USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1013 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 58 SER OG : rot 37:sc= 1.27 USER MOD Set 1.2: A 102 MET CE :methyl -173:sc= 0 (180deg=-0.077) USER MOD Set 2.1: A 52 TYR OH : rot -16:sc= 1.3 USER MOD Set 2.2: A 86 HIS : no HD1:sc= 1.05 K(o=3.1,f=-0.33) USER MOD Set 2.3: A 121 CYS SG : rot -160:sc= 0.773 USER MOD Set 3.1: A 53 CYS SG : rot 75:sc= -0.48 USER MOD Set 3.2: A 74 GLN : amide:sc= 0.571 K(o=0.091,f=-1.3) USER MOD Set 4.1: A 6 GLN : amide:sc= -0.64 X(o=0.33,f=0.089) USER MOD Set 4.2: A 117 SER OG : rot 70:sc= 0.969 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0.0267 USER MOD Single : A 17 LYS NZ :NH3+ 177:sc= 1.2 (180deg=1.2) USER MOD Single : A 19 LYS NZ :NH3+ 169:sc= 1.18 (180deg=1.08) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 142:sc= 1.27 USER MOD Single : A 29 ASN : amide:sc= 0.136 K(o=0.14,f=-1.4!) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= 0.79 K(o=0.79,f=-5.6!) USER MOD Single : A 36 SER OG : rot 180:sc=-0.00654 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 CYS SG : rot -111:sc= -2.03 USER MOD Single : A 43 LYS NZ :NH3+ 143:sc= 0.0628 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 120:sc= 0.0767 USER MOD Single : A 47 THR OG1 : rot 100:sc= 0.324 USER MOD Single : A 57 ASN : amide:sc= -0.094 K(o=-0.094,f=-0.77) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl -172:sc= 0 (180deg=-0.0656) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 ASN : amide:sc= 0.961 K(o=0.96,f=0) USER MOD Single : A 83 LYS NZ :NH3+ 150:sc= 1.26 (180deg=0.808) USER MOD Single : A 84 SER OG : rot 152:sc= 1.26 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= 0.276 X(o=0.28,f=0) USER MOD Single : A 92 THR OG1 : rot -110:sc= -0.0587 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 MET CE :methyl -174:sc= 0 (180deg=-0.0306) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 MET CE :methyl 176:sc= 0 (180deg=-0.0331) USER MOD ----------------------------------------------------------------- ATOM 63 N GLN A 6 7.665 28.141 0.800 1.00 0.00 N ATOM 64 CA GLN A 6 6.466 28.420 0.014 1.00 0.00 C ATOM 65 C GLN A 6 6.432 29.782 -0.707 1.00 0.00 C ATOM 66 O GLN A 6 7.167 30.719 -0.390 1.00 0.00 O ATOM 67 CB GLN A 6 5.233 28.228 0.914 1.00 0.00 C ATOM 68 CG GLN A 6 4.965 29.402 1.869 1.00 0.00 C ATOM 69 CD GLN A 6 6.162 29.745 2.769 1.00 0.00 C ATOM 70 OE1 GLN A 6 6.707 30.841 2.760 1.00 0.00 O ATOM 71 NE2 GLN A 6 6.673 28.797 3.524 1.00 0.00 N ATOM 0 HA GLN A 6 6.469 27.706 -0.810 1.00 0.00 H new ATOM 0 HB2 GLN A 6 4.356 28.079 0.284 1.00 0.00 H new ATOM 0 HB3 GLN A 6 5.363 27.319 1.501 1.00 0.00 H new ATOM 0 HG2 GLN A 6 4.696 30.282 1.284 1.00 0.00 H new ATOM 0 HG3 GLN A 6 4.106 29.161 2.496 1.00 0.00 H new ATOM 0 HE21 GLN A 6 6.238 27.875 3.549 1.00 0.00 H new ATOM 0 HE22 GLN A 6 7.505 28.984 4.084 1.00 0.00 H new ATOM 80 N ILE A 7 5.488 29.887 -1.647 1.00 0.00 N ATOM 81 CA ILE A 7 5.096 31.129 -2.334 1.00 0.00 C ATOM 82 C ILE A 7 4.277 32.082 -1.439 1.00 0.00 C ATOM 83 O ILE A 7 4.476 33.295 -1.487 1.00 0.00 O ATOM 84 CB ILE A 7 4.317 30.754 -3.618 1.00 0.00 C ATOM 85 CG1 ILE A 7 3.918 31.957 -4.494 1.00 0.00 C ATOM 86 CG2 ILE A 7 3.030 29.976 -3.309 1.00 0.00 C ATOM 87 CD1 ILE A 7 5.132 32.679 -5.078 1.00 0.00 C ATOM 0 H ILE A 7 4.953 29.079 -1.965 1.00 0.00 H new ATOM 0 HA ILE A 7 6.001 31.680 -2.590 1.00 0.00 H new ATOM 0 HB ILE A 7 5.026 30.137 -4.170 1.00 0.00 H new ATOM 0 HG12 ILE A 7 3.276 31.615 -5.306 1.00 0.00 H new ATOM 0 HG13 ILE A 7 3.333 32.658 -3.899 1.00 0.00 H new ATOM 0 HG21 ILE A 7 2.518 29.735 -4.241 1.00 0.00 H new ATOM 0 HG22 ILE A 7 3.279 29.054 -2.783 1.00 0.00 H new ATOM 0 HG23 ILE A 7 2.378 30.585 -2.683 1.00 0.00 H new ATOM 0 HD11 ILE A 7 4.798 33.519 -5.687 1.00 0.00 H new ATOM 0 HD12 ILE A 7 5.761 33.047 -4.268 1.00 0.00 H new ATOM 0 HD13 ILE A 7 5.704 31.987 -5.696 1.00 0.00 H new ATOM 99 N LEU A 8 3.345 31.546 -0.636 1.00 0.00 N ATOM 100 CA LEU A 8 2.399 32.328 0.172 1.00 0.00 C ATOM 101 C LEU A 8 3.090 33.082 1.319 1.00 0.00 C ATOM 102 O LEU A 8 4.041 32.585 1.920 1.00 0.00 O ATOM 103 CB LEU A 8 1.301 31.409 0.754 1.00 0.00 C ATOM 104 CG LEU A 8 0.387 30.706 -0.266 1.00 0.00 C ATOM 105 CD1 LEU A 8 -0.690 29.904 0.456 1.00 0.00 C ATOM 106 CD2 LEU A 8 -0.326 31.711 -1.165 1.00 0.00 C ATOM 0 H LEU A 8 3.226 30.539 -0.529 1.00 0.00 H new ATOM 0 HA LEU A 8 1.954 33.067 -0.494 1.00 0.00 H new ATOM 0 HB2 LEU A 8 1.783 30.645 1.365 1.00 0.00 H new ATOM 0 HB3 LEU A 8 0.676 32.003 1.421 1.00 0.00 H new ATOM 0 HG LEU A 8 1.025 30.058 -0.867 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.330 29.412 -0.277 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -0.220 29.153 1.091 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -1.291 30.574 1.071 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.962 31.179 -1.872 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -0.938 32.375 -0.555 1.00 0.00 H new ATOM 0 HD23 LEU A 8 0.412 32.298 -1.711 1.00 0.00 H new ATOM 118 N VAL A 9 2.554 34.251 1.677 1.00 0.00 N ATOM 119 CA VAL A 9 2.948 34.988 2.888 1.00 0.00 C ATOM 120 C VAL A 9 1.922 34.728 3.986 1.00 0.00 C ATOM 121 O VAL A 9 0.719 34.825 3.745 1.00 0.00 O ATOM 122 CB VAL A 9 3.191 36.487 2.636 1.00 0.00 C ATOM 123 CG1 VAL A 9 4.484 36.648 1.843 1.00 0.00 C ATOM 124 CG2 VAL A 9 2.065 37.205 1.887 1.00 0.00 C ATOM 0 H VAL A 9 1.829 34.719 1.133 1.00 0.00 H new ATOM 0 HA VAL A 9 3.917 34.614 3.218 1.00 0.00 H new ATOM 0 HB VAL A 9 3.244 36.952 3.620 1.00 0.00 H new ATOM 0 HG11 VAL A 9 4.668 37.706 1.658 1.00 0.00 H new ATOM 0 HG12 VAL A 9 5.314 36.230 2.412 1.00 0.00 H new ATOM 0 HG13 VAL A 9 4.395 36.123 0.892 1.00 0.00 H new ATOM 0 HG21 VAL A 9 2.327 38.255 1.757 1.00 0.00 H new ATOM 0 HG22 VAL A 9 1.925 36.742 0.910 1.00 0.00 H new ATOM 0 HG23 VAL A 9 1.141 37.130 2.460 1.00 0.00 H new ATOM 134 N LEU A 10 2.402 34.343 5.174 1.00 0.00 N ATOM 135 CA LEU A 10 1.561 33.922 6.296 1.00 0.00 C ATOM 136 C LEU A 10 1.502 35.025 7.376 1.00 0.00 C ATOM 137 O LEU A 10 2.404 35.856 7.476 1.00 0.00 O ATOM 138 CB LEU A 10 1.955 32.532 6.864 1.00 0.00 C ATOM 139 CG LEU A 10 2.320 31.417 5.853 1.00 0.00 C ATOM 140 CD1 LEU A 10 3.774 31.490 5.394 1.00 0.00 C ATOM 141 CD2 LEU A 10 2.149 30.045 6.503 1.00 0.00 C ATOM 0 H LEU A 10 3.400 34.315 5.384 1.00 0.00 H new ATOM 0 HA LEU A 10 0.549 33.786 5.914 1.00 0.00 H new ATOM 0 HB2 LEU A 10 2.806 32.671 7.531 1.00 0.00 H new ATOM 0 HB3 LEU A 10 1.127 32.173 7.475 1.00 0.00 H new ATOM 0 HG LEU A 10 1.656 31.560 5.000 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.973 30.685 4.687 1.00 0.00 H new ATOM 0 HD12 LEU A 10 3.955 32.450 4.911 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.433 31.387 6.256 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.408 29.267 5.785 1.00 0.00 H new ATOM 0 HD22 LEU A 10 2.804 29.970 7.371 1.00 0.00 H new ATOM 0 HD23 LEU A 10 1.113 29.918 6.818 1.00 0.00 H new ATOM 153 N ASP A 11 0.443 35.039 8.186 1.00 0.00 N ATOM 154 CA ASP A 11 0.170 36.086 9.178 1.00 0.00 C ATOM 155 C ASP A 11 -0.573 35.509 10.402 1.00 0.00 C ATOM 156 O ASP A 11 -1.774 35.233 10.295 1.00 0.00 O ATOM 157 CB ASP A 11 -0.700 37.183 8.543 1.00 0.00 C ATOM 158 CG ASP A 11 -0.855 38.415 9.451 1.00 0.00 C ATOM 159 OD1 ASP A 11 0.087 38.744 10.213 1.00 0.00 O ATOM 160 OD2 ASP A 11 -1.919 39.076 9.395 1.00 0.00 O ATOM 0 H ASP A 11 -0.267 34.307 8.172 1.00 0.00 H new ATOM 0 HA ASP A 11 1.124 36.500 9.506 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -0.258 37.489 7.595 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -1.686 36.775 8.319 1.00 0.00 H new ATOM 165 N PRO A 12 0.089 35.321 11.559 1.00 0.00 N ATOM 166 CA PRO A 12 1.519 35.520 11.817 1.00 0.00 C ATOM 167 C PRO A 12 2.447 34.582 10.999 1.00 0.00 C ATOM 168 O PRO A 12 2.124 33.405 10.816 1.00 0.00 O ATOM 169 CB PRO A 12 1.691 35.292 13.325 1.00 0.00 C ATOM 170 CG PRO A 12 0.508 34.396 13.696 1.00 0.00 C ATOM 171 CD PRO A 12 -0.590 34.911 12.775 1.00 0.00 C ATOM 0 HA PRO A 12 1.817 36.520 11.502 1.00 0.00 H new ATOM 0 HB2 PRO A 12 2.643 34.812 13.551 1.00 0.00 H new ATOM 0 HB3 PRO A 12 1.669 36.232 13.877 1.00 0.00 H new ATOM 0 HG2 PRO A 12 0.725 33.342 13.521 1.00 0.00 H new ATOM 0 HG3 PRO A 12 0.237 34.495 14.747 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -1.328 34.135 12.571 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -1.123 35.747 13.228 1.00 0.00 H new ATOM 179 N PRO A 13 3.611 35.069 10.515 1.00 0.00 N ATOM 180 CA PRO A 13 4.538 34.297 9.671 1.00 0.00 C ATOM 181 C PRO A 13 5.427 33.300 10.427 1.00 0.00 C ATOM 182 O PRO A 13 5.817 32.271 9.875 1.00 0.00 O ATOM 183 CB PRO A 13 5.416 35.348 8.983 1.00 0.00 C ATOM 184 CG PRO A 13 5.403 36.538 9.939 1.00 0.00 C ATOM 185 CD PRO A 13 3.996 36.472 10.527 1.00 0.00 C ATOM 0 HA PRO A 13 3.959 33.676 8.987 1.00 0.00 H new ATOM 0 HB2 PRO A 13 6.429 34.977 8.824 1.00 0.00 H new ATOM 0 HB3 PRO A 13 5.018 35.619 8.005 1.00 0.00 H new ATOM 0 HG2 PRO A 13 6.169 36.449 10.709 1.00 0.00 H new ATOM 0 HG3 PRO A 13 5.582 37.479 9.419 1.00 0.00 H new ATOM 0 HD2 PRO A 13 3.980 36.870 11.541 1.00 0.00 H new ATOM 0 HD3 PRO A 13 3.301 37.071 9.938 1.00 0.00 H new ATOM 193 N THR A 14 5.785 33.629 11.668 1.00 0.00 N ATOM 194 CA THR A 14 6.774 32.891 12.475 1.00 0.00 C ATOM 195 C THR A 14 6.168 31.724 13.259 1.00 0.00 C ATOM 196 O THR A 14 6.579 30.579 13.072 1.00 0.00 O ATOM 197 CB THR A 14 7.503 33.828 13.449 1.00 0.00 C ATOM 198 OG1 THR A 14 6.584 34.696 14.085 1.00 0.00 O ATOM 199 CG2 THR A 14 8.530 34.701 12.729 1.00 0.00 C ATOM 0 H THR A 14 5.391 34.433 12.157 1.00 0.00 H new ATOM 0 HA THR A 14 7.482 32.474 11.759 1.00 0.00 H new ATOM 0 HB THR A 14 8.005 33.190 14.177 1.00 0.00 H new ATOM 0 HG1 THR A 14 7.065 35.285 14.703 1.00 0.00 H new ATOM 0 HG21 THR A 14 9.025 35.350 13.451 1.00 0.00 H new ATOM 0 HG22 THR A 14 9.271 34.066 12.244 1.00 0.00 H new ATOM 0 HG23 THR A 14 8.027 35.310 11.978 1.00 0.00 H new ATOM 207 N ASP A 15 5.191 32.008 14.125 1.00 0.00 N ATOM 208 CA ASP A 15 4.556 31.054 15.043 1.00 0.00 C ATOM 209 C ASP A 15 3.060 31.365 15.230 1.00 0.00 C ATOM 210 O ASP A 15 2.639 32.517 15.100 1.00 0.00 O ATOM 211 CB ASP A 15 5.266 31.091 16.404 1.00 0.00 C ATOM 212 CG ASP A 15 6.729 30.634 16.314 1.00 0.00 C ATOM 213 OD1 ASP A 15 6.977 29.450 15.997 1.00 0.00 O ATOM 214 OD2 ASP A 15 7.642 31.439 16.619 1.00 0.00 O ATOM 0 H ASP A 15 4.804 32.948 14.210 1.00 0.00 H new ATOM 0 HA ASP A 15 4.643 30.058 14.608 1.00 0.00 H new ATOM 0 HB2 ASP A 15 5.229 32.105 16.803 1.00 0.00 H new ATOM 0 HB3 ASP A 15 4.731 30.452 17.107 1.00 0.00 H new ATOM 219 N LEU A 16 2.260 30.362 15.607 1.00 0.00 N ATOM 220 CA LEU A 16 0.854 30.535 15.979 1.00 0.00 C ATOM 221 C LEU A 16 0.786 30.857 17.476 1.00 0.00 C ATOM 222 O LEU A 16 1.278 30.095 18.309 1.00 0.00 O ATOM 223 CB LEU A 16 0.050 29.247 15.695 1.00 0.00 C ATOM 224 CG LEU A 16 -0.541 29.056 14.286 1.00 0.00 C ATOM 225 CD1 LEU A 16 -1.652 30.052 13.974 1.00 0.00 C ATOM 226 CD2 LEU A 16 0.506 29.130 13.179 1.00 0.00 C ATOM 0 H LEU A 16 2.577 29.394 15.663 1.00 0.00 H new ATOM 0 HA LEU A 16 0.423 31.345 15.391 1.00 0.00 H new ATOM 0 HB2 LEU A 16 0.699 28.396 15.902 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.772 29.203 16.410 1.00 0.00 H new ATOM 0 HG LEU A 16 -0.957 28.049 14.305 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -2.031 29.871 12.968 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -2.461 29.932 14.694 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -1.259 31.067 14.036 1.00 0.00 H new ATOM 0 HD21 LEU A 16 0.024 28.988 12.212 1.00 0.00 H new ATOM 0 HD22 LEU A 16 0.992 30.106 13.202 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.252 28.350 13.331 1.00 0.00 H new ATOM 238 N LYS A 17 0.145 31.976 17.823 1.00 0.00 N ATOM 239 CA LYS A 17 -0.033 32.412 19.212 1.00 0.00 C ATOM 240 C LYS A 17 -1.434 32.082 19.710 1.00 0.00 C ATOM 241 O LYS A 17 -2.436 32.412 19.074 1.00 0.00 O ATOM 242 CB LYS A 17 0.322 33.899 19.392 1.00 0.00 C ATOM 243 CG LYS A 17 1.803 34.186 19.065 1.00 0.00 C ATOM 244 CD LYS A 17 2.320 35.498 19.679 1.00 0.00 C ATOM 245 CE LYS A 17 2.439 35.383 21.208 1.00 0.00 C ATOM 246 NZ LYS A 17 3.044 36.594 21.826 1.00 0.00 N ATOM 0 H LYS A 17 -0.269 32.612 17.141 1.00 0.00 H new ATOM 0 HA LYS A 17 0.668 31.854 19.833 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -0.315 34.504 18.747 1.00 0.00 H new ATOM 0 HB3 LYS A 17 0.113 34.199 20.419 1.00 0.00 H new ATOM 0 HG2 LYS A 17 2.414 33.359 19.426 1.00 0.00 H new ATOM 0 HG3 LYS A 17 1.928 34.226 17.983 1.00 0.00 H new ATOM 0 HD2 LYS A 17 3.292 35.745 19.253 1.00 0.00 H new ATOM 0 HD3 LYS A 17 1.644 36.314 19.424 1.00 0.00 H new ATOM 0 HE2 LYS A 17 1.450 35.217 21.635 1.00 0.00 H new ATOM 0 HE3 LYS A 17 3.044 34.511 21.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 3.055 36.487 22.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 4.018 36.711 21.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 2.483 37.431 21.571 1.00 0.00 H new ATOM 260 N PHE A 18 -1.480 31.449 20.875 1.00 0.00 N ATOM 261 CA PHE A 18 -2.695 31.062 21.583 1.00 0.00 C ATOM 262 C PHE A 18 -2.734 31.783 22.935 1.00 0.00 C ATOM 263 O PHE A 18 -1.948 31.486 23.832 1.00 0.00 O ATOM 264 CB PHE A 18 -2.728 29.532 21.707 1.00 0.00 C ATOM 265 CG PHE A 18 -2.763 28.822 20.369 1.00 0.00 C ATOM 266 CD1 PHE A 18 -3.999 28.668 19.718 1.00 0.00 C ATOM 267 CD2 PHE A 18 -1.584 28.361 19.744 1.00 0.00 C ATOM 268 CE1 PHE A 18 -4.068 28.078 18.450 1.00 0.00 C ATOM 269 CE2 PHE A 18 -1.659 27.748 18.486 1.00 0.00 C ATOM 270 CZ PHE A 18 -2.892 27.624 17.824 1.00 0.00 C ATOM 0 H PHE A 18 -0.633 31.179 21.375 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.591 31.359 21.039 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -1.851 29.201 22.263 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -3.603 29.240 22.288 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -4.904 29.008 20.200 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -0.629 28.480 20.233 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -5.021 27.972 17.954 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -0.761 27.368 18.021 1.00 0.00 H new ATOM 0 HZ PHE A 18 -2.937 27.182 16.839 1.00 0.00 H new ATOM 280 N LYS A 19 -3.639 32.757 23.070 1.00 0.00 N ATOM 281 CA LYS A 19 -3.868 33.541 24.293 1.00 0.00 C ATOM 282 C LYS A 19 -5.222 33.175 24.888 1.00 0.00 C ATOM 283 O LYS A 19 -6.230 33.178 24.177 1.00 0.00 O ATOM 284 CB LYS A 19 -3.776 35.033 23.936 1.00 0.00 C ATOM 285 CG LYS A 19 -4.089 36.012 25.080 1.00 0.00 C ATOM 286 CD LYS A 19 -2.983 36.157 26.132 1.00 0.00 C ATOM 287 CE LYS A 19 -3.249 37.404 26.991 1.00 0.00 C ATOM 288 NZ LYS A 19 -2.093 37.735 27.874 1.00 0.00 N ATOM 0 H LYS A 19 -4.255 33.033 22.305 1.00 0.00 H new ATOM 0 HA LYS A 19 -3.113 33.320 25.048 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -2.770 35.239 23.571 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -4.461 35.234 23.113 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -4.293 36.993 24.652 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -5.002 35.685 25.578 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -2.949 35.269 26.763 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -2.012 36.239 25.644 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -3.463 38.252 26.341 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -4.136 37.240 27.