USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1129 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 99 MET CE :methyl -162:sc= -1.1 (180deg=-1.97!) USER MOD Set 1.2: A 100 THR OG1 : rot 180:sc= -0.132 USER MOD Set 2.1: A 68 SER OG : rot 61:sc= 0.632 USER MOD Set 2.2: A 134 LYS NZ :NH3+ -129:sc= 0.0238 (180deg=0) USER MOD Set 3.1: A 40 TYR OH : rot 180:sc= 0.901 USER MOD Set 3.2: A 103 GLN : amide:sc= -3.21! C(o=-1!,f=-1.4!) USER MOD Set 3.3: A 107 LYS NZ :NH3+ 144:sc= 1.3 (180deg=0.424) USER MOD Set 4.1: A 28 MET CE :methyl -112:sc= -1.55 (180deg=-2.71!) USER MOD Set 4.2: A 110 MET CE :methyl 175:sc= -1.7! (180deg=-1.14) USER MOD Single : A 10 SER OG : rot 180:sc= -0.544 USER MOD Single : A 11 ASN :FLIP amide:sc= -0.208 F(o=-1.6,f=-0.21) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.0259 X(o=-0.026,f=-0.12) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ -113:sc= 0.91 (180deg=-0.108) USER MOD Single : A 29 SER OG : rot 85:sc= 0.768 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= -0.475 K(o=-0.47,f=-3.9!) USER MOD Single : A 43 MET CE :methyl -128:sc= -0.651 (180deg=-5.31!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 61:sc= 1.24 USER MOD Single : A 57 THR OG1 : rot -35:sc= -0.733 USER MOD Single : A 61 SER OG : rot 56:sc= -1.69 USER MOD Single : A 69 THR OG1 : rot -49:sc= 0.558 USER MOD Single : A 70 HIS : no HD1:sc= -3.81! X(o=-3.8!,f=-4.2) USER MOD Single : A 75 MET CE :methyl -161:sc= -0.0619 (180deg=-0.436) USER MOD Single : A 77 GLN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -0.188 K(o=-0.19,f=-2.1!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 MET CE :methyl -110:sc= -1.97 (180deg=-6.76!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -0.182 K(o=-0.18,f=-1.4) USER MOD Single : A 96 GLN : amide:sc= -0.0569 X(o=-0.057,f=0) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 65:sc= 0.00362 USER MOD Single : A 104 GLN : amide:sc= -0.12 X(o=-0.12,f=-0.55) USER MOD Single : A 106 TYR OH : rot -15:sc= -1.18 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 GLN : amide:sc= -0.04 X(o=-0.04,f=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 HIS : no HD1:sc= -0.488 K(o=-0.49,f=-1.9) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 ASN : amide:sc= -0.722 K(o=-0.72,f=-1.8) USER MOD Single : A 130 GLN : amide:sc= -0.0168 K(o=-0.017,f=-0.76) USER MOD Single : A 135 MET CE :methyl 136:sc= -0.219 (180deg=-0.87) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 97 N SER A 10 4.334 7.320 -8.393 1.00 14.25 N ATOM 98 CA SER A 10 5.233 8.412 -8.747 1.00 71.24 C ATOM 99 C SER A 10 5.867 8.171 -10.114 1.00 54.12 C ATOM 100 O SER A 10 6.107 9.109 -10.873 1.00 4.24 O ATOM 101 CB SER A 10 6.324 8.567 -7.687 1.00 24.23 C ATOM 102 OG SER A 10 7.497 7.862 -8.055 1.00 21.41 O ATOM 0 HA SER A 10 4.648 9.331 -8.793 1.00 71.24 H new ATOM 0 HB2 SER A 10 6.558 9.623 -7.553 1.00 24.23 H new ATOM 0 HB3 SER A 10 5.959 8.197 -6.729 1.00 24.23 H new ATOM 0 HG SER A 10 8.180 7.978 -7.362 1.00 21.41 H new ATOM 108 N ASN A 11 6.134 6.906 -10.421 1.00 21.22 N ATOM 109 CA ASN A 11 6.741 6.540 -11.696 1.00 15.12 C ATOM 110 C ASN A 11 5.787 6.824 -12.853 1.00 23.32 C ATOM 111 O ASN A 11 6.201 7.305 -13.908 1.00 10.35 O ATOM 112 CB ASN A 11 7.131 5.061 -11.693 1.00 30.32 C ATOM 113 CG ASN A 11 7.356 4.519 -13.091 1.00 52.34 C ATOM 114 OD1 ASN A 11 8.075 5.277 -13.911 1.00 10.31 O flip ATOM 115 ND2 ASN A 11 6.888 3.432 -13.431 1.00 4.35 N flip ATOM 0 H ASN A 11 5.940 6.117 -9.805 1.00 21.22 H new ATOM 0 HA ASN A 11 7.638 7.145 -11.831 1.00 15.12 H new ATOM 0 HB2 ASN A 11 8.039 4.929 -11.105 1.00 30.32 H new ATOM 0 HB3 ASN A 11 6.347 4.483 -11.204 1.00 30.32 H new ATOM 0 HD21 ASN A 11 6.341 2.882 -12.768 1.00 4.35 H new ATOM 0 HD22 ASN A 11 7.047 3.081 -14.375 1.00 4.35 H new ATOM 122 N ASP A 12 4.510 6.522 -12.647 1.00 40.21 N ATOM 123 CA ASP A 12 3.497 6.746 -13.672 1.00 10.01 C ATOM 124 C ASP A 12 3.026 8.197 -13.663 1.00 32.15 C ATOM 125 O ASP A 12 2.591 8.727 -14.685 1.00 73.53 O ATOM 126 CB ASP A 12 2.307 5.809 -13.457 1.00 4.15 C ATOM 127 CG ASP A 12 1.584 5.485 -14.749 1.00 2.20 C ATOM 128 OD1 ASP A 12 1.597 6.334 -15.664 1.00 42.15 O ATOM 129 OD2 ASP A 12 1.004 4.383 -14.845 1.00 24.03 O ATOM 0 H ASP A 12 4.152 6.122 -11.780 1.00 40.21 H new ATOM 0 HA ASP A 12 3.945 6.534 -14.643 1.00 10.01 H new ATOM 0 HB2 ASP A 12 2.655 4.884 -12.997 1.00 4.15 H new ATOM 0 HB3 ASP A 12 1.608 6.269 -12.758 1.00 4.15 H new ATOM 134 N LYS A 13 3.115 8.835 -12.500 1.00 75.14 N ATOM 135 CA LYS A 13 2.698 10.225 -12.356 1.00 70.23 C ATOM 136 C LYS A 13 3.485 11.129 -13.300 1.00 13.24 C ATOM 137 O LYS A 13 2.905 11.855 -14.107 1.00 52.03 O ATOM 138 CB LYS A 13 2.889 10.689 -10.910 1.00 70.45 C ATOM 139 CG LYS A 13 2.686 12.182 -10.719 1.00 21.31 C ATOM 140 CD LYS A 13 2.469 12.532 -9.256 1.00 71.23 C ATOM 141 CE LYS A 13 1.384 13.585 -9.090 1.00 72.44 C ATOM 142 NZ LYS A 13 1.434 14.226 -7.747 1.00 70.04 N ATOM 0 H LYS A 13 3.472 8.411 -11.644 1.00 75.14 H new ATOM 0 HA LYS A 13 1.641 10.291 -12.615 1.00 70.23 H new ATOM 0 HB2 LYS A 13 2.190 10.151 -10.269 1.00 70.45 H new ATOM 0 HB3 LYS A 13 3.893 10.422 -10.581 1.00 70.45 H new ATOM 0 HG2 LYS A 13 3.555 12.720 -11.098 1.00 21.31 H new ATOM 0 HG3 LYS A 13 1.827 12.511 -11.304 1.00 21.31 H new ATOM 0 HD2 LYS A 13 2.194 11.634 -8.703 1.00 71.23 H new ATOM 0 HD3 LYS A 13 3.401 12.898 -8.826 1.00 71.23 H new ATOM 0 HE2 LYS A 13 1.497 14.347 -9.861 1.00 72.44 H new ATOM 0 HE3 LYS A 13 0.407 13.126 -9.237 1.00 72.44 H new ATOM 0 HZ1 LYS A 13 0.679 14.937 -7.674 1.00 70.04 H new ATOM 0 HZ2 LYS A 13 1.301 13.503 -7.012 1.00 70.04 H new ATOM 0 HZ3 LYS A 13 2.357 14.686 -7.616 1.00 70.04 H new ATOM 156 N VAL A 14 4.809 11.079 -13.193 1.00 12.53 N ATOM 157 CA VAL A 14 5.675 11.892 -14.038 1.00 40.30 C ATOM 158 C VAL A 14 5.502 11.533 -15.509 1.00 73.33 C ATOM 159 O VAL A 14 5.509 12.406 -16.378 1.00 31.43 O ATOM 160 CB VAL A 14 7.156 11.723 -13.651 1.00 2.54 C ATOM 161 CG1 VAL A 14 7.562 10.259 -13.718 1.00 43.21 C ATOM 162 CG2 VAL A 14 8.042 12.573 -14.550 1.00 33.13 C ATOM 0 H VAL A 14 5.305 10.484 -12.529 1.00 12.53 H new ATOM 0 HA VAL A 14 5.383 12.931 -13.884 1.00 40.30 H new ATOM 0 HB VAL A 14 7.286 12.064 -12.624 1.00 2.54 H new ATOM 0 HG11 VAL A 14 8.612 10.159 -13.441 1.00 43.21 H new ATOM 0 HG12 VAL A 14 6.948 9.679 -13.028 1.00 43.21 H new ATOM 0 HG13 VAL A 14 7.417 9.887 -14.732 1.00 43.21 H new ATOM 0 HG21 VAL A 14 9.085 12.441 -14.262 1.00 33.13 H new ATOM 0 HG22 VAL A 14 7.910 12.265 -15.587 1.00 33.13 H new ATOM 0 HG23 VAL A 14 7.766 13.622 -14.445 1.00 33.13 H new ATOM 172 N TYR A 15 5.346 10.242 -15.783 1.00 14.24 N ATOM 173 CA TYR A 15 5.172 9.766 -17.150 1.00 21.13 C ATOM 174 C TYR A 15 3.802 10.159 -17.694 1.00 31.43 C ATOM 175 O TYR A 15 3.579 10.156 -18.904 1.00 31.33 O ATOM 176 CB TYR A 15 5.340 8.247 -17.208 1.00 30.30 C ATOM 177 CG TYR A 15 4.999 7.651 -18.555 1.00 52.02 C ATOM 178 CD1 TYR A 15 5.535 8.175 -19.725 1.00 10.43 C ATOM 179 CD2 TYR A 15 4.141 6.563 -18.658 1.00 71.22 C ATOM 180 CE1 TYR A 15 5.225 7.635 -20.958 1.00 23.34 C ATOM 181 CE2 TYR A 15 3.827 6.015 -19.887 1.00 32.32 C ATOM 182 CZ TYR A 15 4.371 6.554 -21.034 1.00 0.45 C ATOM 183 OH TYR A 15 4.061 6.012 -22.260 1.00 2.13 O ATOM 0 H TYR A 15 5.337 9.507 -15.076 1.00 14.24 H new ATOM 0 HA TYR A 15 5.936 10.234 -17.771 1.00 21.13 H new ATOM 0 HB2 TYR A 15 6.371 7.994 -16.959 1.00 30.30 H new ATOM 0 HB3 TYR A 15 4.707 7.791 -16.447 1.00 30.30 H new ATOM 0 HD1 TYR A 15 6.206 9.020 -19.669 1.00 10.43 H new ATOM 0 HD2 TYR A 15 3.712 6.138 -17.762 1.00 71.22 H new ATOM 0 HE1 TYR A 15 5.649 8.057 -21.858 1.00 23.34 H new ATOM 0 HE2 TYR A 15 3.159 5.169 -19.949 1.00 32.32 H new ATOM 0 HH TYR A 15 3.448 5.257 -22.138 1.00 2.13 H new ATOM 193 N GLU A 16 2.888 10.497 -16.789 1.00 60.33 N ATOM 194 CA GLU A 16 1.539 10.892 -17.178 1.00 23.11 C ATOM 195 C GLU A 16 1.457 12.399 -17.400 1.00 12.42 C ATOM 196 O GLU A 16 1.155 12.860 -18.500 1.00 20.20 O ATOM 197 CB GLU A 16 0.531 10.467 -16.108 1.00 62.22 C ATOM 198 CG GLU A 16 -0.163 9.151 -16.415 1.00 73.31 C ATOM 199 CD GLU A 16 -1.550 9.345 -16.996 1.00 74.40 C ATOM 200 OE1 GLU A 16 -1.748 10.325 -17.745 1.00 24.52 O ATOM 201 OE2 GLU A 16 -2.438 8.517 -16.702 1.00 54.41 O ATOM 0 H GLU A 16 3.057 10.505 -15.783 1.00 60.33 H new ATOM 0 HA GLU A 16 1.296 10.390 -18.115 1.00 23.11 H new ATOM 0 HB2 GLU A 16 1.044 10.383 -15.150 1.00 62.22 H new ATOM 0 HB3 GLU A 16 -0.221 11.248 -15.999 1.00 62.22 H new ATOM 0 HG2 GLU A 16 0.444 8.579 -17.117 1.00 73.31 H new ATOM 0 HG3 GLU A 16 -0.235 8.561 -15.502 1.00 73.31 H new ATOM 208 N ASN A 17 1.727 13.162 -16.346 1.00 12.44 N ATOM 209 CA ASN A 17 1.682 14.618 -16.424 1.00 42.00 C ATOM 210 C ASN A 17 2.523 15.126 -17.592 1.00 32.14 C ATOM 211 O ASN A 17 2.149 16.083 -18.270 1.00 74.52 O ATOM 212 CB ASN A 17 2.180 15.236 -15.116 1.00 23.42 C ATOM 213 CG ASN A 17 1.178 15.087 -13.988 1.00 32.43 C ATOM 214 OD1 ASN A 17 0.220 15.853 -13.889 1.00 14.24 O ATOM 215 ND2 ASN A 17 1.395 14.096 -13.130 1.00 43.40 N ATOM 0 H ASN A 17 1.979 12.797 -15.428 1.00 12.44 H new ATOM 0 HA ASN A 17 0.646 14.916 -16.587 1.00 42.00 H new ATOM 0 HB2 ASN A 17 3.119 14.764 -14.829 1.00 23.42 H new ATOM 0 HB3 ASN A 17 2.390 16.294 -15.274 1.00 23.42 H new ATOM 0 HD21 ASN A 17 0.754 13.947 -12.351 1.00 43.40 H new ATOM 0 HD22 ASN A 17 2.203 13.485 -13.251 1.00 43.40 H new ATOM 222 N VAL A 18 3.661 14.478 -17.820 1.00 52.13 N ATOM 223 CA VAL A 18 4.554 14.862 -18.907 1.00 2.34 C ATOM 224 C VAL A 18 3.800 14.966 -20.227 1.00 42.45 C ATOM 225 O VAL A 18 4.172 15.742 -21.109 1.00 2.02 O ATOM 226 CB VAL A 18 5.710 13.856 -19.065 1.00 54.35 C ATOM 227 CG1 VAL A 18 5.178 12.494 -19.485 1.00 40.44 C ATOM 228 CG2 VAL A 18 6.730 14.372 -20.069 1.00 22.12 C ATOM 0 H VAL A 18 3.986 13.685 -17.267 1.00 52.13 H new ATOM 0 HA VAL A 18 4.965 15.838 -18.650 1.00 2.34 H new ATOM 0 HB VAL A 18 6.207 13.744 -18.101 1.00 54.35 H new ATOM 0 HG11 VAL A 18 6.008 11.796 -19.592 1.00 40.44 H new ATOM 0 HG12 VAL A 18 4.488 12.123 -18.727 1.00 40.44 H new ATOM 0 HG13 VAL A 18 4.656 12.585 -20.438 1.00 40.44 H new ATOM 0 HG21 VAL A 18 7.540 13.649 -20.169 1.00 22.12 H new ATOM 0 HG22 VAL A 18 6.249 14.513 -21.037 1.00 22.12 H new ATOM 0 HG23 VAL A 18 7.133 15.323 -19.722 1.00 22.12 H new ATOM 238 N THR A 19 2.736 14.180 -20.359 1.00 65.31 N ATOM 239 CA THR A 19 1.929 14.182 -21.573 1.00 5.34 C ATOM 240 C THR A 19 0.808 15.211 -21.485 1.00 41.21 C ATOM 241 O THR A 19 0.614 16.012 -22.399 1.00 21.41 O ATOM 242 CB THR A 19 1.318 12.795 -21.843 1.00 73.24 C ATOM 243 OG1 THR A 19 2.358 11.825 -22.009 1.00 72.31 O ATOM 244 CG2 THR A 19 0.441 12.823 -23.086 1.00 50.13 C ATOM 0 H THR A 19 2.413 13.533 -19.639 1.00 65.31 H new ATOM 0 HA THR A 19 2.595 14.443 -22.396 1.00 5.34 H new ATOM 0 HB THR A 19 0.700 12.522 -20.987 1.00 73.24 H new ATOM 0 HG1 THR A 19 1.961 10.945 -22.179 1.00 72.31 H new ATOM 0 HG21 THR A 19 0.020 11.832 -23.257 1.00 50.13 H new ATOM 0 HG22 THR A 19 -0.367 13.541 -22.945 1.00 50.13 H new ATOM 0 HG23 THR A 19 1.041 13.116 -23.948 1.00 50.13 H new ATOM 252 N GLY A 20 0.072 15.185 -20.378 1.00 72.32 N ATOM 253 CA GLY A 20 -1.021 16.121 -20.192 1.00 33.02 C ATOM 254 C GLY A 20 -0.597 17.559 -20.413 1.00 41.25 C ATOM 255 O GLY A 20 -1.214 18.283 -21.196 1.00 13.23 O ATOM 0 H GLY A 20 0.213 14.532 -19.607 1.00 72.32 H new ATOM 0 HA2 GLY A 20 -1.828 15.874 -20.881 1.00 33.02 H new ATOM 0 HA3 GLY A 20 -1.419 16.014 -19.183 1.00 33.02 H new ATOM 259 N LEU A 21 0.459 17.976 -19.723 1.00 34.12 N ATOM 260 CA LEU A 21 0.965 19.339 -19.847 1.00 35.44 C ATOM 261 C LEU A 21 1.194 19.704 -21.310 1.00 35.32 C ATOM 262 O LEU A 21 0.954 20.839 -21.722 1.00 64.32 O ATOM 263 CB LEU A 21 2.268 19.493 -19.061 1.00 13.14 C ATOM 264 CG LEU A 21 3.504 18.835 -19.675 1.00 10.43 C ATOM 265 CD1 LEU A 21 4.206 19.797 -20.621 1.00 12.20 C ATOM 266 CD2 LEU A 21 4.456 18.367 -18.584 1.00 44.31 C ATOM 0 H LEU A 21 0.982 17.390 -19.072 1.00 34.12 H new ATOM 0 HA LEU A 21 0.217 20.017 -19.436 1.00 35.44 H new ATOM 0 HB2 LEU A 21 2.471 20.557 -18.938 1.00 13.14 H new ATOM 0 HB3 LEU A 21 2.118 19.079 -18.064 1.00 13.14 H new ATOM 0 HG LEU A 21 3.183 17.965 -20.247 1.00 10.43 H new ATOM 0 HD11 LEU A 21 5.083 19.312 -21.049 1.00 12.20 H new ATOM 0 HD12 LEU A 21 3.524 20.083 -21.421 1.00 12.20 H new ATOM 0 HD13 LEU A 21 4.515 20.687 -20.072 1.00 12.20 H new ATOM 0 HD21 LEU A 21 5.330 17.901 -19.039 1.00 44.31 H new ATOM 0 HD22 LEU A 21 4.771 19.221 -17.985 1.00 44.31 H new ATOM 0 HD23 LEU A 21 3.950 17.643 -17.946 1.00 44.31 H new ATOM 278 N VAL A 22 1.657 18.733 -22.091 1.00 55.01 N ATOM 279 CA VAL A 22 1.915 18.951 -23.509 1.00 74.15 C ATOM 280 C VAL A 22 0.621 19.229 -24.267 1.00 42.00 C ATOM 281 O VAL A 22 0.595 20.033 -25.199 1.00 12.21 O ATOM 282 CB VAL A 22 2.618 17.737 -24.145 1.00 31.21 C ATOM 283 CG1 VAL A 22 2.842 17.967 -25.632 1.00 2.24 C ATOM 284 CG2 VAL A 22 3.934 17.453 -23.437 1.00 32.15 C ATOM 0 H VAL A 22 1.861 17.788 -21.765 1.00 55.01 H new ATOM 0 HA VAL A 22 2.569 19.820 -23.581 1.00 74.15 H new ATOM 0 HB VAL A 22 1.974 16.865 -24.030 1.00 31.21 H new ATOM 0 HG11 VAL A 22 3.340 17.099 -26.064 1.00 2.24 H new ATOM 0 HG12 VAL A 22 1.882 18.118 -26.126 1.00 2.24 H new ATOM 0 HG13 VAL A 22 3.465 18.850 -25.774 1.00 2.24 H new ATOM 0 HG21 VAL A 22 4.417 16.592 -23.899 1.00 32.15 H new ATOM 0 HG22 VAL A 22 4.586 18.323 -23.519 1.00 32.15 H new ATOM 0 HG23 VAL A 22 3.743 17.240 -22.385 1.00 32.15 H new ATOM 294 N LYS A 23 -0.452 18.559 -23.861 1.00 23.13 N ATOM 295 CA LYS A 23 -1.751 18.734 -24.499 1.00 1.01 C ATOM 296 C LYS A 23 -2.219 20.182 -24.393 1.00 24.04 C ATOM 297 O LYS A 23 -2.732 20.750 -25.355 1.00 55.35 O ATOM 298 CB LYS A 23 -2.785 17.805 -23.860 1.00 74.41 C ATOM 299 CG LYS A 23 -2.391 16.338 -23.899 1.00 15.24 C ATOM 300 CD LYS A 23 -2.711 15.710 -25.245 1.00 11.12 C ATOM 301 CE LYS A 23 -2.331 14.238 -25.277 1.00 34.40 C ATOM 302 NZ LYS A 23 -3.473 13.379 -25.698 1.00 14.42 N