1.00 0.00 H new ATOM 0 HA THR A 98 1.509 -15.314 -2.235 1.00 0.00 H new ATOM 0 HB THR A 98 3.984 -15.318 -2.571 1.00 0.00 H new ATOM 0 HG1 THR A 98 2.855 -16.943 -0.500 1.00 0.00 H new ATOM 0 HG21 THR A 98 5.454 -15.223 -0.580 1.00 0.00 H new ATOM 0 HG22 THR A 98 4.552 -13.702 -0.784 1.00 0.00 H new ATOM 0 HG23 THR A 98 4.041 -14.881 0.447 1.00 0.00 H new ATOM 1545 N SER A 99 0.852 -13.928 0.310 1.00 0.00 N ATOM 1546 CA SER A 99 0.255 -13.983 1.669 1.00 0.00 C ATOM 1547 C SER A 99 -0.837 -12.924 1.749 1.00 0.00 C ATOM 1548 O SER A 99 -0.586 -11.750 1.566 1.00 0.00 O ATOM 1549 CB SER A 99 1.329 -13.706 2.723 1.00 0.00 C ATOM 1550 OG SER A 99 2.111 -14.877 2.917 1.00 0.00 O ATOM 0 H SER A 99 0.635 -13.087 -0.224 1.00 0.00 H new ATOM 0 HA SER A 99 -0.164 -14.972 1.857 1.00 0.00 H new ATOM 0 HB2 SER A 99 1.964 -12.880 2.403 1.00 0.00 H new ATOM 0 HB3 SER A 99 0.864 -13.406 3.662 1.00 0.00 H new ATOM 0 HG SER A 99 1.867 -15.548 2.246 1.00 0.00 H new ATOM 1556 N ILE A 100 -2.054 -13.330 1.996 1.00 0.00 N ATOM 1557 CA ILE A 100 -3.183 -12.356 2.064 1.00 0.00 C ATOM 1558 C ILE A 100 -3.990 -12.593 3.342 1.00 0.00 C ATOM 1559 O ILE A 100 -3.832 -13.594 4.012 1.00 0.00 O ATOM 1560 CB ILE A 100 -4.066 -12.554 0.828 1.00 0.00 C ATOM 1561 CG1 ILE A 100 -3.302 -12.080 -0.416 1.00 0.00 C ATOM 1562 CG2 ILE A 100 -5.356 -11.743 0.972 1.00 0.00 C ATOM 1563 CD1 ILE A 100 -3.970 -12.638 -1.674 1.00 0.00 C ATOM 0 H ILE A 100 -2.317 -14.303 2.155 1.00 0.00 H new ATOM 0 HA ILE A 100 -2.804 -11.334 2.083 1.00 0.00 H new ATOM 0 HB ILE A 100 -4.318 -13.610 0.729 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -3.288 -10.991 -0.453 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -2.265 -12.411 -0.366 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -5.978 -11.889 0.089 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -5.898 -12.076 1.857 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -5.112 -10.686 1.073 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -3.425 -12.300 -2.556 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -3.961 -13.727 -1.638 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -5.000 -12.285 -1.726 1.00 0.00 H new ATOM 1842 N ASP A 118 10.282 -10.827 6.491 1.00 0.00 N ATOM 1843 CA ASP A 118 11.212 -10.065 5.589 1.00 0.00 C ATOM 1844 C ASP A 118 10.492 -8.828 5.053 1.00 0.00 C ATOM 1845 O ASP A 118 9.300 -8.698 5.204 1.00 0.00 O ATOM 1846 CB ASP A 118 11.622 -10.958 4.415 1.00 0.00 C ATOM 1847 CG ASP A 118 12.609 -12.020 4.902 1.00 0.00 C ATOM 1848 OD1 ASP A 118 13.669 -11.645 5.375 1.00 0.00 O ATOM 1849 OD2 ASP A 118 12.287 -13.193 4.791 1.00 0.00 O ATOM 0 HA ASP A 118 12.098 -9.762 6.147 1.00 0.00 H new ATOM 0 HB2 ASP A 118 10.742 -11.435 3.983 1.00 0.00 H new ATOM 0 HB3 ASP A 118 12.078 -10.356 3.628 1.00 0.00 H new ATOM 1854 N LYS A 119 11.210 -7.925 4.422 1.00 0.00 N ATOM 1855 CA LYS A 119 10.565 -6.692 3.858 1.00 0.00 C ATOM 1856 C LYS A 119 9.229 -7.074 3.208 1.00 0.00 C ATOM 1857 O LYS A 119 9.170 -7.427 2.047 1.00 0.00 O ATOM 1858 CB LYS A 119 11.484 -6.079 2.793 1.00 0.00 C ATOM 1859 CG LYS A 119 12.866 -5.753 3.394 1.00 0.00 C ATOM 1860 CD LYS A 119 12.855 -4.344 4.003 1.00 0.00 C ATOM 1861 CE LYS A 119 14.038 -4.185 4.962 1.00 0.00 C ATOM 1862 NZ LYS A 119 13.987 -2.836 5.593 1.00 0.00 N ATOM 0 H LYS A 119 12.217 -7.989 4.273 1.00 0.00 H new ATOM 0 HA LYS A 119 10.395 -5.970 4.657 1.00 0.00 H new ATOM 0 HB2 LYS A 119 11.598 -6.773 1.960 1.00 0.00 H new ATOM 0 HB3 LYS A 119 11.032 -5.172 2.393 1.00 0.00 H new ATOM 0 HG2 LYS A 119 13.121 -6.487 4.159 1.00 0.00 H new ATOM 0 HG3 LYS A 119 13.632 -5.818 2.621 1.00 0.00 H new ATOM 0 HD2 LYS A 119 12.913 -3.596 3.213 1.00 0.00 H new ATOM 0 HD3 LYS A 119 11.919 -4.175 4.535 1.00 0.00 H new ATOM 0 HE2 LYS A 119 14.005 -4.959 5.729 1.00 0.00 H new ATOM 0 HE3 LYS A 119 14.977 -4.311 4.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 14.424 -2.877 6.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 14.504 -2.156 5.