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -2.235 38.676 28.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -2.020 37.026 28.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -1.217 37.735 27.314 1.00 0.00 H new ATOM 302 N GLY A 20 -5.255 32.881 26.184 1.00 0.00 N ATOM 303 CA GLY A 20 -6.474 32.487 26.875 1.00 0.00 C ATOM 304 C GLY A 20 -6.178 31.589 28.071 1.00 0.00 C ATOM 305 O GLY A 20 -5.020 31.252 28.321 1.00 0.00 O ATOM 0 H GLY A 20 -4.432 32.910 26.786 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -7.006 33.377 27.211 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -7.133 31.964 26.182 1.00 0.00 H new ATOM 309 N PRO A 21 -7.209 31.187 28.832 1.00 0.00 N ATOM 310 CA PRO A 21 -6.974 30.452 30.072 1.00 0.00 C ATOM 311 C PRO A 21 -6.576 28.980 29.982 1.00 0.00 C ATOM 312 O PRO A 21 -6.067 28.360 30.915 1.00 0.00 O ATOM 313 CB PRO A 21 -8.314 30.513 30.782 1.00 0.00 C ATOM 314 CG PRO A 21 -9.009 31.761 30.268 1.00 0.00 C ATOM 315 CD PRO A 21 -8.567 31.733 28.807 1.00 0.00 C ATOM 0 HA PRO A 21 -6.113 30.914 30.556 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -8.907 29.623 30.572 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -8.180 30.559 31.863 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -10.092 31.708 30.376 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -8.681 32.663 30.785 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -9.231 31.112 28.206 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -8.583 32.732 28.371 1.00 0.00 H new ATOM 323 N PHE A 22 -6.946 28.463 28.830 1.00 0.00 N ATOM 324 CA PHE A 22 -6.970 27.077 28.369 1.00 0.00 C ATOM 325 C PHE A 22 -7.967 26.195 29.139 1.00 0.00 C ATOM 326 O PHE A 22 -7.878 24.971 29.130 1.00 0.00 O ATOM 327 CB PHE A 22 -5.540 26.544 28.272 1.00 0.00 C ATOM 328 CG PHE A 22 -4.581 27.473 27.543 1.00 0.00 C ATOM 329 CD1 PHE A 22 -4.774 27.755 26.178 1.00 0.00 C ATOM 330 CD2 PHE A 22 -3.533 28.107 28.241 1.00 0.00 C ATOM 331 CE1 PHE A 22 -3.880 28.606 25.501 1.00 0.00 C ATOM 332 CE2 PHE A 22 -2.662 28.982 27.570 1.00 0.00 C ATOM 333 CZ PHE A 22 -2.817 29.209 26.191 1.00 0.00 C ATOM 0 H PHE A 22 -7.283 29.082 28.092 1.00 0.00 H new ATOM 0 HA PHE A 22 -7.377 27.041 27.358 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -5.161 26.364 29.278 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -5.556 25.581 27.761 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -5.608 27.318 25.649 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -3.399 27.919 29.296 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -4.013 28.796 24.446 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -1.873 29.480 28.114 1.00 0.00 H new ATOM 0 HZ PHE A 22 -2.121 29.845 25.665 1.00 0.00 H new ATOM 343 N THR A 23 -8.968 26.837 29.751 1.00 0.00 N ATOM 344 CA THR A 23 -10.154 26.211 30.369 1.00 0.00 C ATOM 345 C THR A 23 -11.266 25.909 29.352 1.00 0.00 C ATOM 346 O THR A 23 -12.157 25.101 29.619 1.00 0.00 O ATOM 347 CB THR A 23 -10.713 27.123 31.474 1.00 0.00 C ATOM 348 OG1 THR A 23 -11.158 28.341 30.917 1.00 0.00 O ATOM 349 CG2 THR A 23 -9.642 27.479 32.506 1.00 0.00 C ATOM 0 H THR A 23 -8.979 27.853 29.836 1.00 0.00 H new ATOM 0 HA THR A 23 -9.825 25.260 30.788 1.00 0.00 H new ATOM 0 HB THR A 23 -11.527 26.576 31.951 1.00 0.00 H new ATOM 0 HG1 THR A 23 -11.514 28.915 31.627 1.00 0.00 H new ATOM 0 HG21 THR A 23 -10.074 28.124 33.271 1.00 0.00 H new ATOM 0 HG22 THR A 23 -9.267 26.567 32.970 1.00 0.00 H new ATOM 0 HG23 THR A 23 -8.821 28.000 32.013 1.00 0.00 H new ATOM 357 N ASP A 24 -11.193 26.526 28.167 1.00 0.00 N ATOM 358 CA ASP A 24 -12.050 26.277 26.997 1.00 0.00 C ATOM 359 C ASP A 24 -11.238 26.414 25.682 1.00 0.00 C ATOM 360 O ASP A 24 -10.041 26.722 25.707 1.00 0.00 O ATOM 361 CB ASP A 24 -13.242 27.254 27.028 1.00 0.00 C ATOM 362 CG ASP A 24 -14.542 26.662 26.452 1.00 0.00 C ATOM 363 OD1 ASP A 24 -14.495 25.904 25.453 1.00 0.00 O ATOM 364 OD2 ASP A 24 -15.631 26.970 26.997 1.00 0.00 O ATOM 0 H ASP A 24 -10.499 27.251 27.987 1.00 0.00 H new ATOM 0 HA ASP A 24 -12.431 25.256 27.034 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -13.419 27.564 28.058 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -12.981 28.150 26.465 1.00 0.00 H new ATOM 369 N VAL A 25 -11.879 26.187 24.532 1.00 0.00 N ATOM 370 CA VAL A 25 -11.272 26.295 23.192 1.00 0.00 C ATOM 371 C VAL A 25 -10.780 27.721 22.901 1.00 0.00 C ATOM 372 O VAL A 25 -11.503 28.698 23.114 1.00 0.00 O ATOM 373 CB VAL A 25 -12.263 25.833 22.099 1.00 0.00 C ATOM 374 CG1 VAL A 25 -11.740 26.052 20.672 1.00 0.00 C ATOM 375 CG2 VAL A 25 -12.581 24.337 22.227 1.00 0.00 C ATOM 0 H VAL A 25 -12.862 25.915 24.501 1.00 0.00 H new ATOM 0 HA VAL A 25 -10.404 25.636 23.178 1.00 0.00 H new ATOM 0 HB VAL A 25 -13.151 26.445 22.258 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -12.484 25.706 19.955 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -11.549 27.113 20.513 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -10.815 25.492 20.534 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -13.280 24.045 21.443 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.662 23.760 22.126 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -13.027 24.142 23.202 1.00 0.00 H new ATOM 385 N VAL A 26 -9.571 27.832 22.339 1.00 0.00 N ATOM 386 CA VAL A 26 -8.997 29.072 21.786 1.00 0.00 C ATOM 387 C VAL A 26 -9.187 29.085 20.270 1.00 0.00 C ATOM 388 O VAL A 26 -8.834 28.115 19.602 1.00 0.00 O ATOM 389 CB VAL A 26 -7.496 29.208 22.114 1.00 0.00 C ATOM 390 CG1 VAL A 26 -6.925 30.557 21.655 1.00 0.00 C ATOM 391 CG2 VAL A 26 -7.224 29.089 23.612 1.00 0.00 C ATOM 0 H VAL A 26 -8.940 27.035 22.252 1.00 0.00 H new ATOM 0 HA VAL A 26 -9.517 29.914 22.243 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.012 28.392 21.577 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.866 30.608 21.907 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -7.047 30.656 20.576 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -7.456 31.366 22.156 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.155 29.191 23.797 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.760 29.875 24.143 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -7.563 28.116 23.967 1.00 0.00 H new ATOM 401 N THR A 27 -9.693 30.190 19.717 1.00 0.00 N ATOM 402 CA THR A 27 -9.749 30.415 18.259 1.00 0.00 C ATOM 403 C THR A 27 -8.622 31.355 17.830 1.00 0.00 C ATOM 404 O THR A 27 -8.490 32.458 18.365 1.00 0.00 O ATOM 405 CB THR A 27 -11.123 30.950 17.816 1.00 0.00 C ATOM 406 OG1 THR A 27 -12.132 30.035 18.191 1.00 0.00 O ATOM 407 CG2 THR A 27 -11.221 31.114 16.299 1.00 0.00 C ATOM 0 H THR A 27 -10.078 30.960 20.264 1.00 0.00 H new ATOM 0 HA THR A 27 -9.610 29.455 17.762 1.00 0.00 H new ATOM 0 HB THR A 27 -11.248 31.921 18.296 1.00 0.00 H new ATOM 0 HG1 THR A 27 -13.006 30.378 17.910 1.00 0.00 H new ATOM 0 HG21 THR A 27 -12.209 31.494 16.037 1.00 0.00 H new ATOM 0 HG22 THR A 27 -10.460 31.817 15.959 1.00 0.00 H new ATOM 0 HG23 THR A 27 -11.064 30.149 15.818 1.00 0.00 H new ATOM 415 N THR A 28 -7.836 30.929 16.839 1.00 0.00 N ATOM 416 CA THR A 28 -6.684 31.661 16.291 1.00 0.00 C ATOM 417 C THR A 28 -6.795 31.664 14.771 1.00 0.00 C ATOM 418 O THR A 28 -6.811 30.604 14.148 1.00 0.00 O ATOM 419 CB THR A 28 -5.363 31.015 16.755 1.00 0.00 C ATOM 420 OG1 THR A 28 -5.251 31.142 18.154 1.00 0.00 O ATOM 421 CG2 THR A 28 -4.114 31.669 16.167 1.00 0.00 C ATOM 0 H THR A 28 -7.987 30.032 16.377 1.00 0.00 H new ATOM 0 HA THR A 28 -6.685 32.689 16.655 1.00 0.00 H new ATOM 0 HB THR A 28 -5.408 29.980 16.416 1.00 0.00 H new ATOM 0 HG1 THR A 28 -4.857 30.326 18.526 1.00 0.00 H new ATOM 0 HG21 THR A 28 -3.226 31.159 16.541 1.00 0.00 H new ATOM 0 HG22 THR A 28 -4.143 31.597 15.080 1.00 0.00 H new ATOM 0 HG23 THR A 28 -4.080 32.718 16.461 1.00 0.00 H new ATOM 429 N ASN A 29 -6.891 32.843 14.162 1.00 0.00 N ATOM 430 CA ASN A 29 -6.945 33.018 12.714 1.00 0.00 C ATOM 431 C ASN A 29 -5.550 33.281 12.116 1.00 0.00 C ATOM 432 O ASN A 29 -4.792 34.124 12.602 1.00 0.00 O ATOM 433 CB ASN A 29 -8.012 34.055 12.323 1.00 0.00 C ATOM 434 CG ASN A 29 -8.100 35.296 13.196 1.00 0.00 C ATOM 435 OD1 ASN A 29 -7.191 35.695 13.911 1.00 0.00 O ATOM 436 ND2 ASN A 29 -9.243 35.933 13.192 1.00 0.00 N ATOM 0 H ASN A 29 -6.934 33.724 14.674 1.00 0.00 H new ATOM 0 HA ASN A 29 -7.267 32.080 12.262 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -7.821 34.371 11.298 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -8.985 33.563 12.329 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -9.371 36.755 13.782 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -10.006 35.607 12.599 1.00 0.00 H new ATOM 443 N LEU A 30 -5.232 32.559 11.040 1.00 0.00 N ATOM 444 CA LEU A 30 -4.015 32.687 10.243 1.00 0.00 C ATOM 445 C LEU A 30 -4.396 33.226 8.857 1.00 0.00 C ATOM 446 O LEU A 30 -5.173 32.585 8.150 1.00 0.00 O ATOM 447 CB LEU A 30 -3.336 31.302 10.173 1.00 0.00 C ATOM 448 CG LEU A 30 -1.953 31.312 9.497 1.00 0.00 C ATOM 449 CD1 LEU A 30 -0.861 31.819 10.433 1.00 0.00 C ATOM 450 CD2 LEU A 30 -1.544 29.905 9.068 1.00 0.00 C ATOM 0 H LEU A 30 -5.851 31.831 10.684 1.00 0.00 H new ATOM 0 HA LEU A 30 -3.307 33.386 10.687 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -3.231 30.910 11.184 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -3.988 30.617 9.631 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.048 31.975 8.637 1.00 0.00 H new ATOM 0 HD11 LEU A 30 0.097 31.809 9.914 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -1.093 32.837 10.745 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.805 31.174 11.310 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.563 29.940 8.593 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -1.501 29.256 9.943 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -2.275 29.513 8.361 1.00 0.00 H new ATOM 462 N LYS A 31 -3.870 34.383 8.450 1.00 0.00 N ATOM 463 CA LYS A 31 -4.099 34.957 7.110 1.00 0.00 C ATOM 464 C LYS A 31 -3.002 34.520 6.144 1.00 0.00 C ATOM 465 O LYS A 31 -1.825 34.733 6.422 1.00 0.00 O ATOM 466 CB LYS A 31 -4.221 36.488 7.193 1.00 0.00 C ATOM 467 CG LYS A 31 -5.703 36.827 7.228 1.00 0.00 C ATOM 468 CD LYS A 31 -5.986 38.326 7.274 1.00 0.00 C ATOM 469 CE LYS A 31 -7.509 38.437 7.197 1.00 0.00 C ATOM 470 NZ LYS A 31 -7.970 39.853 7.208 1.00 0.00 N ATOM 0 H LYS A 31 -3.268 34.957 9.041 1.00 0.00 H new ATOM 0 HA LYS A 31 -5.043 34.577 6.719 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.720 36.865 8.085 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -3.740 36.958 6.335 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -6.185 36.402 6.348 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -6.155 36.353 8.100 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -5.602 38.773 8.191 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -5.509 38.845 6.443 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -7.862 37.949 6.289 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -7.954 37.905 8.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -9.008 39.880 7.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -7.656 40.313 8.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -7.568 40.355 6.391 1.00 0.00 H new ATOM 484 N LEU A 32 -3.380 33.923 5.014 1.00 0.00 N ATOM 485 CA LEU A 32 -2.465 33.531 3.939 1.00 0.00 C ATOM 486 C LEU A 32 -2.756 34.352 2.686 1.00 0.00 C ATOM 487 O LEU A 32 -3.834 34.203 2.115 1.00 0.00 O ATOM 488 CB LEU A 32 -2.600 32.028 3.615 1.00 0.00 C ATOM 489 CG LEU A 32 -2.299 30.990 4.707 1.00 0.00 C ATOM 490 CD1 LEU A 32 -1.203 31.414 5.664 1.00 0.00 C ATOM 491 CD2 LEU A 32 -3.531 30.637 5.528 1.00 0.00 C ATOM 0 H LEU A 32 -4.353 33.693 4.815 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.446 33.721 4.275 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -3.621 31.857 3.275 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.943 31.815 2.772 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.958 30.116 4.151 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -1.046 30.632 6.407 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -0.279 31.579 5.109 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -1.495 32.337 6.165 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -3.264 29.900 6.286 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -3.914 31.534 6.014 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -4.298 30.223 4.873 1.00 0.00 H new ATOM 503 N ARG A 33 -1.811 35.185 2.236 1.00 0.00 N ATOM 504 CA ARG A 33 -1.922 35.948 0.976 1.00 0.00 C ATOM 505 C ARG A 33 -0.990 35.382 -0.091 1.00 0.00 C ATOM 506 O ARG A 33 0.108 34.920 0.218 1.00 0.00 O ATOM 507 CB ARG A 33 -1.735 37.461 1.231 1.00 0.00 C ATOM 508 CG ARG A 33 -2.080 38.308 -0.007 1.00 0.00 C ATOM 509 CD ARG A 33 -2.075 39.815 0.258 1.00 0.00 C ATOM 510 NE ARG A 33 -2.685 40.520 -0.887 1.00 0.00 N ATOM 511 CZ ARG A 33 -2.570 41.790 -1.221 1.00 0.00 C ATOM 512 NH1 ARG A 33 -1.854 42.636 -0.536 1.00 0.00 N ATOM 513 NH2 ARG A 33 -3.195 42.221 -2.278 1.00 0.00 N ATOM 0 H ARG A 33 -0.938 35.354 2.736 1.00 0.00 H new ATOM 0 HA ARG A 33 -2.930 35.834 0.578 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -2.366 37.767 2.066 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -0.703 37.653 1.524 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -1.366 38.085 -0.799 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -3.064 38.016 -0.374 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -2.628 40.036 1.171 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -1.054 40.164 0.411 1.00 0.00 H new ATOM 0 HE ARG A 33 -3.271 39.951 -1.498 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -1.354 42.324 0.296 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -1.794 43.610 -0.832 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -3.762 41.579 -2.832 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -3.118 43.200 -2.552 1.00 0.00 H new ATOM 527 N ASN A 34 -1.407 35.453 -1.354 1.00 0.00 N ATOM 528 CA ASN A 34 -0.616 34.994 -2.495 1.00 0.00 C ATOM 529 C ASN A 34 -0.010 36.199 -3.238 1.00 0.00 C ATOM 530 O ASN A 34 -0.756 36.973 -3.843 1.00 0.00 O ATOM 531 CB ASN A 34 -1.534 34.139 -3.392 1.00 0.00 C ATOM 532 CG ASN A 34 -0.845 33.571 -4.622 1.00 0.00 C ATOM 533 OD1 ASN A 34 0.343 33.744 -4.848 1.00 0.00 O ATOM 534 ND2 ASN A 34 -1.584 32.879 -5.451 1.00 0.00 N ATOM 0 H ASN A 34 -2.315 35.836 -1.617 1.00 0.00 H new ATOM 0 HA ASN A 34 0.225 34.380 -2.173 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -1.937 33.316 -2.802 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -2.381 