ATOM 0 H LYS A 23 -0.447 17.889 -23.092 1.00 23.13 H new ATOM 0 HA LYS A 23 -1.647 18.481 -25.554 1.00 1.01 H new ATOM 0 HB2 LYS A 23 -2.938 18.104 -22.823 1.00 74.41 H new ATOM 0 HB3 LYS A 23 -3.739 17.930 -24.372 1.00 74.41 H new ATOM 0 HG2 LYS A 23 -1.324 16.241 -23.696 1.00 15.24 H new ATOM 0 HG3 LYS A 23 -2.916 15.798 -23.111 1.00 15.24 H new ATOM 0 HD2 LYS A 23 -3.775 15.817 -25.454 1.00 11.12 H new ATOM 0 HD3 LYS A 23 -2.177 16.242 -26.032 1.00 11.12 H new ATOM 0 HE2 LYS A 23 -1.496 14.093 -25.962 1.00 34.40 H new ATOM 0 HE3 LYS A 23 -1.990 13.930 -24.289 1.00 34.40 H new ATOM 0 HZ1 LYS A 23 -3.772 12.784 -24.900 1.00 14.42 H new ATOM 0 HZ2 LYS A 23 -4.267 13.980 -25.999 1.00 14.42 H new ATOM 0 HZ3 LYS A 23 -3.178 12.773 -26.490 1.00 14.42 H new ATOM 316 N ALA A 24 -2.036 20.773 -23.216 1.00 44.35 N ATOM 317 CA ALA A 24 -2.436 22.156 -22.986 1.00 63.12 C ATOM 318 C ALA A 24 -1.594 23.117 -23.819 1.00 71.11 C ATOM 319 O ALA A 24 -2.113 24.072 -24.397 1.00 14.03 O ATOM 320 CB ALA A 24 -2.324 22.498 -21.508 1.00 3.40 C ATOM 0 H ALA A 24 -1.614 20.316 -22.408 1.00 44.35 H new ATOM 0 HA ALA A 24 -3.476 22.264 -23.295 1.00 63.12 H new ATOM 0 HB1 ALA A 24 -2.626 23.533 -21.350 1.00 3.40 H new ATOM 0 HB2 ALA A 24 -2.974 21.839 -20.932 1.00 3.40 H new ATOM 0 HB3 ALA A 24 -1.292 22.367 -21.181 1.00 3.40 H new ATOM 326 N VAL A 25 -0.291 22.858 -23.876 1.00 55.43 N ATOM 327 CA VAL A 25 0.622 23.700 -24.639 1.00 42.51 C ATOM 328 C VAL A 25 0.157 23.848 -26.083 1.00 43.15 C ATOM 329 O VAL A 25 0.178 24.944 -26.644 1.00 3.52 O ATOM 330 CB VAL A 25 2.053 23.130 -24.628 1.00 10.23 C ATOM 331 CG1 VAL A 25 3.018 24.095 -25.300 1.00 10.14 C ATOM 332 CG2 VAL A 25 2.494 22.827 -23.204 1.00 10.44 C ATOM 0 H VAL A 25 0.155 22.072 -23.403 1.00 55.43 H new ATOM 0 HA VAL A 25 0.625 24.679 -24.159 1.00 42.51 H new ATOM 0 HB VAL A 25 2.058 22.197 -25.192 1.00 10.23 H new ATOM 0 HG11 VAL A 25 4.024 23.675 -25.282 1.00 10.14 H new ATOM 0 HG12 VAL A 25 2.710 24.257 -26.333 1.00 10.14 H new ATOM 0 HG13 VAL A 25 3.012 25.046 -24.767 1.00 10.14 H new ATOM 0 HG21 VAL A 25 3.507 22.425 -23.215 1.00 10.44 H new ATOM 0 HG22 VAL A 25 2.473 23.743 -22.614 1.00 10.44 H new ATOM 0 HG23 VAL A 25 1.818 22.095 -22.762 1.00 10.44 H new ATOM 342 N ILE A 26 -0.262 22.738 -26.680 1.00 75.25 N ATOM 343 CA ILE A 26 -0.734 22.744 -28.060 1.00 14.24 C ATOM 344 C ILE A 26 -2.164 23.267 -28.149 1.00 31.01 C ATOM 345 O ILE A 26 -2.464 24.148 -28.954 1.00 63.55 O ATOM 346 CB ILE A 26 -0.675 21.337 -28.682 1.00 24.44 C ATOM 347 CG1 ILE A 26 0.759 20.802 -28.650 1.00 35.54 C ATOM 348 CG2 ILE A 26 -1.204 21.365 -30.108 1.00 25.22 C ATOM 349 CD1 ILE A 26 0.852 19.348 -28.240 1.00 10.52 C ATOM 0 H ILE A 26 -0.285 21.823 -26.230 1.00 75.25 H new ATOM 0 HA ILE A 26 -0.071 23.406 -28.617 1.00 14.24 H new ATOM 0 HB ILE A 26 -1.306 20.669 -28.095 1.00 24.44 H new ATOM 0 HG12 ILE A 26 1.205 20.922 -29.637 1.00 35.54 H new ATOM 0 HG13 ILE A 26 1.348 21.405 -27.958 1.00 35.54 H new ATOM 0 HG21 ILE A 26 -1.156 20.363 -30.534 1.00 25.22 H new ATOM 0 HG22 ILE A 26 -2.238 21.709 -30.106 1.00 25.22 H new ATOM 0 HG23 ILE A 26 -0.598 22.044 -30.708 1.00 25.22 H new ATOM 0 HD11 ILE A 26 1.896 19.036 -28.239 1.00 10.52 H new ATOM 0 HD12 ILE A 26 0.436 19.225 -27.240 1.00 10.52 H new ATOM 0 HD13 ILE A 26 0.291 18.735 -28.945 1.00 10.52 H new ATOM 361 N GLU A 27 -3.042 22.719 -27.315 1.00 11.05 N ATOM 362 CA GLU A 27 -4.441 23.132 -27.299 1.00 64.52 C ATOM 363 C GLU A 27 -4.559 24.648 -27.175 1.00 33.21 C ATOM 364 O GLU A 27 -5.281 25.289 -27.938 1.00 34.12 O ATOM 365 CB GLU A 27 -5.182 22.455 -26.145 1.00 35.51 C ATOM 366 CG GLU A 27 -6.689 22.649 -26.192 1.00 3.10 C ATOM 367 CD GLU A 27 -7.319 22.024 -27.421 1.00 55.22 C ATOM 368 OE1 GLU A 27 -7.656 20.823 -27.369 1.00 30.43 O ATOM 369 OE2 GLU A 27 -7.476 22.736 -28.435 1.00 73.21 O ATOM 0 H GLU A 27 -2.810 21.989 -26.642 1.00 11.05 H new ATOM 0 HA GLU A 27 -4.895 22.826 -28.242 1.00 64.52 H new ATOM 0 HB2 GLU A 27 -4.961 21.388 -26.159 1.00 35.51 H new ATOM 0 HB3 GLU A 27 -4.803 22.847 -25.201 1.00 35.51 H new ATOM 0 HG2 GLU A 27 -7.136 22.214 -25.298 1.00 3.10 H new ATOM 0 HG3 GLU A 27 -6.915 23.715 -26.175 1.00 3.10 H new ATOM 376 N MET A 28 -3.845 25.214 -26.207 1.00 75.14 N ATOM 377 CA MET A 28 -3.870 26.655 -25.983 1.00 70.31 C ATOM 378 C MET A 28 -3.459 27.408 -27.244 1.00 53.31 C ATOM 379 O MET A 28 -4.105 28.381 -27.635 1.00 62.44 O ATOM 380 CB MET A 28 -2.941 27.028 -24.826 1.00 51.23 C ATOM 381 CG MET A 28 -2.929 28.516 -24.513 1.00 21.43 C ATOM 382 SD MET A 28 -2.187 28.882 -22.911 1.00 31.55 S ATOM 383 CE MET A 28 -0.448 28.683 -23.290 1.00 2.35 C ATOM 0 H MET A 28 -3.243 24.697 -25.566 1.00 75.14 H new ATOM 0 HA MET A 28 -4.890 26.941 -25.727 1.00 70.31 H new ATOM 0 HB2 MET A 28 -3.246 26.480 -23.935 1.00 51.23 H new ATOM 0 HB3 MET A 28 -1.927 26.707 -25.066 1.00 51.23 H new ATOM 0 HG2 MET A 28 -2.379 29.043 -25.293 1.00 21.43 H new ATOM 0 HG3 MET A 28 -3.951 28.896 -24.531 1.00 21.43 H new ATOM 0 HE1 MET A 28 -0.059 27.809 -22.768 1.00 2.35 H new ATOM 0 HE2 MET A 28 -0.323 28.549 -24.364 1.00 2.35 H new ATOM 0 HE3 MET A 28 0.098 29.570 -22.969 1.00 2.35 H new ATOM 393 N SER A 29 -2.382 26.953 -27.876 1.00 2.34 N ATOM 394 CA SER A 29 -1.883 27.587 -29.090 1.00 41.42 C ATOM 395 C SER A 29 -2.933 27.545 -30.196 1.00 13.21 C ATOM 396 O SER A 29 -2.873 28.316 -31.154 1.00 15.02 O ATOM 397 CB SER A 29 -0.602 26.897 -29.562 1.00 5.32 C ATOM 398 OG SER A 29 0.418 26.989 -28.581 1.00 54.15 O ATOM 0 H SER A 29 -1.838 26.147 -27.567 1.00 2.34 H new ATOM 0 HA SER A 29 -1.663 28.630 -28.861 1.00 41.42 H new ATOM 0 HB2 SER A 29 -0.809 25.849 -29.779 1.00 5.32 H new ATOM 0 HB3 SER A 29 -0.260 27.354 -30.491 1.00 5.32 H new ATOM 0 HG SER A 29 0.316 26.260 -27.934 1.00 54.15 H new ATOM 404 N SER A 30 -3.895 26.639 -30.055 1.00 71.44 N ATOM 405 CA SER A 30 -4.957 26.492 -31.043 1.00 74.15 C ATOM 406 C SER A 30 -5.962 27.635 -30.935 1.00 0.11 C ATOM 407 O SER A 30 -6.183 28.377 -31.892 1.00 64.14 O ATOM 408 CB SER A 30 -5.672 25.151 -30.860 1.00 45.34 C ATOM 409 OG SER A 30 -6.058 24.604 -32.109 1.00 44.44 O ATOM 0 H SER A 30 -3.961 25.996 -29.266 1.00 71.44 H new ATOM 0 HA SER A 30 -4.503 26.522 -32.034 1.00 74.15 H new ATOM 0 HB2 SER A 30 -5.015 24.453 -30.341 1.00 45.34 H new ATOM 0 HB3 SER A 30 -6.552 25.287 -30.232 1.00 45.34 H new ATOM 0 HG SER A 30 -6.511 23.747 -31.965 1.00 44.44 H new ATOM 415 N LYS A 31 -6.569 27.771 -29.761 1.00 1.33 N ATOM 416 CA LYS A 31 -7.550 28.824 -29.523 1.00 63.24 C ATOM 417 C LYS A 31 -6.898 30.037 -28.868 1.00 1.02 C ATOM 418 O LYS A 31 -7.569 30.837 -28.216 1.00 55.42 O ATOM 419 CB LYS A 31 -8.685 28.302 -28.640 1.00 22.42 C ATOM 420 CG LYS A 31 -8.225 27.846 -27.266 1.00 35.52 C ATOM 421 CD LYS A 31 -9.341 27.145 -26.509 1.00 33.11 C ATOM 422 CE LYS A 31 -8.797 26.316 -25.356 1.00 34.34 C ATOM 423 NZ LYS A 31 -9.582 26.521 -24.106 1.00 45.44 N ATOM 0 H LYS A 31 -6.399 27.165 -28.959 1.00 1.33 H new ATOM 0 HA LYS A 31 -7.959 29.130 -30.486 1.00 63.24 H new ATOM 0 HB2 LYS A 31 -9.433 29.086 -28.522 1.00 22.42 H new ATOM 0 HB3 LYS A 31 -9.174 27.469 -29.145 1.00 22.42 H new ATOM 0 HG2 LYS A 31 -7.376 27.171 -27.371 1.00 35.52 H new ATOM 0 HG3 LYS A 31 -7.880 28.706 -26.693 1.00 35.52 H new ATOM 0 HD2 LYS A 31 -10.044 27.885 -26.126 1.00 33.11 H new ATOM 0 HD3 LYS A 31 -9.896 26.501 -27.191 1.00 33.11 H new ATOM 0 HE2 LYS A 31 -8.815 25.260 -25.627 1.00 34.34 H new ATOM 0 HE3 LYS A 31 -7.755 26.581 -25.178 1.00 34.34 H new ATOM 0 HZ1 LYS A 31 -9.180 25.939 -23.344 1.00 45.44 H new ATOM 0 HZ2 LYS A 31 -9.544 27.524 -23.833 1.00 45.44 H new ATOM 0 HZ3 LYS A 31 -10.571 26.244 -24.268 1.00 45.44 H new ATOM 437 N ILE A 32 -5.588 30.167 -29.046 1.00 4.42 N ATOM 438 CA ILE A 32 -4.847 31.285 -28.473 1.00 61.35 C ATOM 439 C ILE A 32 -5.358 32.617 -29.012 1.00 60.42 C ATOM 440 O ILE A 32 -5.483 33.590 -28.270 1.00 32.04 O ATOM 441 CB ILE A 32 -3.339 31.170 -28.767 1.00 33.25 C ATOM 442 CG1 ILE A 32 -2.590 32.367 -28.177 1.00 74.04 C ATOM 443 CG2 ILE A 32 -3.097 31.072 -30.265 1.00 70.23 C ATOM 444 CD1 ILE A 32 -1.386 31.978 -27.349 1.00 42.13 C ATOM 0 H ILE A 32 -5.018 29.513 -29.582 1.00 4.42 H new ATOM 0 HA ILE A 32 -5.003 31.248 -27.395 1.00 61.35 H new ATOM 0 HB ILE A 32 -2.960 30.262 -28.298 1.00 33.25 H new ATOM 0 HG12 ILE A 32 -2.267 33.019 -28.989 1.00 74.04 H new ATOM 0 HG13 ILE A 32 -3.276 32.945 -27.557 1.00 74.04 H new ATOM 0 HG21 ILE A 32 -2.027 30.991 -30.456 1.00 70.23 H new ATOM 0 HG22 ILE A 32 -3.603 30.191 -30.658 1.00 70.23 H new ATOM 0 HG23 ILE A 32 -3.487 31.964 -30.756 1.00 70.23 H new ATOM 0 HD11 ILE A 32 -0.904 32.876 -26.963 1.00 42.13 H new ATOM 0 HD12 ILE A 32 -1.704 31.351 -26.516 1.00 42.13 H new ATOM 0 HD13 ILE A 32 -0.680 31.426 -27.970 1.00 42.13 H new ATOM 456 N GLN A 33 -5.653 32.651 -30.308 1.00 30.33 N ATOM 457 CA GLN A 33 -6.152 33.863 -30.945 1.00 40.43 C ATOM 458 C GLN A 33 -7.478 34.297 -30.328 1.00 64.14 C ATOM 459 O GLN A 33 -7.602 35.385 -29.766 1.00 52.11 O ATOM 460 CB GLN A 33 -6.324 33.640 -32.449 1.00 13.42 C ATOM 461 CG GLN A 33 -5.207 34.243 -33.285 1.00 61.32 C ATOM 462 CD GLN A 33 -4.084 33.260 -33.554 1.00 11.14 C ATOM 463 OE1 GLN A 33 -4.084 32.143 -33.036 1.00 34.21 O ATOM 464 NE2 GLN A 33 -3.118 33.672 -34.367 1.00 35.22 N ATOM 0 H GLN A 33 -5.555 31.853 -30.936 1.00 30.33 H new ATOM 0 HA GLN A 33 -5.421 34.655 -30.783 1.00 40.43 H new ATOM 0 HB2 GLN A 33 -6.376 32.569 -32.645 1.00 13.42 H new ATOM 0 HB3 GLN A 33 -7.275 34.069 -32.765 1.00 13.42 H new ATOM 0 HG2 GLN A 33 -5.616 34.591 -34.234 1.00 61.32 H new ATOM 0 HG3 GLN A 33 -4.805 35.117 -32.772 1.00 61.32 H new ATOM 0 HE21 GLN A 33 -3.158 34.606 -34.774 1.00 35.22 H new ATOM 0 HE22 GLN A 33 -2.336 33.054 -34.584 1.00 35.22 H new ATOM 473 N PRO A 34 -8.493 33.427 -30.435 1.00 10.01 N ATOM 474 CA PRO A 34 -9.828 33.698 -29.893 1.00 41.31 C ATOM 475 C PRO A 34 -9.848 33.686 -28.368 1.00 72.25 C ATOM 476 O PRO A 34 -10.854 34.032 -27.749 1.00 24.10 O ATOM 477 CB PRO A 34 -10.676 32.551 -30.449 1.00 1.44 C ATOM 478 CG PRO A 34 -9.706 31.448 -30.695 1.00 62.03 C ATOM 479 CD PRO A 34 -8.416 32.111 -31.092 1.00 10.50 C ATOM 0 HA PRO A 34 -10.189 34.688 -30.174 1.00 41.31 H new ATOM 0 HB2 PRO A 34 -11.447 32.249 -29.740 1.00 1.44 H new ATOM 0 HB3 PRO A 34 -11.184 32.844 -31.368 1.00 1.44 H new ATOM 0 HG2 PRO A 34 -9.573 30.839 -29.801 1.00 62.03 H new ATOM 0 HG3 PRO A 34 -10.062 30.784 -31.483 1.00 62.03 H new ATOM 0 HD2 PRO A 34 -7.551 31.542 -30.752 1.00 10.50 H new ATOM 0 HD3 PRO A 34 -8.330 32.207 -32.174 1.00 10.50 H new ATOM 487 N ALA A 35 -8.731 33.285 -27.770 1.00 14.24 N ATOM 488 CA ALA A 35 -8.621 33.230 -26.317 1.00 42.33 C ATOM 489 C ALA A 35 -9.128 34.519 -25.679 1.00 10.00 C ATOM 490 O ALA A 35 -8.486 35.567 -25.745 1.00 4.34 O ATOM 491 CB ALA A 35 -7.179 32.968 -25.907 1.00 73.23 C ATOM 0 H ALA A 35 -7.890 32.994 -28.268 1.00 14.24 H new ATOM 0 HA ALA A 35 -9.244 32.410 -25.961 1.00 42.33 H new ATOM 0 HB1 ALA A 35 -7.111 32.929 -24.820 1.00 73.23 H new ATOM 0 HB2 ALA A 35 -6.849 32.017 -26.325 1.00 73.23 H new ATOM 0 HB3 ALA A 35 -6.543 33.770 -26.282 1.00 73.23 H new ATOM 497 N PRO A 36 -10.308 34.442 -25.047 1.00 15.43 N ATOM 498 CA PRO A 36 -10.928 35.594 -24.384 1.00 41.25 C ATOM 499 C PRO A 36 -10.172 36.017 -23.129 1.00 72.23 C ATOM 500 O PRO A 36 -9.286 35.314 -22.643 1.00 41.10 O ATOM 501 CB PRO A 36 -12.325 35.085 -24.021 1.00 52.44 C ATOM 502 CG PRO A 36 -12.175 33.607 -23.918 1.00 70.24 C ATOM 503 CD PRO A 36 -11.129 33.225 -24.929 1.00 51.41 C ATOM 0 HA PRO A 36 -10.934 36.477 -25.023 1.00 41.25 H new ATOM 0 HB2 PRO A 36 -12.671 35.514 -23.081 1.00 52.44 H new ATOM 0 HB3 PRO A 36 -13.056 35.357 -24.783 1.00 52.44 H new ATOM 0 HG2 PRO A 36 -11.871 33.315 -22.913 1.00 70.24 H new ATOM 0 HG3 PRO A 36 -13.119 33.104 -24.125 1.00 70.24 H new ATOM 0 HD2 PRO A 36 -10.538 32.373 -24.593 1.00 51.41 H new ATOM 0 HD3 PRO A 36 -11.575 32.947 -25.884 1.00 51.41 H new ATOM 511 N PRO A 37 -10.529 37.192 -22.590 1.00 41.13 N ATOM 512 CA PRO A 37 -9.897 37.734 -21.384 1.00 1.02 C ATOM 513 C PRO A 37 -10.258 36.940 -20.133 1.00 73.54 C ATOM 514 O PRO A 37 -9.580 37.033 -19.111 1.00 14.12 O ATOM 515 CB PRO A 37 -10.460 39.155 -21.296 1.00 31.31 C ATOM 516 CG PRO A 37 -11.762 39.091 -22.018 1.00 2.53 C ATOM 517 CD PRO A 37 -11.577 38.082 -23.117 1.00 11.20 C ATOM 0 HA PRO A 37 -8.809 37.694 -21.442 1.00 1.02 H new ATOM 0 HB2 PRO A 37 -10.597 39.463 -20.260 1.00 31.31 H new ATOM 0 HB3 PRO A 37 -9.786 39.877 -21.757 1.00 31.31 H new ATOM 0 HG2 PRO A 37 -12.567 38.793 -21.346 1.00 2.53 H new ATOM 0 HG3 PRO A 37 -12.031 40.066 -22.425 1.00 2.53 H new ATOM 0 HD2 PRO A 37 -12.499 37.539 -23.323 1.00 11.20 H new ATOM 0 HD3 PRO A 37 -11.271 38.555 -24.050 1.00 11.20 H new ATOM 525 N GLU A 38 -11.330 36.158 -20.223 1.00 61.04 N ATOM 526 CA GLU A 38 -11.780 35.348 -19.098 1.00 33.31 C ATOM 527 C GLU A 38 -11.047 34.010 -19.063 1.00 32.31 C ATOM 528 O GLU A 38 -10.938 33.378 -18.013 1.00 10.14 O ATOM 529 CB GLU A 38 -13.290 35.112 -19.182 1.00 1.51 C ATOM 530 CG GLU A 38 -14.108 36.121 -18.393 1.00 22.14 C ATOM 531 CD GLU A 38 -13.893 37.545 -18.866 1.00 44.23 C ATOM 532 OE1 GLU A 38 -14.373 37.884 -19.968 1.00 63.41 O ATOM 533 OE2 GLU A 38 -13.244 38.322 -18.134 1.00 63.50 O ATOM 0 H GLU A 38 -11.902 36.069 -21.063 1.00 61.04 H new ATOM 0 HA GLU A 38 -11.555 35.891 -18.180 1.00 33.31 H new ATOM 0 HB2 GLU A 38 -13.597 35.146 -20.227 1.00 1.51 H new ATOM 0 HB3 GLU A 38 -13.514 34.110 -18.816 1.00 1.51 H new ATOM 0 HG2 GLU A 38 -15.165 35.870 -18.477 1.00 22.14 H new ATOM 0 HG3 GLU A 38 -13.846 36.049 -17.337 1.00 22.14 H new ATOM 540 N GLU A 39 -10.548 33.585 -20.219 1.00 64.13 N ATOM 541 CA GLU A 39 -9.826 32.322 -20.321 1.00 34.40 C ATOM 542 C GLU A 39 -8.321 32.544 -20.207 1.00 30.21 C ATOM 543 O GLU A 39 -7.561 31.606 -19.966 1.00 23.04 O ATOM 544 CB GLU A 39 -10.152 31.628 -21.646 1.00 3.33 C ATOM 545 CG GLU A 39 -9.895 30.131 -21.628 1.00 34.31 C ATOM 