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 12.996 -2.532 5.684 1.00 0.00 H new ATOM 1876 N GLN A 120 8.160 -7.032 3.961 1.00 0.00 N ATOM 1877 CA GLN A 120 6.831 -7.420 3.407 1.00 0.00 C ATOM 1878 C GLN A 120 6.100 -6.193 2.864 1.00 0.00 C ATOM 1879 O GLN A 120 6.376 -5.071 3.239 1.00 0.00 O ATOM 1880 CB GLN A 120 5.985 -8.081 4.506 1.00 0.00 C ATOM 1881 CG GLN A 120 6.036 -7.248 5.806 1.00 0.00 C ATOM 1882 CD GLN A 120 7.177 -7.722 6.714 1.00 0.00 C ATOM 1883 OE1 GLN A 120 7.531 -8.881 6.709 1.00 0.00 O ATOM 1884 NE2 GLN A 120 7.761 -6.866 7.509 1.00 0.00 N ATOM 0 H GLN A 120 8.152 -6.744 4.940 1.00 0.00 H new ATOM 0 HA GLN A 120 6.985 -8.126 2.591 1.00 0.00 H new ATOM 0 HB2 GLN A 120 4.953 -8.177 4.170 1.00 0.00 H new ATOM 0 HB3 GLN A 120 6.353 -9.089 4.699 1.00 0.00 H new ATOM 0 HG2 GLN A 120 6.173 -6.194 5.563 1.00 0.00 H new ATOM 0 HG3 GLN A 120 5.086 -7.332 6.334 1.00 0.00 H new ATOM 0 HE21 GLN A 120 7.464 -5.890 7.514 1.00 0.00 H new ATOM 0 HE22 GLN A 120 8.514 -7.173 8.125 1.00 0.00 H new ATOM 1893 N LEU A 121 5.164 -6.414 1.975 1.00 0.00 N ATOM 1894 CA LEU A 121 4.383 -5.289 1.370 1.00 0.00 C ATOM 1895 C LEU A 121 2.919 -5.405 1.811 1.00 0.00 C ATOM 1896 O LEU A 121 2.172 -6.211 1.294 1.00 0.00 O ATOM 1897 CB LEU A 121 4.477 -5.404 -0.162 1.00 0.00 C ATOM 1898 CG LEU A 121 4.234 -4.042 -0.836 1.00 0.00 C ATOM 1899 CD1 LEU A 121 2.923 -3.436 -0.326 1.00 0.00 C ATOM 1900 CD2 LEU A 121 5.405 -3.074 -0.555 1.00 0.00 C ATOM 0 H LEU A 121 4.903 -7.341 1.637 1.00 0.00 H new ATOM 0 HA LEU A 121 4.780 -4.327 1.694 1.00 0.00 H new ATOM 0 HB2 LEU A 121 5.461 -5.781 -0.442 1.00 0.00 H new ATOM 0 HB3 LEU A 121 3.744 -6.127 -0.521 1.00 0.00 H new ATOM 0 HG LEU A 121 4.166 -4.197 -1.913 1.00 0.00 H new ATOM 0 HD11 LEU A 121 2.757 -2.472 -0.807 1.00 0.00 H new ATOM 0 HD12 LEU A 121 2.096 -4.106 -0.561 1.00 0.00 H new ATOM 0 HD13 LEU A 121 2.982 -3.298 0.754 1.00 0.00 H new ATOM 0 HD21 LEU A 121 5.211 -2.118 -1.041 1.00 0.00 H new ATOM 0 HD22 LEU A 121 5.501 -2.922 0.520 1.00 0.00 H new ATOM 0 HD23 LEU A 121 6.330 -3.499 -0.945 1.00 0.00 H new ATOM 1912 N THR A 122 2.499 -4.604 2.757 1.00 0.00 N ATOM 1913 CA THR A 122 1.079 -4.670 3.224 1.00 0.00 C ATOM 1914 C THR A 122 0.258 -3.601 2.501 1.00 0.00 C ATOM 1915 O THR A 122 0.674 -2.466 2.376 1.00 0.00 O ATOM 1916 CB THR A 122 1.023 -4.421 4.734 1.00 0.00 C ATOM 1917 OG1 THR A 122 1.998 -5.225 5.382 1.00 0.00 O ATOM 1918 CG2 THR A 122 -0.368 -4.778 5.260 1.00 0.00 C ATOM 0 H THR A 122 3.077 -3.907 3.227 1.00 0.00 H new ATOM 0 HA THR A 122 0.670 -5.656 3.005 1.00 0.00 H new ATOM 0 HB THR A 122 1.227 -3.370 4.937 1.00 0.00 H new ATOM 0 HG1 THR A 122 2.639 -4.649 5.849 1.00 0.00 H new ATOM 0 HG21 THR A 122 -0.407 -4.601 6.335 1.00 0.00 H new ATOM 0 HG22 THR A 122 -1.115 -4.159 4.763 1.00 0.00 H new ATOM 0 HG23 THR A 122 -0.575 -5.829 5.058 1.00 0.00 H new ATOM 1926 N LEU A 123 -0.910 -3.960 2.022 1.00 0.00 N ATOM 1927 CA LEU A 123 -1.784 -2.979 1.298 1.00 0.00 C ATOM 1928 C LEU A 123 -3.106 -2.830 2.056 1.00 0.00 C ATOM 1929 O LEU A 123 -3.585 -3.760 2.676 1.00 0.00 O ATOM 1930 CB LEU A 123 -2.058 -3.500 -0.122 1.00 0.00 C ATOM 1931 CG LEU A 123 -0.864 -3.171 -1.049 1.00 0.00 C ATOM 1932 CD1 LEU A 123 -0.773 -4.209 -2.174 1.00 0.00 C ATOM 1933 CD2 LEU A 123 -1.047 -1.774 -1.662 1.00 0.00 C ATOM 0 H LEU A 123 -1.299 -4.899 2.102 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.288 -2.010 1.240 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -2.223 -4.577 -0.097 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -2.969 -3.047 -0.514 1.00 0.00 H new ATOM 0 HG LEU A 123 0.053 -3.193 -0.461 1.00 0.00 H new ATOM 0 HD11 LEU A 123 0.070 -3.970 -2.822 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -0.631 -5.200 -1.744 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -1.694 -4.195 -2.757 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -0.203 -1.549 -2.314 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -1.970 -1.749 -2.242 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -1.099 -1.031 -0.866 1.00 0.00 H new ATOM 1945 N ILE A 124 -3.694 -1.662 2.009 1.00 0.00 N ATOM 1946 CA ILE A 124 -4.990 -1.420 2.721 1.00 0.00 C ATOM 1947 C ILE A 124 -5.943 -0.695 1.777 1.00 0.00 C ATOM 1948 O ILE A 124 -5.539 0.145 1.000 1.00 0.00 O ATOM 1949 CB ILE A 124 -4.749 -0.522 3.938 1.00 0.00 C ATOM 1950 CG1 ILE A 124 -3.739 -1.176 4.885 1.00 0.00 C ATOM 1951 CG2 ILE A 124 -6.073 -0.296 4.678 1.00 0.00 C ATOM 1952 CD1 ILE A 124 -3.208 -0.125 5.860 1.00 0.00 C ATOM 0 H ILE A 124 -3.329 -0.855 1.503 1.00 0.00 H new ATOM 0 HA ILE A 124 -5.411 -2.374 3.039 1.00 0.00 H new ATOM 0 HB ILE A 124 -4.350 0.434 3.600 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -4.212 -1.991 5.433 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -2.917 -1.609 4.316 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -5.901 0.343 5.544 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -6.787 0.184 4.008 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -6.474 -1.254 5.008 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -2.488 -0.587 6.536 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -2.721 0.675 5.303 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -4.036 0.287 6.437 1.00 0.00 H new ATOM 1964 N THR A 125 -7.210 -0.998 1.836 1.00 0.00 N ATOM 1965 CA THR A 125 -8.176 -0.302 0.937 1.00 0.00 C ATOM 1966 C THR A 125 -8.722 0.938 1.644 1.00 0.00 C ATOM 1967 O THR A 125 -8.783 0.997 2.856 1.00 0.00 O ATOM 1968 CB THR A 125 -9.340 -1.228 0.607 1.00 0.00 C ATOM 1969 OG1 THR A 125 -10.285 -1.192 1.666 1.00 0.00 O ATOM 1970 CG2 THR A 125 -8.834 -2.658 0.420 1.00 0.00 C ATOM 0 H THR A 125 -7.617 -1.692 2.463 1.00 0.00 H new ATOM 0 HA THR A 125 -7.663 -0.017 0.018 1.00 0.00 H new ATOM 0 HB THR A 125 -9.812 -0.895 -0.317 1.00 0.00 H new ATOM 0 HG1 THR A 125 -11.036 -1.786 1.455 1.00 0.00 H new ATOM 0 HG21 THR A 125 -9.673 -3.313 0.184 1.00 0.00 H new ATOM 0 HG22 THR A 125 -8.112 -2.685 -0.396 1.00 0.00 H new ATOM 0 HG23 THR A 125 -8.355 -2.998 1.339 1.00 0.00 H new ATOM 1978 N CYS A 126 -9.127 1.927 0.896 1.00 0.00 N ATOM 1979 CA CYS A 126 -9.678 3.166 1.518 1.00 0.00 C ATOM 1980 C CYS A 126 -10.721 3.783 0.581 1.00 0.00 C ATOM 1981 O CYS A 126 -10.402 4.571 -0.288 1.00 0.00 O ATOM 1982 CB CYS A 126 -8.539 4.159 1.766 1.00 0.00 C ATOM 1983 SG CYS A 126 -7.722 3.754 3.330 1.00 0.00 S ATOM 0 H CYS A 126 -9.100 1.931 -0.124 1.00 0.00 H new ATOM 0 HA CYS A 126 -10.152 2.924 2.469 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -7.821 4.119 0.947 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -8.929 5.176 1.799 1.00 0.00 H new ATOM 0 HG CYS A 126 -8.287 4.412 4.298 1.00 0.00 H new ATOM 1989 N ASP A 127 -11.966 3.431 0.755 1.00 0.00 N ATOM 1990 CA ASP A 127 -13.041 3.993 -0.115 1.00 0.00 C ATOM 1991 C ASP A 127 -14.336 4.080 0.692 1.00 0.00 C ATOM 1992 O ASP A 127 -14.590 3.268 1.559 1.00 0.00 O ATOM 1993 CB ASP A 127 -13.252 3.076 -1.322 1.00 0.00 C ATOM 1994 CG ASP A 127 -13.464 1.639 -0.842 1.00 0.00 C ATOM 1995 OD1 ASP A 127 -12.508 1.048 -0.367 1.00 0.00 O ATOM 1996 OD2 ASP A 127 -14.577 1.155 -0.959 1.00 0.00 O ATOM 0 H ASP A 127 -12.287 2.774 1.466 1.00 0.00 H new ATOM 0 HA ASP A 127 -12.755 4.985 -0.463 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -14.115 3.409 -1.898 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -12.388 3.125 -1.985 1.00 0.00 H new ATOM 2001 N ASP A 128 -15.150 5.065 0.426 1.00 0.00 N ATOM 2002 CA ASP A 128 -16.419 5.203 1.192 1.00 0.00 C ATOM 2003 C ASP A 128 -16.079 5.355 2.674 1.00 0.00 C ATOM 2004 O ASP A 128 -16.411 4.517 3.483 1.00 0.00 O ATOM 2005 CB ASP A 128 -17.286 3.954 0.985 1.00 0.00 C ATOM 2006 CG ASP A 128 -17.201 3.515 -0.478 1.00 0.00 C ATOM 2007 OD1 ASP A 128 -16.246 2.835 -0.816 1.00 0.00 O ATOM 2008 OD2 ASP A 128 -18.091 3.867 -1.234 1.00 0.00 O ATOM 0 H ASP A 128 -14.991 5.777 -0.286 1.00 0.00 H new ATOM 0 HA ASP A 128 -16.971 6.077 0.845 