34.747 -3.711 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -1.169 32.480 -6.293 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -2.575 32.739 -5.255 1.00 0.00 H new ATOM 541 N PRO A 35 1.330 36.352 -3.237 1.00 0.00 N ATOM 542 CA PRO A 35 2.003 37.452 -3.931 1.00 0.00 C ATOM 543 C PRO A 35 2.047 37.281 -5.462 1.00 0.00 C ATOM 544 O PRO A 35 2.223 38.254 -6.201 1.00 0.00 O ATOM 545 CB PRO A 35 3.421 37.444 -3.368 1.00 0.00 C ATOM 546 CG PRO A 35 3.676 36.008 -2.940 1.00 0.00 C ATOM 547 CD PRO A 35 2.298 35.545 -2.496 1.00 0.00 C ATOM 0 HA PRO A 35 1.466 38.387 -3.769 1.00 0.00 H new ATOM 0 HB2 PRO A 35 4.144 37.765 -4.118 1.00 0.00 H new ATOM 0 HB3 PRO A 35 3.513 38.128 -2.524 1.00 0.00 H new ATOM 0 HG2 PRO A 35 4.062 35.403 -3.760 1.00 0.00 H new ATOM 0 HG3 PRO A 35 4.404 35.949 -2.131 1.00 0.00 H new ATOM 0 HD2 PRO A 35 2.159 34.484 -2.705 1.00 0.00 H new ATOM 0 HD3 PRO A 35 2.172 35.678 -1.421 1.00 0.00 H new ATOM 555 N SER A 36 1.944 36.033 -5.924 1.00 0.00 N ATOM 556 CA SER A 36 2.130 35.604 -7.317 1.00 0.00 C ATOM 557 C SER A 36 1.004 36.028 -8.273 1.00 0.00 C ATOM 558 O SER A 36 -0.047 36.528 -7.869 1.00 0.00 O ATOM 559 CB SER A 36 2.286 34.078 -7.364 1.00 0.00 C ATOM 560 OG SER A 36 3.010 33.696 -8.522 1.00 0.00 O ATOM 0 H SER A 36 1.717 35.253 -5.308 1.00 0.00 H new ATOM 0 HA SER A 36 3.029 36.110 -7.668 1.00 0.00 H new ATOM 0 HB2 SER A 36 2.805 33.730 -6.471 1.00 0.00 H new ATOM 0 HB3 SER A 36 1.304 33.605 -7.367 1.00 0.00 H new ATOM 0 HG SER A 36 3.105 32.721 -8.541 1.00 0.00 H new ATOM 566 N ASP A 37 1.220 35.741 -9.560 1.00 0.00 N ATOM 567 CA ASP A 37 0.263 35.861 -10.669 1.00 0.00 C ATOM 568 C ASP A 37 -0.254 34.472 -11.128 1.00 0.00 C ATOM 569 O ASP A 37 -0.598 34.264 -12.294 1.00 0.00 O ATOM 570 CB ASP A 37 0.908 36.693 -11.791 1.00 0.00 C ATOM 571 CG ASP A 37 -0.094 37.132 -12.877 1.00 0.00 C ATOM 572 OD1 ASP A 37 -1.196 37.625 -12.530 1.00 0.00 O ATOM 573 OD2 ASP A 37 0.242 37.045 -14.083 1.00 0.00 O ATOM 0 H ASP A 37 2.126 35.396 -9.878 1.00 0.00 H new ATOM 0 HA ASP A 37 -0.632 36.390 -10.341 1.00 0.00 H new ATOM 0 HB2 ASP A 37 1.373 37.578 -11.356 1.00 0.00 H new ATOM 0 HB3 ASP A 37 1.704 36.110 -12.255 1.00 0.00 H new ATOM 578 N ARG A 38 -0.273 33.496 -10.204 1.00 0.00 N ATOM 579 CA ARG A 38 -0.657 32.088 -10.408 1.00 0.00 C ATOM 580 C ARG A 38 -1.576 31.636 -9.275 1.00 0.00 C ATOM 581 O ARG A 38 -1.503 32.177 -8.172 1.00 0.00 O ATOM 582 CB ARG A 38 0.601 31.195 -10.448 1.00 0.00 C ATOM 583 CG ARG A 38 1.592 31.554 -11.567 1.00 0.00 C ATOM 584 CD ARG A 38 2.813 30.626 -11.553 1.00 0.00 C ATOM 585 NE ARG A 38 2.473 29.248 -11.971 1.00 0.00 N ATOM 586 CZ ARG A 38 3.261 28.189 -11.904 1.00 0.00 C ATOM 587 NH1 ARG A 38 4.453 28.245 -11.384 1.00 0.00 N ATOM 588 NH2 ARG A 38 2.858 27.041 -12.370 1.00 0.00 N ATOM 0 H ARG A 38 -0.005 33.680 -9.237 1.00 0.00 H new ATOM 0 HA ARG A 38 -1.184 31.998 -11.358 1.00 0.00 H new ATOM 0 HB2 ARG A 38 1.113 31.264 -9.488 1.00 0.00 H new ATOM 0 HB3 ARG A 38 0.292 30.157 -10.570 1.00 0.00 H new ATOM 0 HG2 ARG A 38 1.092 31.486 -12.533 1.00 0.00 H new ATOM 0 HG3 ARG A 38 1.917 32.588 -11.449 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.579 31.027 -12.217 1.00 0.00 H new ATOM 0 HD3 ARG A 38 3.240 30.605 -10.550 1.00 0.00 H new ATOM 0 HE ARG A 38 1.537 29.101 -12.349 1.00 0.00 H new ATOM 0 HH11 ARG A 38 4.806 29.127 -11.012 1.00 0.00 H new ATOM 0 HH12 ARG A 38 5.034 27.407 -11.349 1.00 0.00 H new ATOM 0 HH21 ARG A 38 1.932 26.957 -12.788 1.00 0.00 H new ATOM 0 HH22 ARG A 38 3.469 26.226 -12.317 1.00 0.00 H new ATOM 602 N LYS A 39 -2.398 30.618 -9.523 1.00 0.00 N ATOM 603 CA LYS A 39 -3.241 29.967 -8.501 1.00 0.00 C ATOM 604 C LYS A 39 -2.394 28.947 -7.737 1.00 0.00 C ATOM 605 O LYS A 39 -1.531 28.299 -8.323 1.00 0.00 O ATOM 606 CB LYS A 39 -4.477 29.305 -9.153 1.00 0.00 C ATOM 607 CG LYS A 39 -5.594 30.275 -9.582 1.00 0.00 C ATOM 608 CD LYS A 39 -5.262 31.268 -10.714 1.00 0.00 C ATOM 609 CE LYS A 39 -4.793 30.646 -12.039 1.00 0.00 C ATOM 610 NZ LYS A 39 -5.899 29.955 -12.766 1.00 0.00 N ATOM 0 H LYS A 39 -2.505 30.210 -10.452 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.612 30.714 -7.799 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -4.149 28.745 -10.029 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -4.895 28.583 -8.451 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -6.456 29.684 -9.892 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -5.899 30.849 -8.707 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -6.148 31.872 -10.912 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -4.486 31.947 -10.359 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -4.375 31.426 -12.676 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -3.992 29.934 -11.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -5.533 29.552 -13.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -6.282 29.193 -12.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -6.653 30.638 -12.981 1.00 0.00 H new ATOM 624 N VAL A 40 -2.634 28.771 -6.440 1.00 0.00 N ATOM 625 CA VAL A 40 -1.874 27.824 -5.598 1.00 0.00 C ATOM 626 C VAL A 40 -2.803 27.099 -4.630 1.00 0.00 C ATOM 627 O VAL A 40 -3.611 27.722 -3.946 1.00 0.00 O ATOM 628 CB VAL A 40 -0.694 28.538 -4.904 1.00 0.00 C ATOM 629 CG1 VAL A 40 -1.144 29.665 -3.982 1.00 0.00 C ATOM 630 CG2 VAL A 40 0.205 27.591 -4.103 1.00 0.00 C ATOM 0 H VAL A 40 -3.360 29.277 -5.933 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.433 27.053 -6.230 1.00 0.00 H new ATOM 0 HB VAL A 40 -0.118 28.954 -5.731 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -0.272 30.130 -3.523 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -1.691 30.411 -4.559 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.792 29.262 -3.204 1.00 0.00 H new ATOM 0 HG21 VAL A 40 1.013 28.159 -3.642 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -0.383 27.101 -3.327 1.00 0.00 H new ATOM 0 HG23 VAL A 40 0.625 26.838 -4.769 1.00 0.00 H new ATOM 640 N CYS A 41 -2.692 25.775 -4.577 1.00 0.00 N ATOM 641 CA CYS A 41 -3.446 24.927 -3.661 1.00 0.00 C ATOM 642 C CYS A 41 -2.694 24.811 -2.332 1.00 0.00 C ATOM 643 O CYS A 41 -1.474 24.640 -2.332 1.00 0.00 O ATOM 644 CB CYS A 41 -3.689 23.565 -4.326 1.00 0.00 C ATOM 645 SG CYS A 41 -4.690 23.812 -5.824 1.00 0.00 S ATOM 0 H CYS A 41 -2.061 25.251 -5.183 1.00 0.00 H new ATOM 0 HA CYS A 41 -4.420 25.364 -3.439 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -2.739 23.095 -4.581 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -4.202 22.895 -3.636 1.00 0.00 H new ATOM 0 HG CYS A 41 -5.874 23.306 -5.643 1.00 0.00 H new ATOM 651 N PHE A 42 -3.411 24.905 -1.210 1.00 0.00 N ATOM 652 CA PHE A 42 -2.838 24.791 0.142 1.00 0.00 C ATOM 653 C PHE A 42 -3.449 23.661 0.979 1.00 0.00 C ATOM 654 O PHE A 42 -4.619 23.309 0.827 1.00 0.00 O ATOM 655 CB PHE A 42 -2.890 26.146 0.876 1.00 0.00 C ATOM 656 CG PHE A 42 -4.230 26.544 1.473 1.00 0.00 C ATOM 657 CD1 PHE A 42 -5.143 27.292 0.709 1.00 0.00 C ATOM 658 CD2 PHE A 42 -4.540 26.216 2.809 1.00 0.00 C ATOM 659 CE1 PHE A 42 -6.352 27.727 1.279 1.00 0.00 C ATOM 660 CE2 PHE A 42 -5.760 26.631 3.374 1.00 0.00 C ATOM 661 CZ PHE A 42 -6.664 27.389 2.609 1.00 0.00 C ATOM 0 H PHE A 42 -4.418 25.064 -1.210 1.00 0.00 H new ATOM 0 HA PHE A 42 -1.793 24.512 0.010 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -2.151 26.128 1.677 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -2.583 26.924 0.177 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -4.915 27.533 -0.319 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -3.839 25.645 3.400 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -7.041 28.320 0.697 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -6.002 26.368 4.393 1.00 0.00 H new ATOM 0 HZ PHE A 42 -7.599 27.712 3.043 1.00 0.00 H new ATOM 671 N LYS A 43 -2.660 23.114 1.905 1.00 0.00 N ATOM 672 CA LYS A 43 -3.074 22.123 2.913 1.00 0.00 C ATOM 673 C LYS A 43 -2.470 22.421 4.288 1.00 0.00 C ATOM 674 O LYS A 43 -1.324 22.856 4.363 1.00 0.00 O ATOM 675 CB LYS A 43 -2.657 20.716 2.444 1.00 0.00 C ATOM 676 CG LYS A 43 -3.712 20.008 1.589 1.00 0.00 C ATOM 677 CD LYS A 43 -3.218 18.617 1.169 1.00 0.00 C ATOM 678 CE LYS A 43 -4.345 17.834 0.481 1.00 0.00 C ATOM 679 NZ LYS A 43 -3.874 16.498 0.014 1.00 0.00 N ATOM 0 H LYS A 43 -1.672 23.356 1.981 1.00 0.00 H new ATOM 0 HA LYS A 43 -4.158 22.175 3.017 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -1.733 20.794 1.872 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -2.440 20.102 3.318 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -4.642 19.916 2.150 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -3.932 20.605 0.704 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -2.369 18.715 0.493 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -2.867 18.069 2.044 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -5.177 17.706 1.174 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -4.722 18.405 -0.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -4.632 15.798 0.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -3.621 16.552 -0.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -3.040 16.211 0.566 1.00 0.00 H new ATOM 693 N VAL A 44 -3.207 22.146 5.369 1.00 0.00 N ATOM 694 CA VAL A 44 -2.778 22.342 6.769 1.00 0.00 C ATOM 695 C VAL A 44 -2.630 20.997 7.487 1.00 0.00 C ATOM 696 O VAL A 44 -3.517 20.144 7.414 1.00 0.00 O ATOM 697 CB VAL A 44 -3.731 23.280 7.551 1.00 0.00 C ATOM 698 CG1 VAL A 44 -3.049 23.749 8.840 1.00 0.00 C ATOM 699 CG2 VAL A 44 -4.096 24.530 6.734 1.00 0.00 C ATOM 0 H VAL A 44 -4.152 21.768 5.297 1.00 0.00 H new ATOM 0 HA VAL A 44 -1.804 22.830 6.738 1.00 0.00 H new ATOM 0 HB VAL A 44 -4.638 22.714 7.766 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -3.722 24.409 9.388 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -2.805 22.885 9.458 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -2.134 24.288 8.592 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -4.766 25.163 7.317 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -3.189 25.085 6.494 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.592 24.229 5.811 1.00 0.00 H new ATOM 709 N LYS A 45 -1.526 20.823 8.219 1.00 0.00 N ATOM 710 CA LYS A 45 -1.225 19.652 9.062 1.00 0.00 C ATOM 711 C LYS A 45 -0.872 20.094 10.485 1.00 0.00 C ATOM 712 O LYS A 45 -0.306 21.168 10.685 1.00 0.00 O ATOM 713 CB LYS A 45 -0.101 18.814 8.416 1.00 0.00 C ATOM 714 CG LYS A 45 -0.520 18.192 7.072 1.00 0.00 C ATOM 715 CD LYS A 45 0.614 17.417 6.380 1.00 0.00 C ATOM 716 CE LYS A 45 1.030 16.153 7.152 1.00 0.00 C ATOM 717 NZ LYS A 45 2.073 15.382 6.414 1.00 0.00 N ATOM 0 H LYS A 45 -0.783 21.521 8.245 1.00 0.00 H new ATOM 0 HA LYS A 45 -2.109 19.019 9.134 1.00 0.00 H new ATOM 0 HB2 LYS A 45 0.774 19.445 8.262 1.00 0.00 H new ATOM 0 HB3 LYS A 45 0.195 18.020 9.102 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -1.362 17.520 7.238 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -0.869 18.982 6.407 1.00 0.00 H new ATOM 0 HD2 LYS A 45 0.296 17.136 5.376 1.00 0.00 H new ATOM 0 HD3 LYS A 45 1.479 18.070 6.269 1.00 0.00 H new ATOM 0 HE2 LYS A 45 1.410 16.434 8.134 1.00 0.00 H new ATOM 0 HE3 LYS A 45 0.157 15.521 7.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 2.332 14.536 6.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 1.701 15.094 5.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 2.915 15.978 6.279 1.00 0.00 H new ATOM 731 N THR A 46 -1.193 19.257 11.469 1.00 0.00 N ATOM 732 CA THR A 46 -0.990 19.516 12.913 1.00 0.00 C ATOM 733 C THR A 46 -0.268 18.351 13.585 1.00 0.00 C ATOM 734 O THR A 46 -0.349 17.218 13.117 1.00 0.00 O ATOM 735 CB THR A 46 -2.328 19.810 13.624 1.00 0.00 C ATOM 736 OG1 THR A 46 -2.105 20.012 14.999 1.00 0.00 O ATOM 737 CG2 THR A 46 -3.345 18.671 13.534 1.00 0.00 C ATOM 0 H THR A 46 -1.616 18.347 11.289 1.00 0.00 H new ATOM 0 HA THR A 46 -0.361 20.402 13.001 1.00 0.00 H new ATOM 0 HB THR A 46 -2.728 20.688 13.117 1.00 0.00 H new ATOM 0 HG1 THR A 46 -2.402 20.912 15.250 1.00 0.00 H new ATOM 0 HG21 THR A 46 -4.257 18.956 14.058 1.00 0.00 H new ATOM 0 HG22 THR A 46 -3.575 18.470 12.488 1.00 0.00 H new ATOM 0 HG23 THR A 46 -2.928 17.774 13.992 1.00 0.00 H new ATOM 745 N THR A 47 0.410 18.603 14.703 1.00 0.00 N ATOM 746 CA THR A 47 1.007 17.561 15.551 1.00 0.00 C ATOM 747 C THR A 47 -0.003 16.805 16.427 1.00 0.00 C ATOM 748 O THR A 47 0.362 15.808 17.051 1.00 0.00 O ATOM 749 CB THR A 47 2.106 18.163 16.432 1.00 0.00 C ATOM 750 OG1 THR A 47 1.640 19.330 17.082 1.00 0.00 O ATOM 751 CG2 THR A 47 3.306 18.582 15.590 1.00 0.00 C ATOM 0 H THR A 47 0.565 19.548 15.054 1.00 0.00 H new ATOM 0 HA THR A 47 1.425 16.825 14.864 1.00 0.00 H new ATOM 0 HB THR A 47 2.387 17.398 17.155 1.00 0.00 H new ATOM 0 HG1 THR A 47 1.388 19.113 18.004 1.00 0.00 H new ATOM 0 HG21 THR A 47 4.074 19.007 16.237 1.00 0.00 H new ATOM 0 HG22 THR A 47 3.709 17.712 15.072 1.00 0.00 H new ATOM 0 HG23 THR A 47 2.995 19.328 14.858 1.00 0.00 H new ATOM 759 N ALA A 48 -1.257 17.275 16.530 1.00 0.00 N ATOM 760 CA ALA A 48 -2.263 16.653 17.406 1.00 0.00 C ATOM 761 C ALA A 48 -3.724 16.898 16.957 1.00 0.00 C ATOM 762 O ALA A 48 -4.340 17.867 17.403 1.00 0.00 O ATOM 763 CB ALA A 48 -2.014 17.167 18.839 1.00 0.00 C ATOM 0 H ALA A 48 -1.599 18.087 16.015 1.00 0.00 H new ATOM 0 HA ALA A 48 -2.146 15.571 17.354 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -2.744 16.724 19.516 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -1.009 16.888 19.156 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -2.112 18.252 18.858 1.00 0.00 H new ATOM 769 N PRO A 49 -4.358 15.990 16.183 1.00 0.00 N ATOM 770 CA PRO A 49 -5.777 16.106 15.795 1.00 0.00 C ATOM 771 C PRO A 49 -6.732 16.157 17.000 1.00 0.00 C ATOM 772 O PRO A 49 -7.758 16.831 16.979 1.00 0.00 O ATOM 773 CB PRO A 49 -6.053 14.872 14.926 1.00 0.00 C ATOM 774 CG PRO A 49 -4.683 14.558 14.337 1.00 0.00 C ATOM 775 CD PRO A 49 -3.767 14.832 15.526 1.00 0.00 C ATOM 0 HA PRO A 49 -5.954 17.042 15.266 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -6.440 14.041 15.516 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -6.789 15.081 14.149 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -4.611 13.526 13.994 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -4.448 15.194 13.484 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -3.722 13.975 16.198 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -2.747 15.037 15.202 1.00 0.00 H new ATOM 783 N ARG A 50 -6.334 15.485 18.092 1.00 0.00 N ATOM 784 CA ARG A 50 -7.010 15.469 19.406 1.00 0.00 C ATOM 785 C ARG A 50 -6.763 16.707 20.290 1.00 0.00 C ATOM 786 O ARG A 50 -7.225 16.743 21.428 1.00 0.00 O ATOM 787 CB ARG A 50 -6.762 14.101 20.084 1.00 0.00 C ATOM 788 CG ARG A 50 -5.295 13.639 20.221 1.00 0.00 C ATOM 789 CD ARG A 50 -4.476 14.497 21.191 1.00 0.00 C ATOM 790 NE ARG A 50 -3.139 13.911 21.426 1.00 0.00 N ATOM 791 CZ ARG A 50 -2.793 13.019 22.343 1.00 0.00 C