546 CD GLU A 39 -10.814 29.393 -20.673 1.00 62.01 C ATOM 547 OE1 GLU A 39 -11.935 29.033 -21.087 1.00 73.41 O ATOM 548 OE2 GLU A 39 -10.410 29.176 -19.511 1.00 60.13 O ATOM 0 H GLU A 39 -10.630 34.096 -21.098 1.00 64.13 H new ATOM 0 HA GLU A 39 -10.144 31.684 -19.497 1.00 34.40 H new ATOM 0 HB2 GLU A 39 -11.199 31.805 -21.891 1.00 3.33 H new ATOM 0 HB3 GLU A 39 -9.557 32.081 -22.440 1.00 3.33 H new ATOM 0 HG2 GLU A 39 -10.026 29.732 -22.634 1.00 34.31 H new ATOM 0 HG3 GLU A 39 -8.859 29.947 -21.344 1.00 34.31 H new ATOM 555 N TYR A 40 -7.898 33.791 -20.383 1.00 33.34 N ATOM 556 CA TYR A 40 -6.484 34.137 -20.303 1.00 31.34 C ATOM 557 C TYR A 40 -6.000 34.119 -18.856 1.00 22.30 C ATOM 558 O TYR A 40 -4.856 33.759 -18.576 1.00 72.11 O ATOM 559 CB TYR A 40 -6.239 35.516 -20.917 1.00 14.01 C ATOM 560 CG TYR A 40 -5.311 35.492 -22.110 1.00 25.54 C ATOM 561 CD1 TYR A 40 -5.494 34.577 -23.139 1.00 64.13 C ATOM 562 CD2 TYR A 40 -4.250 36.384 -22.207 1.00 40.12 C ATOM 563 CE1 TYR A 40 -4.647 34.551 -24.230 1.00 62.43 C ATOM 564 CE2 TYR A 40 -3.399 36.366 -23.295 1.00 60.04 C ATOM 565 CZ TYR A 40 -3.601 35.447 -24.304 1.00 12.20 C ATOM 566 OH TYR A 40 -2.756 35.425 -25.390 1.00 13.11 O ATOM 0 H TYR A 40 -8.514 34.579 -20.582 1.00 33.34 H new ATOM 0 HA TYR A 40 -5.921 33.391 -20.865 1.00 31.34 H new ATOM 0 HB2 TYR A 40 -7.194 35.945 -21.219 1.00 14.01 H new ATOM 0 HB3 TYR A 40 -5.821 36.174 -20.155 1.00 14.01 H new ATOM 0 HD1 TYR A 40 -6.312 33.874 -23.085 1.00 64.13 H new ATOM 0 HD2 TYR A 40 -4.088 37.104 -21.418 1.00 40.12 H new ATOM 0 HE1 TYR A 40 -4.803 33.833 -25.021 1.00 62.43 H new ATOM 0 HE2 TYR A 40 -2.580 37.067 -23.355 1.00 60.04 H new ATOM 0 HH TYR A 40 -2.073 36.121 -25.288 1.00 13.11 H new ATOM 576 N VAL A 41 -6.880 34.509 -17.939 1.00 43.43 N ATOM 577 CA VAL A 41 -6.544 34.537 -16.521 1.00 14.23 C ATOM 578 C VAL A 41 -6.176 33.147 -16.016 1.00 32.43 C ATOM 579 O VAL A 41 -5.085 32.917 -15.493 1.00 51.44 O ATOM 580 CB VAL A 41 -7.712 35.085 -15.679 1.00 31.34 C ATOM 581 CG1 VAL A 41 -7.713 34.456 -14.294 1.00 21.43 C ATOM 582 CG2 VAL A 41 -7.635 36.601 -15.584 1.00 55.04 C ATOM 0 H VAL A 41 -7.831 34.810 -18.153 1.00 43.43 H new ATOM 0 HA VAL A 41 -5.685 35.199 -16.412 1.00 14.23 H new ATOM 0 HB VAL A 41 -8.647 34.822 -16.173 1.00 31.34 H new ATOM 0 HG11 VAL A 41 -8.545 34.855 -13.714 1.00 21.43 H new ATOM 0 HG12 VAL A 41 -7.820 33.375 -14.385 1.00 21.43 H new ATOM 0 HG13 VAL A 41 -6.775 34.686 -13.789 1.00 21.43 H new ATOM 0 HG21 VAL A 41 -8.468 36.971 -14.986 1.00 55.04 H new ATOM 0 HG22 VAL A 41 -6.695 36.889 -15.114 1.00 55.04 H new ATOM 0 HG23 VAL A 41 -7.687 37.031 -16.584 1.00 55.04 H new ATOM 592 N PRO A 42 -7.107 32.194 -16.174 1.00 70.13 N ATOM 593 CA PRO A 42 -6.903 30.808 -15.742 1.00 11.22 C ATOM 594 C PRO A 42 -5.871 30.080 -16.597 1.00 14.04 C ATOM 595 O PRO A 42 -5.177 29.184 -16.118 1.00 70.44 O ATOM 596 CB PRO A 42 -8.286 30.175 -15.917 1.00 24.10 C ATOM 597 CG PRO A 42 -8.948 30.996 -16.969 1.00 21.11 C ATOM 598 CD PRO A 42 -8.430 32.396 -16.789 1.00 0.14 C ATOM 0 HA PRO A 42 -6.519 30.751 -14.724 1.00 11.22 H new ATOM 0 HB2 PRO A 42 -8.208 29.131 -16.220 1.00 24.10 H new ATOM 0 HB3 PRO A 42 -8.851 30.195 -14.985 1.00 24.10 H new ATOM 0 HG2 PRO A 42 -8.713 30.618 -17.964 1.00 21.11 H new ATOM 0 HG3 PRO A 42 -10.032 30.965 -16.864 1.00 21.11 H new ATOM 0 HD2 PRO A 42 -8.355 32.922 -17.741 1.00 0.14 H new ATOM 0 HD3 PRO A 42 -9.085 32.987 -16.149 1.00 0.14 H new ATOM 606 N MET A 43 -5.776 30.472 -17.863 1.00 74.30 N ATOM 607 CA MET A 43 -4.827 29.856 -18.784 1.00 15.43 C ATOM 608 C MET A 43 -3.423 29.845 -18.189 1.00 43.13 C ATOM 609 O MET A 43 -2.664 28.895 -18.383 1.00 4.41 O ATOM 610 CB MET A 43 -4.823 30.603 -20.119 1.00 62.42 C ATOM 611 CG MET A 43 -5.594 29.888 -21.217 1.00 43.13 C ATOM 612 SD MET A 43 -5.679 30.846 -22.742 1.00 53.33 S ATOM 613 CE MET A 43 -7.169 30.178 -23.479 1.00 63.00 C ATOM 0 H MET A 43 -6.344 31.213 -18.275 1.00 74.30 H new ATOM 0 HA MET A 43 -5.138 28.825 -18.954 1.00 15.43 H new ATOM 0 HB2 MET A 43 -5.251 31.595 -19.972 1.00 62.42 H new ATOM 0 HB3 MET A 43 -3.792 30.745 -20.443 1.00 62.42 H new ATOM 0 HG2 MET A 43 -5.121 28.928 -21.422 1.00 43.13 H new ATOM 0 HG3 MET A 43 -6.605 29.677 -20.868 1.00 43.13 H new ATOM 0 HE1 MET A 43 -6.960 29.866 -24.502 1.00 63.00 H new ATOM 0 HE2 MET A 43 -7.508 29.319 -22.900 1.00 63.00 H new ATOM 0 HE3 MET A 43 -7.946 30.942 -23.484 1.00 63.00 H new ATOM 623 N VAL A 44 -3.083 30.907 -17.465 1.00 63.32 N ATOM 624 CA VAL A 44 -1.769 31.018 -16.842 1.00 13.21 C ATOM 625 C VAL A 44 -1.561 29.925 -15.800 1.00 21.01 C ATOM 626 O VAL A 44 -0.555 29.215 -15.821 1.00 12.11 O ATOM 627 CB VAL A 44 -1.580 32.393 -16.173 1.00 34.41 C ATOM 628 CG1 VAL A 44 -0.219 32.476 -15.499 1.00 34.02 C ATOM 629 CG2 VAL A 44 -1.749 33.509 -17.193 1.00 23.33 C ATOM 0 H VAL A 44 -3.699 31.702 -17.296 1.00 63.32 H new ATOM 0 HA VAL A 44 -1.031 30.904 -17.636 1.00 13.21 H new ATOM 0 HB VAL A 44 -2.346 32.514 -15.407 1.00 34.41 H new ATOM 0 HG11 VAL A 44 -0.103 33.454 -15.032 1.00 34.02 H new ATOM 0 HG12 VAL A 44 -0.142 31.699 -14.738 1.00 34.02 H new ATOM 0 HG13 VAL A 44 0.565 32.334 -16.243 1.00 34.02 H new ATOM 0 HG21 VAL A 44 -1.612 34.473 -16.703 1.00 23.33 H new ATOM 0 HG22 VAL A 44 -1.007 33.395 -17.983 1.00 23.33 H new ATOM 0 HG23 VAL A 44 -2.749 33.460 -17.624 1.00 23.33 H new ATOM 639 N LYS A 45 -2.519 29.794 -14.888 1.00 44.03 N ATOM 640 CA LYS A 45 -2.443 28.786 -13.838 1.00 23.05 C ATOM 641 C LYS A 45 -2.227 27.397 -14.430 1.00 51.24 C ATOM 642 O LYS A 45 -1.526 26.568 -13.852 1.00 1.13 O ATOM 643 CB LYS A 45 -3.721 28.800 -12.996 1.00 24.03 C ATOM 644 CG LYS A 45 -3.554 29.480 -11.648 1.00 4.02 C ATOM 645 CD LYS A 45 -4.028 30.923 -11.689 1.00 2.12 C ATOM 646 CE LYS A 45 -2.899 31.870 -12.068 1.00 34.03 C ATOM 647 NZ LYS A 45 -3.041 33.195 -11.404 1.00 52.50 N ATOM 0 H LYS A 45 -3.357 30.374 -14.855 1.00 44.03 H new ATOM 0 HA LYS A 45 -1.592 29.026 -13.201 1.00 23.05 H new ATOM 0 HB2 LYS A 45 -4.508 29.307 -13.554 1.00 24.03 H new ATOM 0 HB3 LYS A 45 -4.053 27.774 -12.837 1.00 24.03 H new ATOM 0 HG2 LYS A 45 -4.116 28.933 -10.891 1.00 4.02 H new ATOM 0 HG3 LYS A 45 -2.506 29.449 -11.351 1.00 4.02 H new ATOM 0 HD2 LYS A 45 -4.842 31.019 -12.408 1.00 2.12 H new ATOM 0 HD3 LYS A 45 -4.428 31.204 -10.715 1.00 2.12 H new ATOM 0 HE2 LYS A 45 -1.943 31.425 -11.791 1.00 34.03 H new ATOM 0 HE3 LYS A 45 -2.886 32.005 -13.150 1.00 34.03 H new ATOM 0 HZ1 LYS A 45 -2.253 33.812 -11.687 1.00 52.50 H new ATOM 0 HZ2 LYS A 45 -3.941 33.631 -11.688 1.00 52.50 H new ATOM 0 HZ3 LYS A 45 -3.028 33.069 -10.372 1.00 52.50 H new ATOM 661 N GLU A 46 -2.833 27.152 -15.588 1.00 14.02 N ATOM 662 CA GLU A 46 -2.706 25.863 -16.258 1.00 50.31 C ATOM 663 C GLU A 46 -1.251 25.579 -16.619 1.00 42.43 C ATOM 664 O GLU A 46 -0.635 24.657 -16.085 1.00 34.30 O ATOM 665 CB GLU A 46 -3.572 25.832 -17.520 1.00 25.25 C ATOM 666 CG GLU A 46 -5.057 25.986 -17.242 1.00 75.21 C ATOM 667 CD GLU A 46 -5.862 26.243 -18.501 1.00 54.02 C ATOM 668 OE1 GLU A 46 -5.354 25.946 -19.602 1.00 42.32 O ATOM 669 OE2 GLU A 46 -7.002 26.741 -18.385 1.00 2.13 O ATOM 0 H GLU A 46 -3.416 27.828 -16.081 1.00 14.02 H new ATOM 0 HA GLU A 46 -3.049 25.089 -15.571 1.00 50.31 H new ATOM 0 HB2 GLU A 46 -3.252 26.630 -18.190 1.00 25.25 H new ATOM 0 HB3 GLU A 46 -3.404 24.890 -18.043 1.00 25.25 H new ATOM 0 HG2 GLU A 46 -5.427 25.083 -16.756 1.00 75.21 H new ATOM 0 HG3 GLU A 46 -5.209 26.809 -16.544 1.00 75.21 H new ATOM 676 N VAL A 47 -0.707 26.379 -17.531 1.00 4.31 N ATOM 677 CA VAL A 47 0.676 26.215 -17.964 1.00 51.41 C ATOM 678 C VAL A 47 1.637 26.313 -16.784 1.00 73.15 C ATOM 679 O VAL A 47 2.550 25.501 -16.646 1.00 24.03 O ATOM 680 CB VAL A 47 1.063 27.271 -19.016 1.00 43.53 C ATOM 681 CG1 VAL A 47 2.443 26.978 -19.585 1.00 22.21 C ATOM 682 CG2 VAL A 47 0.022 27.327 -20.124 1.00 31.52 C ATOM 0 H VAL A 47 -1.203 27.147 -17.984 1.00 4.31 H new ATOM 0 HA VAL A 47 0.753 25.223 -18.410 1.00 51.41 H new ATOM 0 HB VAL A 47 1.096 28.246 -18.530 1.00 43.53 H new ATOM 0 HG11 VAL A 47 2.699 27.735 -20.327 1.00 22.21 H new ATOM 0 HG12 VAL A 47 3.179 26.994 -18.781 1.00 22.21 H new ATOM 0 HG13 VAL A 47 2.441 25.995 -20.056 1.00 22.21 H new ATOM 0 HG21 VAL A 47 0.312 28.079 -20.858 1.00 31.52 H new ATOM 0 HG22 VAL A 47 -0.046 26.353 -20.609 1.00 31.52 H new ATOM 0 HG23 VAL A 47 -0.947 27.589 -19.700 1.00 31.52 H new ATOM 692 N GLY A 48 1.423 27.313 -15.935 1.00 50.41 N ATOM 693 CA GLY A 48 2.278 27.499 -14.777 1.00 51.03 C ATOM 694 C GLY A 48 2.350 26.261 -13.906 1.00 23.04 C ATOM 695 O GLY A 48 3.413 25.921 -13.383 1.00 51.43 O ATOM 0 H GLY A 48 0.673 27.998 -16.028 1.00 50.41 H new ATOM 0 HA2 GLY A 48 3.282 27.765 -15.109 1.00 51.03 H new ATOM 0 HA3 GLY A 48 1.906 28.335 -14.185 1.00 51.03 H new ATOM 699 N LEU A 49 1.218 25.585 -13.746 1.00 31.01 N ATOM 700 CA LEU A 49 1.156 24.378 -12.929 1.00 63.45 C ATOM 701 C LEU A 49 2.025 23.274 -13.523 1.00 63.45 C ATOM 702 O LEU A 49 2.670 22.518 -12.796 1.00 55.33 O ATOM 703 CB LEU A 49 -0.290 23.894 -12.807 1.00 63.04 C ATOM 704 CG LEU A 49 -0.546 22.797 -11.774 1.00 25.33 C ATOM 705 CD1 LEU A 49 -0.831 23.405 -10.409 1.00 62.22 C ATOM 706 CD2 LEU A 49 -1.699 21.907 -12.215 1.00 25.24 C ATOM 0 H LEU A 49 0.330 25.852 -14.171 1.00 31.01 H new ATOM 0 HA LEU A 49 1.536 24.621 -11.937 1.00 63.45 H new ATOM 0 HB2 LEU A 49 -0.919 24.750 -12.562 1.00 63.04 H new ATOM 0 HB3 LEU A 49 -0.613 23.530 -13.782 1.00 63.04 H new ATOM 0 HG LEU A 49 0.351 22.183 -11.695 1.00 25.33 H new ATOM 0 HD11 LEU A 49 -1.011 22.609 -9.686 1.00 62.22 H new ATOM 0 HD12 LEU A 49 0.025 23.999 -10.089 1.00 62.22 H new ATOM 0 HD13 LEU A 49 -1.712 24.044 -10.472 1.00 62.22 H new ATOM 0 HD21 LEU A 49 -1.867 21.132 -11.467 1.00 25.24 H new ATOM 0 HD22 LEU A 49 -2.602 22.508 -12.323 1.00 25.24 H new ATOM 0 HD23 LEU A 49 -1.455 21.443 -13.171 1.00 25.24 H new ATOM 718 N ALA A 50 2.039 23.188 -14.850 1.00 25.13 N ATOM 719 CA ALA A 50 2.833 22.180 -15.542 1.00 34.55 C ATOM 720 C ALA A 50 4.310 22.303 -15.185 1.00 1.41 C ATOM 721 O ALA A 50 4.975 21.308 -14.894 1.00 33.11 O ATOM 722 CB ALA A 50 2.639 22.297 -17.046 1.00 62.11 C ATOM 0 H ALA A 50 1.509 23.804 -15.467 1.00 25.13 H new ATOM 0 HA ALA A 50 2.490 21.198 -15.218 1.00 34.55 H new ATOM 0 HB1 ALA A 50 3.238 21.538 -17.550 1.00 62.11 H new ATOM 0 HB2 ALA A 50 1.587 22.150 -17.290 1.00 62.11 H new ATOM 0 HB3 ALA A 50 2.953 23.287 -17.378 1.00 62.11 H new ATOM 728 N LEU A 51 4.819 23.530 -15.210 1.00 10.20 N ATOM 729 CA LEU A 51 6.219 23.784 -14.890 1.00 3.33 C ATOM 730 C LEU A 51 6.518 23.433 -13.436 1.00 12.24 C ATOM 731 O LEU A 51 7.408 22.632 -13.150 1.00 73.24 O ATOM 732 CB LEU A 51 6.565 25.251 -15.153 1.00 63.25 C ATOM 733 CG LEU A 51 6.564 25.688 -16.619 1.00 22.42 C ATOM 734 CD1 LEU A 51 5.624 26.865 -16.824 1.00 40.22 C ATOM 735 CD2 LEU A 51 7.973 26.043 -17.070 1.00 63.25 C ATOM 0 H LEU A 51 4.283 24.364 -15.449 1.00 10.20 H new ATOM 0 HA LEU A 51 6.833 23.151 -15.531 1.00 3.33 H new ATOM 0 HB2 LEU A 51 5.856 25.874 -14.608 1.00 63.25 H new ATOM 0 HB3 LEU A 51 7.552 25.451 -14.735 1.00 63.25 H new ATOM 0 HG LEU A 51 6.208 24.856 -17.227 1.00 22.42 H new ATOM 0 HD11 LEU A 51 5.636 27.162 -17.873 1.00 40.22 H new ATOM 0 HD12 LEU A 51 4.612 26.576 -16.541 1.00 40.22 H new ATOM 0 HD13 LEU A 51 5.949 27.702 -16.206 1.00 40.22 H new ATOM 0 HD21 LEU A 51 7.954 26.352 -18.115 1.00 63.25 H new ATOM 0 HD22 LEU A 51 8.356 26.859 -16.458 1.00 63.25 H new ATOM 0 HD23 LEU A 51 8.620 25.173 -16.961 1.00 63.25 H new ATOM 747 N ARG A 52 5.767 24.037 -12.520 1.00 74.34 N ATOM 748 CA ARG A 52 5.950 23.787 -11.096 1.00 20.02 C ATOM 749 C ARG A 52 5.837 22.297 -10.786 1.00 45.11 C ATOM 750 O ARG A 52 6.583 21.764 -9.963 1.00 41.24 O ATOM 751 CB ARG A 52 4.916 24.567 -10.282 1.00 50.42 C ATOM 752 CG ARG A 52 5.459 25.115 -8.972 1.00 52.14 C ATOM 753 CD ARG A 52 4.341 25.401 -7.982 1.00 32.51 C ATOM 754 NE ARG A 52 4.124 26.833 -7.799 1.00 4.23 N ATOM 755 CZ ARG A 52 3.193 27.339 -6.998 1.00 53.25 C ATOM 756 NH1 ARG A 52 2.396 26.533 -6.311 1.00 13.23 N ATOM 757 NH2 ARG A 52 3.057 28.654 -6.885 1.00 3.35 N ATOM 0 H ARG A 52 5.026 24.703 -12.739 1.00 74.34 H new ATOM 0 HA ARG A 52 6.949 24.124 -10.820 1.00 20.02 H new ATOM 0 HB2 ARG A 52 4.541 25.394 -10.884 1.00 50.42 H new ATOM 0 HB3 ARG A 52 4.067 23.917 -10.070 1.00 50.42 H new ATOM 0 HG2 ARG A 52 6.156 24.399 -8.538 1.00 52.14 H new ATOM 0 HG3 ARG A 52 6.020 26.030 -9.164 1.00 52.14 H new ATOM 0 HD2 ARG A 52 3.419 24.937 -8.332 1.00 32.51 H new ATOM 0 HD3 ARG A 52 4.582 24.945 -7.022 1.00 32.51 H new ATOM 0 HE ARG A 52 4.720 27.481 -8.315 1.00 4.23 H new ATOM 0 HH11 ARG A 52 2.497 25.522 -6.397 1.00 13.23 H new ATOM 0 HH12 ARG A 52 1.682 26.924 -5.697 1.00 13.23 H new ATOM 0 HH21 ARG A 52 3.668 29.277 -7.413 1.00 3.35 H new ATOM 0 HH22 ARG A 52 2.342 29.042 -6.270 1.00 3.35 H new ATOM 771 N THR A 53 4.899 21.629 -11.450 1.00 65.14 N ATOM 772 CA THR A 53 4.688 20.202 -11.245 1.00 73.43 C ATOM 773 C THR A 53 5.823 19.385 -11.852 1.00 74.42 C ATOM 774 O THR A 53 6.250 18.378 -11.284 1.00 54.34 O ATOM 775 CB THR A 53 3.352 19.738 -11.857 1.00 44.25 C ATOM 776 OG1 THR A 53 2.266 20.457 -11.264 1.00 14.21 O ATOM 777 CG2 THR A 53 3.152 18.244 -11.651 1.00 12.42 C ATOM 0 H THR A 53 4.273 22.054 -12.134 1.00 65.14 H new ATOM 0 HA THR A 53 4.662 20.038 -10.168 1.00 73.43 H new ATOM 0 HB THR A 53 3.378 19.940 -12.928 1.00 44.25 H new ATOM 0 HG1 THR A 53 2.375 21.415 -11.437 1.00 14.21 H new ATOM 0 HG21 THR A 53 2.202 17.940 -12.091 1.00 12.42 H new ATOM 0 HG22 THR A 53 3.965 17.699 -12.130 1.00 12.42 H new ATOM 0 HG23 THR A 53 3.145 18.022 -10.584 1.00 12.42 H new ATOM 785 N LEU A 54 6.308 19.823 -13.008 1.00 43.13 N ATOM 786 CA LEU A 54 7.396 19.132 -13.693 1.00 13.23 C ATOM 787 C LEU A 54 8.595 18.953 -12.767 1.00 73.21 C ATOM 788 O LEU A 54 9.284 17.933 -12.817 1.00 43.41 O ATOM 789 CB LEU A 54 7.813 19.909 -14.942 1.00 44.23 C ATOM 790 CG LEU A 54 6.975 19.664 -16.197 1.00 