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -16.947 3.150 1.638 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -18.321 4.167 1.253 1.00 0.00 H new ATOM 2013 N TYR A 129 -15.404 6.409 3.032 1.00 0.00 N ATOM 2014 CA TYR A 129 -15.033 6.595 4.458 1.00 0.00 C ATOM 2015 C TYR A 129 -16.300 6.731 5.307 1.00 0.00 C ATOM 2016 O TYR A 129 -17.143 7.568 5.049 1.00 0.00 O ATOM 2017 CB TYR A 129 -14.158 7.847 4.603 1.00 0.00 C ATOM 2018 CG TYR A 129 -13.688 7.983 6.034 1.00 0.00 C ATOM 2019 CD1 TYR A 129 -14.553 8.478 7.017 1.00 0.00 C ATOM 2020 CD2 TYR A 129 -12.382 7.617 6.375 1.00 0.00 C ATOM 2021 CE1 TYR A 129 -14.108 8.604 8.339 1.00 0.00 C ATOM 2022 CE2 TYR A 129 -11.937 7.743 7.693 1.00 0.00 C ATOM 2023 CZ TYR A 129 -12.800 8.237 8.677 1.00 0.00 C ATOM 2024 OH TYR A 129 -12.363 8.361 9.981 1.00 0.00 O ATOM 0 H TYR A 129 -15.094 7.147 2.400 1.00 0.00 H new ATOM 0 HA TYR A 129 -14.469 5.728 4.804 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -13.300 7.781 3.934 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -14.723 8.732 4.311 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -15.562 8.762 6.756 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -11.715 7.235 5.616 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -14.775 8.985 9.099 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -10.928 7.459 7.952 1.00 0.00 H new ATOM 0 HH TYR A 129 -11.747 7.628 10.191 1.00 0.00 H new ATOM 2034 N ASN A 130 -16.447 5.908 6.318 1.00 0.00 N ATOM 2035 CA ASN A 130 -17.665 5.989 7.177 1.00 0.00 C ATOM 2036 C ASN A 130 -17.450 7.050 8.263 1.00 0.00 C ATOM 2037 O ASN A 130 -16.599 6.916 9.119 1.00 0.00 O ATOM 2038 CB ASN A 130 -17.904 4.620 7.828 1.00 0.00 C ATOM 2039 CG ASN A 130 -18.973 4.734 8.918 1.00 0.00 C ATOM 2040 OD1 ASN A 130 -18.799 5.454 9.880 1.00 0.00 O ATOM 2041 ND2 ASN A 130 -20.077 4.049 8.807 1.00 0.00 N ATOM 0 H ASN A 130 -15.777 5.186 6.583 1.00 0.00 H new ATOM 0 HA ASN A 130 -18.531 6.264 6.575 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -18.219 3.900 7.073 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -16.975 4.246 8.257 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -20.795 4.118 9.528 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -20.223 3.444 7.999 1.00 0.00 H new ATOM 2048 N GLU A 131 -18.219 8.108 8.226 1.00 0.00 N ATOM 2049 CA GLU A 131 -18.066 9.187 9.247 1.00 0.00 C ATOM 2050 C GLU A 131 -18.848 8.824 10.510 1.00 0.00 C ATOM 2051 O GLU A 131 -18.881 9.570 11.467 1.00 0.00 O ATOM 2052 CB GLU A 131 -18.603 10.504 8.679 1.00 0.00 C ATOM 2053 CG GLU A 131 -19.970 10.264 8.039 1.00 0.00 C ATOM 2054 CD GLU A 131 -20.646 11.608 7.761 1.00 0.00 C ATOM 2055 OE1 GLU A 131 -20.871 12.343 8.709 1.00 0.00 O ATOM 2056 OE2 GLU A 131 -20.925 11.881 6.606 1.00 0.00 O ATOM 0 H GLU A 131 -18.948 8.271 7.531 1.00 0.00 H new ATOM 0 HA GLU A 131 -17.011 9.296 9.497 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -18.686 11.247 9.472 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.909 10.903 7.940 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -19.856 9.704 7.111 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -20.593 9.662 8.701 1.00 0.00 H new ATOM 2063 N LYS A 132 -19.477 7.682 10.523 1.00 0.00 N ATOM 2064 CA LYS A 132 -20.252 7.275 11.728 1.00 0.00 C ATOM 2065 C LYS A 132 -19.291 6.722 12.784 1.00 0.00 C ATOM 2066 O LYS A 132 -19.272 7.167 13.914 1.00 0.00 O ATOM 2067 CB LYS A 132 -21.270 6.196 11.347 1.00 0.00 C ATOM 2068 CG LYS A 132 -22.016 6.614 10.075 1.00 0.00 C ATOM 2069 CD LYS A 132 -22.770 7.925 10.323 1.00 0.00 C ATOM 2070 CE LYS A 132 -23.828 8.125 9.236 1.00 0.00 C ATOM 2071 NZ LYS A 132 -24.534 9.417 9.462 1.00 0.00 N ATOM 0 H LYS A 132 -19.488 7.014 9.752 1.00 0.00 H new ATOM 0 HA LYS A 132 -20.780 8.140 12.130 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -20.763 5.245 11.186 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -21.978 6.046 12.162 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -21.311 6.739 9.253 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -22.715 5.832 9.779 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -23.243 7.904 11.305 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -22.072 8.763 10.323 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -23.359 8.122 8.252 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -24.541 7.301 9.