ATOM 792 NH1 ARG A 50 -3.645 12.524 23.195 1.00 0.00 N ATOM 793 NH2 ARG A 50 -1.563 12.601 22.416 1.00 0.00 N ATOM 0 H ARG A 50 -5.492 14.909 18.086 1.00 0.00 H new ATOM 0 HA ARG A 50 -8.082 15.566 19.237 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -7.201 14.133 21.081 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -7.305 13.341 19.521 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -5.278 12.603 20.560 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -4.822 13.661 19.239 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -4.369 15.504 20.788 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -5.008 14.588 22.138 1.00 0.00 H new ATOM 0 HE ARG A 50 -2.393 14.232 20.808 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -4.620 12.821 23.172 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -3.337 11.839 23.885 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -0.863 12.960 21.767 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -1.299 11.914 23.123 1.00 0.00 H new ATOM 807 N ARG A 51 -6.031 17.716 19.794 1.00 0.00 N ATOM 808 CA ARG A 51 -5.881 19.047 20.431 1.00 0.00 C ATOM 809 C ARG A 51 -6.069 20.242 19.486 1.00 0.00 C ATOM 810 O ARG A 51 -6.279 21.344 19.987 1.00 0.00 O ATOM 811 CB ARG A 51 -4.534 19.153 21.180 1.00 0.00 C ATOM 812 CG ARG A 51 -4.439 18.301 22.458 1.00 0.00 C ATOM 813 CD ARG A 51 -5.430 18.742 23.548 1.00 0.00 C ATOM 814 NE ARG A 51 -5.326 17.892 24.751 1.00 0.00 N ATOM 815 CZ ARG A 51 -6.052 16.829 25.056 1.00 0.00 C ATOM 816 NH1 ARG A 51 -6.930 16.312 24.240 1.00 0.00 N ATOM 817 NH2 ARG A 51 -5.902 16.248 26.211 1.00 0.00 N ATOM 0 H ARG A 51 -5.512 17.634 18.919 1.00 0.00 H new ATOM 0 HA ARG A 51 -6.704 19.111 21.142 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -3.733 18.857 20.502 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -4.361 20.197 21.442 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -4.625 17.257 22.207 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -3.424 18.359 22.852 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -5.237 19.780 23.817 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -6.446 18.697 23.157 1.00 0.00 H new ATOM 0 HE ARG A 51 -4.609 18.156 25.427 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -7.080 16.729 23.321 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -7.466 15.491 24.521 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -5.225 16.612 26.881 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -6.462 15.428 26.446 1.00 0.00 H new ATOM 831 N TYR A 52 -6.047 20.049 18.166 1.00 0.00 N ATOM 832 CA TYR A 52 -6.247 21.113 17.176 1.00 0.00 C ATOM 833 C TYR A 52 -7.243 20.723 16.080 1.00 0.00 C ATOM 834 O TYR A 52 -7.138 19.659 15.467 1.00 0.00 O ATOM 835 CB TYR A 52 -4.916 21.489 16.525 1.00 0.00 C ATOM 836 CG TYR A 52 -3.872 21.992 17.497 1.00 0.00 C ATOM 837 CD1 TYR A 52 -3.003 21.071 18.107 1.00 0.00 C ATOM 838 CD2 TYR A 52 -3.787 23.361 17.811 1.00 0.00 C ATOM 839 CE1 TYR A 52 -2.069 21.506 19.061 1.00 0.00 C ATOM 840 CE2 TYR A 52 -2.805 23.812 18.713 1.00 0.00 C ATOM 841 CZ TYR A 52 -1.971 22.879 19.365 1.00 0.00 C ATOM 842 OH TYR A 52 -1.085 23.306 20.296 1.00 0.00 O ATOM 0 H TYR A 52 -5.887 19.133 17.746 1.00 0.00 H new ATOM 0 HA TYR A 52 -6.661 21.964 17.717 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -4.521 20.618 16.003 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -5.096 22.257 15.773 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -3.054 20.025 17.841 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -4.473 24.064 17.361 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -1.429 20.793 19.559 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -2.690 24.869 18.905 1.00 0.00 H new ATOM 0 HH TYR A 52 -0.784 22.545 20.834 1.00 0.00 H new ATOM 852 N CYS A 53 -8.149 21.652 15.778 1.00 0.00 N ATOM 853 CA CYS A 53 -9.107 21.580 14.675 1.00 0.00 C ATOM 854 C CYS A 53 -8.868 22.753 13.701 1.00 0.00 C ATOM 855 O CYS A 53 -8.634 23.877 14.136 1.00 0.00 O ATOM 856 CB CYS A 53 -10.523 21.546 15.277 1.00 0.00 C ATOM 857 SG CYS A 53 -10.727 20.056 16.301 1.00 0.00 S ATOM 0 H CYS A 53 -8.239 22.512 16.318 1.00 0.00 H new ATOM 0 HA CYS A 53 -8.980 20.674 14.083 1.00 0.00 H new ATOM 0 HB2 CYS A 53 -10.692 22.438 15.880 1.00 0.00 H new ATOM 0 HB3 CYS A 53 -11.266 21.554 14.480 1.00 0.00 H new ATOM 0 HG CYS A 53 -10.097 20.214 17.427 1.00 0.00 H new ATOM 863 N VAL A 54 -8.906 22.503 12.391 1.00 0.00 N ATOM 864 CA VAL A 54 -8.590 23.459 11.305 1.00 0.00 C ATOM 865 C VAL A 54 -9.784 23.495 10.352 1.00 0.00 C ATOM 866 O VAL A 54 -9.890 22.624 9.494 1.00 0.00 O ATOM 867 CB VAL A 54 -7.304 23.047 10.573 1.00 0.00 C ATOM 868 CG1 VAL A 54 -6.921 24.174 9.603 1.00 0.00 C ATOM 869 CG2 VAL A 54 -6.123 22.887 11.540 1.00 0.00 C ATOM 0 H VAL A 54 -9.170 21.586 12.031 1.00 0.00 H new ATOM 0 HA VAL A 54 -8.414 24.454 11.715 1.00 0.00 H new ATOM 0 HB VAL A 54 -7.496 22.099 10.071 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -6.009 23.902 9.072 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -7.727 24.326 8.886 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -6.754 25.095 10.162 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -5.233 22.595 10.982 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.938 23.833 12.049 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -6.358 22.119 12.277 1.00 0.00 H new ATOM 879 N ARG A 55 -10.679 24.489 10.452 1.00 0.00 N ATOM 880 CA ARG A 55 -11.976 24.454 9.731 1.00 0.00 C ATOM 881 C ARG A 55 -11.926 24.160 8.228 1.00 0.00 C ATOM 882 O ARG A 55 -12.540 23.184 7.800 1.00 0.00 O ATOM 883 CB ARG A 55 -12.867 25.661 10.070 1.00 0.00 C ATOM 884 CG ARG A 55 -14.351 25.326 9.848 1.00 0.00 C ATOM 885 CD ARG A 55 -15.263 26.451 10.355 1.00 0.00 C ATOM 886 NE ARG A 55 -16.686 26.127 10.128 1.00 0.00 N ATOM 887 CZ ARG A 55 -17.733 26.807 10.565 1.00 0.00 C ATOM 888 NH1 ARG A 55 -17.609 27.892 11.277 1.00 0.00 N ATOM 889 NH2 ARG A 55 -18.941 26.401 10.291 1.00 0.00 N ATOM 0 H ARG A 55 -10.537 25.325 11.019 1.00 0.00 H new ATOM 0 HA ARG A 55 -12.451 23.558 10.130 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -12.708 25.956 11.107 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -12.585 26.512 9.450 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -14.533 25.159 8.786 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -14.596 24.397 10.363 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -15.089 26.612 11.419 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -15.014 27.382 9.846 1.00 0.00 H new ATOM 0 HE ARG A 55 -16.882 25.292 9.577 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -16.681 28.243 11.515 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -18.440 28.390 11.597 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -19.082 25.556 9.738 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -19.746 26.928 10.630 1.00 0.00 H new ATOM 903 N PRO A 56 -11.179 24.938 7.430 1.00 0.00 N ATOM 904 CA PRO A 56 -10.960 24.612 6.026 1.00 0.00 C ATOM 905 C PRO A 56 -10.143 23.330 5.787 1.00 0.00 C ATOM 906 O PRO A 56 -10.438 22.570 4.869 1.00 0.00 O ATOM 907 CB PRO A 56 -10.168 25.800 5.458 1.00 0.00 C ATOM 908 CG PRO A 56 -9.555 26.429 6.712 1.00 0.00 C ATOM 909 CD PRO A 56 -10.642 26.253 7.736 1.00 0.00 C ATOM 0 HA PRO A 56 -11.926 24.436 5.554 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -9.403 25.476 4.753 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -10.814 26.500 4.928 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -8.634 25.926 7.008 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -9.309 27.480 6.559 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -10.249 26.301 8.752 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -11.404 27.028 7.652 1.00 0.00 H new ATOM 917 N ASN A 57 -9.071 23.148 6.579 1.00 0.00 N ATOM 918 CA ASN A 57 -7.962 22.173 6.497 1.00 0.00 C ATOM 919 C ASN A 57 -7.166 22.179 5.173 1.00 0.00 C ATOM 920 O ASN A 57 -6.033 21.701 5.124 1.00 0.00 O ATOM 921 CB ASN A 57 -8.389 20.772 6.971 1.00 0.00 C ATOM 922 CG ASN A 57 -9.278 20.021 5.996 1.00 0.00 C ATOM 923 OD1 ASN A 57 -8.876 19.669 4.895 1.00 0.00 O ATOM 924 ND2 ASN A 57 -10.506 19.734 6.371 1.00 0.00 N ATOM 0 H ASN A 57 -8.944 23.753 7.390 1.00 0.00 H new ATOM 0 HA ASN A 57 -7.221 22.531 7.212 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -7.495 20.178 7.159 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -8.914 20.868 7.921 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -11.123 19.218 5.744 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -10.841 20.027 7.289 1.00 0.00 H new ATOM 931 N SER A 58 -7.722 22.773 4.121 1.00 0.00 N ATOM 932 CA SER A 58 -7.153 22.882 2.776 1.00 0.00 C ATOM 933 C SER A 58 -7.966 23.882 1.946 1.00 0.00 C ATOM 934 O SER A 58 -9.074 24.271 2.324 1.00 0.00 O ATOM 935 CB SER A 58 -7.182 21.499 2.100 1.00 0.00 C ATOM 936 OG SER A 58 -6.567 21.478 0.825 1.00 0.00 O ATOM 0 H SER A 58 -8.637 23.219 4.186 1.00 0.00 H new ATOM 0 HA SER A 58 -6.124 23.234 2.844 1.00 0.00 H new ATOM 0 HB2 SER A 58 -6.683 20.777 2.747 1.00 0.00 H new ATOM 0 HB3 SER A 58 -8.218 21.175 2.000 1.00 0.00 H new ATOM 0 HG SER A 58 -5.779 22.061 0.832 1.00 0.00 H new ATOM 942 N GLY A 59 -7.421 24.282 0.801 1.00 0.00 N ATOM 943 CA GLY A 59 -8.100 25.162 -0.152 1.00 0.00 C ATOM 944 C GLY A 59 -7.208 25.581 -1.315 1.00 0.00 C ATOM 945 O GLY A 59 -6.175 24.968 -1.571 1.00 0.00 O ATOM 0 H GLY A 59 -6.486 24.003 0.503 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -8.982 24.654 -0.542 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -8.450 26.053 0.370 1.00 0.00 H new ATOM 949 N ILE A 60 -7.614 26.626 -2.035 1.00 0.00 N ATOM 950 CA ILE A 60 -6.844 27.239 -3.130 1.00 0.00 C ATOM 951 C ILE A 60 -6.871 28.771 -2.971 1.00 0.00 C ATOM 952 O ILE A 60 -7.916 29.328 -2.629 1.00 0.00 O ATOM 953 CB ILE A 60 -7.402 26.790 -4.501 1.00 0.00 C ATOM 954 CG1 ILE A 60 -7.716 25.273 -4.580 1.00 0.00 C ATOM 955 CG2 ILE A 60 -6.475 27.240 -5.649 1.00 0.00 C ATOM 956 CD1 ILE A 60 -8.225 24.771 -5.942 1.00 0.00 C ATOM 0 H ILE A 60 -8.510 27.086 -1.873 1.00 0.00 H new ATOM 0 HA ILE A 60 -5.807 26.908 -3.085 1.00 0.00 H new ATOM 0 HB ILE A 60 -8.363 27.291 -4.616 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -6.813 24.719 -4.323 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -8.463 25.035 -3.823 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -6.890 26.912 -6.602 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.392 28.327 -5.645 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -5.487 26.800 -5.513 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -8.413 23.699 -5.887 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -9.149 25.289 -6.199 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -7.474 24.969 -6.707 1.00 0.00 H new ATOM 968 N ILE A 61 -5.749 29.457 -3.227 1.00 0.00 N ATOM 969 CA ILE A 61 -5.644 30.926 -3.163 1.00 0.00 C ATOM 970 C ILE A 61 -5.398 31.527 -4.552 1.00 0.00 C ATOM 971 O ILE A 61 -4.489 31.119 -5.278 1.00 0.00 O ATOM 972 CB ILE A 61 -4.587 31.395 -2.136 1.00 0.00 C ATOM 973 CG1 ILE A 61 -4.769 30.627 -0.809 1.00 0.00 C ATOM 974 CG2 ILE A 61 -4.696 32.922 -1.951 1.00 0.00 C ATOM 975 CD1 ILE A 61 -4.105 31.250 0.417 1.00 0.00 C ATOM 0 H ILE A 61 -4.874 29.003 -3.489 1.00 0.00 H new ATOM 0 HA ILE A 61 -6.604 31.300 -2.808 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.583 31.177 -2.499 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.836 30.530 -0.611 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.376 29.618 -0.938 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.952 33.255 -1.227 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -4.521 33.418 -2.906 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -5.693 33.174 -1.589 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -4.298 30.628 1.291 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.030 31.321 0.252 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.513 32.247 0.585 1.00 0.00 H new ATOM 987 N ASP A 62 -6.195 32.542 -4.889 1.00 0.00 N ATOM 988 CA ASP A 62 -6.103 33.304 -6.138 1.00 0.00 C ATOM 989 C ASP A 62 -4.961 34.344 -6.111 1.00 0.00 C ATOM 990 O ASP A 62 -4.612 34.846 -5.039 1.00 0.00 O ATOM 991 CB ASP A 62 -7.454 33.980 -6.418 1.00 0.00 C ATOM 992 CG ASP A 62 -8.552 32.961 -6.763 1.00 0.00 C ATOM 993 OD1 ASP A 62 -8.542 32.428 -7.898 1.00 0.00 O ATOM 994 OD2 ASP A 62 -9.435 32.710 -5.910 1.00 0.00 O ATOM 0 H ASP A 62 -6.947 32.868 -4.282 1.00 0.00 H new ATOM 0 HA ASP A 62 -5.865 32.609 -6.943 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -7.758 34.557 -5.545 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -7.342 34.684 -7.242 1.00 0.00 H new ATOM 999 N PRO A 63 -4.372 34.706 -7.266 1.00 0.00 N ATOM 1000 CA PRO A 63 -3.288 35.686 -7.348 1.00 0.00 C ATOM 1001 C PRO A 63 -3.685 37.048 -6.758 1.00 0.00 C ATOM 1002 O PRO A 63 -4.730 37.612 -7.091 1.00 0.00 O ATOM 1003 CB PRO A 63 -2.934 35.779 -8.834 1.00 0.00 C ATOM 1004 CG PRO A 63 -4.179 35.275 -9.559 1.00 0.00 C ATOM 1005 CD PRO A 63 -4.694 34.214 -8.594 1.00 0.00 C ATOM 0 HA PRO A 63 -2.429 35.375 -6.754 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -2.695 36.803 -9.121 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -2.062 35.170 -9.073 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -4.908 36.069 -9.720 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -3.941 34.857 -10.537 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -5.768 34.068 -8.708 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -4.220 33.251 -8.781 1.00 0.00 H new ATOM 1013 N GLY A 64 -2.850 37.571 -5.853 1.00 0.00 N ATOM 1014 CA GLY A 64 -3.097 38.801 -5.090 1.00 0.00 C ATOM 1015 C GLY A 64 -4.116 38.679 -3.954 1.00 0.00 C ATOM 1016 O GLY A 64 -4.285 39.644 -3.201 1.00 0.00 O ATOM 0 H GLY A 64 -1.956 37.137 -5.624 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -2.151 39.144 -4.671 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -3.438 39.573 -5.780 1.00 0.00 H new ATOM 1020 N SER A 65 -4.773 37.526 -3.794 1.00 0.00 N ATOM 1021 CA SER A 65 -5.858 37.325 -2.827 1.00 0.00 C ATOM 1022 C SER A 65 -5.391 36.689 -1.515 1.00 0.00 C ATOM 1023 O SER A 65 -4.280 36.162 -1.425 1.00 0.00 O ATOM 1024 CB SER A 65 -6.975 36.486 -3.454 1.00 0.00 C ATOM 1025 OG SER A 65 -8.199 36.730 -2.782 1.00 0.00 O ATOM 0 H SER A 65 -4.563 36.692 -4.342 1.00 0.00 H new ATOM 0 HA SER A 65 -6.236 38.316 -2.573 1.00 0.00 H new ATOM 0 HB2 SER A 65 -7.076 36.731 -4.511 1.00 0.00 H new ATOM 0 HB3 SER A 65 -6.723 35.427 -3.395 1.00 0.00 H new ATOM 0 HG SER A 65 -8.909 36.191 -3.190 1.00 0.00 H new ATOM 1031 N THR A 66 -6.267 36.720 -0.506 1.00 0.00 N ATOM 1032 CA THR A 66 -6.012 36.243 0.863 1.00 0.00 C ATOM 1033 C THR A 66 -7.117 35.294 1.341 1.00 0.00 C ATOM 1034 O THR A 66 -8.303 35.579 1.161 1.00 0.00 O ATOM 1035 CB THR A 66 -5.889 37.407 1.870 1.00 0.00 C ATOM 1036 OG1 THR A 66 -5.066 38.435 1.366 1.00 0.00 O