74.30 C ATOM 791 CD1 LEU A 54 6.980 20.893 -17.092 1.00 44.21 C ATOM 792 CD2 LEU A 54 7.490 18.448 -16.954 1.00 2.32 C ATOM 0 H LEU A 54 5.966 20.653 -13.491 1.00 43.13 H new ATOM 0 HA LEU A 54 7.038 18.146 -13.989 1.00 13.23 H new ATOM 0 HB2 LEU A 54 7.781 20.974 -14.710 1.00 44.23 H new ATOM 0 HB3 LEU A 54 8.850 19.663 -15.169 1.00 44.23 H new ATOM 0 HG LEU A 54 5.947 19.468 -15.891 1.00 74.30 H new ATOM 0 HD11 LEU A 54 6.378 20.699 -17.980 1.00 44.21 H new ATOM 0 HD12 LEU A 54 6.562 21.741 -16.549 1.00 44.21 H new ATOM 0 HD13 LEU A 54 8.003 21.122 -17.390 1.00 44.21 H new ATOM 0 HD21 LEU A 54 6.881 18.289 -17.844 1.00 2.32 H new ATOM 0 HD22 LEU A 54 8.526 18.614 -17.248 1.00 2.32 H new ATOM 0 HD23 LEU A 54 7.432 17.569 -16.313 1.00 2.32 H new ATOM 804 N LEU A 55 8.837 19.948 -11.921 1.00 52.35 N ATOM 805 CA LEU A 55 9.952 19.900 -10.982 1.00 14.03 C ATOM 806 C LEU A 55 9.793 18.736 -10.009 1.00 4.24 C ATOM 807 O LEU A 55 10.744 18.000 -9.746 1.00 1.31 O ATOM 808 CB LEU A 55 10.050 21.216 -10.209 1.00 0.33 C ATOM 809 CG LEU A 55 11.354 21.450 -9.445 1.00 13.14 C ATOM 810 CD1 LEU A 55 12.321 22.275 -10.279 1.00 51.32 C ATOM 811 CD2 LEU A 55 11.077 22.134 -8.114 1.00 13.31 C ATOM 0 H LEU A 55 8.276 20.798 -11.866 1.00 52.35 H new ATOM 0 HA LEU A 55 10.869 19.751 -11.552 1.00 14.03 H new ATOM 0 HB2 LEU A 55 9.911 22.038 -10.911 1.00 0.33 H new ATOM 0 HB3 LEU A 55 9.224 21.260 -9.500 1.00 0.33 H new ATOM 0 HG LEU A 55 11.814 20.482 -9.245 1.00 13.14 H new ATOM 0 HD11 LEU A 55 13.243 22.431 -9.719 1.00 51.32 H new ATOM 0 HD12 LEU A 55 12.545 21.747 -11.206 1.00 51.32 H new ATOM 0 HD13 LEU A 55 11.870 23.240 -10.511 1.00 51.32 H new ATOM 0 HD21 LEU A 55 12.016 22.293 -7.584 1.00 13.31 H new ATOM 0 HD22 LEU A 55 10.594 23.095 -8.292 1.00 13.31 H new ATOM 0 HD23 LEU A 55 10.422 21.505 -7.511 1.00 13.31 H new ATOM 823 N ALA A 56 8.585 18.575 -9.478 1.00 64.14 N ATOM 824 CA ALA A 56 8.302 17.498 -8.538 1.00 15.11 C ATOM 825 C ALA A 56 8.250 16.149 -9.247 1.00 54.22 C ATOM 826 O ALA A 56 8.793 15.158 -8.759 1.00 71.52 O ATOM 827 CB ALA A 56 6.992 17.765 -7.810 1.00 63.40 C ATOM 0 H ALA A 56 7.787 19.177 -9.683 1.00 64.14 H new ATOM 0 HA ALA A 56 9.111 17.464 -7.808 1.00 15.11 H new ATOM 0 HB1 ALA A 56 6.792 16.953 -7.111 1.00 63.40 H new ATOM 0 HB2 ALA A 56 7.065 18.705 -7.263 1.00 63.40 H new ATOM 0 HB3 ALA A 56 6.180 17.828 -8.534 1.00 63.40 H new ATOM 833 N THR A 57 7.592 16.118 -10.402 1.00 73.21 N ATOM 834 CA THR A 57 7.467 14.890 -11.178 1.00 2.24 C ATOM 835 C THR A 57 8.830 14.251 -11.418 1.00 20.01 C ATOM 836 O THR A 57 9.043 13.081 -11.101 1.00 34.41 O ATOM 837 CB THR A 57 6.788 15.150 -12.536 1.00 1.14 C ATOM 838 OG1 THR A 57 7.592 16.034 -13.324 1.00 65.14 O ATOM 839 CG2 THR A 57 5.404 15.752 -12.342 1.00 45.13 C ATOM 0 H THR A 57 7.137 16.929 -10.821 1.00 73.21 H new ATOM 0 HA THR A 57 6.847 14.209 -10.595 1.00 2.24 H new ATOM 0 HB THR A 57 6.683 14.197 -13.054 1.00 1.14 H new ATOM 0 HG1 THR A 57 8.034 16.684 -12.738 1.00 65.14 H new ATOM 0 HG21 THR A 57 4.944 15.927 -13.314 1.00 45.13 H new ATOM 0 HG22 THR A 57 4.785 15.064 -11.766 1.00 45.13 H new ATOM 0 HG23 THR A 57 5.490 16.697 -11.806 1.00 45.13 H new ATOM 847 N VAL A 58 9.752 15.027 -11.980 1.00 33.23 N ATOM 848 CA VAL A 58 11.096 14.536 -12.261 1.00 13.52 C ATOM 849 C VAL A 58 11.844 14.215 -10.972 1.00 42.12 C ATOM 850 O VAL A 58 12.684 13.315 -10.938 1.00 13.33 O ATOM 851 CB VAL A 58 11.909 15.563 -13.072 1.00 22.51 C ATOM 852 CG1 VAL A 58 13.320 15.050 -13.320 1.00 74.33 C ATOM 853 CG2 VAL A 58 11.209 15.879 -14.385 1.00 21.12 C ATOM 0 H VAL A 58 9.593 15.998 -12.249 1.00 33.23 H new ATOM 0 HA VAL A 58 10.985 13.625 -12.849 1.00 13.52 H new ATOM 0 HB VAL A 58 11.979 16.484 -12.494 1.00 22.51 H new ATOM 0 HG11 VAL A 58 13.880 15.788 -13.894 1.00 74.33 H new ATOM 0 HG12 VAL A 58 13.818 14.879 -12.366 1.00 74.33 H new ATOM 0 HG13 VAL A 58 13.274 14.115 -13.878 1.00 74.33 H new ATOM 0 HG21 VAL A 58 11.797 16.606 -14.945 1.00 21.12 H new ATOM 0 HG22 VAL A 58 11.106 14.966 -14.972 1.00 21.12 H new ATOM 0 HG23 VAL A 58 10.221 16.292 -14.181 1.00 21.12 H new ATOM 863 N ASP A 59 11.534 14.956 -9.914 1.00 41.11 N ATOM 864 CA ASP A 59 12.176 14.749 -8.621 1.00 43.32 C ATOM 865 C ASP A 59 12.103 13.283 -8.206 1.00 53.21 C ATOM 866 O ASP A 59 13.102 12.694 -7.795 1.00 51.34 O ATOM 867 CB ASP A 59 11.519 15.628 -7.555 1.00 63.42 C ATOM 868 CG ASP A 59 12.520 16.511 -6.836 1.00 33.35 C ATOM 869 OD1 ASP A 59 12.880 17.572 -7.388 1.00 20.44 O ATOM 870 OD2 ASP A 59 12.942 16.141 -5.720 1.00 15.41 O ATOM 0 H ASP A 59 10.842 15.705 -9.926 1.00 41.11 H new ATOM 0 HA ASP A 59 13.225 15.029 -8.715 1.00 43.32 H new ATOM 0 HB2 ASP A 59 10.757 16.253 -8.022 1.00 63.42 H new ATOM 0 HB3 ASP A 59 11.010 14.994 -6.829 1.00 63.42 H new ATOM 875 N GLU A 60 10.912 12.701 -8.316 1.00 5.43 N ATOM 876 CA GLU A 60 10.709 11.305 -7.950 1.00 22.44 C ATOM 877 C GLU A 60 11.207 10.375 -9.053 1.00 14.02 C ATOM 878 O GLU A 60 11.378 9.175 -8.838 1.00 3.22 O ATOM 879 CB GLU A 60 9.228 11.037 -7.672 1.00 4.44 C ATOM 880 CG GLU A 60 8.391 10.882 -8.930 1.00 42.40 C ATOM 881 CD GLU A 60 7.104 11.682 -8.876 1.00 74.52 C ATOM 882 OE1 GLU A 60 6.630 11.967 -7.756 1.00 50.55 O ATOM 883 OE2 GLU A 60 6.570 12.021 -9.953 1.00 33.42 O ATOM 0 H GLU A 60 10.075 13.175 -8.655 1.00 5.43 H new ATOM 0 HA GLU A 60 11.283 11.107 -7.045 1.00 22.44 H new ATOM 0 HB2 GLU A 60 9.138 10.132 -7.072 1.00 4.44 H new ATOM 0 HB3 GLU A 60 8.825 11.856 -7.076 1.00 4.44 H new ATOM 0 HG2 GLU A 60 8.976 11.200 -9.793 1.00 42.40 H new ATOM 0 HG3 GLU A 60 8.154 9.828 -9.077 1.00 42.40 H new ATOM 890 N SER A 61 11.436 10.938 -10.235 1.00 15.53 N ATOM 891 CA SER A 61 11.909 10.160 -11.374 1.00 11.54 C ATOM 892 C SER A 61 13.376 9.779 -11.199 1.00 13.01 C ATOM 893 O SER A 61 13.847 8.797 -11.775 1.00 10.34 O ATOM 894 CB SER A 61 11.727 10.952 -12.670 1.00 51.20 C ATOM 895 OG SER A 61 10.396 11.421 -12.799 1.00 0.45 O ATOM 0 H SER A 61 11.302 11.930 -10.429 1.00 15.53 H new ATOM 0 HA SER A 61 11.318 9.246 -11.429 1.00 11.54 H new ATOM 0 HB2 SER A 61 12.416 11.796 -12.684 1.00 51.20 H new ATOM 0 HB3 SER A 61 11.978 10.322 -13.523 1.00 51.20 H new ATOM 0 HG SER A 61 10.157 11.948 -12.008 1.00 0.45 H new ATOM 901 N LEU A 62 14.093 10.562 -10.401 1.00 11.03 N ATOM 902 CA LEU A 62 15.507 10.308 -10.149 1.00 21.24 C ATOM 903 C LEU A 62 15.733 8.860 -9.724 1.00 10.41 C ATOM 904 O LEU A 62 16.443 8.098 -10.381 1.00 13.42 O ATOM 905 CB LEU A 62 16.031 11.256 -9.069 1.00 24.12 C ATOM 906 CG LEU A 62 16.833 12.460 -9.564 1.00 64.23 C ATOM 907 CD1 LEU A 62 17.152 13.400 -8.412 1.00 64.40 C ATOM 908 CD2 LEU A 62 18.112 12.003 -10.252 1.00 32.43 C ATOM 0 H LEU A 62 13.719 11.378 -9.917 1.00 11.03 H new ATOM 0 HA LEU A 62 16.053 10.485 -11.075 1.00 21.24 H new ATOM 0 HB2 LEU A 62 15.182 11.623 -8.493 1.00 24.12 H new ATOM 0 HB3 LEU A 62 16.658 10.684 -8.385 1.00 24.12 H new ATOM 0 HG LEU A 62 16.227 13.002 -10.290 1.00 64.23 H new ATOM 0 HD11 LEU A 62 17.723 14.251 -8.784 1.00 64.40 H new ATOM 0 HD12 LEU A 62 16.224 13.754 -7.964 1.00 64.40 H new ATOM 0 HD13 LEU A 62 17.738 12.870 -7.661 1.00 64.40 H new ATOM 0 HD21 LEU A 62 18.670 12.873 -10.598 1.00 32.43 H new ATOM 0 HD22 LEU A 62 18.722 11.437 -9.548 1.00 32.43 H new ATOM 0 HD23 LEU A 62 17.861 11.371 -11.104 1.00 32.43 H new ATOM 920 N PRO A 63 15.114 8.470 -8.600 1.00 31.31 N ATOM 921 CA PRO A 63 15.230 7.110 -8.064 1.00 0.43 C ATOM 922 C PRO A 63 14.514 6.082 -8.932 1.00 70.41 C ATOM 923 O PRO A 63 15.015 4.978 -9.146 1.00 24.34 O ATOM 924 CB PRO A 63 14.559 7.212 -6.692 1.00 21.23 C ATOM 925 CG PRO A 63 13.608 8.352 -6.818 1.00 63.42 C ATOM 926 CD PRO A 63 14.252 9.325 -7.766 1.00 65.13 C ATOM 0 HA PRO A 63 16.266 6.775 -8.023 1.00 0.43 H new ATOM 0 HB2 PRO A 63 14.039 6.289 -6.436 1.00 21.23 H new ATOM 0 HB3 PRO A 63 15.292 7.393 -5.906 1.00 21.23 H new ATOM 0 HG2 PRO A 63 12.644 8.016 -7.199 1.00 63.42 H new ATOM 0 HG3 PRO A 63 13.423 8.815 -5.849 1.00 63.42 H new ATOM 0 HD2 PRO A 63 13.510 9.853 -8.365 1.00 65.13 H new ATOM 0 HD3 PRO A 63 14.830 10.081 -7.235 1.00 65.13 H new ATOM 934 N VAL A 64 13.339 6.451 -9.431 1.00 74.44 N ATOM 935 CA VAL A 64 12.554 5.560 -10.278 1.00 41.13 C ATOM 936 C VAL A 64 13.364 5.090 -11.481 1.00 45.52 C ATOM 937 O VAL A 64 13.087 4.038 -12.058 1.00 24.22 O ATOM 938 CB VAL A 64 11.268 6.247 -10.776 1.00 24.12 C ATOM 939 CG1 VAL A 64 10.531 5.352 -11.760 1.00 62.32 C ATOM 940 CG2 VAL A 64 10.373 6.614 -9.602 1.00 53.04 C ATOM 0 H VAL A 64 12.909 7.361 -9.264 1.00 74.44 H new ATOM 0 HA VAL A 64 12.284 4.699 -9.666 1.00 41.13 H new ATOM 0 HB VAL A 64 11.544 7.165 -11.295 1.00 24.12 H new ATOM 0 HG11 VAL A 64 9.625 5.854 -12.101 1.00 62.32 H new ATOM 0 HG12 VAL A 64 11.174 5.144 -12.615 1.00 62.32 H new ATOM 0 HG13 VAL A 64 10.264 4.415 -11.271 1.00 62.32 H new ATOM 0 HG21 VAL A 64 9.469 7.098 -9.971 1.00 53.04 H new ATOM 0 HG22 VAL A 64 10.103 5.711 -9.054 1.00 53.04 H new ATOM 0 HG23 VAL A 64 10.905 7.296 -8.938 1.00 53.04 H new ATOM 950 N LEU A 65 14.367 5.877 -11.855 1.00 44.23 N ATOM 951 CA LEU A 65 15.220 5.542 -12.990 1.00 42.15 C ATOM 952 C LEU A 65 16.649 5.263 -12.535 1.00 33.34 C ATOM 953 O LEU A 65 17.088 5.713 -11.476 1.00 71.30 O ATOM 954 CB LEU A 65 15.212 6.680 -14.013 1.00 23.11 C ATOM 955 CG LEU A 65 14.065 6.666 -15.024 1.00 64.30 C ATOM 956 CD1 LEU A 65 14.473 5.916 -16.283 1.00 33.53 C ATOM 957 CD2 LEU A 65 12.820 6.043 -14.409 1.00 42.44 C ATOM 0 H LEU A 65 14.609 6.751 -11.389 1.00 44.23 H new ATOM 0 HA LEU A 65 14.824 4.640 -13.456 1.00 42.15 H new ATOM 0 HB2 LEU A 65 15.182 7.627 -13.473 1.00 23.11 H new ATOM 0 HB3 LEU A 65 16.154 6.655 -14.562 1.00 23.11 H new ATOM 0 HG LEU A 65 13.834 7.695 -15.298 1.00 64.30 H new ATOM 0 HD11 LEU A 65 13.644 5.916 -16.991 1.00 33.53 H new ATOM 0 HD12 LEU A 65 15.336 6.405 -16.734 1.00 33.53 H new ATOM 0 HD13 LEU A 65 14.731 4.888 -16.027 1.00 33.53 H new ATOM 0 HD21 LEU A 65 12.014 6.041 -15.143 1.00 42.44 H new ATOM 0 HD22 LEU A 65 13.037 5.019 -14.106 1.00 42.44 H new ATOM 0 HD23 LEU A 65 12.516 6.622 -13.537 1.00 42.44 H new ATOM 969 N PRO A 66 17.393 4.504 -13.352 1.00 64.13 N ATOM 970 CA PRO A 66 18.785 4.150 -13.055 1.00 74.23 C ATOM 971 C PRO A 66 19.722 5.349 -13.154 1.00 73.33 C ATOM 972 O PRO A 66 19.631 6.144 -14.089 1.00 74.00 O ATOM 973 CB PRO A 66 19.125 3.115 -14.131 1.00 14.12 C ATOM 974 CG PRO A 66 18.202 3.424 -15.259 1.00 42.31 C ATOM 975 CD PRO A 66 16.935 3.934 -14.630 1.00 72.51 C ATOM 0 HA PRO A 66 18.903 3.781 -12.036 1.00 74.23 H new ATOM 0 HB2 PRO A 66 20.167 3.193 -14.440 1.00 14.12 H new ATOM 0 HB3 PRO A 66 18.976 2.099 -13.764 1.00 14.12 H new ATOM 0 HG2 PRO A 66 18.635 4.171 -15.924 1.00 42.31 H new ATOM 0 HG3 PRO A 66 18.009 2.535 -15.860 1.00 42.31 H new ATOM 0 HD2 PRO A 66 16.451 4.685 -15.254 1.00 72.51 H new ATOM 0 HD3 PRO A 66 16.212 3.133 -14.476 1.00 72.51 H new ATOM 983 N ALA A 67 20.622 5.472 -12.185 1.00 21.23 N ATOM 984 CA ALA A 67 21.578 6.572 -12.165 1.00 15.44 C ATOM 985 C ALA A 67 22.396 6.612 -13.451 1.00 0.44 C ATOM 986 O ALA A 67 23.171 5.699 -13.733 1.00 22.20 O ATOM 987 CB ALA A 67 22.495 6.453 -10.956 1.00 53.15 C ATOM 0 H ALA A 67 20.709 4.823 -11.403 1.00 21.23 H new ATOM 0 HA ALA A 67 21.019 7.505 -12.092 1.00 15.44 H new ATOM 0 HB1 ALA A 67 23.204 7.281 -10.954 1.00 53.15 H new ATOM 0 HB2 ALA A 67 21.900 6.483 -10.043 1.00 53.15 H new ATOM 0 HB3 ALA A 67 23.039 5.510 -11.004 1.00 53.15 H new ATOM 993 N SER A 68 22.218 7.676 -14.227 1.00 51.41 N ATOM 994 CA SER A 68 22.937 7.833 -15.486 1.00 71.10 C ATOM 995 C SER A 68 22.511 9.112 -16.199 1.00 51.55 C ATOM 996 O SER A 68 23.309 9.749 -16.889 1.00 74.42 O ATOM 997 CB SER A 68 22.691 6.625 -16.392 1.00 24.43 C ATOM 998 OG SER A 68 23.818 5.765 -16.411 1.00 74.24 O ATOM 0 H SER A 68 21.582 8.442 -14.006 1.00 51.41 H new ATOM 0 HA SER A 68 24.002 7.900 -15.262 1.00 71.10 H new ATOM 0 HB2 SER A 68 21.816 6.076 -16.043 1.00 24.43 H new ATOM 0 HB3 SER A 68 22.471 6.964 -17.404 1.00 24.43 H new ATOM 0 HG SER A 68 23.987 5.427 -15.507 1.00 74.24 H new ATOM 1004 N THR A 69 21.246 9.485 -16.029 1.00 21.13 N ATOM 1005 CA THR A 69 20.712 10.687 -16.656 1.00 70.11 C ATOM 1006 C THR A 69 20.399 11.757 -15.616 1.00 74.15 C ATOM 1007 O THR A 69 19.528 12.603 -15.825 1.00 4.05 O ATOM 1008 CB THR A 69 19.435 10.380 -17.461 1.00 42.34 C ATOM 1009 OG1 THR A 69 18.989 11.560 -18.140 1.00 62.43 O ATOM 1010 CG2 THR A 69 18.331 9.865 -16.550 1.00 42.43 C ATOM 0 H THR A 69 20.572 8.971 -15.462 1.00 21.13 H new ATOM 0 HA THR A 69 21.480 11.058 -17.335 1.00 70.11 H new ATOM 0 HB THR A 69 19.670 9.607 -18.192 1.00 42.34 H new ATOM 0 HG1 THR A 69 18.959 12.309 -17.509 1.00 62.43 H new ATOM 0 HG21 THR A 69 17.440 9.655 -17.141 1.00 42.43 H new ATOM 0 HG22 THR A 69 18.663 8.951 -16.057 1.00 42.43 H new ATOM 0 HG23 THR A 69 18.098 10.619 -15.798 1.00 42.43 H new ATOM 1018 N HIS A 70 21.113 11.715 -14.497 1.00 25.35 N ATOM 1019 CA HIS A 70 20.912 12.683 -13.424 1.00 70.41 C ATOM 1020 C HIS A 70 21.446 14.055 -13.823 1.00 60.13 C ATOM 1021 O HIS A 70 20.899 15.084 -13.426 1.00 62.12 O ATOM 1022 CB HIS A 70 21.600 12.207 -12.144 1.00 13.41 C ATOM 1023 CG HIS A 70 20.906 11.056 -11.483 1.00 63.14 C ATOM 1024 ND1 HIS A 70 21.061 10.750 -10.148 1.00 22.22 N ATOM 1025 CD2 HIS A 70 20.049 10.135 -11.982 1.00 20.30 C ATOM 1026 CE1 HIS A 70 20.331 9.689 -9.854 1.00 14.22 C ATOM 1027 NE2 HIS A 70 19.706 9.297 -10.950 1.00 21.35 N ATOM 0 H HIS A 70 21.836 11.021 -14.309 1.00 25.35 H new ATOM 0 HA HIS A 70 19.841 12.769 -13.241 1.00 70.41 H new ATOM 0 HB2 HIS A 70 22.624 11.917 -12.378 1.00 13.41 H new ATOM 0 HB3 HIS A 70 21.657 13.038 -11.441 1.00 13.41 H new ATOM 0 HD2 HIS A 70 19.700 10.071 -13.002 1.00 20.30 H new ATOM 0 HE1 HIS A 70 20.258 9.222 -8.883 1.00 14.22 H new ATOM 0 HE2 HIS A 70 19.072 8.501 -11.018 1.00 21.35 H new ATOM 1035 N ARG A 71 22.517 14.062 -14.610 1.00 22.31 N ATOM 1036 CA ARG A 71 23.126 15.307 -15.061 1.00 0.32 C ATOM 1037 C ARG A 71 22.082 16.228 -15.685 1.00 73.04 C ATOM 1038 O ARG A 71 21.841 17.331 -15.195 1.00 72.45 O ATOM 1039 CB ARG A 71 24.238 15.020 -16.072 1.00 32.25 C ATOM 1040 CG ARG A 71 25.575 15.638 -15.698 1.00 41.33 C ATOM 1041 CD ARG A 71 26.698 14.615 -15.758 1.00 63.10 C ATOM 1042 NE ARG A 71 27.854 15.024 -14.965 1.00 4.10 N ATOM 1043 CZ ARG A 71 27.904 14.939 -13.640 1.00 41.13 C ATOM 1044 NH1 ARG A 71 26.868 14.462 -12.964 1.00 24.30 N ATOM 1045 NH2 ARG A 71 28.992 15.332 -12.989 1.00 72.54 N ATOM 0 H ARG A 71 22.981 13.219 -14.948 1.00 22.31 H new ATOM 0 HA ARG A 71 23.555 15.807 -14.193 1.00 0.32 H new ATOM 0 HB2 ARG A 71 24.360 13.941 -16.168 1.00 32.25 H new ATOM 0 HB3 ARG A 71 23.935 15.395 -17.049 1.00 32.25 H new ATOM 0 HG2 ARG A 71 25.797 16.464 -16.374 1.00 41.33 H new ATOM 0 HG3 ARG A 71 25.515 16.056 -14.693 1.00 41.33 H new ATOM 0 HD2 ARG A 71 26.332 13.654 -15.397 1.00 63.10 H new ATOM 0 HD3 ARG A 71 27.002 14.471 -16.795 1.00 63.10 H new ATOM 0 HE ARG A 71 28.668 15.395 -15.455 1.00 4.10 H new ATOM 0 HH11 ARG A 71 26.030 14.159 -13.461 1.00 24.30 H new ATOM 0 HH12 ARG A 71 26.909 14.398 -11.947 1.00 24.30 H new ATOM 0 HH21 ARG A 71 29.791 15.700 -13.506 1.00 72.54 H new ATOM 0 HH22 ARG A 71 29.029 15.266 -11.972 1.00 72.54 H new ATOM 1059 N GLU A 72 21.466 15.767 -16.770 1.00 22.43 N ATOM 1060 CA GLU A 72 20.449 16.550 -17.461 1.00 61.13 C ATOM 1061 C GLU A 72 19.268 16.842 -16.540 1.00 51.25 C ATOM 1062 O GLU A 72 18.774 17.969 -16.485 1.00 65.04 O ATOM 1063 CB GLU A 72 19.965 15.810 -18.710 1.00 64.31 C ATOM 1064 CG GLU A 72 21.052 15.596 -19.750 1.00 42.44 C ATOM 1065 CD GLU A 72 20.506 15.080 -21.067 1.00 52.44 C ATOM 1066 OE1 GLU A 72 19.267 15.027 -21.217 1.00 2.34 O ATOM 1067 OE2 GLU A 72 21.318 14.730 -21.949 1.00 52.03 O ATOM 0 H GLU A 72 21.654 14.856 -17.188 1.00 22.43 H new ATOM 0 HA GLU A 72 20.898 17.497 -17.760 1.00 61.13 H new ATOM 0 HB2 GLU A 72 19.561 14.842 -18.415 1.00 64.31 H new ATOM 0 HB3 GLU A 72 19.148 16.372 -19.161 1.00 64.31 H new ATOM 0 HG2 GLU A 72 21.576 16.536 -19.922 1.00 42.44 H new ATOM 0 HG3 GLU A 72 21.786 14.889 -19.363 1.00 42.44 H new ATOM 1074 N ILE A 73 18.820 15.820 -15.820 1.00 71.50 N ATOM 1075 CA ILE A 73 17.698 15.966 -14.902 1.00 14.44 C ATOM 1076 C ILE A 73 17.935 17.110 -13.921 1.00 45.14 C ATOM 1077 O ILE A 73 17.042 17.917 -13.666 1.00 21.32 O ATOM 1078 CB ILE A 73 17.445 14.670 -14.109 1.00 44.11 C ATOM 1079 CG1 ILE A 73 16.822 13.606 -15.015 1.00 24.12 C ATOM 1080 CG2 ILE A 73 16.547 14.947 -12.913 1.00 4.03 C ATOM 1081 CD1 ILE A 73 15.418 13.942 -15.464 1.00 73.02 C ATOM 0 H ILE A 73 19.217 14.881 -15.855 1.00 71.50 H new ATOM 0 HA ILE A 73 16.821 16.187 -15.510 1.00 14.44 H new ATOM 0 HB ILE A 73 18.400 14.294 -13.742 1.00 44.11 H new ATOM 0 HG12 ILE A 73 17.454 13.473 -15.893 1.00 24.12 H new ATOM 0 HG13 ILE A 73 16.807 12.653 -14.486 1.00 24.12 H new ATOM 0 HG21 ILE A 73 16.378 14.021 -12.363 1.00 4.03 H new ATOM 0 HG22 ILE A 73 17.027 15.675 -12.259 1.00 4.03 H new ATOM 0 HG23 ILE A 73 15.592 15.343 -13.259 1.00 4.03 H new ATOM 0 HD11 ILE A 73 15.040 13.144 -16.103 1.00 73.02 H new ATOM 0 HD12 ILE A 73 14.772 14.046 -14.592 1.00 73.02 H new ATOM 0 HD13 ILE A 73 15.429 14.879 -16.021 1.00 73.02 H new ATOM 1093 N GLU A 74 19.147 17.174 -13.377 1.00 73.23 N ATOM 1094 CA GLU A 74 19.502 18.220 -12.426 1.00 11.12 C ATOM 1095 C GLU A 74 19.368 19.601 -13.061 1.00 3.22 C ATOM 1096 O GLU A 74 18.681 20.475 -12.533 1.00 20.23 O ATOM 1097 CB GLU A 74 20.931 18.016 -11.919 1.00 62.31 C ATOM 1098 CG GLU A 74 21.037 17.952 -10.405 1.00 32.13 C ATOM 1099 CD GLU A 74 21.834 19.105 -9.826 1.00 64.44 C ATOM 1100 OE1 GLU A 74 21.390 20.263 -9.969 1.00 11.13 O ATOM 1101 OE2 GLU A 74 22.902 18.849 -9.232 1.00 64.22 O ATOM 0 H GLU A 74 19.898 16.514 -13.579 1.00 73.23 H new ATOM 0 HA GLU A 74 18.813 18.158 -11.583 1.00 11.12 H new ATOM 0 HB2 GLU A 74 21.329 17.094 -12.342 1.00 62.31 H new ATOM 0 HB3 GLU A 74 21.557 18.830 -12.284 1.00 62.31 H new ATOM 0 HG2 GLU A 74 20.036 17.955 -9.974 1.00 32.13 H new ATOM 0 HG3 GLU A 74 21.505 17.011 -10.117 1.00 32.13 H new ATOM 1108 N MET A 75 20.031 19.790 -14.197 1.00 42.11 N ATOM 1109 CA MET A 75 19.986 21.064 -14.905 1.00 2.41 C ATOM 1110 C MET A 75 18.564 21.388 -15.352 1.00 62.12 C ATOM 1111 O MET A 75 18.200 22.554 -15.500 1.00 3.22 O ATOM 1112 CB MET A 75 20.920 21.032 -16.117 1.00 14.44 C ATOM 1113 CG MET A 75 21.986 22.115 -16.091 1.00 50.30 C ATOM 1114 SD MET A 75 23.156 21.971 -17.455 1.00 72.45 S ATOM 1115 CE MET A 75 24.034 20.480 -16.992 1.00 2.23 C ATOM 0 H MET A 75 20.606 19.077 -14.647 1.00 42.11 H new ATOM 0 HA MET A 75 20.319 21.844 -14.220 1.00 2.41 H new ATOM 0 HB2 MET A 75 21.405 20.057 -16.166 1.00 14.44 H new ATOM 0 HB3 MET A 75 20.327 21.139 -17.025 1.00 14.44 H new ATOM 0 HG2 MET A 75 21.506 23.093 -16.131 1.00 50.30 H new ATOM 0 HG3 MET A 75 22.527 22.064 -15.146 1.00 50.30 H new ATOM 0 HE1 MET A 75 24.984 20.437 -17.524 1.00 2.23 H new ATOM 0 HE2 MET A 75 24.219 20.486 -15.918 1.00 2.23 H new ATOM 0 HE3 MET A 75 23.433 19.608 -17.252 1.00 2.23 H new ATOM 1125 N ALA A 76 17.765 20.348 -15.567 1.00 30.15 N ATOM 1126 CA ALA A 76 16.383 20.522 -15.995 1.00 52.32 C ATOM 1127 C ALA A 76 15.545 21.168 -14.897 1.00 52.42 C ATOM 1128 O ALA A 76 14.603 21.909 -15.178 1.00 42.31 O ATOM 1129 CB ALA A 76 15.783 19.184 -16.401 1.00 43.10 C ATOM 0 H ALA A 76 18.052 19.376 -15.452 1.00 30.15 H new ATOM 0 HA ALA A 76 16.378 21.187 -16.859 1.00 52.32 H new ATOM 0 HB1 ALA A 76 14.750 19.330 -16.718 1.00 43.10 H new ATOM 0 HB2 ALA A 76 16.359 18.761 -17.224 1.00 43.10 H new ATOM 0 HB3 ALA A 76 15.809 18.501 -15.552 1.00 43.10 H new ATOM 1135 N GLN A 77 15.893 20.882 -13.647 1.00 64.31 N ATOM 1136 CA GLN A 77 15.171 21.434 -12.507 1.00 43.53 C ATOM 1137 C GLN A 77 15.212 22.959 -12.525 1.00 34.03 C ATOM 1138 O GLN A 77 14.182 23.616 -12.677 1.00 51.45 O ATOM 1139 CB GLN A 77 15.765 20.912 -11.198 1.00 62.31 C ATOM 1140 CG GLN A 77 15.402 19.466 -10.900 1.00 12.13 C ATOM 1141 CD GLN A 77 15.896 19.009 -9.541 1.00 74.33 C ATOM 1142 OE1 GLN A 77 16.750 19.651 -8.930 1.00 10.00 O ATOM 1143 NE2 GLN A 77 15.359 17.893 -9.061 1.00 1.00 N ATOM 0 H GLN A 77 16.671 20.271 -13.398 1.00 64.31 H new ATOM 0 HA GLN A 77 14.131 21.115 -12.578 1.00 43.53 H new ATOM 0 HB2 GLN A 77 16.850 21.005 -11.239 1.00 62.31 H new ATOM 0 HB3 GLN A 77 15.422 21.541 -10.377 1.00 62.31 H new ATOM 0 HG2 GLN A 77 14.319 19.350 -10.947 1.00 12.13 H new ATOM 0 HG3 GLN A 77 15.825 18.823 -11.671 1.00 12.13 H new ATOM 0 HE21 GLN A 77 14.654 17.393 -9.602 1.00 1.00 H new ATOM 0 HE22 GLN A 77 15.652 17.536 -8.151 1.00 1.00 H new ATOM 1152 N LYS A 78 16.408 23.516 -12.367 1.00 15.12 N ATOM 1153 CA LYS A 78 16.584 24.963 -12.365 1.00 53.51 C ATOM 1154 C LYS A 78 16.162 25.564 -13.702 1.00 50.42 C ATOM 1155 O LYS A 78 15.496 26.600 -13.747 1.00 23.13 O ATOM 1156 CB LYS A 78 18.043 25.320 -12.071 1.00 74.01 C ATOM 1157 CG LYS A 78 18.447 25.084 -10.626 1.00 62.43 C ATOM 1158 CD LYS A 78 19.580 24.076 -10.522 1.00 72.01 C ATOM 1159 CE LYS A 78 20.928 24.721 -10.805 1.00 12.44 C ATOM 1160 NZ LYS A 78 21.596 24.115 -11.990 1.00 15.24 N ATOM 0 H LYS A 78 17.270 22.986 -12.239 1.00 15.12 H new ATOM 0 HA LYS A 78 15.950 25.380 -11.583 1.00 53.51 H new ATOM 0 HB2 LYS A 78 18.690 24.732 -12.721 1.00 74.01 H new ATOM 0 HB3 LYS A 78 18.209 26.368 -12.319 1.00 74.01 H new ATOM 0 HG2 LYS A 78 18.755 26.027 -10.175 1.00 62.43 H new ATOM 0 HG3 LYS A 78 17.587 24.726 -10.060 1.00 62.43 H new ATOM 0 HD2 LYS A 78 19.588 23.637 -9.524 1.00 72.01 H new ATOM 0 HD3 LYS A 78 19.410 23.262 -11.227 1.00 72.01 H new ATOM 0 HE2 LYS A 78 20.791 25.789 -10.972 1.00 12.44 H new ATOM 0 HE3 LYS A 78 21.572 24.615 -9.932 1.00 12.44 H new ATOM 0 HZ1 LYS A 78 22.511 24.582 -12.149 1.00 15.24 H new ATOM 0 HZ2 LYS A 78 21.750 23.100 -11.821 1.00 15.24 H new ATOM 0 HZ3 LYS A 78 20.994 24.238 -12.829 1.00 15.24 H new ATOM 1174 N LEU A 79 16.552 24.909 -14.790 1.00 31.44 N ATOM 1175 CA LEU A 79 16.213 25.378 -16.129 1.00 33.53 C ATOM 1176 C LEU A 79 14.709 25.597 -16.264 1.00 63.34 C ATOM 1177 O LEU A 79 14.261 26.677 -16.650 1.00 11.32 O ATOM 1178 CB LEU A 79 16.690 24.372 -17.178 1.00 51.45 C ATOM 1179 CG LEU A 79 16.328 24.694 -18.629 1.00 0.01 C ATOM 1180 CD1 LEU A 79 17.483 24.349 -19.556 1.00 71.13 C ATOM 1181 CD2 LEU A 79 15.068 23.947 -19.042 1.00 41.54 C ATOM 0 H LEU A 79 17.104 24.051 -14.771 1.00 31.44 H new ATOM 0 HA LEU A 79 16.716 26.331 -16.293 1.00 33.53 H new ATOM 0 HB2 LEU A 79 17.774 24.288 -17.105 1.00 51.45 H new ATOM 0 HB3 LEU A 79 16.277 23.394 -16.930 1.00 51.45 H new ATOM 0 HG LEU A 79 16.134 25.764 -18.707 1.00 0.01 H new ATOM 0 HD11 LEU A 79 17.207 24.585 -20.584 1.00 71.13 H new ATOM 0 HD12 LEU A 79 18.362 24.929 -19.274 1.00 71.13 H new ATOM 0 HD13 LEU A 79 17.709 23.286 -19.476 1.00 71.13 H new ATOM 0 HD21 LEU A 79 14.825 24.188 -20.077 1.00 41.54 H new ATOM 0 HD22 LEU A 79 15.234 22.874 -18.948 1.00 41.54 H new ATOM 0 HD23 LEU A 79 14.241 24.244 -18.397 1.00 41.54 H new ATOM 1193 N LEU A 80 13.935 24.566 -15.943 1.00 42.04 N ATOM 1194 CA LEU A 80 12.481 24.646 -16.027 1.00 50.11 C ATOM 1195 C LEU A 80 11.959 25.868 -15.278 1.00 50.11 C ATOM 1196 O LEU A 80 11.065 26.565 -15.755 1.00 51.53 O ATOM 1197 CB LEU A 80 11.847 23.376 -15.458 1.00 30.31 C ATOM 1198 CG LEU A 80 11.399 22.332 -16.482 1.00 54.50 C ATOM 1199 CD1 LEU A 80 12.530 22.010 -17.446 1.00 20.13 C ATOM 1200 CD2 LEU A 80 10.916 21.071 -15.782 1.00 20.44 C ATOM 0 H LEU A 80 14.290 23.665 -15.622 1.00 42.04 H new ATOM 0 HA LEU A 80 12.207 24.742 -17.078 1.00 50.11 H new ATOM 0 HB2 LEU A 80 12.563 22.908 -14.782 1.00 30.31 H new ATOM 0 HB3 LEU A 80 10.983 23.662 -14.859 1.00 30.31 H new ATOM 0 HG LEU A 80 10.569 22.746 -17.054 1.00 54.50 H new ATOM 0 HD11 LEU A 80 12.193 21.265 -18.167 1.00 20.13 H new ATOM 0 HD12 LEU A 80 12.828 22.916 -17.973 1.00 20.13 H new ATOM 0 HD13 LEU A 80 13.381 21.617 -16.890 1.00 20.13 H new ATOM 0 HD21 LEU A 80 10.601 20.340 -16.526 1.00 20.44 H new ATOM 0 HD22 LEU A 80 11.726 20.654 -15.183 1.00 20.44 H new ATOM 0 HD23 LEU A 80 10.074 21.314 -15.134 1.00 20.44 H new ATOM 1212 N ASN A 81 12.525 26.122 -14.103 1.00 5.10 N ATOM 1213 CA ASN A 81 12.118 27.261 -13.289 1.00 3.45 C ATOM 1214 C ASN A 81 12.146 28.551 -14.104 1.00 32.51 C ATOM 1215 O ASN A 81 11.174 29.306 -14.122 1.00 43.34 O ATOM 1216 CB ASN A 81 13.033 27.396 -12.069 1.00 40.24 C ATOM 1217 CG ASN A 81 12.256 27.615 -10.785 1.00 64.43 C ATOM 1218 OD1 ASN A 81 11.910 28.745 -10.441 1.00 74.51 O ATOM 1219 ND2 ASN A 81 11.980 26.531 -10.070 1.00 20.34 N ATOM 0 H ASN A 81 13.267 25.554 -13.693 1.00 5.10 H new ATOM 0 HA ASN A 81 11.096 27.087 -12.952 1.00 3.45 H new ATOM 0 HB2 ASN A 81 13.642 26.497 -11.973 1.00 40.24 H new ATOM 0 HB3 ASN A 81 13.718 28.230 -12.223 1.00 40.24 H new ATOM 0 HD21 ASN A 81 11.461 26.615 -9.196 1.00 20.34 H new ATOM 0 HD22 ASN A 81 12.287 25.614 -10.395 1.00 20.34 H new ATOM 1226 N SER A 82 13.265 28.795 -14.778 1.00 24.55 N ATOM 1227 CA SER A 82 13.421 29.994 -15.593 1.00 22.44 C ATOM 1228 C SER A 82 12.264 30.136 -16.577 1.00 31.25 C ATOM 1229 O SER A 82 11.598 31.171 -16.624 1.00 24.52 O ATOM 1230 CB SER A 82 14.749 29.951 -16.352 1.00 33.21 C ATOM 1231 OG SER A 82 15.376 31.222 -16.355 1.00 33.31 O ATOM 0 H SER A 82 14.077 28.178 -14.776 1.00 24.55 H new ATOM 0 HA SER A 82 13.418 30.858 -14.929 1.00 22.44 H new ATOM 0 HB2 SER A 82 15.411 29.217 -15.892 1.00 33.21 H new ATOM 0 HB3 SER A 82 14.575 29.625 -17.378 1.00 33.21 H new ATOM 0 HG SER A 82 16.223 31.168 -16.845 1.00 33.31 H new ATOM 1237 N ASP A 83 12.030 29.089 -17.360 1.00 43.04 N ATOM 1238 CA ASP A 83 10.953 29.095 -18.343 1.00 41.24 C ATOM 1239 C ASP A 83 9.628 29.483 -17.695 1.00 10.21 C ATOM 1240 O ASP A 83 8.833 30.223 -18.277 1.00 31.24 O ATOM 1241 CB ASP A 83 10.829 27.721 -19.004 1.00 11.30 C ATOM 1242 CG ASP A 83 12.154 27.213 -19.536 1.00 24.44 C ATOM 1243 OD1 ASP A 83 13.093 28.026 -19.668 1.00 53.41 O ATOM 1244 OD2 ASP A 83 12.254 26.001 -19.818 1.00 71.53 O ATOM 0 H ASP A 83 12.572 28.225 -17.333 1.00 43.04 H new ATOM 0 HA ASP A 83 11.194 29.836 -19.105 1.00 41.24 H new ATOM 0 HB2 ASP A 83 10.434 27.008 -18.281 1.00 11.30 H new ATOM 0 HB3 ASP A 83 10.110 27.778 -19.822 1.00 11.30 H new ATOM 1249 N LEU A 84 9.396 28.979 -16.488 1.00 52.01 N ATOM 1250 CA LEU A 84 8.166 29.272 -15.760 1.00 70.11 C ATOM 1251 C LEU A 84 7.921 30.776 -15.688 1.00 72.41 C ATOM 1252 O LEU A 84 6.962 31.287 -16.267 1.00 24.44 O ATOM 1253 CB LEU A 84 8.234 28.686 -14.349 1.00 11.45 C ATOM 1254 CG LEU A 84 6.906 28.594 -13.596 1.00 2.34 C ATOM 1255 CD1 LEU A 84 6.863 27.337 -12.741 1.00 62.23 C ATOM 1256 CD2 LEU A 84 6.693 29.832 -12.737 1.00 1.33 C ATOM 0 H LEU A 84 10.043 28.366 -15.993 1.00 52.01 H new ATOM 0 HA LEU A 84 7.336 28.813 -16.298 1.00 70.11 H new ATOM 0 HB2 LEU A 84 8.663 27.686 -14.413 1.00 11.45 H new ATOM 0 HB3 LEU A 84 8.922 29.291 -13.759 1.00 11.45 H new ATOM 0 HG LEU A 84 6.099 28.540 -14.327 1.00 2.34 H new ATOM 0 HD11 LEU A 84 5.911 27.289 -12.213 1.00 62.23 H new ATOM 0 HD12 LEU A 84 6.969 26.459 -13.379 1.00 62.23 H new ATOM 0 HD13 LEU A 84 7.678 27.361 -12.018 1.00 62.23 H new ATOM 0 HD21 LEU A 84 5.743 29.749 -12.209 1.00 1.33 H new ATOM 0 HD22 LEU A 84 7.504 29.917 -12.014 1.00 1.33 H new ATOM 0 HD23 LEU A 84 6.679 30.718 -13.372 1.00 1.33 H new ATOM 1268 N ALA A 85 8.795 31.479 -14.976 1.00 32.04 N ATOM 1269 CA ALA A 85 8.676 32.925 -14.832 1.00 33.44 C ATOM 1270 C ALA A 85 8.634 33.610 -16.193 1.00 52.30 C ATOM 1271 O ALA A 85 7.931 34.603 -16.376 1.00 13.41 O ATOM 1272 CB ALA A 85 9.827 33.469 -14.000 1.00 25.24 C ATOM 0 H ALA A 85 9.593 31.071 -14.490 1.00 32.04 H new ATOM 0 HA ALA A 85 7.739 33.138 -14.318 1.00 33.44 H new ATOM 0 HB1 ALA A 85 9.725 34.550 -13.901 1.00 25.24 H new ATOM 0 HB2 ALA A 85 9.810 33.011 -13.011 1.00 25.24 H new ATOM 0 HB3 ALA A 85 10.772 33.237 -14.491 1.00 25.24 H new ATOM 1278 N GLU A 86 9.392 33.074 -17.144 1.00 74.24 N ATOM 1279 CA GLU A 86 9.441 