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -25.253 9.553 8.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -24.994 9.403 10.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -23.848 10.198 9.426 1.00 0.00 H new ATOM 2085 N THR A 133 -18.488 5.754 12.422 1.00 0.00 N ATOM 2086 CA THR A 133 -17.521 5.169 13.400 1.00 0.00 C ATOM 2087 C THR A 133 -16.160 5.849 13.237 1.00 0.00 C ATOM 2088 O THR A 133 -15.262 5.664 14.036 1.00 0.00 O ATOM 2089 CB THR A 133 -17.374 3.669 13.134 1.00 0.00 C ATOM 2090 OG1 THR A 133 -16.905 3.469 11.808 1.00 0.00 O ATOM 2091 CG2 THR A 133 -18.730 2.983 13.307 1.00 0.00 C ATOM 0 H THR A 133 -18.460 5.343 11.489 1.00 0.00 H new ATOM 0 HA THR A 133 -17.888 5.326 14.414 1.00 0.00 H new ATOM 0 HB THR A 133 -16.661 3.242 13.840 1.00 0.00 H new ATOM 0 HG1 THR A 133 -16.809 2.509 11.636 1.00 0.00 H new ATOM 0 HG21 THR A 133 -18.624 1.915 13.117 1.00 0.00 H new ATOM 0 HG22 THR A 133 -19.088 3.137 14.325 1.00 0.00 H new ATOM 0 HG23 THR A 133 -19.445 3.408 12.602 1.00 0.00 H new ATOM 2099 N GLY A 134 -15.996 6.633 12.206 1.00 0.00 N ATOM 2100 CA GLY A 134 -14.691 7.320 11.993 1.00 0.00 C ATOM 2101 C GLY A 134 -13.661 6.310 11.489 1.00 0.00 C ATOM 2102 O GLY A 134 -12.527 6.295 11.926 1.00 0.00 O ATOM 0 H GLY A 134 -16.709 6.827 11.503 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -14.807 8.129 11.271 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -14.349 7.771 12.924 1.00 0.00 H new ATOM 2106 N VAL A 135 -14.048 5.459 10.574 1.00 0.00 N ATOM 2107 CA VAL A 135 -13.096 4.439 10.041 1.00 0.00 C ATOM 2108 C VAL A 135 -13.414 4.158 8.572 1.00 0.00 C ATOM 2109 O VAL A 135 -14.545 4.273 8.143 1.00 0.00 O ATOM 2110 CB VAL A 135 -13.259 3.135 10.831 1.00 0.00 C ATOM 2111 CG1 VAL A 135 -12.031 2.246 10.619 1.00 0.00 C ATOM 2112 CG2 VAL A 135 -13.406 3.452 12.322 1.00 0.00 C ATOM 0 H VAL A 135 -14.985 5.427 10.172 1.00 0.00 H new ATOM 0 HA VAL A 135 -12.077 4.815 10.136 1.00 0.00 H new ATOM 0 HB VAL A 135 -14.149 2.613 10.481 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -12.150 1.320 11.182 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -11.928 2.015 9.559 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -11.139 2.769 10.965 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -13.522 2.524 12.882 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -12.518 3.978 12.671 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -14.283 4.080 12.476 1.00 0.00 H new ATOM 2122 N TRP A 136 -12.438 3.764 7.801 1.00 0.00 N ATOM 2123 CA TRP A 136 -12.717 3.451 6.382 1.00 0.00 C ATOM 2124 C TRP A 136 -13.767 2.343 6.339 1.00 0.00 C ATOM 2125 O TRP A 136 -13.535 1.242 6.793 1.00 0.00 O ATOM 2126 CB TRP A 136 -11.425 2.993 5.687 1.00 0.00 C ATOM 2127 CG TRP A 136 -10.651 4.192 5.244 1.00 0.00 C ATOM 2128 CD1 TRP A 136 -9.508 4.639 5.810 1.00 0.00 C ATOM 2129 CD2 TRP A 136 -10.956 5.109 4.158 1.00 0.00 C ATOM 2130 NE1 TRP A 136 -9.098 5.776 5.138 1.00 0.00 N ATOM 2131 CE2 TRP A 136 -9.954 6.102 4.111 1.00 0.00 C ATOM 2132 CE3 TRP A 136 -11.996 5.170 3.219 1.00 0.00 C ATOM 2133 CZ2 TRP A 136 -9.983 7.125 3.165 1.00 0.00 C ATOM 2134 CZ3 TRP A 136 -12.031 6.197 2.261 1.00 0.00 C ATOM 2135 CH2 TRP A 136 -11.023 7.174 2.235 1.00 0.00 C ATOM 0 H TRP A 136 -11.468 3.648 8.094 1.00 0.00 H new ATOM 0 HA TRP A 136 -13.088 4.334 5.862 1.00 0.00 H new ATOM 0 HB2 TRP A 136 -10.825 2.390 6.369 1.00 0.00 H new ATOM 0 HB3 TRP A 136 -11.663 2.363 4.830 1.00 0.00 H new ATOM 0 HD1 TRP A 136 -9.000 4.184 6.647 1.00 0.00 H new ATOM 0 HE1 TRP A 136 -8.261 6.309 5.375 1.00 0.00 H new ATOM 0 HE3 TRP A 136 -12.775 4.422 3.232 