ATOM 1037 CG2 THR A 66 -5.283 36.989 3.217 1.00 0.00 C ATOM 0 H THR A 66 -7.210 37.092 -0.621 1.00 0.00 H new ATOM 0 HA THR A 66 -5.063 35.708 0.823 1.00 0.00 H new ATOM 0 HB THR A 66 -6.914 37.746 2.021 1.00 0.00 H new ATOM 0 HG1 THR A 66 -5.008 39.159 2.024 1.00 0.00 H new ATOM 0 HG21 THR A 66 -5.226 37.856 3.875 1.00 0.00 H new ATOM 0 HG22 THR A 66 -5.910 36.225 3.677 1.00 0.00 H new ATOM 0 HG23 THR A 66 -4.282 36.589 3.057 1.00 0.00 H new ATOM 1045 N VAL A 67 -6.731 34.200 2.004 1.00 0.00 N ATOM 1046 CA VAL A 67 -7.640 33.283 2.727 1.00 0.00 C ATOM 1047 C VAL A 67 -7.302 33.293 4.219 1.00 0.00 C ATOM 1048 O VAL A 67 -6.130 33.266 4.597 1.00 0.00 O ATOM 1049 CB VAL A 67 -7.597 31.851 2.148 1.00 0.00 C ATOM 1050 CG1 VAL A 67 -8.510 30.874 2.908 1.00 0.00 C ATOM 1051 CG2 VAL A 67 -8.048 31.848 0.681 1.00 0.00 C ATOM 0 H VAL A 67 -5.754 33.913 2.059 1.00 0.00 H new ATOM 0 HA VAL A 67 -8.662 33.639 2.594 1.00 0.00 H new ATOM 0 HB VAL A 67 -6.562 31.524 2.246 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -8.439 29.884 2.457 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -8.198 30.821 3.951 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -9.541 31.224 2.855 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -8.011 30.831 0.291 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -9.068 32.226 0.613 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -7.386 32.485 0.095 1.00 0.00 H new ATOM 1061 N THR A 68 -8.323 33.304 5.074 1.00 0.00 N ATOM 1062 CA THR A 68 -8.193 33.198 6.529 1.00 0.00 C ATOM 1063 C THR A 68 -8.507 31.767 6.961 1.00 0.00 C ATOM 1064 O THR A 68 -9.604 31.256 6.730 1.00 0.00 O ATOM 1065 CB THR A 68 -9.119 34.190 7.245 1.00 0.00 C ATOM 1066 OG1 THR A 68 -8.924 35.497 6.752 1.00 0.00 O ATOM 1067 CG2 THR A 68 -8.823 34.235 8.740 1.00 0.00 C ATOM 0 H THR A 68 -9.292 33.389 4.766 1.00 0.00 H new ATOM 0 HA THR A 68 -7.169 33.447 6.807 1.00 0.00 H new ATOM 0 HB THR A 68 -10.140 33.852 7.066 1.00 0.00 H new ATOM 0 HG1 THR A 68 -9.524 36.116 7.219 1.00 0.00 H new ATOM 0 HG21 THR A 68 -9.494 34.946 9.222 1.00 0.00 H new ATOM 0 HG22 THR A 68 -8.973 33.245 9.171 1.00 0.00 H new ATOM 0 HG23 THR A 68 -7.790 34.546 8.897 1.00 0.00 H new ATOM 1075 N VAL A 69 -7.536 31.130 7.608 1.00 0.00 N ATOM 1076 CA VAL A 69 -7.626 29.777 8.177 1.00 0.00 C ATOM 1077 C VAL A 69 -7.857 29.887 9.683 1.00 0.00 C ATOM 1078 O VAL A 69 -7.027 30.437 10.403 1.00 0.00 O ATOM 1079 CB VAL A 69 -6.351 28.980 7.835 1.00 0.00 C ATOM 1080 CG1 VAL A 69 -6.265 27.626 8.543 1.00 0.00 C ATOM 1081 CG2 VAL A 69 -6.279 28.709 6.326 1.00 0.00 C ATOM 0 H VAL A 69 -6.622 31.556 7.760 1.00 0.00 H new ATOM 0 HA VAL A 69 -8.467 29.234 7.746 1.00 0.00 H new ATOM 0 HB VAL A 69 -5.524 29.602 8.176 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -5.342 27.122 8.254 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -6.273 27.779 9.622 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -7.119 27.011 8.257 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -5.374 28.146 6.100 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -7.151 28.133 6.018 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -6.261 29.656 5.787 1.00 0.00 H new ATOM 1091 N SER A 70 -8.980 29.356 10.163 1.00 0.00 N ATOM 1092 CA SER A 70 -9.334 29.342 11.591 1.00 0.00 C ATOM 1093 C SER A 70 -8.859 28.051 12.252 1.00 0.00 C ATOM 1094 O SER A 70 -9.235 26.951 11.836 1.00 0.00 O ATOM 1095 CB SER A 70 -10.845 29.532 11.781 1.00 0.00 C ATOM 1096 OG SER A 70 -11.236 30.793 11.266 1.00 0.00 O ATOM 0 H SER A 70 -9.682 28.916 9.568 1.00 0.00 H new ATOM 0 HA SER A 70 -8.827 30.177 12.075 1.00 0.00 H new ATOM 0 HB2 SER A 70 -11.388 28.736 11.272 1.00 0.00 H new ATOM 0 HB3 SER A 70 -11.100 29.466 12.839 1.00 0.00 H new ATOM 0 HG SER A 70 -12.201 30.911 11.387 1.00 0.00 H new ATOM 1102 N VAL A 71 -8.050 28.195 13.302 1.00 0.00 N ATOM 1103 CA VAL A 71 -7.558 27.112 14.157 1.00 0.00 C ATOM 1104 C VAL A 71 -8.313 27.171 15.477 1.00 0.00 C ATOM 1105 O VAL A 71 -8.403 28.229 16.095 1.00 0.00 O ATOM 1106 CB VAL A 71 -6.037 27.222 14.393 1.00 0.00 C ATOM 1107 CG1 VAL A 71 -5.535 26.094 15.303 1.00 0.00 C ATOM 1108 CG2 VAL A 71 -5.260 27.154 13.072 1.00 0.00 C ATOM 0 H VAL A 71 -7.704 29.109 13.593 1.00 0.00 H new ATOM 0 HA VAL A 71 -7.731 26.155 13.665 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.865 28.187 14.870 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -4.460 26.197 15.451 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -6.042 26.151 16.266 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -5.746 25.131 14.839 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -4.192 27.234 13.274 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -5.466 26.205 12.577 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -5.570 27.975 12.425 1.00 0.00 H new ATOM 1118 N MET A 72 -8.838 26.032 15.916 1.00 0.00 N ATOM 1119 CA MET A 72 -9.506 25.840 17.198 1.00 0.00 C ATOM 1120 C MET A 72 -8.646 24.895 18.041 1.00 0.00 C ATOM 1121 O MET A 72 -8.599 23.693 17.773 1.00 0.00 O ATOM 1122 CB MET A 72 -10.922 25.304 16.942 1.00 0.00 C ATOM 1123 CG MET A 72 -11.839 26.377 16.342 1.00 0.00 C ATOM 1124 SD MET A 72 -13.473 25.771 15.828 1.00 0.00 S ATOM 1125 CE MET A 72 -13.036 24.811 14.346 1.00 0.00 C ATOM 0 H MET A 72 -8.808 25.177 15.361 1.00 0.00 H new ATOM 0 HA MET A 72 -9.615 26.773 17.751 1.00 0.00 H new ATOM 0 HB2 MET A 72 -10.871 24.451 16.266 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.349 24.944 17.878 1.00 0.00 H new ATOM 0 HG2 MET A 72 -11.975 27.172 17.075 1.00 0.00 H new ATOM 0 HG3 MET A 72 -11.342 26.820 15.479 1.00 0.00 H new ATOM 0 HE1 MET A 72 -13.946 24.494 13.836 1.00 0.00 H new ATOM 0 HE2 MET A 72 -12.440 25.429 13.674 1.00 0.00 H new ATOM 0 HE3 MET A 72 -12.459 23.933 14.638 1.00 0.00 H new ATOM 1135 N LEU A 73 -7.950 25.442 19.038 1.00 0.00 N ATOM 1136 CA LEU A 73 -7.055 24.743 19.966 1.00 0.00 C ATOM 1137 C LEU A 73 -7.831 24.381 21.236 1.00 0.00 C ATOM 1138 O LEU A 73 -8.443 25.241 21.866 1.00 0.00 O ATOM 1139 CB LEU A 73 -5.826 25.636 20.186 1.00 0.00 C ATOM 1140 CG LEU A 73 -4.784 25.262 21.261 1.00 0.00 C ATOM 1141 CD1 LEU A 73 -5.041 25.985 22.585 1.00 0.00 C ATOM 1142 CD2 LEU A 73 -4.573 23.775 21.547 1.00 0.00 C ATOM 0 H LEU A 73 -7.997 26.442 19.232 1.00 0.00 H new ATOM 0 HA LEU A 73 -6.690 23.794 19.574 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -5.300 25.704 19.234 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -6.190 26.636 20.421 1.00 0.00 H new ATOM 0 HG LEU A 73 -3.859 25.600 20.794 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -4.284 25.692 23.312 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -4.994 27.062 22.426 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -6.028 25.716 22.961 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -3.815 23.657 22.321 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -5.510 23.333 21.886 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -4.243 23.273 20.638 1.00 0.00 H new ATOM 1154 N GLN A 74 -7.851 23.096 21.579 1.00 0.00 N ATOM 1155 CA GLN A 74 -8.660 22.537 22.673 1.00 0.00 C ATOM 1156 C GLN A 74 -8.076 22.854 24.072 1.00 0.00 C ATOM 1157 O GLN A 74 -6.859 23.015 24.211 1.00 0.00 O ATOM 1158 CB GLN A 74 -8.854 21.019 22.472 1.00 0.00 C ATOM 1159 CG GLN A 74 -9.972 20.616 21.484 1.00 0.00 C ATOM 1160 CD GLN A 74 -9.710 21.012 20.032 1.00 0.00 C ATOM 1161 OE1 GLN A 74 -9.096 20.293 19.259 1.00 0.00 O ATOM 1162 NE2 GLN A 74 -10.159 22.171 19.599 1.00 0.00 N ATOM 0 H GLN A 74 -7.293 22.392 21.096 1.00 0.00 H new ATOM 0 HA GLN A 74 -9.635 23.022 22.637 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -7.913 20.593 22.122 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -9.068 20.566 23.440 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -10.110 19.536 21.533 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -10.907 21.072 21.808 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -10.674 22.786 20.229 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -9.992 22.454 18.633 1.00 0.00 H new ATOM 1171 N PRO A 75 -8.919 22.931 25.124 1.00 0.00 N ATOM 1172 CA PRO A 75 -8.476 23.251 26.484 1.00 0.00 C ATOM 1173 C PRO A 75 -7.491 22.223 27.065 1.00 0.00 C ATOM 1174 O PRO A 75 -7.592 21.022 26.790 1.00 0.00 O ATOM 1175 CB PRO A 75 -9.751 23.347 27.320 1.00 0.00 C ATOM 1176 CG PRO A 75 -10.796 22.552 26.547 1.00 0.00 C ATOM 1177 CD PRO A 75 -10.365 22.740 25.095 1.00 0.00 C ATOM 0 HA PRO A 75 -7.914 24.185 26.487 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -9.600 22.934 28.317 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -10.061 24.384 27.448 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -10.798 21.501 26.835 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -11.803 22.932 26.722 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -10.631 21.871 24.494 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -10.863 23.601 24.649 1.00 0.00 H new ATOM 1185 N PHE A 76 -6.546 22.697 27.887 1.00 0.00 N ATOM 1186 CA PHE A 76 -5.524 21.863 28.539 1.00 0.00 C ATOM 1187 C PHE A 76 -4.921 22.505 29.804 1.00 0.00 C ATOM 1188 O PHE A 76 -5.104 23.692 30.084 1.00 0.00 O ATOM 1189 CB PHE A 76 -4.400 21.507 27.546 1.00 0.00 C ATOM 1190 CG PHE A 76 -3.441 22.633 27.201 1.00 0.00 C ATOM 1191 CD1 PHE A 76 -3.818 23.642 26.294 1.00 0.00 C ATOM 1192 CD2 PHE A 76 -2.158 22.666 27.786 1.00 0.00 C ATOM 1193 CE1 PHE A 76 -2.926 24.686 25.991 1.00 0.00 C ATOM 1194 CE2 PHE A 76 -1.265 23.708 27.474 1.00 0.00 C ATOM 1195 CZ PHE A 76 -1.654 24.720 26.581 1.00 0.00 C ATOM 0 H PHE A 76 -6.467 23.686 28.122 1.00 0.00 H new ATOM 0 HA PHE A 76 -6.037 20.957 28.860 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -3.824 20.679 27.960 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -4.856 21.148 26.623 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -4.793 23.614 25.831 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -1.860 21.890 28.475 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -3.221 25.464 25.302 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -0.282 23.729 27.921 1.00 0.00 H new ATOM 0 HZ PHE A 76 -0.973 25.525 26.348 1.00 0.00 H new ATOM 1205 N ASP A 77 -4.171 21.707 30.566 1.00 0.00 N ATOM 1206 CA ASP A 77 -3.451 22.147 31.767 1.00 0.00 C ATOM 1207 C ASP A 77 -2.040 22.667 31.419 1.00 0.00 C ATOM 1208 O ASP A 77 -1.106 21.885 31.214 1.00 0.00 O ATOM 1209 CB ASP A 77 -3.420 20.998 32.786 1.00 0.00 C ATOM 1210 CG ASP A 77 -2.721 21.407 34.092 1.00 0.00 C ATOM 1211 OD1 ASP A 77 -3.106 22.444 34.686 1.00 0.00 O ATOM 1212 OD2 ASP A 77 -1.807 20.679 34.551 1.00 0.00 O ATOM 0 H ASP A 77 -4.043 20.716 30.363 1.00 0.00 H new ATOM 0 HA ASP A 77 -3.977 22.989 32.217 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -4.439 20.679 33.004 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -2.904 20.142 32.351 1.00 0.00 H new ATOM 1217 N TYR A 78 -1.889 23.991 31.333 1.00 0.00 N ATOM 1218 CA TYR A 78 -0.611 24.657 31.046 1.00 0.00 C ATOM 1219 C TYR A 78 0.399 24.536 32.207 1.00 0.00 C ATOM 1220 O TYR A 78 0.027 24.599 33.384 1.00 0.00 O ATOM 1221 CB TYR A 78 -0.873 26.126 30.677 1.00 0.00 C ATOM 1222 CG TYR A 78 0.388 26.943 30.451 1.00 0.00 C ATOM 1223 CD1 TYR A 78 1.082 26.848 29.228 1.00 0.00 C ATOM 1224 CD2 TYR A 78 0.891 27.760 31.484 1.00 0.00 C ATOM 1225 CE1 TYR A 78 2.275 27.572 29.039 1.00 0.00 C ATOM 1226 CE2 TYR A 78 2.080 28.491 31.294 1.00 0.00 C ATOM 1227 CZ TYR A 78 2.772 28.403 30.066 1.00 0.00 C ATOM 1228 OH TYR A 78 3.912 29.121 29.866 1.00 0.00 O ATOM 0 H TYR A 78 -2.663 24.643 31.463 1.00 0.00 H new ATOM 0 HA TYR A 78 -0.149 24.149 30.199 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -1.482 26.160 29.773 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -1.457 26.591 31.472 1.00 0.00 H new ATOM 0 HD1 TYR A 78 0.699 26.221 28.437 1.00 0.00 H new ATOM 0 HD2 TYR A 78 0.363 27.826 32.424 1.00 0.00 H new ATOM 0 HE1 TYR A 78 2.811 27.491 28.105 1.00 0.00 H new ATOM 0 HE2 TYR A 78 2.462 29.118 32.086 1.00 0.00 H new ATOM 0 HH TYR A 78 4.116 29.642 30.671 1.00 0.00 H new ATOM 1238 N ASP A 79 1.689 24.405 31.874 1.00 0.00 N ATOM 1239 CA ASP A 79 2.813 24.428 32.821 1.00 0.00 C ATOM 1240 C ASP A 79 3.869 25.488 32.415 1.00 0.00 C ATOM 1241 O ASP A 79 4.281 25.509 31.249 1.00 0.00 O ATOM 1242 CB ASP A 79 3.445 23.033 32.908 1.00 0.00 C ATOM 1243 CG ASP A 79 4.404 22.939 34.096 1.00 0.00 C ATOM 1244 OD1 ASP A 79 5.554 23.409 33.955 1.00 0.00 O ATOM 1245 OD2 ASP A 79 4.007 22.435 35.173 1.00 0.00 O ATOM 0 H ASP A 79 1.990 24.276 30.908 1.00 0.00 H new ATOM 0 HA ASP A 79 2.433 24.707 33.804 1.00 0.00 H new ATOM 0 HB2 ASP A 79 2.662 22.281 33.007 1.00 0.00 H new ATOM 0 HB3 ASP A 79 3.982 22.815 31.985 1.00 0.00 H new ATOM 1250 N PRO A 80 4.346 26.348 33.340 1.00 0.00 N ATOM 1251 CA PRO A 80 5.305 27.413 33.033 1.00 0.00 C ATOM 1252 C PRO A 80 6.756 26.914 32.885 1.00 0.00 C ATOM 1253 O PRO A 80 7.611 27.654 32.389 1.00 0.00 O ATOM 1254 CB PRO A 80 5.164 28.407 34.190 1.00 0.00 C ATOM 1255 CG PRO A 80 4.803 27.513 35.373 1.00 0.00 C ATOM 1256 CD PRO A 80 3.936 26.429 34.733 1.00 0.00 C ATOM 0 HA PRO A 80 5.087 27.861 32.063 1.00 0.00 H new ATOM 0 HB2 PRO A 80 6.090 28.954 34.366 1.00 0.00 H new ATOM 0 HB3 PRO A 80 4.389 29.147 33.993 1.00 0.00 H new ATOM 0 HG2 PRO A 80 5.690 27.093 35.847 1.00 0.00 H new ATOM 0 HG3 PRO A 80 4.260 28.062 36.143 1.00 0.00 H new ATOM 0 HD2 PRO A 80 4.076 25.472 35.236 1.00 0.00 H new ATOM 0 HD3 PRO A 80 2.878 26.679 34.813 1.00 0.00 H new ATOM 1264 N ASN A 81 7.047 25.679 33.307 1.00 0.00 N ATOM 1265 CA ASN A 81 8.358 25.032 33.198 1.00 0.00 C ATOM 1266 C ASN A 81 8.448 24.173 31.923 1.00 0.00 C ATOM 1267 O ASN A 81 9.500 24.133 31.280 1.00 0.00 O ATOM 1268 CB ASN A 81 8.645 24.160 34.439 1.00 0.00 C ATOM 1269 CG ASN A 81 8.186 24.748 35.761 1.00 0.00 C ATOM 1270 OD1 ASN A 81 8.919 25.434 36.464 1.00 0.00 O ATOM 1271 ND2 ASN A 81 6.957 24.482 36.143 1.00 0.00 N ATOM 0 H ASN A 81 6.350 25.081 33.750 1.00 0.00 H new ATOM 0 HA ASN A 81 9.109 25.820 33.140 1.00 0.00 H new ATOM 0 HB2 ASN A 81 8.162 23.192 34.303 1.00 0.00 H new ATOM 0 HB3 ASN A 81 9.718 23.976 34.494 1.00 0.00 H new ATOM 0 HD21 ASN A 81 6.608 24.847 37.029 1.00 0.00 H new ATOM 0 HD22 ASN A 81 6.352 23.910 35.553 1.00 0.00 H new ATOM 1278 N GLU A 82 7.363 23.482 31.548 1.00 0.00 N ATOM 1279 CA GLU A 82 7.350 22.608 30.364 1.00 0.00 C ATOM 1280 C GLU A 82 7.335 23.422 29.049 1.00 0.00 C ATOM 1281 O GLU A 82 6.436 24.234 28.810 1.00 0.00 O ATOM 1282 CB GLU A 82 6.162 21.633 30.448 1.00 0.00 C ATOM 1283 CG GLU A 82 6.287 20.432 29.500 1.00 0.00 C ATOM 1284 CD GLU A 82 7.391 19.443 29.927 1.00 0.00 C ATOM 1285 OE1 GLU A 82 7.237 18.765 30.973 1.00 0.00 O ATOM 1286 OE2 GLU A 82 8.412 19.322 29.206 1.00 0.00 O ATOM 0 H GLU A 82 6.476 23.511 32.051 1.00 0.00 H new ATOM 0 HA GLU A 82 8.272 22.027 30.353 1.00 0.00 H new ATOM 0 HB2 GLU A 82 6.072 21.270 31.472 1.00 0.00 H new ATOM 0 HB3 GLU A 82 5.243 22.172 30.219 1.00 0.00 H new ATOM 0 HG2 GLU A 82 5.332 19.907 29.458 1.00 0.00 H new ATOM 0 HG3 GLU A 82 6.498 20.791 28.493 1.00 0.00 H new ATOM 1293 N LYS A 83 8.325 23.183 28.175 1.00 0.00 N ATOM 1294 CA LYS A 83 8.395 23.754 26.813 1.00 0.00 C ATOM 1295 C LYS A 83 7.221 23.320 25.920 1.00 0.00 C ATOM 1296 O LYS A 83 6.632 22.253 26.122 1.00 0.00 O ATOM 1297 CB LYS A 83 9.764 23.452 26.156 1.00 0.00 C ATOM 1298 CG LYS A 83 9.998 22.017 25.634 1.00 0.00 C ATOM 1299 CD LYS A 83 9.989 20.948 26.734 1.00 0.00 C ATOM 1300 CE LYS A 83 10.292 19.546 26.192 1.00 0.00 C ATOM 1301 NZ LYS A 83 10.330 18.560 27.305 1.00 0.00 N ATOM 0 H LYS A 83 9.115 22.577 28.395 1.00 0.00 H new ATOM 0 HA LYS A 83 8.303 24.835 26.918 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.897 24.140 25.321 1.00 0.00 H new ATOM 0 HB3 LYS A 83 10.544 23.678 26.883 1.00 0.00 H new ATOM 0 HG2 LYS A 83 9.228 21.777 24.901 1.00 0.00 H new ATOM 0 HG3 LYS A 83 10.955 21.981 25.114 1.00 0.00 H new ATOM 0 HD2 LYS A 83 10.726 21.207 27.494 1.00 0.00 H new ATOM 0 HD3 LYS A 83 9.015 20.942 27.223 1.00 0.00 H new ATOM 0 HE2 LYS A 83 9.532 19.257 25.467 1.00 0.00 H new ATOM 0 HE3 LYS A 83 11.248 19.550 25.