33.636 -18.489 1.00 1.43 C ATOM 1280 C GLU A 86 8.048 33.683 -19.111 1.00 3.14 C ATOM 1281 O GLU A 86 7.625 34.713 -19.637 1.00 42.21 O ATOM 1282 CB GLU A 86 10.380 32.815 -19.375 1.00 40.30 C ATOM 1283 CG GLU A 86 10.941 33.594 -20.553 1.00 72.11 C ATOM 1284 CD GLU A 86 10.053 33.516 -21.780 1.00 32.12 C ATOM 1285 OE1 GLU A 86 9.825 32.393 -22.276 1.00 31.51 O ATOM 1286 OE2 GLU A 86 9.586 34.577 -22.244 1.00 2.12 O ATOM 0 H GLU A 86 9.980 32.252 -17.008 1.00 74.24 H new ATOM 0 HA GLU A 86 9.821 34.655 -18.415 1.00 1.43 H new ATOM 0 HB2 GLU A 86 11.206 32.444 -18.769 1.00 40.30 H new ATOM 0 HB3 GLU A 86 9.843 31.943 -19.749 1.00 40.30 H new ATOM 0 HG2 GLU A 86 11.067 34.638 -20.266 1.00 72.11 H new ATOM 0 HG3 GLU A 86 11.930 33.209 -20.800 1.00 72.11 H new ATOM 1293 N LEU A 87 7.340 32.561 -19.046 1.00 65.14 N ATOM 1294 CA LEU A 87 5.995 32.472 -19.603 1.00 40.02 C ATOM 1295 C LEU A 87 5.031 33.379 -18.845 1.00 31.52 C ATOM 1296 O LEU A 87 4.354 34.217 -19.440 1.00 53.12 O ATOM 1297 CB LEU A 87 5.497 31.026 -19.557 1.00 1.41 C ATOM 1298 CG LEU A 87 4.373 30.672 -20.531 1.00 12.20 C ATOM 1299 CD1 LEU A 87 4.386 29.184 -20.843 1.00 63.13 C ATOM 1300 CD2 LEU A 87 3.024 31.088 -19.962 1.00 71.43 C ATOM 0 H LEU A 87 7.675 31.700 -18.613 1.00 65.14 H new ATOM 0 HA LEU A 87 6.035 32.802 -20.641 1.00 40.02 H new ATOM 0 HB2 LEU A 87 6.342 30.366 -19.753 1.00 1.41 H new ATOM 0 HB3 LEU A 87 5.154 30.813 -18.545 1.00 1.41 H new ATOM 0 HG LEU A 87 4.537 31.218 -21.460 1.00 12.20 H new ATOM 0 HD11 LEU A 87 3.579 28.951 -21.538 1.00 63.13 H new ATOM 0 HD12 LEU A 87 5.342 28.915 -21.293 1.00 63.13 H new ATOM 0 HD13 LEU A 87 4.247 28.618 -19.922 1.00 63.13 H new ATOM 0 HD21 LEU A 87 2.235 30.828 -20.668 1.00 71.43 H new ATOM 0 HD22 LEU A 87 2.851 30.569 -19.019 1.00 71.43 H new ATOM 0 HD23 LEU A 87 3.018 32.164 -19.791 1.00 71.43 H new ATOM 1312 N ILE A 88 4.976 33.206 -17.529 1.00 31.55 N ATOM 1313 CA ILE A 88 4.097 34.010 -16.689 1.00 4.32 C ATOM 1314 C ILE A 88 4.320 35.500 -16.929 1.00 73.43 C ATOM 1315 O ILE A 88 3.367 36.268 -17.051 1.00 72.15 O ATOM 1316 CB ILE A 88 4.312 33.705 -15.195 1.00 2.45 C ATOM 1317 CG1 ILE A 88 4.104 32.215 -14.921 1.00 31.52 C ATOM 1318 CG2 ILE A 88 3.370 34.543 -14.342 1.00 61.44 C ATOM 1319 CD1 ILE A 88 4.309 31.832 -13.472 1.00 23.31 C ATOM 0 H ILE A 88 5.530 32.516 -17.021 1.00 31.55 H new ATOM 0 HA ILE A 88 3.074 33.749 -16.961 1.00 4.32 H new ATOM 0 HB ILE A 88 5.337 33.964 -14.931 1.00 2.45 H new ATOM 0 HG12 ILE A 88 3.094 31.936 -15.223 1.00 31.52 H new ATOM 0 HG13 ILE A 88 4.792 31.640 -15.541 1.00 31.52 H new ATOM 0 HG21 ILE A 88 3.534 34.316 -13.289 1.00 61.44 H new ATOM 0 HG22 ILE A 88 3.563 35.601 -14.520 1.00 61.44 H new ATOM 0 HG23 ILE A 88 2.338 34.313 -14.606 1.00 61.44 H new ATOM 0 HD11 ILE A 88 4.145 30.761 -13.352 1.00 23.31 H new ATOM 0 HD12 ILE A 88 5.327 32.079 -13.171 1.00 23.31 H new ATOM 0 HD13 ILE A 88 3.603 32.379 -12.848 1.00 23.31 H new ATOM 1331 N ASN A 89 5.585 35.900 -16.998 1.00 23.11 N ATOM 1332 CA ASN A 89 5.934 37.298 -17.225 1.00 75.34 C ATOM 1333 C ASN A 89 5.422 37.772 -18.582 1.00 62.24 C ATOM 1334 O ASN A 89 4.641 38.720 -18.668 1.00 31.43 O ATOM 1335 CB ASN A 89 7.450 37.487 -17.145 1.00 33.13 C ATOM 1336 CG ASN A 89 7.843 38.942 -16.980 1.00 12.20 C ATOM 1337 OD1 ASN A 89 7.367 39.812 -17.711 1.00 25.34 O ATOM 1338 ND2 ASN A 89 8.715 39.214 -16.017 1.00 25.24 N ATOM 0 H ASN A 89 6.386 35.276 -16.900 1.00 23.11 H new ATOM 0 HA ASN A 89 5.459 37.896 -16.447 1.00 75.34 H new ATOM 0 HB2 ASN A 89 7.842 36.910 -16.307 1.00 33.13 H new ATOM 0 HB3 ASN A 89 7.911 37.089 -18.049 1.00 33.13 H new ATOM 0 HD21 ASN A 89 9.017 40.175 -15.859 1.00 25.24 H new ATOM 0 HD22 ASN A 89 9.083 38.462 -15.435 1.00 25.24 H new ATOM 1345 N LYS A 90 5.868 37.106 -19.642 1.00 71.51 N ATOM 1346 CA LYS A 90 5.455 37.456 -20.996 1.00 21.11 C ATOM 1347 C LYS A 90 3.935 37.528 -21.100 1.00 20.41 C ATOM 1348 O LYS A 90 3.389 38.430 -21.735 1.00 20.45 O ATOM 1349 CB LYS A 90 5.998 36.434 -21.997 1.00 72.32 C ATOM 1350 CG LYS A 90 6.781 37.058 -23.140 1.00 34.45 C ATOM 1351 CD LYS A 90 5.959 38.104 -23.873 1.00 15.22 C ATOM 1352 CE LYS A 90 6.577 39.488 -23.747 1.00 23.13 C ATOM 1353 NZ LYS A 90 7.616 39.728 -24.787 1.00 15.12 N ATOM 0 H LYS A 90 6.516 36.320 -19.589 1.00 71.51 H new ATOM 0 HA LYS A 90 5.864 38.438 -21.231 1.00 21.11 H new ATOM 0 HB2 LYS A 90 6.640 35.728 -21.470 1.00 72.32 H new ATOM 0 HB3 LYS A 90 5.166 35.862 -22.407 1.00 72.32 H new ATOM 0 HG2 LYS A 90 7.691 37.516 -22.752 1.00 34.45 H new ATOM 0 HG3 LYS A 90 7.088 36.280 -23.839 1.00 34.45 H new ATOM 0 HD2 LYS A 90 5.881 37.834 -24.926 1.00 15.22 H new ATOM 0 HD3 LYS A 90 4.946 38.119 -23.471 1.00 15.22 H new ATOM 0 HE2 LYS A 90 5.796 40.244 -23.833 1.00 23.13 H new ATOM 0 HE3 LYS A 90 7.021 39.599 -22.758 1.00 23.13 H new ATOM 0 HZ1 LYS A 90 8.013 40.682 -24.667 1.00 15.12 H new ATOM 0 HZ2 LYS A 90 8.374 39.023 -24.690 1.00 15.12 H new ATOM 0 HZ3 LYS A 90 7.187 39.647 -25.731 1.00 15.12 H new ATOM 1367 N MET A 91 3.258 36.572 -20.472 1.00 13.24 N ATOM 1368 CA MET A 91 1.800 36.530 -20.492 1.00 22.41 C ATOM 1369 C MET A 91 1.211 37.793 -19.872 1.00 73.24 C ATOM 1370 O MET A 91 0.346 38.441 -20.463 1.00 4.23 O ATOM 1371 CB MET A 91 1.294 35.296 -19.742 1.00 22.10 C ATOM 1372 CG MET A 91 0.090 34.639 -20.396 1.00 73.31 C ATOM 1373 SD MET A 91 -1.292 35.777 -20.609 1.00 34.03 S ATOM 1374 CE MET A 91 -1.641 36.209 -18.906 1.00 25.24 C ATOM 0 H MET A 91 3.695 35.817 -19.944 1.00 13.24 H new ATOM 0 HA MET A 91 1.477 36.472 -21.532 1.00 22.41 H new ATOM 0 HB2 MET A 91 2.102 34.567 -19.671 1.00 22.10 H new ATOM 0 HB3 MET A 91 1.033 35.582 -18.723 1.00 22.10 H new ATOM 0 HG2 MET A 91 0.381 34.242 -21.368 1.00 73.31 H new ATOM 0 HG3 MET A 91 -0.232 33.793 -19.789 1.00 73.31 H new ATOM 0 HE1 MET A 91 -2.591 35.767 -18.606 1.00 25.24 H new ATOM 0 HE2 MET A 91 -0.846 35.830 -18.264 1.00 25.24 H new ATOM 0 HE3 MET A 91 -1.699 37.293 -18.810 1.00 25.24 H new ATOM 1384 N LYS A 92 1.683 38.137 -18.679 1.00 41.22 N ATOM 1385 CA LYS A 92 1.204 39.323 -17.979 1.00 41.24 C ATOM 1386 C LYS A 92 1.284 40.554 -18.877 1.00 75.10 C ATOM 1387 O LYS A 92 0.492 41.487 -18.740 1.00 13.44 O ATOM 1388 CB LYS A 92 2.021 39.554 -16.706 1.00 41.01 C ATOM 1389 CG LYS A 92 1.192 40.046 -15.532 1.00 61.22 C ATOM 1390 CD LYS A 92 1.934 41.101 -14.729 1.00 12.00 C ATOM 1391 CE LYS A 92 3.010 40.480 -13.852 1.00 34.55 C ATOM 1392 NZ LYS A 92 3.678 41.494 -12.990 1.00 55.33 N ATOM 0 H LYS A 92 2.398 37.611 -18.176 1.00 41.22 H new ATOM 0 HA LYS A 92 0.161 39.158 -17.709 1.00 41.24 H new ATOM 0 HB2 LYS A 92 2.514 38.623 -16.427 1.00 41.01 H new ATOM 0 HB3 LYS A 92 2.806 40.280 -16.915 1.00 41.01 H new ATOM 0 HG2 LYS A 92 0.252 40.460 -15.897 1.00 61.22 H new ATOM 0 HG3 LYS A 92 0.940 39.205 -14.885 1.00 61.22 H new ATOM 0 HD2 LYS A 92 2.388 41.823 -15.407 1.00 12.00 H new ATOM 0 HD3 LYS A 92 1.227 41.649 -14.106 1.00 12.00 H new ATOM 0 HE2 LYS A 92 2.566 39.707 -13.225 1.00 34.55 H new ATOM 0 HE3 LYS A 92 3.754 39.992 -14.481 1.00 34.55 H new ATOM 0 HZ1 LYS A 92 4.405 41.030 -12.408 1.00 55.33 H new ATOM 0 HZ2 LYS A 92 4.124 42.219 -13.588 1.00 55.33 H new ATOM 0 HZ3 LYS A 92 2.973 41.942 -12.371 1.00 55.33 H new ATOM 1406 N LEU A 93 2.242 40.549 -19.797 1.00 22.34 N ATOM 1407 CA LEU A 93 2.424 41.665 -20.719 1.00 31.53 C ATOM 1408 C LEU A 93 1.324 41.683 -21.775 1.00 72.30 C ATOM 1409 O LEU A 93 0.668 42.703 -21.985 1.00 63.32 O ATOM 1410 CB LEU A 93 3.794 41.576 -21.394 1.00 34.11 C ATOM 1411 CG LEU A 93 4.681 42.816 -21.277 1.00 70.31 C ATOM 1412 CD1 LEU A 93 5.369 42.854 -19.922 1.00 23.24 C ATOM 1413 CD2 LEU A 93 5.708 42.844 -22.400 1.00 11.22 C ATOM 0 H LEU A 93 2.905 39.784 -19.925 1.00 22.34 H new ATOM 0 HA LEU A 93 2.368 42.591 -20.146 1.00 31.53 H new ATOM 0 HB2 LEU A 93 4.331 40.728 -20.970 1.00 34.11 H new ATOM 0 HB3 LEU A 93 3.642 41.361 -22.452 1.00 34.11 H new ATOM 0 HG LEU A 93 4.050 43.701 -21.366 1.00 70.31 H new ATOM 0 HD11 LEU A 93 5.996 43.743 -19.857 1.00 23.24 H new ATOM 0 HD12 LEU A 93 4.617 42.881 -19.133 1.00 23.24 H new ATOM 0 HD13 LEU A 93 5.988 41.965 -19.803 1.00 23.24 H new ATOM 0 HD21 LEU A 93 6.331 43.733 -22.301 1.00 11.22 H new ATOM 0 HD22 LEU A 93 6.334 41.954 -22.342 1.00 11.22 H new ATOM 0 HD23 LEU A 93 5.195 42.865 -23.362 1.00 11.22 H new ATOM 1425 N ALA A 94 1.126 40.546 -22.435 1.00 52.53 N ATOM 1426 CA ALA A 94 0.102 40.431 -23.467 1.00 22.44 C ATOM 1427 C ALA A 94 -1.257 40.883 -22.944 1.00 71.12 C ATOM 1428 O ALA A 94 -2.038 41.497 -23.671 1.00 4.43 O ATOM 1429 CB ALA A 94 0.025 38.999 -23.975 1.00 34.43 C ATOM 0 H ALA A 94 1.661 39.692 -22.274 1.00 52.53 H new ATOM 0 HA ALA A 94 0.379 41.084 -24.294 1.00 22.44 H new ATOM 0 HB1 ALA A 94 -0.743 38.927 -24.745 1.00 34.43 H new ATOM 0 HB2 ALA A 94 0.988 38.710 -24.395 1.00 34.43 H new ATOM 0 HB3 ALA A 94 -0.225 38.333 -23.149 1.00 34.43 H new ATOM 1435 N GLN A 95 -1.533 40.574 -21.681 1.00 52.12 N ATOM 1436 CA GLN A 95 -2.800 40.948 -21.063 1.00 43.31 C ATOM 1437 C GLN A 95 -3.021 42.455 -21.145 1.00 53.03 C ATOM 1438 O GLN A 95 -4.159 42.924 -21.159 1.00 60.02 O ATOM 1439 CB GLN A 95 -2.832 40.495 -19.603 1.00 12.04 C ATOM 1440 CG GLN A 95 -3.698 39.269 -19.365 1.00 74.43 C ATOM 1441 CD GLN A 95 -5.181 39.582 -19.420 1.00 23.40 C ATOM 1442 OE1 GLN A 95 -5.579 40.698 -19.755 1.00 34.45 O ATOM 1443 NE2 GLN A 95 -6.007 38.595 -19.091 1.00 2.52 N ATOM 0 H GLN A 95 -0.897 40.066 -21.066 1.00 52.12 H new ATOM 0 HA GLN A 95 -3.603 40.451 -21.608 1.00 43.31 H new ATOM 0 HB2 GLN A 95 -1.815 40.280 -19.276 1.00 12.04 H new ATOM 0 HB3 GLN A 95 -3.199 41.314 -18.985 1.00 12.04 H new ATOM 0 HG2 GLN A 95 -3.462 38.512 -20.113 1.00 74.43 H new ATOM 0 HG3 GLN A 95 -3.457 38.842 -18.392 1.00 74.43 H new ATOM 0 HE21 GLN A 95 -5.633 37.686 -18.820 1.00 2.52 H new ATOM 0 HE22 GLN A 95 -7.016 38.746 -19.110 1.00 2.52 H new ATOM 1452 N GLN A 96 -1.927 43.207 -21.199 1.00 42.11 N ATOM 1453 CA GLN A 96 -2.003 44.661 -21.279 1.00 3.13 C ATOM 1454 C GLN A 96 -1.716 45.144 -22.697 1.00 14.34 C ATOM 1455 O GLN A 96 -2.159 46.221 -23.097 1.00 41.23 O ATOM 1456 CB GLN A 96 -1.015 45.299 -20.301 1.00 24.25 C ATOM 1457 CG GLN A 96 -1.608 45.574 -18.928 1.00 74.44 C ATOM 1458 CD GLN A 96 -1.931 47.039 -18.715 1.00 3.51 C ATOM 1459 OE1 GLN A 96 -3.091 47.413 -18.541 1.00 72.03 O ATOM 1460 NE2 GLN A 96 -0.903 47.880 -18.726 1.00 65.34 N ATOM 0 H GLN A 96 -0.978 42.834 -21.189 1.00 42.11 H new ATOM 0 HA GLN A 96 -3.016 44.962 -21.010 1.00 3.13 H new ATOM 0 HB2 GLN A 96 -0.152 44.643 -20.190 1.00 24.25 H new ATOM 0 HB3 GLN A 96 -0.651 46.235 -20.724 1.00 24.25 H new ATOM 0 HG2 GLN A 96 -2.516 44.984 -18.804 1.00 74.44 H new ATOM 0 HG3 GLN A 96 -0.907 45.245 -18.161 1.00 74.44 H new ATOM 0 HE21 GLN A 96 0.043 47.528 -18.874 1.00 65.34 H new ATOM 0 HE22 GLN A 96 -1.059 48.878 -18.587 1.00 65.34 H new ATOM 1469 N TYR A 97 -0.974 44.342 -23.451 1.00 22.11 N ATOM 1470 CA TYR A 97 -0.626 44.689 -24.824 1.00 1.23 C ATOM 1471 C TYR A 97 -1.570 44.012 -25.813 1.00 24.22 C ATOM 1472 O TYR A 97 -1.211 43.772 -26.966 1.00 34.10 O ATOM 1473 CB TYR A 97 0.819 44.287 -25.123 1.00 61.01 C ATOM 1474 CG TYR A 97 1.840 45.287 -24.631 1.00 5.40 C ATOM 1475 CD1 TYR A 97 2.032 46.496 -25.290 1.00 72.42 C ATOM 1476 CD2 TYR A 97 2.615 45.024 -23.508 1.00 13.42 C ATOM 1477 CE1 TYR A 97 2.964 47.413 -24.845 1.00 22.52 C ATOM 1478 CE2 TYR A 97 3.548 45.936 -23.054 1.00 64.04 C ATOM 1479 CZ TYR A 97 3.720 47.128 -23.726 1.00 54.43 C ATOM 1480 OH TYR A 97 4.650 48.038 -23.279 1.00 14.44 O ATOM 0 H TYR A 97 -0.601 43.447 -23.135 1.00 22.11 H new ATOM 0 HA TYR A 97 -0.726 45.769 -24.936 1.00 1.23 H new ATOM 0 HB2 TYR A 97 1.020 43.319 -24.664 1.00 61.01 H new ATOM 0 HB3 TYR A 97 0.937 44.160 -26.199 1.00 61.01 H new ATOM 0 HD1 TYR A 97 1.442 46.722 -26.166 1.00 72.42 H new ATOM 0 HD2 TYR A 97 2.486 44.090 -22.981 1.00 13.42 H new ATOM 0 HE1 TYR A 97 3.100 48.347 -25.369 1.00 22.52 H new ATOM 0 HE2 TYR A 97 4.140 45.717 -22.177 1.00 64.04 H new ATOM 0 HH TYR A 97 5.096 47.685 -22.481 1.00 14.44 H new ATOM 1490 N VAL A 98 -2.779 43.706 -25.353 1.00 3.23 N ATOM 1491 CA VAL A 98 -3.776 43.058 -26.196 1.00 12.22 C ATOM 1492 C VAL A 98 -4.915 44.014 -26.534 1.00 23.01 C ATOM 1493 O VAL A 98 -5.442 43.998 -27.646 1.00 11.54 O ATOM 1494 CB VAL A 98 -4.358 41.805 -25.515 1.00 63.11 C ATOM 1495 CG1 VAL A 98 -4.956 42.161 -24.163 1.00 31.33 C ATOM 1496 CG2 VAL A 98 -5.396 41.146 -26.410 1.00 54.33 C ATOM 0 H VAL A 98 -3.091 43.897 -24.401 1.00 3.23 H new ATOM 0 HA VAL A 98 -3.269 42.761 -27.114 1.00 12.22 H new ATOM 0 HB VAL A 98 -3.549 41.093 -25.351 1.00 63.11 H new ATOM 0 HG11 VAL A 98 -5.362 41.263 -23.697 1.00 31.33 H new ATOM 0 HG12 VAL A 98 -4.182 42.584 -23.523 1.00 31.33 H new ATOM 0 HG13 VAL A 98 -5.753 42.892 -24.299 1.00 31.33 H new ATOM 0 HG21 VAL A 98 -5.797 40.262 -25.913 1.00 54.33 H new ATOM 0 HG22 VAL A 98 -6.205 41.849 -26.608 1.00 54.33 H new ATOM 0 HG23 VAL A 98 -4.931 40.853 -27.352 1.00 54.33 H new ATOM 1506 N MET A 99 -5.289 44.846 -25.567 1.00 65.30 N ATOM 1507 CA MET A 99 -6.364 45.811 -25.763 1.00 72.31 C ATOM 1508 C MET A 99 -5.894 46.983 -26.618 1.00 43.00 C ATOM 1509 O MET A 99 -6.705 47.731 -27.165 1.00 5.51 O ATOM 1510 CB MET A 99 -6.873 46.320 -24.413 1.00 51.54 C ATOM 1511 CG MET A 99 -5.925 47.296 -23.735 1.00 63.23 C ATOM 1512 SD MET A 99 -6.594 48.968 -23.647 1.00 21.30 S ATOM 1513 CE MET A 99 -5.385 49.868 -24.615 1.00 73.21 C ATOM 0 H MET A 99 -4.863 44.871 -24.640 1.00 65.30 H new ATOM 0 HA MET A 99 -7.179 45.309 -26.284 1.00 72.31 H new ATOM 0 HB2 MET A 99 -7.839 46.805 -24.557 1.00 51.54 H new ATOM 0 HB3 MET A 99 -7.039 45.469 -23.752 1.00 51.54 H new ATOM 0 HG2 MET A 99 -5.706 46.943 -22.727 1.00 63.23 H new ATOM 0 HG3 MET A 99 -4.980 47.315 -24.278 1.00 63.23 H new ATOM 0 HE1 MET A 99 -5.466 50.933 -24.399 1.00 73.21 H new ATOM 0 HE2 MET A 99 -4.384 49.521 -24.360 1.00 73.21 H new ATOM 0 HE3 MET A 99 -5.569 49.698 -25.676 1.00 73.21 H new ATOM 