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 -9.206 7.875 3.151 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 -12.836 6.235 1.542 1.00 0.00 H new ATOM 0 HH2 TRP A 136 -11.052 7.962 1.497 1.00 0.00 H new ATOM 2146 N GLU A 137 -14.932 2.642 5.822 1.00 0.00 N ATOM 2147 CA GLU A 137 -16.030 1.627 5.764 1.00 0.00 C ATOM 2148 C GLU A 137 -15.463 0.236 5.435 1.00 0.00 C ATOM 2149 O GLU A 137 -15.394 -0.628 6.285 1.00 0.00 O ATOM 2150 CB GLU A 137 -17.048 2.029 4.694 1.00 0.00 C ATOM 2151 CG GLU A 137 -18.196 1.016 4.671 1.00 0.00 C ATOM 2152 CD GLU A 137 -19.281 1.495 3.706 1.00 0.00 C ATOM 2153 OE1 GLU A 137 -19.568 2.681 3.709 1.00 0.00 O ATOM 2154 OE2 GLU A 137 -19.807 0.668 2.979 1.00 0.00 O ATOM 0 H GLU A 137 -15.172 3.554 5.434 1.00 0.00 H new ATOM 0 HA GLU A 137 -16.517 1.586 6.738 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -17.434 3.027 4.902 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -16.567 2.071 3.717 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -17.826 0.038 4.362 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -18.611 0.898 5.672 1.00 0.00 H new ATOM 2161 N LYS A 138 -15.054 0.015 4.212 1.00 0.00 N ATOM 2162 CA LYS A 138 -14.487 -1.319 3.836 1.00 0.00 C ATOM 2163 C LYS A 138 -12.968 -1.301 4.044 1.00 0.00 C ATOM 2164 O LYS A 138 -12.330 -0.278 3.896 1.00 0.00 O ATOM 2165 CB LYS A 138 -14.790 -1.609 2.362 1.00 0.00 C ATOM 2166 CG LYS A 138 -16.287 -1.426 2.096 1.00 0.00 C ATOM 2167 CD LYS A 138 -16.566 -1.565 0.595 1.00 0.00 C ATOM 2168 CE LYS A 138 -16.141 -2.956 0.102 1.00 0.00 C ATOM 2169 NZ LYS A 138 -14.690 -2.940 -0.235 1.00 0.00 N ATOM 0 H LYS A 138 -15.087 0.699 3.456 1.00 0.00 H new ATOM 0 HA LYS A 138 -14.936 -2.092 4.459 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -14.213 -0.940 1.724 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -14.488 -2.626 2.112 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -16.858 -2.169 2.652 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -16.611 -0.446 2.447 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -17.627 -1.411 0.399 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -16.025 -0.795 0.045 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -16.339 -3.703 0.871 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -16.726 -3.238 -0.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -14.561 -3.217 -1.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -14.310 -1.983 -0.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -14.184 -3.610 0.379 1.00 0.00 H new ATOM 2183 N ARG A 139 -12.380 -2.420 4.393 1.00 0.00 N ATOM 2184 CA ARG A 139 -10.901 -2.445 4.613 1.00 0.00 C ATOM 2185 C ARG A 139 -10.337 -3.850 4.378 1.00 0.00 C ATOM 2186 O ARG A 139 -10.282 -4.658 5.283 1.00 0.00 O ATOM 2187 CB ARG A 139 -10.594 -2.046 6.057 1.00 0.00 C ATOM 2188 CG ARG A 139 -10.910 -0.568 6.274 1.00 0.00 C ATOM 2189 CD ARG A 139 -10.319 -0.123 7.613 1.00 0.00 C ATOM 2190 NE ARG A 139 -10.429 -1.237 8.597 1.00 0.00 N ATOM 2191 CZ ARG A 139 -9.731 -1.206 9.699 1.00 0.00 C ATOM 2192 NH1 ARG A 139 -8.935 -0.200 9.939 1.00 0.00 N ATOM 2193 NH2 ARG A 139 -9.829 -2.181 10.561 1.00 0.00 N ATOM 0 H ARG A 139 -12.857 -3.311 4.534 1.00 0.00 H new ATOM 0 HA ARG A 139 -10.443 -1.748 3.911 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -11.182 -2.656 6.743 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -9.544 -2.238 6.280 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -10.494 0.029 5.462 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -11.988 -0.409 6.267 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -9.275 0.162 7.485 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -10.847 0.756 7.982 1.00 0.00 H new ATOM 0 HE ARG A 139 -11.050 -2.024 8.409 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -8.859 0.562 9.265 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -8.389 -0.176 10.800 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -10.451 -2.967 10.373 