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 10.030 17.628 26.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 11.299 18.494 27.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 9.688 18.867 28.063 1.00 0.00 H new ATOM 1315 N SER A 84 6.904 24.120 24.898 1.00 0.00 N ATOM 1316 CA SER A 84 5.887 23.758 23.896 1.00 0.00 C ATOM 1317 C SER A 84 6.321 22.539 23.069 1.00 0.00 C ATOM 1318 O SER A 84 7.493 22.406 22.699 1.00 0.00 O ATOM 1319 CB SER A 84 5.555 24.942 22.983 1.00 0.00 C ATOM 1320 OG SER A 84 4.502 24.582 22.109 1.00 0.00 O ATOM 0 H SER A 84 7.338 25.029 24.739 1.00 0.00 H new ATOM 0 HA SER A 84 4.982 23.489 24.440 1.00 0.00 H new ATOM 0 HB2 SER A 84 5.266 25.806 23.581 1.00 0.00 H new ATOM 0 HB3 SER A 84 6.436 25.231 22.409 1.00 0.00 H new ATOM 0 HG SER A 84 3.993 25.383 21.863 1.00 0.00 H new ATOM 1326 N LYS A 85 5.360 21.650 22.776 1.00 0.00 N ATOM 1327 CA LYS A 85 5.553 20.377 22.050 1.00 0.00 C ATOM 1328 C LYS A 85 4.659 20.218 20.812 1.00 0.00 C ATOM 1329 O LYS A 85 4.532 19.120 20.269 1.00 0.00 O ATOM 1330 CB LYS A 85 5.488 19.184 23.029 1.00 0.00 C ATOM 1331 CG LYS A 85 4.100 18.770 23.563 1.00 0.00 C ATOM 1332 CD LYS A 85 3.426 19.798 24.487 1.00 0.00 C ATOM 1333 CE LYS A 85 2.213 19.159 25.179 1.00 0.00 C ATOM 1334 NZ LYS A 85 1.554 20.103 26.127 1.00 0.00 N ATOM 0 H LYS A 85 4.388 21.800 23.047 1.00 0.00 H new ATOM 0 HA LYS A 85 6.557 20.397 21.626 1.00 0.00 H new ATOM 0 HB2 LYS A 85 5.929 18.319 22.533 1.00 0.00 H new ATOM 0 HB3 LYS A 85 6.121 19.418 23.885 1.00 0.00 H new ATOM 0 HG2 LYS A 85 3.443 18.581 22.714 1.00 0.00 H new ATOM 0 HG3 LYS A 85 4.201 17.829 24.104 1.00 0.00 H new ATOM 0 HD2 LYS A 85 4.138 20.151 25.233 1.00 0.00 H new ATOM 0 HD3 LYS A 85 3.111 20.668 23.910 1.00 0.00 H new ATOM 0 HE2 LYS A 85 1.493 18.838 24.426 1.00 0.00 H new ATOM 0 HE3 LYS A 85 2.531 18.266 25.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 0.740 19.635 26.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 2.234 20.390 26.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 1.228 20.944 25.609 1.00 0.00 H new ATOM 1348 N HIS A 86 4.033 21.312 20.365 1.00 0.00 N ATOM 1349 CA HIS A 86 3.083 21.331 19.247 1.00 0.00 C ATOM 1350 C HIS A 86 3.523 22.266 18.118 1.00 0.00 C ATOM 1351 O HIS A 86 4.069 23.346 18.362 1.00 0.00 O ATOM 1352 CB HIS A 86 1.685 21.716 19.748 1.00 0.00 C ATOM 1353 CG HIS A 86 1.055 20.778 20.748 1.00 0.00 C ATOM 1354 ND1 HIS A 86 0.165 21.181 21.745 1.00 0.00 N ATOM 1355 CD2 HIS A 86 1.152 19.417 20.767 1.00 0.00 C ATOM 1356 CE1 HIS A 86 -0.249 20.055 22.349 1.00 0.00 C ATOM 1357 NE2 HIS A 86 0.330 18.982 21.785 1.00 0.00 N ATOM 0 H HIS A 86 4.177 22.232 20.781 1.00 0.00 H new ATOM 0 HA HIS A 86 3.055 20.324 18.831 1.00 0.00 H new ATOM 0 HB2 HIS A 86 1.743 22.707 20.197 1.00 0.00 H new ATOM 0 HB3 HIS A 86 1.022 21.795 18.887 1.00 0.00 H new ATOM 0 HD2 HIS A 86 1.754 18.802 20.114 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -0.948 20.018 23.171 1.00 0.00 H new ATOM 0 HE2 HIS A 86 0.186 18.011 22.063 1.00 0.00 H new ATOM 1365 N LYS A 87 3.258 21.846 16.875 1.00 0.00 N ATOM 1366 CA LYS A 87 3.608 22.570 15.643 1.00 0.00 C ATOM 1367 C LYS A 87 2.490 22.494 14.596 1.00 0.00 C ATOM 1368 O LYS A 87 1.662 21.581 14.594 1.00 0.00 O ATOM 1369 CB LYS A 87 4.944 22.048 15.066 1.00 0.00 C ATOM 1370 CG LYS A 87 6.172 22.375 15.933 1.00 0.00 C ATOM 1371 CD LYS A 87 7.472 21.872 15.282 1.00 0.00 C ATOM 1372 CE LYS A 87 8.690 22.317 16.108 1.00 0.00 C ATOM 1373 NZ LYS A 87 9.959 21.715 15.613 1.00 0.00 N ATOM 0 H LYS A 87 2.779 20.965 16.691 1.00 0.00 H new ATOM 0 HA LYS A 87 3.731 23.621 15.904 1.00 0.00 H new ATOM 0 HB2 LYS A 87 4.877 20.967 14.943 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.090 22.473 14.073 1.00 0.00 H new ATOM 0 HG2 LYS A 87 6.234 23.452 16.086 1.00 0.00 H new ATOM 0 HG3 LYS A 87 6.056 21.919 16.916 1.00 0.00 H new ATOM 0 HD2 LYS A 87 7.452 20.785 15.208 1.00 0.00 H new ATOM 0 HD3 LYS A 87 7.552 22.260 14.266 1.00 0.00 H new ATOM 0 HE2 LYS A 87 8.770 23.404 16.077 1.00 0.00 H new ATOM 0 HE3 LYS A 87 8.541 22.038 17.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 10.752 22.044 16.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 9.895 20.678 15.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 10.117 22.002 14.626 1.00 0.00 H new ATOM 1387 N PHE A 88 2.521 23.448 13.672 1.00 0.00 N ATOM 1388 CA PHE A 88 1.714 23.502 12.455 1.00 0.00 C ATOM 1389 C PHE A 88 2.609 23.456 11.216 1.00 0.00 C ATOM 1390 O PHE A 88 3.713 24.004 11.201 1.00 0.00 O ATOM 1391 CB PHE A 88 0.836 24.761 12.445 1.00 0.00 C ATOM 1392 CG PHE A 88 -0.471 24.547 13.165 1.00 0.00 C ATOM 1393 CD1 PHE A 88 -1.517 23.875 12.508 1.00 0.00 C ATOM 1394 CD2 PHE A 88 -0.624 24.963 14.498 1.00 0.00 C ATOM 1395 CE1 PHE A 88 -2.719 23.615 13.185 1.00 0.00 C ATOM 1396 CE2 PHE A 88 -1.826 24.699 15.175 1.00 0.00 C ATOM 1397 CZ PHE A 88 -2.870 24.026 14.517 1.00 0.00 C ATOM 0 H PHE A 88 3.145 24.251 13.756 1.00 0.00 H new ATOM 0 HA PHE A 88 1.060 22.630 12.436 1.00 0.00 H new ATOM 0 HB2 PHE A 88 1.377 25.583 12.913 1.00 0.00 H new ATOM 0 HB3 PHE A 88 0.638 25.056 11.415 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -1.396 23.559 11.482 1.00 0.00 H new ATOM 0 HD2 PHE A 88 0.179 25.483 15.000 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -3.524 23.100 12.682 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -1.948 25.013 16.201 1.00 0.00 H new ATOM 0 HZ PHE A 88 -3.793 23.824 15.040 1.00 0.00 H new ATOM 1407 N MET A 89 2.094 22.834 10.158 1.00 0.00 N ATOM 1408 CA MET A 89 2.724 22.778 8.841 1.00 0.00 C ATOM 1409 C MET A 89 1.702 23.175 7.774 1.00 0.00 C ATOM 1410 O MET A 89 0.566 22.701 7.797 1.00 0.00 O ATOM 1411 CB MET A 89 3.316 21.376 8.628 1.00 0.00 C ATOM 1412 CG MET A 89 3.981 21.181 7.261 1.00 0.00 C ATOM 1413 SD MET A 89 4.515 19.470 6.977 1.00 0.00 S ATOM 1414 CE MET A 89 5.280 19.643 5.343 1.00 0.00 C ATOM 0 H MET A 89 1.202 22.341 10.194 1.00 0.00 H new ATOM 0 HA MET A 89 3.548 23.487 8.766 1.00 0.00 H new ATOM 0 HB2 MET A 89 4.051 21.181 9.409 1.00 0.00 H new ATOM 0 HB3 MET A 89 2.523 20.637 8.744 1.00 0.00 H new ATOM 0 HG2 MET A 89 3.282 21.474 6.477 1.00 0.00 H new ATOM 0 HG3 MET A 89 4.843 21.844 7.183 1.00 0.00 H new ATOM 0 HE1 MET A 89 5.663 18.676 5.017 1.00 0.00 H new ATOM 0 HE2 MET A 89 4.537 19.998 4.629 1.00 0.00 H new ATOM 0 HE3 MET A 89 6.100 20.358 5.399 1.00 0.00 H new ATOM 1424 N VAL A 90 2.102 24.028 6.829 1.00 0.00 N ATOM 1425 CA VAL A 90 1.277 24.437 5.679 1.00 0.00 C ATOM 1426 C VAL A 90 2.006 24.061 4.391 1.00 0.00 C ATOM 1427 O VAL A 90 3.002 24.694 4.040 1.00 0.00 O ATOM 1428 CB VAL A 90 0.899 25.934 5.732 1.00 0.00 C ATOM 1429 CG1 VAL A 90 -0.031 26.318 4.571 1.00 0.00 C ATOM 1430 CG2 VAL A 90 0.178 26.291 7.039 1.00 0.00 C ATOM 0 H VAL A 90 3.024 24.464 6.837 1.00 0.00 H new ATOM 0 HA VAL A 90 0.327 23.904 5.713 1.00 0.00 H new ATOM 0 HB VAL A 90 1.838 26.484 5.662 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -0.278 27.378 4.638 1.00 0.00 H new ATOM 0 HG12 VAL A 90 0.470 26.121 3.623 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -0.946 25.728 4.627 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -0.071 27.352 7.039 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -0.736 25.703 7.122 1.00 0.00 H new ATOM 0 HG23 VAL A 90 0.829 26.072 7.885 1.00 0.00 H new ATOM 1440 N GLN A 91 1.510 23.041 3.690 1.00 0.00 N ATOM 1441 CA GLN A 91 2.055 22.533 2.428 1.00 0.00 C ATOM 1442 C GLN A 91 1.303 23.174 1.258 1.00 0.00 C ATOM 1443 O GLN A 91 0.085 23.333 1.312 1.00 0.00 O ATOM 1444 CB GLN A 91 1.942 20.997 2.413 1.00 0.00 C ATOM 1445 CG GLN A 91 2.711 20.352 1.246 1.00 0.00 C ATOM 1446 CD GLN A 91 2.475 18.845 1.180 1.00 0.00 C ATOM 1447 OE1 GLN A 91 3.145 18.055 1.831 1.00 0.00 O ATOM 1448 NE2 GLN A 91 1.507 18.391 0.411 1.00 0.00 N ATOM 0 H GLN A 91 0.685 22.525 3.997 1.00 0.00 H new ATOM 0 HA GLN A 91 3.109 22.794 2.330 1.00 0.00 H new ATOM 0 HB2 GLN A 91 2.321 20.600 3.355 1.00 0.00 H new ATOM 0 HB3 GLN A 91 0.891 20.715 2.349 1.00 0.00 H new ATOM 0 HG2 GLN A 91 2.400 20.811 0.307 1.00 0.00 H new ATOM 0 HG3 GLN A 91 3.777 20.549 1.359 1.00 0.00 H new ATOM 0 HE21 GLN A 91 0.943 19.041 -0.136 1.00 0.00 H new ATOM 0 HE22 GLN A 91 1.322 17.389 0.362 1.00 0.00 H new ATOM 1457 N THR A 92 2.013 23.566 0.202 1.00 0.00 N ATOM 1458 CA THR A 92 1.453 24.299 -0.947 1.00 0.00 C ATOM 1459 C THR A 92 2.041 23.839 -2.274 1.00 0.00 C ATOM 1460 O THR A 92 3.192 23.405 -2.343 1.00 0.00 O ATOM 1461 CB THR A 92 1.630 25.816 -0.804 1.00 0.00 C ATOM 1462 OG1 THR A 92 2.900 26.144 -0.296 1.00 0.00 O ATOM 1463 CG2 THR A 92 0.578 26.417 0.125 1.00 0.00 C ATOM 0 H THR A 92 3.012 23.383 0.113 1.00 0.00 H new ATOM 0 HA THR A 92 0.387 24.070 -0.949 1.00 0.00 H new ATOM 0 HB THR A 92 1.517 26.230 -1.806 1.00 0.00 H new ATOM 0 HG1 THR A 92 2.808 26.489 0.617 1.00 0.00 H new ATOM 0 HG21 THR A 92 0.734 27.493 0.203 1.00 0.00 H new ATOM 0 HG22 THR A 92 -0.416 26.222 -0.277 1.00 0.00 H new ATOM 0 HG23 THR A 92 0.665 25.965 1.113 1.00 0.00 H new ATOM 1471 N ILE A 93 1.248 23.934 -3.341 1.00 0.00 N ATOM 1472 CA ILE A 93 1.690 23.606 -4.705 1.00 0.00 C ATOM 1473 C ILE A 93 0.942 24.439 -5.750 1.00 0.00 C ATOM 1474 O ILE A 93 -0.245 24.725 -5.593 1.00 0.00 O ATOM 1475 CB ILE A 93 1.569 22.083 -4.925 1.00 0.00 C ATOM 1476 CG1 ILE A 93 2.564 21.544 -5.973 1.00 0.00 C ATOM 1477 CG2 ILE A 93 0.120 21.610 -5.130 1.00 0.00 C ATOM 1478 CD1 ILE A 93 2.084 21.462 -7.421 1.00 0.00 C ATOM 0 H ILE A 93 0.277 24.241 -3.288 1.00 0.00 H new ATOM 0 HA ILE A 93 2.740 23.872 -4.829 1.00 0.00 H new ATOM 0 HB ILE A 93 1.875 21.621 -3.986 1.00 0.00 H new ATOM 0 HG12 ILE A 93 3.453 22.174 -5.948 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.872 20.545 -5.663 1.00 0.00 H new ATOM 0 HG21 ILE A 93 0.107 20.530 -5.279 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.473 21.862 -4.251 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -0.303 22.102 -6.006 1.00 0.00 H new ATOM 0 HD11 ILE A 93 2.884 21.067 -8.048 1.00 0.00 H new ATOM 0 HD12 ILE A 93 1.217 20.804 -7.480 1.00 0.00 H new ATOM 0 HD13 ILE A 93 1.808 22.457 -7.770 1.00 0.00 H new ATOM 1490 N PHE A 94 1.632 24.866 -6.808 1.00 0.00 N ATOM 1491 CA PHE A 94 1.014 25.677 -7.862 1.00 0.00 C ATOM 1492 C PHE A 94 -0.068 24.892 -8.615 1.00 0.00 C ATOM 1493 O PHE A 94 0.171 23.794 -9.123 1.00 0.00 O ATOM 1494 CB PHE A 94 2.072 26.231 -8.822 1.00 0.00 C ATOM 1495 CG PHE A 94 2.810 27.436 -8.279 1.00 0.00 C ATOM 1496 CD1 PHE A 94 2.112 28.645 -8.085 1.00 0.00 C ATOM 1497 CD2 PHE A 94 4.183 27.367 -7.981 1.00 0.00 C ATOM 1498 CE1 PHE A 94 2.786 29.780 -7.611 1.00 0.00 C ATOM 1499 CE2 PHE A 94 4.861 28.509 -7.520 1.00 0.00 C ATOM 1500 CZ PHE A 94 4.164 29.717 -7.347 1.00 0.00 C ATOM 0 H PHE A 94 2.620 24.664 -6.960 1.00 0.00 H new ATOM 0 HA PHE A 94 0.524 26.524 -7.382 1.00 0.00 H new ATOM 0 HB2 PHE A 94 2.793 25.445 -9.048 1.00 0.00 H new ATOM 0 HB3 PHE A 94 1.591 26.503 -9.762 1.00 0.00 H new ATOM 0 HD1 PHE A 94 1.055 28.698 -8.302 1.00 0.00 H new ATOM 0 HD2 PHE A 94 4.716 26.436 -8.106 1.00 0.00 H new ATOM 0 HE1 PHE A 94 2.246 30.701 -7.449 1.00 0.00 H new ATOM 0 HE2 PHE A 94 5.917 28.458 -7.299 1.00 0.00 H new ATOM 0 HZ PHE A 94 4.689 30.599 -7.010 1.00 0.00 H new ATOM 1510 N ALA A 95 -1.264 25.473 -8.696 1.00 0.00 N ATOM 1511 CA ALA A 95 -2.398 24.848 -9.374 1.00 0.00 C ATOM 1512 C ALA A 95 -2.256 24.919 -10.915 1.00 0.00 C ATOM 1513 O ALA A 95 -1.629 25.854 -11.432 1.00 0.00 O ATOM 1514 CB ALA A 95 -3.685 25.502 -8.861 1.00 0.00 C ATOM 0 H ALA A 95 -1.474 26.387 -8.295 1.00 0.00 H new ATOM 0 HA ALA A 95 -2.431 23.783 -9.142 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.545 25.050 -9.355 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -3.765 25.353 -7.784 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -3.662 26.570 -9.078 1.00 0.00 H new ATOM 1520 N PRO A 96 -2.836 23.963 -11.669 1.00 0.00 N ATOM 1521 CA PRO A 96 -2.849 23.992 -13.135 1.00 0.00 C ATOM 1522 C PRO A 96 -3.705 25.150 -13.689 1.00 0.00 C ATOM 1523 O PRO A 96 -4.505 25.737 -12.955 1.00 0.00 O ATOM 1524 CB PRO A 96 -3.377 22.613 -13.556 1.00 0.00 C ATOM 1525 CG PRO A 96 -4.307 22.246 -12.405 1.00 0.00 C ATOM 1526 CD PRO A 96 -3.573 22.799 -11.187 1.00 0.00 C ATOM 0 HA PRO A 96 -1.856 24.179 -13.544 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -3.907 22.655 -14.507 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -2.571 21.889 -13.672 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -5.293 22.697 -12.522 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -4.456 21.169 -12.333 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -4.274 23.077 -10.400 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -2.898 22.055 -10.765 1.00 0.00 H new ATOM 1599 N MET A 102 -9.448 19.644 -6.425 1.00 0.00 N ATOM 1600 CA MET A 102 -8.347 20.008 -5.522 1.00 0.00 C ATOM 1601 C MET A 102 -7.561 18.809 -4.976 1.00 0.00 C ATOM 1602 O MET A 102 -6.503 19.019 -4.394 1.00 0.00 O ATOM 1603 CB MET A 102 -8.833 20.902 -4.370 1.00 0.00 C ATOM 1604 CG MET A 102 -9.867 20.236 -3.451 1.00 0.00 C ATOM 1605 SD MET A 102 -10.548 21.325 -2.166 1.00 0.00 S ATOM 1606 CE MET A 102 -9.084 21.581 -1.125 1.00 0.00 C ATOM 0 HA MET A 102 -7.650 20.572 -6.141 1.00 0.00 H new ATOM 0 HB2 MET A 102 -7.973 21.205 -3.772 1.00 0.00 H new ATOM 0 HB3 MET A 102 -9.266 21.811 -4.788 1.00 0.00 H new ATOM 0 HG2 MET A 102 -10.687 19.859 -4.062 1.00 0.00 H new ATOM 0 HG3 MET A 102 -9.405 19.374 -2.971 1.00 0.00 H new ATOM 0 HE1 MET A 102 -9.368 22.127 -0.225 1.00 0.00 H new ATOM 0 HE2 MET A 102 -8.663 20.615 -0.846 1.00 0.00 H new ATOM 0 HE3 MET A 102 -8.340 22.155 -1.678 1.00 0.00 H new ATOM 1616 N GLU A 103 -8.021 17.568 -5.161 1.00 0.00 N ATOM 1617 CA GLU A 103 -7.241 16.368 -4.823 1.00 0.00 C ATOM 1618 C GLU A 