1523 N THR A 100 -4.578 47.138 -26.730 1.00 0.25 N ATOM 1524 CA THR A 100 -4.000 48.220 -27.516 1.00 41.14 C ATOM 1525 C THR A 100 -4.059 47.908 -29.007 1.00 62.23 C ATOM 1526 O THR A 100 -4.863 48.483 -29.740 1.00 41.35 O ATOM 1527 CB THR A 100 -2.536 48.486 -27.117 1.00 32.45 C ATOM 1528 OG1 THR A 100 -2.466 48.859 -25.736 1.00 24.01 O ATOM 1529 CG2 THR A 100 -1.931 49.585 -27.976 1.00 54.41 C ATOM 0 H THR A 100 -3.893 46.527 -26.286 1.00 0.25 H new ATOM 0 HA THR A 100 -4.592 49.111 -27.309 1.00 41.14 H new ATOM 0 HB THR A 100 -1.967 47.570 -27.276 1.00 32.45 H new ATOM 0 HG1 THR A 100 -1.532 49.025 -25.489 1.00 24.01 H new ATOM 0 HG21 THR A 100 -0.897 49.754 -27.675 1.00 54.41 H new ATOM 0 HG22 THR A 100 -1.960 49.285 -29.024 1.00 54.41 H new ATOM 0 HG23 THR A 100 -2.502 50.504 -27.846 1.00 54.41 H new ATOM 1537 N SER A 101 -3.203 46.992 -29.450 1.00 5.52 N ATOM 1538 CA SER A 101 -3.155 46.606 -30.855 1.00 74.10 C ATOM 1539 C SER A 101 -2.093 45.537 -31.089 1.00 24.51 C ATOM 1540 O SER A 101 -2.260 44.651 -31.929 1.00 11.23 O ATOM 1541 CB SER A 101 -2.869 47.826 -31.732 1.00 50.12 C ATOM 1542 OG SER A 101 -3.946 48.082 -32.618 1.00 25.43 O ATOM 0 H SER A 101 -2.533 46.504 -28.856 1.00 5.52 H new ATOM 0 HA SER A 101 -4.127 46.193 -31.126 1.00 74.10 H new ATOM 0 HB2 SER A 101 -2.697 48.699 -31.102 1.00 50.12 H new ATOM 0 HB3 SER A 101 -1.956 47.661 -32.303 1.00 50.12 H new ATOM 0 HG SER A 101 -4.742 48.328 -32.102 1.00 25.43 H new ATOM 1548 N LEU A 102 -0.999 45.625 -30.340 1.00 43.24 N ATOM 1549 CA LEU A 102 0.093 44.666 -30.465 1.00 23.12 C ATOM 1550 C LEU A 102 -0.257 43.350 -29.777 1.00 3.31 C ATOM 1551 O LEU A 102 0.405 42.943 -28.823 1.00 4.12 O ATOM 1552 CB LEU A 102 1.376 45.243 -29.864 1.00 43.12 C ATOM 1553 CG LEU A 102 1.781 46.634 -30.355 1.00 35.23 C ATOM 1554 CD1 LEU A 102 3.065 47.086 -29.678 1.00 65.34 C ATOM 1555 CD2 LEU A 102 1.941 46.640 -31.868 1.00 25.31 C ATOM 0 H LEU A 102 -0.845 46.351 -29.640 1.00 43.24 H new ATOM 0 HA LEU A 102 0.252 44.470 -31.525 1.00 23.12 H new ATOM 0 HB2 LEU A 102 1.261 45.281 -28.781 1.00 43.12 H new ATOM 0 HB3 LEU A 102 2.194 44.553 -30.073 1.00 43.12 H new ATOM 0 HG LEU A 102 0.990 47.336 -30.092 1.00 35.23 H new ATOM 0 HD11 LEU A 102 3.338 48.077 -30.040 1.00 65.34 H new ATOM 0 HD12 LEU A 102 2.914 47.122 -28.599 1.00 65.34 H new ATOM 0 HD13 LEU A 102 3.865 46.383 -29.909 1.00 65.34 H new ATOM 0 HD21 LEU A 102 2.229 47.638 -32.199 1.00 25.31 H new ATOM 0 HD22 LEU A 102 2.712 45.925 -32.155 1.00 25.31 H new ATOM 0 HD23 LEU A 102 0.996 46.361 -32.335 1.00 25.31 H new ATOM 1567 N GLN A 103 -1.300 42.690 -30.269 1.00 42.15 N ATOM 1568 CA GLN A 103 -1.736 41.420 -29.703 1.00 31.54 C ATOM 1569 C GLN A 103 -1.149 40.246 -30.480 1.00 5.22 C ATOM 1570 O GLN A 103 -0.515 39.363 -29.902 1.00 72.05 O ATOM 1571 CB GLN A 103 -3.263 41.334 -29.704 1.00 74.11 C ATOM 1572 CG GLN A 103 -3.800 40.023 -29.151 1.00 42.34 C ATOM 1573 CD GLN A 103 -5.305 39.904 -29.290 1.00 2.13 C ATOM 1574 OE1 GLN A 103 -5.993 40.884 -29.574 1.00 52.53 O ATOM 1575 NE2 GLN A 103 -5.824 38.699 -29.089 1.00 33.33 N ATOM 0 H GLN A 103 -1.859 43.014 -31.058 1.00 42.15 H new ATOM 0 HA GLN A 103 -1.376 41.368 -28.675 1.00 31.54 H new ATOM 0 HB2 GLN A 103 -3.665 42.159 -29.116 1.00 74.11 H new ATOM 0 HB3 GLN A 103 -3.625 41.464 -30.724 1.00 74.11 H new ATOM 0 HG2 GLN A 103 -3.324 39.192 -29.671 1.00 42.34 H new ATOM 0 HG3 GLN A 103 -3.528 39.938 -28.099 1.00 42.34 H new ATOM 0 HE21 GLN A 103 -5.216 37.914 -28.855 1.00 33.33 H new ATOM 0 HE22 GLN A 103 -6.831 38.558 -29.168 1.00 33.33 H new ATOM 1584 N GLN A 104 -1.363 40.245 -31.791 1.00 74.44 N ATOM 1585 CA GLN A 104 -0.856 39.179 -32.647 1.00 25.41 C ATOM 1586 C GLN A 104 0.633 38.952 -32.408 1.00 25.43 C ATOM 1587 O GLN A 104 1.113 37.819 -32.455 1.00 1.43 O ATOM 1588 CB GLN A 104 -1.102 39.516 -34.118 1.00 73.34 C ATOM 1589 CG GLN A 104 -2.570 39.477 -34.514 1.00 24.14 C ATOM 1590 CD GLN A 104 -2.965 38.165 -35.163 1.00 44.20 C ATOM 1591 OE1 GLN A 104 -2.245 37.638 -36.011 1.00 62.43 O ATOM 1592 NE2 GLN A 104 -4.114 37.631 -34.767 1.00 61.30 N ATOM 0 H GLN A 104 -1.884 40.970 -32.284 1.00 74.44 H new ATOM 0 HA GLN A 104 -1.390 38.262 -32.398 1.00 25.41 H new ATOM 0 HB2 GLN A 104 -0.704 40.509 -34.326 1.00 73.34 H new ATOM 0 HB3 GLN A 104 -0.547 38.814 -34.741 1.00 73.34 H new ATOM 0 HG2 GLN A 104 -3.185 39.640 -33.629 1.00 24.14 H new ATOM 0 HG3 GLN A 104 -2.778 40.296 -35.203 1.00 24.14 H new ATOM 0 HE21 GLN A 104 -4.679 38.103 -34.061 1.00 61.30 H new ATOM 0 HE22 GLN A 104 -4.432 36.749 -35.169 1.00 61.30 H new ATOM 1601 N GLU A 105 1.359 40.036 -32.152 1.00 31.23 N ATOM 1602 CA GLU A 105 2.794 39.954 -31.907 1.00 30.44 C ATOM 1603 C GLU A 105 3.103 38.922 -30.826 1.00 21.42 C ATOM 1604 O GLU A 105 3.807 37.942 -31.071 1.00 24.11 O ATOM 1605 CB GLU A 105 3.342 41.321 -31.493 1.00 65.14 C ATOM 1606 CG GLU A 105 4.849 41.445 -31.650 1.00 13.13 C ATOM 1607 CD GLU A 105 5.359 42.831 -31.305 1.00 32.34 C ATOM 1608 OE1 GLU A 105 4.718 43.510 -30.476 1.00 1.13 O ATOM 1609 OE2 GLU A 105 6.400 43.235 -31.864 1.00 13.41 O ATOM 0 H GLU A 105 0.977 40.981 -32.109 1.00 31.23 H new ATOM 0 HA GLU A 105 3.277 39.642 -32.833 1.00 30.44 H new ATOM 0 HB2 GLU A 105 2.858 42.093 -32.091 1.00 65.14 H new ATOM 0 HB3 GLU A 105 3.077 41.510 -30.453 1.00 65.14 H new ATOM 0 HG2 GLU A 105 5.339 40.712 -31.009 1.00 13.13 H new ATOM 0 HG3 GLU A 105 5.125 41.206 -32.677 1.00 13.13 H new ATOM 1616 N TYR A 106 2.572 39.149 -29.630 1.00 11.32 N ATOM 1617 CA TYR A 106 2.793 38.242 -28.510 1.00 72.11 C ATOM 1618 C TYR A 106 2.367 36.821 -28.868 1.00 15.43 C ATOM 1619 O TYR A 106 2.897 35.848 -28.333 1.00 62.51 O ATOM 1620 CB TYR A 106 2.024 38.722 -27.278 1.00 1.10 C ATOM 1621 CG TYR A 106 1.944 37.691 -26.175 1.00 13.43 C ATOM 1622 CD1 TYR A 106 2.920 37.623 -25.189 1.00 3.34 C ATOM 1623 CD2 TYR A 106 0.892 36.785 -26.119 1.00 1.13 C ATOM 1624 CE1 TYR A 106 2.852 36.683 -24.179 1.00 34.21 C ATOM 1625 CE2 TYR A 106 0.814 35.842 -25.112 1.00 45.41 C ATOM 1626 CZ TYR A 106 1.797 35.795 -24.145 1.00 34.03 C ATOM 1627 OH TYR A 106 1.724 34.856 -23.141 1.00 54.41 O ATOM 0 H TYR A 106 1.985 39.954 -29.411 1.00 11.32 H new ATOM 0 HA TYR A 106 3.859 38.237 -28.285 1.00 72.11 H new ATOM 0 HB2 TYR A 106 2.502 39.621 -26.889 1.00 1.10 H new ATOM 0 HB3 TYR A 106 1.014 39.001 -27.577 1.00 1.10 H new ATOM 0 HD1 TYR A 106 3.747 38.317 -25.212 1.00 3.34 H new ATOM 0 HD2 TYR A 106 0.122 36.818 -26.876 1.00 1.13 H new ATOM 0 HE1 TYR A 106 3.620 36.644 -23.421 1.00 34.21 H new ATOM 0 HE2 TYR A 106 -0.011 35.146 -25.082 1.00 45.41 H new ATOM 0 HH TYR A 106 2.591 34.792 -22.689 1.00 54.41 H new ATOM 1637 N LYS A 107 1.404 36.711 -29.777 1.00 30.10 N ATOM 1638 CA LYS A 107 0.905 35.411 -30.210 1.00 23.01 C ATOM 1639 C LYS A 107 2.011 34.599 -30.876 1.00 70.53 C ATOM 1640 O LYS A 107 2.209 33.425 -30.562 1.00 33.41 O ATOM 1641 CB LYS A 107 -0.266 35.588 -31.178 1.00 74.04 C ATOM 1642 CG LYS A 107 -1.374 34.567 -30.986 1.00 70.40 C ATOM 1643 CD LYS A 107 -2.602 35.190 -30.343 1.00 24.21 C ATOM 1644 CE LYS A 107 -2.290 35.732 -28.956 1.00 71.33 C ATOM 1645 NZ LYS A 107 -3.517 35.861 -28.123 1.00 13.32 N ATOM 0 H LYS A 107 0.953 37.507 -30.228 1.00 30.10 H new ATOM 0 HA LYS A 107 0.561 34.869 -29.329 1.00 23.01 H new ATOM 0 HB2 LYS A 107 -0.680 36.589 -31.055 1.00 74.04 H new ATOM 0 HB3 LYS A 107 0.105 35.521 -32.201 1.00 74.04 H new ATOM 0 HG2 LYS A 107 -1.646 34.138 -31.950 1.00 70.40 H new ATOM 0 HG3 LYS A 107 -1.012 33.749 -30.364 1.00 70.40 H new ATOM 0 HD2 LYS A 107 -2.975 35.996 -30.974 1.00 24.21 H new ATOM 0 HD3 LYS A 107 -3.395 34.446 -30.274 1.00 24.21 H new ATOM 0 HE2 LYS A 107 -1.581 35.070 -28.458 1.00 71.33 H new ATOM 0 HE3 LYS A 107 -1.808 36.706 -29.046 1.00 71.33 H new ATOM 0 HZ1 LYS A 107 -3.291 35.630 -27.134 1.00 13.32 H new ATOM 0 HZ2 LYS A 107 -3.873 36.837 -28.178 1.00 13.32 H new ATOM 0 HZ3 LYS A 107 -4.245 35.206 -28.474 1.00 13.32 H new ATOM 1659 N LYS A 108 2.731 35.231 -31.797 1.00 75.31 N ATOM 1660 CA LYS A 108 3.819 34.568 -32.506 1.00 53.24 C ATOM 1661 C LYS A 108 4.921 34.147 -31.540 1.00 42.20 C ATOM 1662 O LYS A 108 5.405 33.017 -31.592 1.00 63.10 O ATOM 1663 CB LYS A 108 4.394 35.495 -33.580 1.00 74.43 C ATOM 1664 CG LYS A 108 3.887 35.191 -34.980 1.00 1.32 C ATOM 1665 CD LYS A 108 3.329 36.434 -35.652 1.00 52.23 C ATOM 1666 CE LYS A 108 4.366 37.099 -36.545 1.00 31.43 C ATOM 1667 NZ LYS A 108 5.082 38.198 -35.840 1.00 15.01 N ATOM 0 H LYS A 108 2.580 36.202 -32.070 1.00 75.31 H new ATOM 0 HA LYS A 108 3.417 33.674 -32.983 1.00 53.24 H new ATOM 0 HB2 LYS A 108 4.146 36.526 -33.329 1.00 74.43 H new ATOM 0 HB3 LYS A 108 5.481 35.417 -33.571 1.00 74.43 H new ATOM 0 HG2 LYS A 108 4.700 34.784 -35.582 1.00 1.32 H new ATOM 0 HG3 LYS A 108 3.113 34.425 -34.930 1.00 1.32 H new ATOM 0 HD2 LYS A 108 2.455 36.167 -36.245 1.00 52.23 H new ATOM 0 HD3 LYS A 108 2.995 37.141 -34.892 1.00 52.23 H new ATOM 0 HE2 LYS A 108 5.086 36.354 -36.882 1.00 31.43 H new ATOM 0 HE3 LYS A 108 3.878 37.496 -37.435 1.00 31.43 H new ATOM 0 HZ1 LYS A 108 5.780 38.626 -36.482 1.00 15.01 H new ATOM 0 HZ2 LYS A 108 4.398 38.922 -35.540 1.00 15.01 H new ATOM 0 HZ3 LYS A 108 5.569 37.815 -35.005 1.00 15.01 H new ATOM 1681 N GLN A 109 5.312 35.063 -30.659 1.00 75.13 N ATOM 1682 CA GLN A 109 6.356 34.785 -29.681 1.00 64.31 C ATOM 1683 C GLN A 109 5.963 33.617 -28.782 1.00 4.31 C ATOM 1684 O GLN A 109 6.752 32.699 -28.561 1.00 22.11 O ATOM 1685 CB GLN A 109 6.634 36.027 -28.832 1.00 75.24 C ATOM 1686 CG GLN A 109 8.110 36.371 -28.722 1.00 21.03 C ATOM 1687 CD GLN A 109 8.553 37.382 -29.761 1.00 22.12 C ATOM 1688 OE1 GLN A 109 8.850 38.532 -29.437 1.00 42.44 O ATOM 1689 NE2 GLN A 109 8.600 36.957 -31.018 1.00 44.20 N ATOM 0 H GLN A 109 4.921 36.003 -30.603 1.00 75.13 H new ATOM 0 HA GLN A 109 7.262 34.514 -30.222 1.00 64.31 H new ATOM 0 HB2 GLN A 109 6.103 36.876 -29.261 1.00 75.24 H new ATOM 0 HB3 GLN A 109 6.230 35.871 -27.832 1.00 75.24 H new ATOM 0 HG2 GLN A 109 8.314 36.766 -27.727 1.00 21.03 H new ATOM 0 HG3 GLN A 109 8.700 35.461 -28.831 1.00 21.03 H new ATOM 0 HE21 GLN A 109 8.345 35.995 -31.241 1.00 44.20 H new ATOM 0 HE22 GLN A 109 8.891 37.593 -31.761 1.00 44.20 H new ATOM 1698 N MET A 110 4.739 33.660 -28.266 1.00 5.21 N ATOM 1699 CA MET A 110 4.242 32.605 -27.391 1.00 30.20 C ATOM 1700 C MET A 110 4.413 31.235 -28.040 1.00 22.01 C ATOM 1701 O MET A 110 4.935 30.305 -27.423 1.00 10.32 O ATOM 1702 CB MET A 110 2.768 32.843 -27.056 1.00 63.12 C ATOM 1703 CG MET A 110 2.501 33.004 -25.568 1.00 64.34 C ATOM 1704 SD MET A 110 2.711 31.463 -24.655 1.00 15.43 S ATOM 1705 CE MET A 110 1.506 30.419 -25.471 1.00 42.15 C ATOM 0 H MET A 110 4.074 34.414 -28.439 1.00 5.21 H new ATOM 0 HA MET A 110 4.825 32.627 -26.470 1.00 30.20 H new ATOM 0 HB2 MET A 110 2.425 33.737 -27.577 1.00 63.12 H new ATOM 0 HB3 MET A 110 2.178 32.008 -27.434 1.00 63.12 H new ATOM 0 HG2 MET A 110 3.175 33.758 -25.161 1.00 64.34 H new ATOM 0 HG3 MET A 110 1.486 33.373 -25.423 1.00 64.34 H new ATOM 0 HE1 MET A 110 1.578 29.405 -25.078 1.00 42.15 H new ATOM 0 HE2 MET A 110 0.504 30.809 -25.289 1.00 42.15 H new ATOM 0 HE3 MET A 110 1.702 30.407 -26.543 1.00 42.15 H new ATOM 1715 N LEU A 111 3.971 31.117 -29.287 1.00 32.41 N ATOM 1716 CA LEU A 111 4.075 29.859 -30.020 1.00 10.54 C ATOM 1717 C LEU A 111 5.503 29.324 -29.982 1.00 53.00 C ATOM 1718 O LEU A 111 5.725 28.128 -29.788 1.00 14.45 O ATOM 1719 CB LEU A 111 3.629 30.053 -31.470 1.00 11.31 C ATOM 1720 CG LEU A 111 3.584 28.792 -32.333 1.00 22.44 C ATOM 1721 CD1 LEU A 111 2.146 28.359 -32.572 1.00 11.04 C ATOM 1722 CD2 LEU A 111 4.300 29.024 -33.655 1.00 52.43 C ATOM 0 H LEU A 111 3.537 31.876 -29.812 1.00 32.41 H new ATOM 0 HA LEU A 111 3.421 29.131 -29.540 1.00 10.54 H new ATOM 0 HB2 LEU A 111 2.636 30.502 -31.467 1.00 11.31 H new ATOM 0 HB3 LEU A 111 4.301 30.769 -31.943 1.00 11.31 H new ATOM 0 HG LEU A 111 4.098 27.992 -31.800 1.00 22.44 H new ATOM 0 HD11 LEU A 111 2.134 27.460 -33.188 1.00 11.04 H new ATOM 0 HD12 LEU A 111 1.665 28.150 -31.616 1.00 11.04 H new ATOM 0 HD13 LEU A 111 1.606 29.156 -33.083 1.00 11.04 H new ATOM 0 HD21 LEU A 111 4.258 28.116 -34.256 1.00 52.43 H new ATOM 0 HD22 LEU A 111 3.815 29.838 -34.193 1.00 52.43 H new ATOM 0 HD23 LEU A 111 5.341 29.285 -33.464 1.00 52.43 H new ATOM 1734 N THR A 112 6.470 30.218 -30.167 1.00 74.54 N ATOM 1735 CA THR A 112 7.876 29.836 -30.154 1.00 20.33 C ATOM 1736 C THR A 112 8.258 29.190 -28.827 1.00 35.23 C ATOM 1737 O THR A 112 8.770 28.071 -28.795 1.00 11.44 O ATOM 1738 CB THR A 112 8.790 31.050 -30.402 1.00 43.21 C ATOM 1739 OG1 THR A 112 8.506 31.624 -31.683 1.00 33.11 O ATOM 1740 CG2 THR A 112 10.256 30.647 -30.336 1.00 33.02 C ATOM 0 H THR A 112 6.304 31.212 -30.328 1.00 74.54 H new ATOM 0 HA THR A 112 8.015 29.115 -30.960 1.00 20.33 H new ATOM 0 HB THR A 112 8.596 31.787 -29.623 1.00 43.21 H new ATOM 0 HG1 THR A 112 9.090 32.396 -31.832 1.00 33.11 H new ATOM 0 HG21 THR A 112 10.882 31.521 -30.514 1.00 33.02 H new ATOM 0 HG22 THR A 112 10.477 30.238 -29.350 1.00 33.02 H new ATOM 0 HG23 THR A 112 10.461 29.893 -31.096 1.00 33.02 H new ATOM 1748 N ALA A 113 8.004 29.901 -27.733 1.00 53.01 N ATOM 1749 CA ALA A 113 8.318 29.395 -26.403 1.00 3.22 C ATOM 1750 C ALA A 113 7.558 28.106 -26.112 1.00 24.50 C ATOM 1751 O ALA A 113 8.150 27.100 -25.722 1.00 24.32 O ATOM 1752 CB ALA A 113 8.000 30.446 -25.350 1.00 4.43 C ATOM 0 H ALA A 113 7.582 30.829 -27.742 1.00 53.01 H new ATOM 0 HA ALA A 113 9.385 29.173 -26.369 1.00 3.22 H new ATOM 0 HB1 ALA A 113 8.239 30.055 -24.361 1.00 4.43 H new ATOM 0 HB2 ALA A 113 8.592 31.341 -25.539 1.00 4.43 H new ATOM 0 HB3 ALA A 113 6.940 30.696 -25.394 1.00 4.43 H new ATOM 1758 N ALA A 114 6.244 28.143 -26.304 1.00 32.32 N ATOM 1759 CA ALA A 114 5.403 26.976 -26.063 1.00 44.32 C ATOM 1760 C ALA A 114 5.935 25.754 -26.805 1.00 54.51 C ATOM 1761 O ALA A 114 5.849 24.630 -26.311 1.00 24.23 O ATOM 1762 CB ALA A 114 3.968 27.265 -26.478 1.00 3.21 C