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -9.283 -2.157 11.422 1.00 0.00 H new ATOM 2207 N LYS A 140 -9.877 -4.138 3.186 1.00 0.00 N ATOM 2208 CA LYS A 140 -9.273 -5.483 2.925 1.00 0.00 C ATOM 2209 C LYS A 140 -7.762 -5.349 3.112 1.00 0.00 C ATOM 2210 O LYS A 140 -7.238 -4.248 3.156 1.00 0.00 O ATOM 2211 CB LYS A 140 -9.576 -5.951 1.490 1.00 0.00 C ATOM 2212 CG LYS A 140 -11.085 -5.760 1.146 1.00 0.00 C ATOM 2213 CD LYS A 140 -11.789 -7.120 0.972 1.00 0.00 C ATOM 2214 CE LYS A 140 -11.154 -7.921 -0.186 1.00 0.00 C ATOM 2215 NZ LYS A 140 -10.458 -6.998 -1.128 1.00 0.00 N ATOM 0 H LYS A 140 -9.893 -3.505 2.386 1.00 0.00 H new ATOM 0 HA LYS A 140 -9.692 -6.219 3.611 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -8.965 -5.389 0.784 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -9.305 -7.001 1.381 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -11.573 -5.193 1.938 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -11.182 -5.177 0.230 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -11.719 -7.692 1.897 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -12.849 -6.963 0.773 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -10.447 -8.649 0.211 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -11.924 -8.481 -0.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -10.227 -7.507 -2.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -11.079 -6.193 -1.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -9.582 -6.650 -0.689 1.00 0.00 H new ATOM 2229 N ILE A 141 -7.053 -6.446 3.239 1.00 0.00 N ATOM 2230 CA ILE A 141 -5.571 -6.363 3.444 1.00 0.00 C ATOM 2231 C ILE A 141 -4.855 -7.444 2.628 1.00 0.00 C ATOM 2232 O ILE A 141 -5.375 -8.516 2.392 1.00 0.00 O ATOM 2233 CB ILE A 141 -5.261 -6.567 4.930 1.00 0.00 C ATOM 2234 CG1 ILE A 141 -6.209 -5.708 5.770 1.00 0.00 C ATOM 2235 CG2 ILE A 141 -3.814 -6.154 5.216 1.00 0.00 C ATOM 2236 CD1 ILE A 141 -5.860 -5.860 7.252 1.00 0.00 C ATOM 0 H ILE A 141 -7.434 -7.392 3.210 1.00 0.00 H new ATOM 0 HA ILE A 141 -5.222 -5.384 3.115 1.00 0.00 H new ATOM 0 HB ILE A 141 -5.395 -7.618 5.186 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -6.129 -4.662 5.472 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -7.241 -6.011 5.596 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -3.596 -6.300 6.274 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -3.137 -6.764 4.618 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -3.678 -5.103 4.959 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -6.536 -5.248 7.850 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -5.962 -6.905 7.545 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -4.833 -5.536 7.419 1.00 0.00 H new ATOM 2248 N PHE A 142 -3.647 -7.159 2.212 1.00 0.00 N ATOM 2249 CA PHE A 142 -2.845 -8.145 1.424 1.00 0.00 C ATOM 2250 C PHE A 142 -1.410 -8.122 1.957 1.00 0.00 C ATOM 2251 O PHE A 142 -1.035 -7.219 2.673 1.00 0.00 O ATOM 2252 CB PHE A 142 -2.859 -7.752 -0.056 1.00 0.00 C ATOM 2253 CG PHE A 142 -4.271 -7.394 -0.467 1.00 0.00 C ATOM 2254 CD1 PHE A 142 -4.831 -6.179 -0.055 1.00 0.00 C ATOM 2255 CD2 PHE A 142 -5.017 -8.278 -1.258 1.00 0.00 C ATOM 2256 CE1 PHE A 142 -6.139 -5.848 -0.433 1.00 0.00 C ATOM 2257 CE2 PHE A 142 -6.324 -7.944 -1.635 1.00 0.00 C ATOM 2258 CZ PHE A 142 -6.885 -6.730 -1.222 1.00 0.00 C ATOM 0 H PHE A 142 -3.175 -6.272 2.388 1.00 0.00 H new ATOM 0 HA PHE A 142 -3.266 -9.146 1.522 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -2.193 -6.906 -0.225 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -2.489 -8.576 -0.666 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -4.255 -5.497 0.554 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -4.585 -9.215 -1.576 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -6.572 -4.911 -0.115 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -6.900 -8.624 -2.245 1.00 0.00 H new ATOM 0 HZ PHE A 142 -7.893 -6.474 -1.512 1.00 0.00 H new ATOM 2268 N VAL A 143 -0.601 -9.105 1.641 1.00 