103 -6.234 16.031 -5.934 1.00 0.00 C ATOM 1619 O GLU A 103 -5.111 15.615 -5.653 1.00 0.00 O ATOM 1620 CB GLU A 103 -8.189 15.188 -4.542 1.00 0.00 C ATOM 1621 CG GLU A 103 -7.465 13.999 -3.899 1.00 0.00 C ATOM 1622 CD GLU A 103 -8.442 12.841 -3.615 1.00 0.00 C ATOM 1623 OE1 GLU A 103 -9.153 12.876 -2.582 1.00 0.00 O ATOM 1624 OE2 GLU A 103 -8.490 11.875 -4.417 1.00 0.00 O ATOM 0 H GLU A 103 -8.942 17.364 -5.548 1.00 0.00 H new ATOM 0 HA GLU A 103 -6.665 16.567 -3.919 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -8.993 15.519 -3.885 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -8.652 14.867 -5.475 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -6.669 13.654 -4.559 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -6.993 14.317 -2.969 1.00 0.00 H new ATOM 1631 N ALA A 104 -6.598 16.267 -7.200 1.00 0.00 N ATOM 1632 CA ALA A 104 -5.824 15.833 -8.360 1.00 0.00 C ATOM 1633 C ALA A 104 -4.471 16.549 -8.471 1.00 0.00 C ATOM 1634 O ALA A 104 -3.484 15.920 -8.858 1.00 0.00 O ATOM 1635 CB ALA A 104 -6.668 16.051 -9.618 1.00 0.00 C ATOM 0 H ALA A 104 -7.450 16.771 -7.446 1.00 0.00 H new ATOM 0 HA ALA A 104 -5.591 14.775 -8.243 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -6.104 15.732 -10.494 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -7.586 15.468 -9.545 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -6.915 17.108 -9.711 1.00 0.00 H new ATOM 1641 N VAL A 105 -4.397 17.826 -8.061 1.00 0.00 N ATOM 1642 CA VAL A 105 -3.136 18.588 -8.079 1.00 0.00 C ATOM 1643 C VAL A 105 -2.055 17.914 -7.223 1.00 0.00 C ATOM 1644 O VAL A 105 -0.890 17.878 -7.600 1.00 0.00 O ATOM 1645 CB VAL A 105 -3.343 20.054 -7.662 1.00 0.00 C ATOM 1646 CG1 VAL A 105 -3.591 20.213 -6.158 1.00 0.00 C ATOM 1647 CG2 VAL A 105 -2.132 20.905 -8.052 1.00 0.00 C ATOM 0 H VAL A 105 -5.197 18.354 -7.712 1.00 0.00 H new ATOM 0 HA VAL A 105 -2.785 18.592 -9.111 1.00 0.00 H new ATOM 0 HB VAL A 105 -4.232 20.395 -8.192 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -3.730 21.268 -5.922 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -4.485 19.657 -5.876 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -2.734 19.827 -5.605 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -2.300 21.938 -7.748 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -1.242 20.520 -7.555 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -1.991 20.863 -9.132 1.00 0.00 H new ATOM 1657 N TRP A 106 -2.433 17.308 -6.094 1.00 0.00 N ATOM 1658 CA TRP A 106 -1.509 16.616 -5.192 1.00 0.00 C ATOM 1659 C TRP A 106 -1.055 15.258 -5.741 1.00 0.00 C ATOM 1660 O TRP A 106 0.046 14.803 -5.428 1.00 0.00 O ATOM 1661 CB TRP A 106 -2.209 16.445 -3.848 1.00 0.00 C ATOM 1662 CG TRP A 106 -2.656 17.730 -3.210 1.00 0.00 C ATOM 1663 CD1 TRP A 106 -3.937 18.138 -3.070 1.00 0.00 C ATOM 1664 CD2 TRP A 106 -1.841 18.831 -2.699 1.00 0.00 C ATOM 1665 NE1 TRP A 106 -3.973 19.396 -2.505 1.00 0.00 N ATOM 1666 CE2 TRP A 106 -2.708 19.867 -2.241 1.00 0.00 C ATOM 1667 CE3 TRP A 106 -0.455 19.073 -2.605 1.00 0.00 C ATOM 1668 CZ2 TRP A 106 -2.234 21.055 -1.674 1.00 0.00 C ATOM 1669 CZ3 TRP A 106 0.037 20.282 -2.078 1.00 0.00 C ATOM 1670 CH2 TRP A 106 -0.849 21.257 -1.583 1.00 0.00 C ATOM 0 H TRP A 106 -3.402 17.284 -5.777 1.00 0.00 H new ATOM 0 HA TRP A 106 -0.604 17.215 -5.087 1.00 0.00 H new ATOM 0 HB2 TRP A 106 -3.077 15.801 -3.984 1.00 0.00 H new ATOM 0 HB3 TRP A 106 -1.534 15.930 -3.164 1.00 0.00 H new ATOM 0 HD1 TRP A 106 -4.805 17.563 -3.358 1.00 0.00 H new ATOM 0 HE1 TRP A 106 -4.830 19.912 -2.308 1.00 0.00 H new ATOM 0 HE3 TRP A 106 0.240 18.319 -2.943 1.00 0.00 H new ATOM 0 HZ2 TRP A 106 -2.923 21.804 -1.312 1.00 0.00 H new ATOM 0 HZ3 TRP A 106 1.102 20.463 -2.053 1.00 0.00 H new ATOM 0 HH2 TRP A 106 -0.463 22.160 -1.133 1.00 0.00 H new ATOM 1681 N LYS A 107 -1.889 14.623 -6.578 1.00 0.00 N ATOM 1682 CA LYS A 107 -1.583 13.346 -7.242 1.00 0.00 C ATOM 1683 C LYS A 107 -0.670 13.525 -8.461 1.00 0.00 C ATOM 1684 O LYS A 107 0.151 12.652 -8.743 1.00 0.00 O ATOM 1685 CB LYS A 107 -2.896 12.631 -7.613 1.00 0.00 C ATOM 1686 CG LYS A 107 -3.839 12.365 -6.423 1.00 0.00 C ATOM 1687 CD LYS A 107 -3.240 11.454 -5.342 1.00 0.00 C ATOM 1688 CE LYS A 107 -4.202 11.369 -4.149 1.00 0.00 C ATOM 1689 NZ LYS A 107 -3.722 10.397 -3.127 1.00 0.00 N ATOM 0 H LYS A 107 -2.811 14.988 -6.817 1.00 0.00 H new ATOM 0 HA LYS A 107 -1.026 12.723 -6.542 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -3.426 13.232 -8.352 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -2.655 11.680 -8.089 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -4.113 13.318 -5.970 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -4.758 11.913 -6.795 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -3.061 10.459 -5.749 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -2.275 11.844 -5.017 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -4.307 12.354 -3.694 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -5.191 11.072 -4.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -4.396 10.365 -2.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -3.646 9.452 -3.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -2.789 10.694 -2.776 1.00 0.00 H new ATOM 1703 N GLU A 108 -0.769 14.664 -9.153 1.00 0.00 N ATOM 1704 CA GLU A 108 0.122 15.022 -10.268 1.00 0.00 C ATOM 1705 C GLU A 108 1.440 15.682 -9.831 1.00 0.00 C ATOM 1706 O GLU A 108 2.451 15.579 -10.531 1.00 0.00 O ATOM 1707 CB GLU A 108 -0.626 15.912 -11.267 1.00 0.00 C ATOM 1708 CG GLU A 108 -0.923 17.337 -10.819 1.00 0.00 C ATOM 1709 CD GLU A 108 -1.683 18.116 -11.911 1.00 0.00 C ATOM 1710 OE1 GLU A 108 -1.031 18.631 -12.853 1.00 0.00 O ATOM 1711 OE2 GLU A 108 -2.931 18.222 -11.839 1.00 0.00 O ATOM 0 H GLU A 108 -1.476 15.372 -8.955 1.00 0.00 H new ATOM 0 HA GLU A 108 0.411 14.085 -10.745 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -0.042 15.958 -12.186 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -1.571 15.428 -11.514 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -1.514 17.318 -9.904 1.00 0.00 H new ATOM 0 HG3 GLU A 108 0.010 17.850 -10.585 1.00 0.00 H new ATOM 1718 N ALA A 109 1.432 16.351 -8.676 1.00 0.00 N ATOM 1719 CA ALA A 109 2.562 17.107 -8.149 1.00 0.00 C ATOM 1720 C ALA A 109 3.741 16.197 -7.808 1.00 0.00 C ATOM 1721 O ALA A 109 3.598 15.209 -7.076 1.00 0.00 O ATOM 1722 CB ALA A 109 2.145 17.896 -6.905 1.00 0.00 C ATOM 0 H ALA A 109 0.614 16.380 -8.067 1.00 0.00 H new ATOM 0 HA ALA A 109 2.881 17.799 -8.928 1.00 0.00 H new ATOM 0 HB1 ALA A 109 3.000 18.454 -6.525 1.00 0.00 H new ATOM 0 HB2 ALA A 109 1.345 18.590 -7.165 1.00 0.00 H new ATOM 0 HB3 ALA A 109 1.792 17.206 -6.138 1.00 0.00 H new ATOM 1728 N LYS A 110 4.924 16.576 -8.292 1.00 0.00 N ATOM 1729 CA LYS A 110 6.182 15.917 -7.950 1.00 0.00 C ATOM 1730 C LYS A 110 6.790 16.476 -6.654 1.00 0.00 C ATOM 1731 O LYS A 110 6.559 17.639 -6.320 1.00 0.00 O ATOM 1732 CB LYS A 110 7.149 16.016 -9.146 1.00 0.00 C ATOM 1733 CG LYS A 110 6.708 15.107 -10.302 1.00 0.00 C ATOM 1734 CD LYS A 110 7.701 15.173 -11.470 1.00 0.00 C ATOM 1735 CE LYS A 110 7.269 14.190 -12.564 1.00 0.00 C ATOM 1736 NZ LYS A 110 8.201 14.213 -13.724 1.00 0.00 N ATOM 0 H LYS A 110 5.036 17.357 -8.939 1.00 0.00 H new ATOM 0 HA LYS A 110 5.988 14.863 -7.750 1.00 0.00 H new ATOM 0 HB2 LYS A 110 7.197 17.049 -9.492 1.00 0.00 H new ATOM 0 HB3 LYS A 110 8.154 15.739 -8.827 1.00 0.00 H new ATOM 0 HG2 LYS A 110 6.626 14.079 -9.949 1.00 0.00 H new ATOM 0 HG3 LYS A 110 5.718 15.406 -10.646 1.00 0.00 H new ATOM 0 HD2 LYS A 110 7.740 16.186 -11.871 1.00 0.00 H new ATOM 0 HD3 LYS A 110 8.705 14.929 -11.122 1.00 0.00 H new ATOM 0 HE2 LYS A 110 7.226 13.182 -12.151 1.00 0.00 H new ATOM 0 HE3 LYS A 110 6.263 14.439 -12.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 7.877 13.536 -14.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 8.223 15.169 -14.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 9.156 13.951 -13.407 1.00 0.00 H new ATOM 1750 N PRO A 111 7.640 15.698 -5.959 1.00 0.00 N ATOM 1751 CA PRO A 111 8.361 16.132 -4.753 1.00 0.00 C ATOM 1752 C PRO A 111 9.271 17.354 -4.982 1.00 0.00 C ATOM 1753 O PRO A 111 9.584 18.074 -4.034 1.00 0.00 O ATOM 1754 CB PRO A 111 9.138 14.896 -4.281 1.00 0.00 C ATOM 1755 CG PRO A 111 9.252 14.022 -5.529 1.00 0.00 C ATOM 1756 CD PRO A 111 7.970 14.321 -6.282 1.00 0.00 C ATOM 0 HA PRO A 111 7.664 16.485 -3.993 1.00 0.00 H new ATOM 0 HB2 PRO A 111 10.120 15.167 -3.894 1.00 0.00 H new ATOM 0 HB3 PRO A 111 8.612 14.378 -3.479 1.00 0.00 H new ATOM 0 HG2 PRO A 111 10.133 14.275 -6.118 1.00 0.00 H new ATOM 0 HG3 PRO A 111 9.332 12.965 -5.274 1.00 0.00 H new ATOM 0 HD2 PRO A 111 8.107 14.192 -7.356 1.00 0.00 H new ATOM 0 HD3 PRO A 111 7.171 13.645 -5.979 1.00 0.00 H new ATOM 1764 N ASP A 112 9.645 17.631 -6.236 1.00 0.00 N ATOM 1765 CA ASP A 112 10.401 18.828 -6.631 1.00 0.00 C ATOM 1766 C ASP A 112 9.528 20.091 -6.824 1.00 0.00 C ATOM 1767 O ASP A 112 10.033 21.213 -6.762 1.00 0.00 O ATOM 1768 CB ASP A 112 11.198 18.493 -7.900 1.00 0.00 C ATOM 1769 CG ASP A 112 12.176 19.610 -8.300 1.00 0.00 C ATOM 1770 OD1 ASP A 112 13.163 19.844 -7.560 1.00 0.00 O ATOM 1771 OD2 ASP A 112 11.989 20.226 -9.378 1.00 0.00 O ATOM 0 H ASP A 112 9.427 17.018 -7.022 1.00 0.00 H new ATOM 0 HA ASP A 112 11.072 19.088 -5.812 1.00 0.00 H new ATOM 0 HB2 ASP A 112 11.754 17.569 -7.741 1.00 0.00 H new ATOM 0 HB3 ASP A 112 10.505 18.311 -8.722 1.00 0.00 H new ATOM 1776 N GLU A 113 8.217 19.924 -7.024 1.00 0.00 N ATOM 1777 CA GLU A 113 7.239 21.016 -7.176 1.00 0.00 C ATOM 1778 C GLU A 113 6.577 21.411 -5.843 1.00 0.00 C ATOM 1779 O GLU A 113 6.012 22.501 -5.728 1.00 0.00 O ATOM 1780 CB GLU A 113 6.141 20.594 -8.165 1.00 0.00 C ATOM 1781 CG GLU A 113 6.667 20.252 -9.565 1.00 0.00 C ATOM 1782 CD GLU A 113 5.511 19.811 -10.482 1.00 0.00 C ATOM 1783 OE1 GLU A 113 4.937 18.720 -10.247 1.00 0.00 O ATOM 1784 OE2 GLU A 113 5.180 20.550 -11.444 1.00 0.00 O ATOM 0 H GLU A 113 7.790 19.000 -7.087 1.00 0.00 H new ATOM 0 HA GLU A 113 7.787 21.882 -7.547 1.00 0.00 H new ATOM 0 HB2 GLU A 113 5.616 19.728 -7.763 1.00 0.00 H new ATOM 0 HB3 GLU A 113 5.411 21.399 -8.248 1.00 0.00 H new ATOM 0 HG2 GLU A 113 7.168 21.120 -9.994 1.00 0.00 H new ATOM 0 HG3 GLU A 113 7.409 19.456 -9.497 1.00 0.00 H new ATOM 1791 N LEU A 114 6.624 20.524 -4.842 1.00 0.00 N ATOM 1792 CA LEU A 114 5.916 20.663 -3.569 1.00 0.00 C ATOM 1793 C LEU A 114 6.686 21.593 -2.621 1.00 0.00 C ATOM 1794 O LEU A 114 7.899 21.449 -2.436 1.00 0.00 O ATOM 1795 CB LEU A 114 5.682 19.265 -2.955 1.00 0.00 C ATOM 1796 CG LEU A 114 4.563 18.476 -3.662 1.00 0.00 C ATOM 1797 CD1 LEU A 114 4.650 16.976 -3.392 1.00 0.00 C ATOM 1798 CD2 LEU A 114 3.193 18.935 -3.168 1.00 0.00 C ATOM 0 H LEU A 114 7.172 19.666 -4.899 1.00 0.00 H new ATOM 0 HA LEU A 114 4.943 21.123 -3.738 1.00 0.00 H new ATOM 0 HB2 LEU A 114 6.609 18.693 -3.004 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.431 19.375 -1.900 1.00 0.00 H new ATOM 0 HG LEU A 114 4.690 18.665 -4.728 1.00 0.00 H new ATOM 0 HD11 LEU A 114 3.840 16.465 -3.912 1.00 0.00 H new ATOM 0 HD12 LEU A 114 5.607 16.597 -3.750 1.00 0.00 H new ATOM 0 HD13 LEU A 114 4.565 16.794 -2.321 1.00 0.00 H new ATOM 0 HD21 LEU A 114 2.414 18.368 -3.677 1.00 0.00 H new ATOM 0 HD22 LEU A 114 3.119 18.769 -2.093 1.00 0.00 H new ATOM 0 HD23 LEU A 114 3.067 19.997 -3.380 1.00 0.00 H new ATOM 1810 N MET A 115 5.968 22.537 -2.009 1.00 0.00 N ATOM 1811 CA MET A 115 6.505 23.523 -1.069 1.00 0.00 C ATOM 1812 C MET A 115 5.868 23.363 0.316 1.00 0.00 C ATOM 1813 O MET A 115 4.753 22.854 0.435 1.00 0.00 O ATOM 1814 CB MET A 115 6.229 24.947 -1.571 1.00 0.00 C ATOM 1815 CG MET A 115 6.787 25.271 -2.961 1.00 0.00 C ATOM 1816 SD MET A 115 6.263 26.885 -3.615 1.00 0.00 S ATOM 1817 CE MET A 115 4.551 26.509 -4.096 1.00 0.00 C ATOM 0 H MET A 115 4.964 22.639 -2.159 1.00 0.00 H new ATOM 0 HA MET A 115 7.580 23.355 -0.996 1.00 0.00 H new ATOM 0 HB2 MET A 115 5.151 25.107 -1.584 1.00 0.00 H new ATOM 0 HB3 MET A 115 6.648 25.654 -0.855 1.00 0.00 H new ATOM 0 HG2 MET A 115 7.876 25.245 -2.919 1.00 0.00 H new ATOM 0 HG3 MET A 115 6.476 24.491 -3.656 1.00 0.00 H new ATOM 0 HE1 MET A 115 4.122 27.367 -4.614 1.00 0.00 H new ATOM 0 HE2 MET A 115 4.541 25.643 -4.758 1.00 0.00 H new ATOM 0 HE3 MET A 115 3.962 26.291 -3.205 1.00 0.00 H new ATOM 1827 N ASP A 116 6.522 23.853 1.370 1.00 0.00 N ATOM 1828 CA ASP A 116 5.962 23.856 2.724 1.00 0.00 C ATOM 1829 C ASP A 116 6.409 25.040 3.603 1.00 0.00 C ATOM 1830 O ASP A 116 7.204 25.893 3.204 1.00 0.00 O ATOM 1831 CB ASP A 116 6.177 22.495 3.409 1.00 0.00 C ATOM 1832 CG ASP A 116 7.662 22.145 3.597 1.00 0.00 C ATOM 1833 OD1 ASP A 116 8.293 22.689 4.533 1.00 0.00 O ATOM 1834 OD2 ASP A 116 8.187 21.293 2.838 1.00 0.00 O ATOM 0 H ASP A 116 7.456 24.259 1.310 1.00 0.00 H new ATOM 0 HA ASP A 116 4.890 24.012 2.603 1.00 0.00 H new ATOM 0 HB2 ASP A 116 5.685 22.502 4.382 1.00 0.00 H new ATOM 0 HB3 ASP A 116 5.698 21.716 2.816 1.00 0.00 H new ATOM 1839 N SER A 117 5.777 25.128 4.776 1.00 0.00 N ATOM 1840 CA SER A 117 5.883 26.196 5.778 1.00 0.00 C ATOM 1841 C SER A 117 5.737 25.556 7.161 1.00 0.00 C ATOM 1842 O SER A 117 4.863 24.703 7.313 1.00 0.00 O ATOM 1843 CB SER A 117 4.759 27.238 5.595 1.00 0.00 C ATOM 1844 OG SER A 117 4.254 27.261 4.266 1.00 0.00 O ATOM 0 H SER A 117 5.128 24.400 5.074 1.00 0.00 H new ATOM 0 HA SER A 117 6.843 26.700 5.668 1.00 0.00 H new ATOM 0 HB2 SER A 117 3.946 27.017 6.286 1.00 0.00 H new ATOM 0 HB3 SER A 117 5.138 28.227 5.854 1.00 0.00 H new ATOM 0 HG SER A 117 3.757 26.435 4.091 1.00 0.00 H new ATOM 1850 N LYS A 118 6.537 25.946 8.161 1.00 0.00 N ATOM 1851 CA LYS A 118 6.518 25.354 9.520 1.00 0.00 C ATOM 1852 C LYS A 118 6.487 26.405 10.637 1.00 0.00 C ATOM 1853 O LYS A 118 7.203 27.406 10.567 1.00 0.00 O ATOM 1854 CB LYS A 118 7.649 24.315 9.680 1.00 0.00 C ATOM 1855 CG LYS A 118 9.089 24.827 9.886 1.00 0.00 C ATOM 1856 CD LYS A 118 9.581 25.838 8.837 1.00 0.00 C ATOM 1857 CE LYS A 118 11.103 26.009 8.910 1.00 0.00 C ATOM 1858 NZ LYS A 118 11.578 27.097 8.010 1.00 0.00 N ATOM 0 H LYS A 118 7.227 26.690 8.056 1.00 0.00 H new ATOM 0 HA LYS A 118 5.575 24.819 9.630 1.00 0.00 H new ATOM 0 HB2 LYS A 118 7.398 23.679 10.529 1.00 0.00 H new ATOM 0 HB3 LYS A 118 7.645 23.681 8.794 1.00 0.00 H new ATOM 0 HG2 LYS A 118 9.156 25.288 10.871 1.00 0.00 H new ATOM 0 HG3 LYS A 118 9.765 23.972 9.888 1.00 0.00 H new ATOM 0 HD2 LYS A 118 9.297 25.501 7.840 1.00 0.00 H new ATOM 0 HD3 LYS A 118 9.095 26.800 8.998 1.00 0.00 H new ATOM 0 HE2 LYS A 118 11.396 26.232 9.936 1.00 0.00 H new ATOM 0 HE3 LYS A 118 11.588 25.072 8.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 12.612 27.184 8.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 11.320 26.872 7.