0.00 N ATOM 2269 CA VAL A 143 0.800 -9.102 2.174 1.00 0.00 C ATOM 2270 C VAL A 143 1.748 -9.861 1.234 1.00 0.00 C ATOM 2271 O VAL A 143 1.601 -11.049 1.010 1.00 0.00 O ATOM 2272 CB VAL A 143 0.818 -9.778 3.555 1.00 0.00 C ATOM 2273 CG1 VAL A 143 2.264 -9.919 4.042 1.00 0.00 C ATOM 2274 CG2 VAL A 143 0.031 -8.929 4.558 1.00 0.00 C ATOM 0 H VAL A 143 -0.844 -9.898 1.047 1.00 0.00 H new ATOM 0 HA VAL A 143 1.138 -8.068 2.251 1.00 0.00 H new ATOM 0 HB VAL A 143 0.361 -10.764 3.474 1.00 0.00 H new ATOM 0 HG11 VAL A 143 2.273 -10.398 5.021 1.00 0.00 H new ATOM 0 HG12 VAL A 143 2.828 -10.527 3.335 1.00 0.00 H new ATOM 0 HG13 VAL A 143 2.721 -8.932 4.117 1.00 0.00 H new ATOM 0 HG21 VAL A 143 0.047 -9.412 5.535 1.00 0.00 H new ATOM 0 HG22 VAL A 143 0.486 -7.941 4.634 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -1.000 -8.829 4.219 1.00 0.00 H new ATOM 2284 N ALA A 144 2.742 -9.183 0.708 1.00 0.00 N ATOM 2285 CA ALA A 144 3.738 -9.854 -0.187 1.00 0.00 C ATOM 2286 C ALA A 144 5.011 -10.119 0.625 1.00 0.00 C ATOM 2287 O ALA A 144 5.062 -9.843 1.807 1.00 0.00 O ATOM 2288 CB ALA A 144 4.064 -8.940 -1.374 1.00 0.00 C ATOM 0 H ALA A 144 2.906 -8.188 0.862 1.00 0.00 H new ATOM 0 HA ALA A 144 3.331 -10.791 -0.567 1.00 0.00 H new ATOM 0 HB1 ALA A 144 4.789 -9.431 -2.023 1.00 0.00 H new ATOM 0 HB2 ALA A 144 3.153 -8.735 -1.937 1.00 0.00 H new ATOM 0 HB3 ALA A 144 4.482 -8.003 -1.007 1.00 0.00 H new ATOM 2294 N THR A 145 6.043 -10.640 0.012 1.00 0.00 N ATOM 2295 CA THR A 145 7.303 -10.899 0.777 1.00 0.00 C ATOM 2296 C THR A 145 8.507 -10.874 -0.171 1.00 0.00 C ATOM 2297 O THR A 145 8.503 -11.496 -1.214 1.00 0.00 O ATOM 2298 CB THR A 145 7.212 -12.261 1.481 1.00 0.00 C ATOM 2299 OG1 THR A 145 8.246 -12.355 2.452 1.00 0.00 O ATOM 2300 CG2 THR A 145 7.364 -13.395 0.465 1.00 0.00 C ATOM 0 H THR A 145 6.070 -10.896 -0.975 1.00 0.00 H new ATOM 0 HA THR A 145 7.432 -10.119 1.528 1.00 0.00 H new ATOM 0 HB THR A 145 6.239 -12.348 1.964 1.00 0.00 H new ATOM 0 HG1 THR A 145 8.191 -13.222 2.905 1.00 0.00 H new ATOM 0 HG21 THR A 145 7.298 -14.354 0.978 1.00 0.00 H new ATOM 0 HG22 THR A 145 6.571 -13.326 -0.279 1.00 0.00 H new ATOM 0 HG23 THR A 145 8.332 -13.314 -0.029 1.00 0.00 H new ATOM 2308 N GLU A 146 9.536 -10.154 0.190 1.00 0.00 N ATOM 2309 CA GLU A 146 10.744 -10.081 -0.680 1.00 0.00 C ATOM 2310 C GLU A 146 11.353 -11.475 -0.837 1.00 0.00 C ATOM 2311 O GLU A 146 11.908 -12.030 0.089 1.00 0.00 O ATOM 2312 CB GLU A 146 11.771 -9.141 -0.049 1.00 0.00 C ATOM 2313 CG GLU A 146 12.941 -8.942 -1.014 1.00 0.00 C ATOM 2314 CD GLU A 146 13.967 -7.996 -0.388 1.00 0.00 C ATOM 2315 OE1 GLU A 146 14.701 -8.439 0.479 1.00 0.00 O ATOM 2316 OE2 GLU A 146 14.001 -6.844 -0.788 1.00 0.00 O ATOM 0 H GLU A 146 9.591 -9.612 1.052 1.00 0.00 H new ATOM 0 HA GLU A 146 10.459 -9.702 -1.661 1.00 0.00 H new ATOM 0 HB2 GLU A 146 11.308 -8.181 0.181 1.00 0.00 H new ATOM 0 HB3 GLU A 146 12.129 -9.556 0.893 1.00 0.00 H new ATOM 0 HG2 GLU A 146 13.406 -9.901 -1.240 1.00 0.00 H new ATOM 0 HG3 GLU A 146 12.581 -8.532 -1.958 1.00 0.00 H new ATOM 2323 N VAL A 147 11.251 -12.044 -2.009 1.00 0.00 N ATOM 2324 CA VAL A 147 11.820 -13.409 -2.241 1.00 0.00 C ATOM 2325 C VAL A 147 13.211 -13.288 -2.844 1.00 0.00 C ATOM 2326 O VAL A 147 13.974 -14.232 -2.891 1.00 0.00 O ATOM 2327 CB VAL A 147 10.924 -14.162 -3.214 1.00 0.00 C ATOM 2328 CG1 VAL A 147 11.541 -15.526 -3.530 1.00 0.00 C ATOM 2329 CG2 VAL A 147 9.542 -14.359 -2.587 1.00 0.00 C ATOM 0 H VAL A 147 10.797 -11.623 -2.820 1.00 0.00 H new ATOM 0 HA VAL A 147 11.878 -13.944 -1.293 1.00 0.00 H new ATOM 0 HB VAL A 147 10.827 -13.587 -4.135 1.00 0.00 H new ATOM 0 HG11 VAL A 147 10.898 -16.064 -4.227 1.00 0.00 H new ATOM 0 HG12 VAL A 147 12.524 -15.385 -3.978 1.00 0.00 H new ATOM 0 HG13 VAL A 147 11.641 -16.102 -2.610 1.00 0.00 H new ATOM 0 HG21 VAL A 147 8.900 -14.898 -3.284 1.00 0.00 H new ATOM 0 HG22 VAL A 147 9.639 -14.932 -1.665 1.00 0.00 H new ATOM 0 HG23 VAL A 147 9.101 -13.387 -2.365 1.00 0.00 H new