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 11.134 27.996 8.287 1.00 0.00 H new ATOM 1872 N LEU A 119 5.636 26.194 11.642 1.00 0.00 N ATOM 1873 CA LEU A 119 5.357 27.142 12.732 1.00 0.00 C ATOM 1874 C LEU A 119 5.118 26.394 14.057 1.00 0.00 C ATOM 1875 O LEU A 119 4.626 25.267 14.040 1.00 0.00 O ATOM 1876 CB LEU A 119 4.116 28.001 12.373 1.00 0.00 C ATOM 1877 CG LEU A 119 4.264 28.929 11.143 1.00 0.00 C ATOM 1878 CD1 LEU A 119 3.742 28.287 9.849 1.00 0.00 C ATOM 1879 CD2 LEU A 119 3.457 30.217 11.308 1.00 0.00 C ATOM 0 H LEU A 119 5.101 25.330 11.726 1.00 0.00 H new ATOM 0 HA LEU A 119 6.222 27.793 12.859 1.00 0.00 H new ATOM 0 HB2 LEU A 119 3.274 27.331 12.198 1.00 0.00 H new ATOM 0 HB3 LEU A 119 3.862 28.615 13.237 1.00 0.00 H new ATOM 0 HG LEU A 119 5.334 29.124 11.076 1.00 0.00 H new ATOM 0 HD11 LEU A 119 3.871 28.983 9.020 1.00 0.00 H new ATOM 0 HD12 LEU A 119 4.300 27.373 9.646 1.00 0.00 H new ATOM 0 HD13 LEU A 119 2.684 28.049 9.962 1.00 0.00 H new ATOM 0 HD21 LEU A 119 3.586 30.843 10.425 1.00 0.00 H new ATOM 0 HD22 LEU A 119 2.402 29.972 11.428 1.00 0.00 H new ATOM 0 HD23 LEU A 119 3.807 30.756 12.189 1.00 0.00 H new ATOM 1891 N ARG A 120 5.415 27.000 15.213 1.00 0.00 N ATOM 1892 CA ARG A 120 5.156 26.417 16.553 1.00 0.00 C ATOM 1893 C ARG A 120 3.876 26.983 17.176 1.00 0.00 C ATOM 1894 O ARG A 120 3.425 28.055 16.777 1.00 0.00 O ATOM 1895 CB ARG A 120 6.352 26.672 17.491 1.00 0.00 C ATOM 1896 CG ARG A 120 7.715 26.261 16.901 1.00 0.00 C ATOM 1897 CD ARG A 120 8.881 26.802 17.735 1.00 0.00 C ATOM 1898 NE ARG A 120 8.982 28.268 17.600 1.00 0.00 N ATOM 1899 CZ ARG A 120 9.888 29.064 18.130 1.00 0.00 C ATOM 1900 NH1 ARG A 120 10.862 28.614 18.872 1.00 0.00 N ATOM 1901 NH2 ARG A 120 9.822 30.343 17.917 1.00 0.00 N ATOM 0 H ARG A 120 5.848 27.922 15.254 1.00 0.00 H new ATOM 0 HA ARG A 120 5.023 25.343 16.423 1.00 0.00 H new ATOM 0 HB2 ARG A 120 6.382 27.732 17.743 1.00 0.00 H new ATOM 0 HB3 ARG A 120 6.192 26.128 18.422 1.00 0.00 H new ATOM 0 HG2 ARG A 120 7.777 25.174 16.851 1.00 0.00 H new ATOM 0 HG3 ARG A 120 7.796 26.632 15.879 1.00 0.00 H new ATOM 0 HD2 ARG A 120 8.739 26.537 18.783 1.00 0.00 H new ATOM 0 HD3 ARG A 120 9.812 26.337 17.412 1.00 0.00 H new ATOM 0 HE ARG A 120 8.266 28.718 17.029 1.00 0.00 H new ATOM 0 HH11 ARG A 120 10.941 27.614 19.059 1.00 0.00 H new ATOM 0 HH12 ARG A 120 11.545 29.262 19.265 1.00 0.00 H new ATOM 0 HH21 ARG A 120 9.072 30.726 17.342 1.00 0.00 H new ATOM 0 HH22 ARG A 120 10.520 30.965 18.325 1.00 0.00 H new ATOM 1915 N CYS A 121 3.319 26.300 18.176 1.00 0.00 N ATOM 1916 CA CYS A 121 2.233 26.811 19.011 1.00 0.00 C ATOM 1917 C CYS A 121 2.812 27.478 20.267 1.00 0.00 C ATOM 1918 O CYS A 121 3.576 26.855 21.010 1.00 0.00 O ATOM 1919 CB CYS A 121 1.285 25.663 19.382 1.00 0.00 C ATOM 1920 SG CYS A 121 0.660 24.834 17.891 1.00 0.00 S ATOM 0 H CYS A 121 3.616 25.359 18.433 1.00 0.00 H new ATOM 0 HA CYS A 121 1.666 27.560 18.459 1.00 0.00 H new ATOM 0 HB2 CYS A 121 1.808 24.943 20.012 1.00 0.00 H new ATOM 0 HB3 CYS A 121 0.450 26.050 19.966 1.00 0.00 H new ATOM 0 HG CYS A 121 -0.429 24.186 18.179 1.00 0.00 H new ATOM 1926 N VAL A 122 2.438 28.732 20.511 1.00 0.00 N ATOM 1927 CA VAL A 122 2.826 29.524 21.692 1.00 0.00 C ATOM 1928 C VAL A 122 1.630 29.684 22.617 1.00 0.00 C ATOM 1929 O VAL A 122 0.544 29.994 22.138 1.00 0.00 O ATOM 1930 CB VAL A 122 3.336 30.919 21.293 1.00 0.00 C ATOM 1931 CG1 VAL A 122 3.719 31.756 22.520 1.00 0.00 C ATOM 1932 CG2 VAL A 122 4.534 30.814 20.353 1.00 0.00 C ATOM 0 H VAL A 122 1.834 29.250 19.873 1.00 0.00 H new ATOM 0 HA VAL A 122 3.631 28.992 22.199 1.00 0.00 H new ATOM 0 HB VAL A 122 2.517 31.420 20.776 1.00 0.00 H new ATOM 0 HG11 VAL A 122 4.074 32.734 22.197 1.00 0.00 H new ATOM 0 HG12 VAL A 122 2.847 31.881 23.162 1.00 0.00 H new ATOM 0 HG13 VAL A 122 4.508 31.248 23.075 1.00 0.00 H new ATOM 0 HG21 VAL A 122 4.876 31.814 20.086 1.00 0.00 H new ATOM 0 HG22 VAL A 122 5.341 30.276 20.851 1.00 0.00 H new ATOM 0 HG23 VAL A 122 4.242 30.277 19.450 1.00 0.00 H new ATOM 1942 N PHE A 123 1.838 29.560 23.926 1.00 0.00 N ATOM 1943 CA PHE A 123 0.772 29.649 24.925 1.00 0.00 C ATOM 1944 C PHE A 123 0.978 30.845 25.867 1.00 0.00 C ATOM 1945 O PHE A 123 2.031 30.980 26.496 1.00 0.00 O ATOM 1946 CB PHE A 123 0.694 28.313 25.668 1.00 0.00 C ATOM 1947 CG PHE A 123 0.560 27.124 24.733 1.00 0.00 C ATOM 1948 CD1 PHE A 123 -0.575 26.999 23.906 1.00 0.00 C ATOM 1949 CD2 PHE A 123 1.601 26.178 24.643 1.00 0.00 C ATOM 1950 CE1 PHE A 123 -0.679 25.918 23.014 1.00 0.00 C ATOM 1951 CE2 PHE A 123 1.489 25.091 23.760 1.00 0.00 C ATOM 1952 CZ PHE A 123 0.348 24.960 22.951 1.00 0.00 C ATOM 0 H PHE A 123 2.760 29.393 24.328 1.00 0.00 H new ATOM 0 HA PHE A 123 -0.184 29.832 24.435 1.00 0.00 H new ATOM 0 HB2 PHE A 123 1.589 28.190 26.278 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -0.157 28.331 26.349 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -1.365 27.734 23.958 1.00 0.00 H new ATOM 0 HD2 PHE A 123 2.485 26.289 25.253 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -1.547 25.823 22.378 1.00 0.00 H new ATOM 0 HE2 PHE A 123 2.279 24.357 23.703 1.00 0.00 H new ATOM 0 HZ PHE A 123 0.259 24.120 22.278 1.00 0.00 H new ATOM 1962 N GLU A 124 -0.029 31.715 25.955 1.00 0.00 N ATOM 1963 CA GLU A 124 -0.016 32.957 26.739 1.00 0.00 C ATOM 1964 C GLU A 124 -1.174 32.977 27.754 1.00 0.00 C ATOM 1965 O GLU A 124 -2.328 32.728 27.398 1.00 0.00 O ATOM 1966 CB GLU A 124 -0.140 34.176 25.807 1.00 0.00 C ATOM 1967 CG GLU A 124 0.949 34.369 24.742 1.00 0.00 C ATOM 1968 CD GLU A 124 2.238 35.032 25.273 1.00 0.00 C ATOM 1969 OE1 GLU A 124 2.641 34.794 26.438 1.00 0.00 O ATOM 1970 OE2 GLU A 124 2.858 35.812 24.506 1.00 0.00 O ATOM 0 H GLU A 124 -0.911 31.571 25.464 1.00 0.00 H new ATOM 0 HA GLU A 124 0.930 33.003 27.279 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -1.101 34.113 25.297 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -0.166 35.072 26.427 1.00 0.00 H new ATOM 0 HG2 GLU A 124 1.201 33.398 24.316 1.00 0.00 H new ATOM 0 HG3 GLU A 124 0.547 34.978 23.932 1.00 0.00 H new ATOM 1977 N MET A 125 -0.881 33.341 29.006 1.00 0.00 N ATOM 1978 CA MET A 125 -1.845 33.333 30.118 1.00 0.00 C ATOM 1979 C MET A 125 -2.602 34.673 30.243 1.00 0.00 C ATOM 1980 O MET A 125 -2.063 35.717 29.857 1.00 0.00 O ATOM 1981 CB MET A 125 -1.124 32.988 31.433 1.00 0.00 C ATOM 1982 CG MET A 125 -0.570 31.558 31.439 1.00 0.00 C ATOM 1983 SD MET A 125 0.183 31.053 33.014 1.00 0.00 S ATOM 1984 CE MET A 125 -1.301 30.806 34.030 1.00 0.00 C ATOM 0 H MET A 125 0.049 33.656 29.283 1.00 0.00 H new ATOM 0 HA MET A 125 -2.592 32.568 29.906 1.00 0.00 H new ATOM 0 HB2 MET A 125 -0.307 33.692 31.591 1.00 0.00 H new ATOM 0 HB3 MET A 125 -1.816 33.110 32.266 1.00 0.00 H new ATOM 0 HG2 MET A 125 -1.378 30.867 31.198 1.00 0.00 H new ATOM 0 HG3 MET A 125 0.174 31.466 30.648 1.00 0.00 H new ATOM 0 HE1 MET A 125 -1.012 30.424 35.009 1.00 0.00 H new ATOM 0 HE2 MET A 125 -1.822 31.756 34.150 1.00 0.00 H new ATOM 0 HE3 MET A 125 -1.961 30.089 33.542 1.00 0.00 H new ATOM 2301 N GLU B 358 5.119 13.876 15.689 1.00 0.00 N ATOM 2302 CA GLU B 358 4.166 13.188 14.810 1.00 0.00 C ATOM 2303 C GLU B 358 3.096 14.108 14.199 1.00 0.00 C ATOM 2304 O GLU B 358 2.087 14.428 14.826 1.00 0.00 O ATOM 2305 CB GLU B 358 3.600 11.928 15.467 1.00 0.00 C ATOM 2306 CG GLU B 358 2.976 11.014 14.410 1.00 0.00 C ATOM 2307 CD GLU B 358 4.025 10.259 13.575 1.00 0.00 C ATOM 2308 OE1 GLU B 358 4.451 9.156 13.995 1.00 0.00 O ATOM 2309 OE2 GLU B 358 4.408 10.749 12.486 1.00 0.00 O ATOM 0 HA GLU B 358 4.738 12.854 13.944 1.00 0.00 H new ATOM 0 HB2 GLU B 358 4.392 11.397 15.995 1.00 0.00 H new ATOM 0 HB3 GLU B 358 2.850 12.202 16.209 1.00 0.00 H new ATOM 0 HG2 GLU B 358 2.323 10.293 14.901 1.00 0.00 H new ATOM 0 HG3 GLU B 358 2.351 11.610 13.745 1.00 0.00 H new ATOM 2316 N PHE B 359 3.303 14.511 12.943 1.00 0.00 N ATOM 2317 CA PHE B 359 2.316 15.253 12.151 1.00 0.00 C ATOM 2318 C PHE B 359 1.191 14.371 11.570 1.00 0.00 C ATOM 2319 O PHE B 359 1.397 13.207 11.213 1.00 0.00 O ATOM 2320 CB PHE B 359 3.017 16.055 11.047 1.00 0.00 C ATOM 2321 CG PHE B 359 3.439 17.441 11.486 1.00 0.00 C ATOM 2322 CD1 PHE B 359 2.483 18.472 11.515 1.00 0.00 C ATOM 2323 CD2 PHE B 359 4.769 17.708 11.861 1.00 0.00 C ATOM 2324 CE1 PHE B 359 2.860 19.776 11.870 1.00 0.00 C ATOM 2325 CE2 PHE B 359 5.147 19.016 12.220 1.00 0.00 C ATOM 2326 CZ PHE B 359 4.197 20.053 12.200 1.00 0.00 C ATOM 0 H PHE B 359 4.172 14.329 12.440 1.00 0.00 H new ATOM 0 HA PHE B 359 1.821 15.939 12.839 1.00 0.00 H new ATOM 0 HB2 PHE B 359 3.896 15.505 10.711 1.00 0.00 H new ATOM 0 HB3 PHE B 359 2.348 16.141 10.190 1.00 0.00 H new ATOM 0 HD1 PHE B 359 1.455 18.259 11.263 1.00 0.00 H new ATOM 0 HD2 PHE B 359 5.498 16.911 11.873 1.00 0.00 H new ATOM 0 HE1 PHE B 359 2.123 20.566 11.890 1.00 0.00 H new ATOM 0 HE2 PHE B 359 6.166 19.223 12.511 1.00 0.00 H new ATOM 0 HZ PHE B 359 4.496 21.063 12.439 1.00 0.00 H new ATOM 2336 N PHE B 360 0.004 14.971 11.430 1.00 0.00 N ATOM 2337 CA PHE B 360 -1.250 14.358 10.981 1.00 0.00 C ATOM 2338 C PHE B 360 -1.998 15.281 10.000 1.00 0.00 C ATOM 2339 O PHE B 360 -1.868 16.506 10.064 1.00 0.00 O ATOM 2340 CB PHE B 360 -2.144 14.119 12.206 1.00 0.00 C ATOM 2341 CG PHE B 360 -1.815 12.879 13.016 1.00 0.00 C ATOM 2342 CD1 PHE B 360 -0.755 12.881 13.941 1.00 0.00 C ATOM 2343 CD2 PHE B 360 -2.592 11.718 12.855 1.00 0.00 C ATOM 2344 CE1 PHE B 360 -0.473 11.729 14.695 1.00 0.00 C ATOM 2345 CE2 PHE B 360 -2.296 10.559 13.591 1.00 0.00 C ATOM 2346 CZ PHE B 360 -1.237 10.563 14.516 1.00 0.00 C ATOM 0 H PHE B 360 -0.114 15.962 11.641 1.00 0.00 H new ATOM 0 HA PHE B 360 -1.019 13.422 10.473 1.00 0.00 H new ATOM 0 HB2 PHE B 360 -2.077 14.989 12.860 1.00 0.00 H new ATOM 0 HB3 PHE B 360 -3.179 14.051 11.872 1.00 0.00 H new ATOM 0 HD1 PHE B 360 -0.156 13.770 14.072 1.00 0.00 H new ATOM 0 HD2 PHE B 360 -3.420 11.718 12.162 1.00 0.00 H new ATOM 0 HE1 PHE B 360 0.333 11.740 15.414 1.00 0.00 H new ATOM 0 HE2 PHE B 360 -2.882 9.664 13.446 1.00 0.00 H new ATOM 0 HZ PHE B 360 -1.012 9.674 15.086 1.00 0.00 H new ATOM 2356 N ASP B 361 -2.831 14.702 9.129 1.00 0.00 N ATOM 2357 CA ASP B 361 -3.775 15.457 8.291 1.00 0.00 C ATOM 2358 C ASP B 361 -4.828 16.115 9.200 1.00 0.00 C ATOM 2359 O ASP B 361 -5.593 15.425 9.882 1.00 0.00 O ATOM 2360 CB ASP B 361 -4.432 14.519 7.265 1.00 0.00 C ATOM 2361 CG ASP B 361 -5.493 15.228 6.397 1.00 0.00 C ATOM 2362 OD1 ASP B 361 -5.213 16.350 5.915 1.00 0.00 O ATOM 2363 OD2 ASP B 361 -6.584 14.647 6.172 1.00 0.00 O ATOM 0 H ASP B 361 -2.871 13.693 8.983 1.00 0.00 H new ATOM 0 HA ASP B 361 -3.249 16.236 7.739 1.00 0.00 H new ATOM 0 HB2 ASP B 361 -3.662 14.100 6.618 1.00 0.00 H new ATOM 0 HB3 ASP B 361 -4.897 13.684 7.789 1.00 0.00 H new ATOM 2368 N ALA B 362 -4.829 17.449 9.262 1.00 0.00 N ATOM 2369 CA ALA B 362 -5.626 18.183 10.242 1.00 0.00 C ATOM 2370 C ALA B 362 -7.149 18.034 10.005 1.00 0.00 C ATOM 2371 O ALA B 362 -7.614 18.240 8.878 1.00 0.00 O ATOM 2372 CB ALA B 362 -5.200 19.655 10.255 1.00 0.00 C ATOM 0 H ALA B 362 -4.282 18.044 8.640 1.00 0.00 H new ATOM 0 HA ALA B 362 -5.434 17.748 11.223 1.00 0.00 H new ATOM 0 HB1 ALA B 362 -5.796 20.200 10.987 1.00 0.00 H new ATOM 0 HB2 ALA B 362 -4.145 19.726 10.521 1.00 0.00 H new ATOM 0 HB3 ALA B 362 -5.355 20.087 9.267 1.00 0.00 H new ATOM 2378 N PRO B 363 -7.949 17.724 11.045 1.00 0.00 N ATOM 2379 CA PRO B 363 -9.398 17.601 10.922 1.00 0.00 C ATOM 2380 C PRO B 363 -10.082 18.971 10.986 1.00 0.00 C ATOM 2381 O PRO B 363 -9.615 19.877 11.671 1.00 0.00 O ATOM 2382 CB PRO B 363 -9.811 16.709 12.095 1.00 0.00 C ATOM 2383 CG PRO B 363 -8.827 17.122 13.191 1.00 0.00 C ATOM 2384 CD PRO B 363 -7.539 17.390 12.406 1.00 0.00 C ATOM 0 HA PRO B 363 -9.695 17.176 9.963 1.00 0.00 H new ATOM 0 HB2 PRO B 363 -10.845 16.883 12.392 1.00 0.00 H new ATOM 0 HB3 PRO B 363 -9.724 15.651 11.850 1.00 0.00 H new ATOM 0 HG2 PRO B 363 -9.166 18.009 13.726 1.00 0.00 H new ATOM 0 HG3 PRO B 363 -8.693 16.334 13.932 1.00 0.00 H new ATOM 0 HD2 PRO B 363 -6.974 18.208 12.853 1.00 0.00 H new ATOM 0 HD3 PRO B 363 -6.891 16.514 12.413 1.00 0.00 H new ATOM 2392 N GLU B 364 -11.242 19.111 10.342 1.00 0.00 N ATOM 2393 CA GLU B 364 -12.094 20.301 10.509 1.00 0.00 C ATOM 2394 C GLU B 364 -12.673 20.419 11.922 1.00 0.00 C ATOM 2395 O GLU B 364 -12.762 21.525 12.459 1.00 0.00 O ATOM 2396 CB GLU B 364 -13.193 20.362 9.446 1.00 0.00 C ATOM 2397 CG GLU B 364 -14.157 19.167 9.418 1.00 0.00 C ATOM 2398 CD GLU B 364 -15.195 19.335 8.295 1.00 0.00 C ATOM 2399 OE1 GLU B 364 -16.256 19.962 8.532 1.00 0.00 O ATOM 2400 OE2 GLU B 364 -14.962 18.830 7.169 1.00 0.00 O ATOM 0 H GLU B 364 -11.618 18.416 9.697 1.00 0.00 H new ATOM 0 HA GLU B 364 -11.446 21.166 10.366 1.00 0.00 H new ATOM 0 HB2 GLU B 364 -13.774 21.271 9.602 1.00 0.00 H new ATOM 0 HB3 GLU B 364 -12.722 20.449 8.467 1.00 0.00 H new ATOM 0 HG2 GLU B 364 -13.597 18.244 9.268 1.00 0.00 H new ATOM 0 HG3 GLU B 364 -14.664 19.079 10.379 1.00 0.00 H new ATOM 2407 N ILE B 365 -13.018 19.281 12.536 1.00 0.00 N ATOM 2408 CA ILE B 365 -13.375 19.182 13.953 1.00 0.00 C ATOM 2409 C ILE B 365 -13.083 17.773 14.500 1.00 0.00 C ATOM 2410 O ILE B 365 -13.042 16.804 13.739 1.00 0.00 O ATOM 2411 CB ILE B 365 -14.829 19.648 14.199 1.00 0.00 C ATOM 2412 CG1 ILE B 365 -14.922 20.313 15.592 1.00 0.00 C ATOM 2413 CG2 ILE B 365 -15.850 18.511 14.012 1.00 0.00 C ATOM 2414 CD1 ILE B 365 -16.228 21.075 15.829 1.00 0.00 C ATOM 0 H ILE B 365 -13.057 18.385 12.050 1.00 0.00 H new ATOM 0 HA ILE B 365 -12.742 19.865 14.519 1.00 0.00 H new ATOM 0 HB ILE B 365 -15.093 20.389 13.445 1.00 0.00 H new ATOM 0 HG12 ILE B 365 -14.817 19.545 16.358 1.00 0.00 H new ATOM 0 HG13 ILE B 365 -14.085 21.000 15.712 1.00 0.00 H new ATOM 0 HG21 ILE B 365 -16.855 18.891 14.196 1.00 0.00 H new ATOM 0 HG22 ILE B 365 -15.787 18.130 12.993 1.00 0.00 H new ATOM 0 HG23 ILE B 365 -15.632 17.707 14.714 1.00 0.00 H new ATOM 0 HD11 ILE B 365 -16.218 21.513 16.827 1.00 0.00 H new ATOM 0 HD12 ILE B 365 -16.327 21.867 15.086 1.00 0.00 H new ATOM 0 HD13 ILE B 365 -17.070 20.389 15.742 1.00 0.00 H new ATOM 2426 N ILE B 366 -12.897 17.640 15.815 1.00 0.00 N ATOM 2427 CA ILE B 366 -12.518 16.370 16.455 1.00 0.00 C ATOM 2428 C ILE B 366 -13.734 15.447 16.666 1.00 0.00 C ATOM 2429 O ILE B 366 -14.750 15.845 17.237 1.00 0.00 O ATOM 2430 CB ILE B 366 -11.682 16.624 17.739 1.00 0.00 C ATOM 2431 CG1 ILE B 366 -11.218 15.332 18.451 1.00 0.00 C ATOM 2432 CG2 ILE B 366 -12.401 17.511 18.772 1.00 0.00 C ATOM 2433 CD1 ILE B 366 -10.384 14.392 17.576 1.00 0.00 C ATOM 0 H ILE B 366 -13.005 18.412 16.473 1.00 0.00 H new ATOM 0 HA ILE B 366 -11.865 15.821 15.776 1.00 0.00 H new ATOM 0 HB ILE B 366 -10.805 17.150 17.360 1.00 0.00 H new ATOM 0 HG12 ILE B 366 -10.633 15.606 19.329 1.00 0.00 H new ATOM 0 HG13 ILE B 366 -12.096 14.793 18.808 1.00 0.00 H new ATOM 0 HG21 ILE B 366 -11.760 17.647 19.643 1.00 0.00 H new ATOM 0 HG22 ILE B 366 -12.621 18.482 18.328 1.00 0.00 H new ATOM 0 HG23 ILE B 366 -13.332 17.033 19.077 1.00 0.00 H new ATOM 0 HD11 ILE B 366 -10.101 13.512 18.154 1.00 0.00 H new ATOM 0 HD12 ILE B 366 -10.971 14.084 16.710 1.00 0.00 H new ATOM 0 HD13 ILE B 366 -9.485 14.909 17.240 1.00 0.00 H new