ATOM 0 H ALA A 114 5.738 28.968 -26.626 1.00 32.32 H new ATOM 0 HA ALA A 114 5.424 26.758 -24.995 1.00 44.32 H new ATOM 0 HB1 ALA A 114 3.351 26.385 -26.293 1.00 3.21 H new ATOM 0 HB2 ALA A 114 3.584 28.106 -25.900 1.00 3.21 H new ATOM 0 HB3 ALA A 114 3.939 27.511 -27.539 1.00 3.21 H new ATOM 1768 N HIS A 115 6.483 25.982 -27.995 1.00 15.13 N ATOM 1769 CA HIS A 115 7.028 24.899 -28.805 1.00 73.21 C ATOM 1770 C HIS A 115 8.148 24.176 -28.063 1.00 34.30 C ATOM 1771 O HIS A 115 8.069 22.971 -27.822 1.00 51.41 O ATOM 1772 CB HIS A 115 7.550 25.442 -30.136 1.00 34.13 C ATOM 1773 CG HIS A 115 7.842 24.375 -31.145 1.00 21.41 C ATOM 1774 ND1 HIS A 115 8.882 23.479 -31.013 1.00 44.13 N ATOM 1775 CD2 HIS A 115 7.222 24.061 -32.307 1.00 23.24 C ATOM 1776 CE1 HIS A 115 8.891 22.662 -32.051 1.00 71.12 C ATOM 1777 NE2 HIS A 115 7.893 22.993 -32.851 1.00 2.43 N ATOM 0 H HIS A 115 6.561 26.906 -28.419 1.00 15.13 H new ATOM 0 HA HIS A 115 6.227 24.186 -29.001 1.00 73.21 H new ATOM 0 HB2 HIS A 115 6.815 26.132 -30.551 1.00 34.13 H new ATOM 0 HB3 HIS A 115 8.458 26.016 -29.954 1.00 34.13 H new ATOM 0 HD2 HIS A 115 6.360 24.558 -32.728 1.00 23.24 H new ATOM 0 HE1 HIS A 115 9.595 21.860 -32.217 1.00 71.12 H new ATOM 0 HE2 HIS A 115 7.659 22.531 -33.730 1.00 2.43 H new ATOM 1785 N ALA A 116 9.189 24.919 -27.704 1.00 63.11 N ATOM 1786 CA ALA A 116 10.324 24.349 -26.989 1.00 21.24 C ATOM 1787 C ALA A 116 9.916 23.882 -25.595 1.00 44.22 C ATOM 1788 O ALA A 116 10.474 22.922 -25.063 1.00 23.30 O ATOM 1789 CB ALA A 116 11.454 25.363 -26.898 1.00 4.20 C ATOM 0 H ALA A 116 9.270 25.917 -27.897 1.00 63.11 H new ATOM 0 HA ALA A 116 10.674 23.481 -27.547 1.00 21.24 H new ATOM 0 HB1 ALA A 116 12.295 24.924 -26.361 1.00 4.20 H new ATOM 0 HB2 ALA A 116 11.772 25.645 -27.902 1.00 4.20 H new ATOM 0 HB3 ALA A 116 11.107 26.248 -26.365 1.00 4.20 H new ATOM 1795 N LEU A 117 8.941 24.568 -25.009 1.00 24.23 N ATOM 1796 CA LEU A 117 8.459 24.224 -23.676 1.00 20.24 C ATOM 1797 C LEU A 117 7.820 22.839 -23.668 1.00 54.04 C ATOM 1798 O LEU A 117 8.308 21.922 -23.009 1.00 4.21 O ATOM 1799 CB LEU A 117 7.450 25.267 -23.192 1.00 72.41 C ATOM 1800 CG LEU A 117 7.985 26.319 -22.221 1.00 4.30 C ATOM 1801 CD1 LEU A 117 8.283 25.694 -20.867 1.00 0.10 C ATOM 1802 CD2 LEU A 117 9.231 26.984 -22.789 1.00 11.22 C ATOM 0 H LEU A 117 8.469 25.365 -25.436 1.00 24.23 H new ATOM 0 HA LEU A 117 9.314 24.213 -22.999 1.00 20.24 H new ATOM 0 HB2 LEU A 117 7.042 25.780 -24.063 1.00 72.41 H new ATOM 0 HB3 LEU A 117 6.622 24.746 -22.712 1.00 72.41 H new ATOM 0 HG LEU A 117 7.219 27.083 -22.085 1.00 4.30 H new ATOM 0 HD11 LEU A 117 8.663 26.458 -20.189 1.00 0.10 H new ATOM 0 HD12 LEU A 117 7.369 25.265 -20.455 1.00 0.10 H new ATOM 0 HD13 LEU A 117 9.031 24.910 -20.985 1.00 0.10 H new ATOM 0 HD21 LEU A 117 9.598 27.730 -22.085 1.00 11.22 H new ATOM 0 HD22 LEU A 117 10.002 26.231 -22.955 1.00 11.22 H new ATOM 0 HD23 LEU A 117 8.986 27.467 -23.735 1.00 11.22 H new ATOM 1814 N ALA A 118 6.725 22.695 -24.408 1.00 70.52 N ATOM 1815 CA ALA A 118 6.021 21.421 -24.490 1.00 62.34 C ATOM 1816 C ALA A 118 6.976 20.288 -24.851 1.00 4.03 C ATOM 1817 O ALA A 118 6.971 19.233 -24.217 1.00 24.24 O ATOM 1818 CB ALA A 118 4.893 21.506 -25.508 1.00 31.14 C ATOM 0 H ALA A 118 6.307 23.445 -24.959 1.00 70.52 H new ATOM 0 HA ALA A 118 5.596 21.205 -23.510 1.00 62.34 H new ATOM 0 HB1 ALA A 118 4.376 20.548 -25.559 1.00 31.14 H new ATOM 0 HB2 ALA A 118 4.190 22.282 -25.208 1.00 31.14 H new ATOM 0 HB3 ALA A 118 5.305 21.749 -26.488 1.00 31.14 H new ATOM 1824 N VAL A 119 7.795 20.513 -25.873 1.00 42.24 N ATOM 1825 CA VAL A 119 8.757 19.511 -26.318 1.00 13.41 C ATOM 1826 C VAL A 119 9.780 19.210 -25.228 1.00 75.34 C ATOM 1827 O VAL A 119 10.224 18.072 -25.078 1.00 22.40 O ATOM 1828 CB VAL A 119 9.497 19.969 -27.589 1.00 73.30 C ATOM 1829 CG1 VAL A 119 10.520 18.927 -28.016 1.00 33.05 C ATOM 1830 CG2 VAL A 119 8.507 20.246 -28.710 1.00 50.34 C ATOM 0 H VAL A 119 7.812 21.381 -26.409 1.00 42.24 H new ATOM 0 HA VAL A 119 8.192 18.606 -26.542 1.00 13.41 H new ATOM 0 HB VAL A 119 10.028 20.895 -27.366 1.00 73.30 H new ATOM 0 HG11 VAL A 119 11.033 19.268 -28.915 1.00 33.05 H new ATOM 0 HG12 VAL A 119 11.247 18.782 -27.217 1.00 33.05 H new ATOM 0 HG13 VAL A 119 10.014 17.984 -28.222 1.00 33.05 H new ATOM 0 HG21 VAL A 119 9.047 20.569 -29.600 1.00 50.34 H new ATOM 0 HG22 VAL A 119 7.947 19.338 -28.934 1.00 50.34 H new ATOM 0 HG23 VAL A 119 7.817 21.030 -28.400 1.00 50.34 H new ATOM 1840 N ASP A 120 10.148 20.236 -24.470 1.00 42.44 N ATOM 1841 CA ASP A 120 11.118 20.082 -23.392 1.00 61.44 C ATOM 1842 C ASP A 120 10.596 19.126 -22.325 1.00 33.44 C ATOM 1843 O ASP A 120 11.240 18.129 -22.001 1.00 63.52 O ATOM 1844 CB ASP A 120 11.438 21.440 -22.766 1.00 72.12 C ATOM 1845 CG ASP A 120 12.671 22.081 -23.372 1.00 53.04 C ATOM 1846 OD1 ASP A 120 12.904 21.890 -24.584 1.00 64.43 O ATOM 1847 OD2 ASP A 120 13.401 22.775 -22.635 1.00 63.01 O ATOM 0 H ASP A 120 9.789 21.184 -24.582 1.00 42.44 H new ATOM 0 HA ASP A 120 12.031 19.663 -23.815 1.00 61.44 H new ATOM 0 HB2 ASP A 120 10.585 22.106 -22.895 1.00 72.12 H new ATOM 0 HB3 ASP A 120 11.586 21.316 -21.693 1.00 72.12 H new ATOM 1852 N ALA A 121 9.424 19.438 -21.780 1.00 62.21 N ATOM 1853 CA ALA A 121 8.815 18.606 -20.750 1.00 11.34 C ATOM 1854 C ALA A 121 8.749 17.148 -21.189 1.00 70.41 C ATOM 1855 O ALA A 121 8.923 16.236 -20.380 1.00 74.10 O ATOM 1856 CB ALA A 121 7.424 19.121 -20.410 1.00 72.25 C ATOM 0 H ALA A 121 8.878 20.261 -22.035 1.00 62.21 H new ATOM 0 HA ALA A 121 9.439 18.661 -19.858 1.00 11.34 H new ATOM 0 HB1 ALA A 121 6.981 18.490 -19.639 1.00 72.25 H new ATOM 0 HB2 ALA A 121 7.495 20.145 -20.044 1.00 72.25 H new ATOM 0 HB3 ALA A 121 6.799 19.097 -21.303 1.00 72.25 H new ATOM 1862 N LYS A 122 8.496 16.933 -22.476 1.00 2.12 N ATOM 1863 CA LYS A 122 8.408 15.585 -23.024 1.00 75.02 C ATOM 1864 C LYS A 122 9.792 14.958 -23.154 1.00 1.13 C ATOM 1865 O LYS A 122 10.024 13.842 -22.691 1.00 73.15 O ATOM 1866 CB LYS A 122 7.719 15.612 -24.390 1.00 54.35 C ATOM 1867 CG LYS A 122 7.533 14.236 -25.006 1.00 14.15 C ATOM 1868 CD LYS A 122 8.736 13.831 -25.840 1.00 61.00 C ATOM 1869 CE LYS A 122 8.380 12.740 -26.839 1.00 2.33 C ATOM 1870 NZ LYS A 122 8.195 13.285 -28.212 1.00 55.12 N ATOM 0 H LYS A 122 8.348 17.676 -23.159 1.00 2.12 H new ATOM 0 HA LYS A 122 7.817 14.979 -22.337 1.00 75.02 H new ATOM 0 HB2 LYS A 122 6.744 16.089 -24.286 1.00 54.35 H new ATOM 0 HB3 LYS A 122 8.305 16.229 -25.071 1.00 54.35 H new ATOM 0 HG2 LYS A 122 7.373 13.502 -24.217 1.00 14.15 H new ATOM 0 HG3 LYS A 122 6.639 14.234 -25.630 1.00 14.15 H new ATOM 0 HD2 LYS A 122 9.121 14.701 -26.372 1.00 61.00 H new ATOM 0 HD3 LYS A 122 9.533 13.480 -25.185 1.00 61.00 H new ATOM 0 HE2 LYS A 122 9.168 11.987 -26.850 1.00 2.33 H new ATOM 0 HE3 LYS A 122 7.465 12.240 -26.520 1.00 2.33 H new ATOM 0 HZ1 LYS A 122 7.954 12.511 -28.863 1.00 55.12 H new ATOM 0 HZ2 LYS A 122 7.426 13.985 -28.207 1.00 55.12 H new ATOM 0 HZ3 LYS A 122 9.076 13.740 -28.527 1.00 55.12 H new ATOM 1884 N ASN A 123 10.709 15.685 -23.784 1.00 61.21 N ATOM 1885 CA ASN A 123 12.071 15.200 -23.973 1.00 64.41 C ATOM 1886 C ASN A 123 12.687 14.775 -22.643 1.00 41.23 C ATOM 1887 O ASN A 123 13.554 13.901 -22.599 1.00 11.13 O ATOM 1888 CB ASN A 123 12.934 16.282 -24.625 1.00 65.54 C ATOM 1889 CG ASN A 123 14.383 15.856 -24.770 1.00 50.50 C ATOM 1890 OD1 ASN A 123 14.682 14.826 -25.373 1.00 73.41 O ATOM 1891 ND2 ASN A 123 15.291 16.651 -24.215 1.00 52.24 N ATOM 0 H ASN A 123 10.534 16.612 -24.172 1.00 61.21 H new ATOM 0 HA ASN A 123 12.033 14.331 -24.629 1.00 64.41 H new ATOM 0 HB2 ASN A 123 12.529 16.523 -25.608 1.00 65.54 H new ATOM 0 HB3 ASN A 123 12.884 17.192 -24.027 1.00 65.54 H new ATOM 0 HD21 ASN A 123 16.282 16.417 -24.280 1.00 52.24 H new ATOM 0 HD22 ASN A 123 14.998 17.496 -23.724 1.00 52.24 H new ATOM 1898 N LEU A 124 12.233 15.399 -21.562 1.00 5.11 N ATOM 1899 CA LEU A 124 12.739 15.086 -20.230 1.00 13.24 C ATOM 1900 C LEU A 124 12.664 13.587 -19.957 1.00 43.22 C ATOM 1901 O LEU A 124 13.676 12.947 -19.666 1.00 14.34 O ATOM 1902 CB LEU A 124 11.943 15.849 -19.169 1.00 2.02 C ATOM 1903 CG LEU A 124 12.743 16.818 -18.297 1.00 64.43 C ATOM 1904 CD1 LEU A 124 11.861 17.410 -17.209 1.00 44.03 C ATOM 1905 CD2 LEU A 124 13.948 16.116 -17.687 1.00 34.51 C ATOM 0 H LEU A 124 11.516 16.124 -21.581 1.00 5.11 H new ATOM 0 HA LEU A 124 13.784 15.393 -20.184 1.00 13.24 H new ATOM 0 HB2 LEU A 124 11.153 16.409 -19.669 1.00 2.02 H new ATOM 0 HB3 LEU A 124 11.456 15.123 -18.518 1.00 2.02 H new ATOM 0 HG LEU A 124 13.102 17.632 -18.927 1.00 64.43 H new ATOM 0 HD11 LEU A 124 12.447 18.097 -16.599 1.00 44.03 H new ATOM 0 HD12 LEU A 124 11.031 17.949 -17.666 1.00 44.03 H new ATOM 0 HD13 LEU A 124 11.471 16.609 -16.581 1.00 44.03 H new ATOM 0 HD21 LEU A 124 14.506 16.820 -17.070 1.00 34.51 H new ATOM 0 HD22 LEU A 124 13.610 15.282 -17.071 1.00 34.51 H new ATOM 0 HD23 LEU A 124 14.592 15.742 -18.483 1.00 34.51 H new ATOM 1917 N LEU A 125 11.461 13.032 -20.056 1.00 3.41 N ATOM 1918 CA LEU A 125 11.255 11.607 -19.822 1.00 54.35 C ATOM 1919 C LEU A 125 11.824 10.779 -20.970 1.00 4.32 C ATOM 1920 O LEU A 125 12.349 9.686 -20.758 1.00 71.35 O ATOM 1921 CB LEU A 125 9.764 11.309 -19.654 1.00 73.05 C ATOM 1922 CG LEU A 125 9.397 10.324 -18.543 1.00 43.44 C ATOM 1923 CD1 LEU A 125 8.475 10.983 -17.529 1.00 73.15 C ATOM 1924 CD2 LEU A 125 8.748 9.078 -19.128 1.00 12.42 C ATOM 0 H LEU A 125 10.614 13.547 -20.297 1.00 3.41 H new ATOM 0 HA LEU A 125 11.780 11.334 -18.906 1.00 54.35 H new ATOM 0 HB2 LEU A 125 9.245 12.249 -19.465 1.00 73.05 H new ATOM 0 HB3 LEU A 125 9.383 10.919 -20.598 1.00 73.05 H new ATOM 0 HG LEU A 125 10.312 10.026 -18.031 1.00 43.44 H new ATOM 0 HD11 LEU A 125 8.224 10.267 -16.746 1.00 73.15 H new ATOM 0 HD12 LEU A 125 8.977 11.844 -17.087 1.00 73.15 H new ATOM 0 HD13 LEU A 125 7.562 11.311 -18.026 1.00 73.15 H new ATOM 0 HD21 LEU A 125 8.494 8.388 -18.323 1.00 12.42 H new ATOM 0 HD22 LEU A 125 7.842 9.358 -19.666 1.00 12.42 H new ATOM 0 HD23 LEU A 125 9.443 8.594 -19.814 1.00 12.42 H new ATOM 1936 N ASP A 126 11.720 11.309 -22.184 1.00 35.15 N ATOM 1937 CA ASP A 126 12.227 10.620 -23.365 1.00 4.44 C ATOM 1938 C ASP A 126 13.718 10.329 -23.225 1.00 22.25 C ATOM 1939 O ASP A 126 14.179 9.232 -23.540 1.00 62.21 O ATOM 1940 CB ASP A 126 11.975 11.459 -24.618 1.00 53.42 C ATOM 1941 CG ASP A 126 10.991 10.802 -25.566 1.00 13.20 C ATOM 1942 OD1 ASP A 126 9.917 10.368 -25.099 1.00 23.12 O ATOM 1943 OD2 ASP A 126 11.294 10.721 -26.775 1.00 3.41 O ATOM 0 H ASP A 126 11.289 12.213 -22.376 1.00 35.15 H new ATOM 0 HA ASP A 126 11.697 9.672 -23.459 1.00 4.44 H new ATOM 0 HB2 ASP A 126 11.595 12.438 -24.326 1.00 53.42 H new ATOM 0 HB3 ASP A 126 12.919 11.625 -25.137 1.00 53.42 H new ATOM 1948 N VAL A 127 14.468 11.319 -22.750 1.00 73.12 N ATOM 1949 CA VAL A 127 15.907 11.169 -22.568 1.00 74.13 C ATOM 1950 C VAL A 127 16.220 10.120 -21.507 1.00 50.12 C ATOM 1951 O VAL A 127 16.871 9.113 -21.789 1.00 13.35 O ATOM 1952 CB VAL A 127 16.563 12.503 -22.166 1.00 24.31 C ATOM 1953 CG1 VAL A 127 18.046 12.306 -21.890 1.00 44.04 C ATOM 1954 CG2 VAL A 127 16.348 13.550 -23.248 1.00 21.00 C ATOM 0 H VAL A 127 14.103 12.233 -22.484 1.00 73.12 H new ATOM 0 HA VAL A 127 16.316 10.846 -23.525 1.00 74.13 H new ATOM 0 HB VAL A 127 16.091 12.859 -21.250 1.00 24.31 H new ATOM 0 HG11 VAL A 127 18.493 13.259 -21.607 1.00 44.04 H new ATOM 0 HG12 VAL A 127 18.173 11.590 -21.078 1.00 44.04 H new ATOM 0 HG13 VAL A 127 18.536 11.927 -22.787 1.00 44.04 H new ATOM 0 HG21 VAL A 127 16.818 14.486 -22.947 1.00 21.00 H new ATOM 0 HG22 VAL A 127 16.792 13.205 -24.182 1.00 21.00 H new ATOM 0 HG23 VAL A 127 15.280 13.710 -23.392 1.00 21.00 H new ATOM 1964 N ILE A 128 15.753 10.363 -20.287 1.00 74.33 N ATOM 1965 CA ILE A 128 15.982 9.438 -19.184 1.00 52.01 C ATOM 1966 C ILE A 128 15.480 8.039 -19.526 1.00 44.12 C ATOM 1967 O ILE A 128 15.944 7.047 -18.963 1.00 43.43 O ATOM 1968 CB ILE A 128 15.290 9.918 -17.894 1.00 62.14 C ATOM 1969 CG1 ILE A 128 13.770 9.810 -18.034 1.00 64.51 C ATOM 1970 CG2 ILE A 128 15.698 11.349 -17.576 1.00 34.42 C ATOM 1971 CD1 ILE A 128 13.015 10.320 -16.827 1.00 73.02 C ATOM 0 H ILE A 128 15.214 11.192 -20.037 1.00 74.33 H new ATOM 0 HA ILE A 128 17.059 9.405 -19.019 1.00 52.01 H new ATOM 0 HB ILE A 128 15.606 9.279 -17.070 1.00 62.14 H new ATOM 0 HG12 ILE A 128 13.453 10.370 -18.914 1.00 64.51 H new ATOM 0 HG13 ILE A 128 13.502 8.768 -18.206 1.00 64.51 H new ATOM 0 HG21 ILE A 128 15.201 11.674 -16.662 1.00 34.42 H new ATOM 0 HG22 ILE A 128 16.778 11.397 -17.439 1.00 34.42 H new ATOM 0 HG23 ILE A 128 15.407 12.002 -18.399 1.00 34.42 H new ATOM 0 HD11 ILE A 128 11.944 10.213 -16.996 1.00 73.02 H new ATOM 0 HD12 ILE A 128 13.303 9.744 -15.948 1.00 73.02 H new ATOM 0 HD13 ILE A 128 13.254 11.371 -16.666 1.00 73.02 H new ATOM 1983 N ASP A 129 14.532 7.967 -20.453 1.00 52.14 N ATOM 1984 CA ASP A 129 13.969 6.689 -20.874 1.00 12.14 C ATOM 1985 C ASP A 129 15.066 5.740 -21.345 1.00 45.51 C ATOM 1986 O ASP A 129 15.039 4.547 -21.046 1.00 12.25 O ATOM 1987 CB ASP A 129 12.946 6.901 -21.991 1.00 31.22 C ATOM 1988 CG ASP A 129 11.581 6.342 -21.640 1.00 21.14 C ATOM 1989 OD1 ASP A 129 10.850 7.001 -20.871 1.00 34.32 O ATOM 1990 OD2 ASP A 129 11.244 5.246 -22.134 1.00 50.23 O ATOM 0 H ASP A 129 14.137 8.779 -20.928 1.00 52.14 H new ATOM 0 HA ASP A 129 13.470 6.240 -20.015 1.00 12.14 H new ATOM 0 HB2 ASP A 129 12.856 7.967 -22.200 1.00 31.22 H new ATOM 0 HB3 ASP A 129 13.306 6.427 -22.904 1.00 31.22 H new ATOM 1995 N GLN A 130 16.030 6.280 -22.085 1.00 22.23 N ATOM 1996 CA GLN A 130 17.136 5.480 -22.599 1.00 12.30 C ATOM 1997 C GLN A 130 17.897 4.808 -21.461 1.00 74.31 C ATOM 1998 O GLN A 130 18.461 3.728 -21.632 1.00 63.21 O ATOM 1999 CB GLN A 130 18.087 6.354 -23.418 1.00 3.31 C ATOM 2000 CG GLN A 130 17.648 6.545 -24.861 1.00 1.33 C ATOM 2001 CD GLN A 130 17.921 5.327 -25.720 1.00 21.50 C ATOM 2002 OE1 GLN A 130 18.949 4.666 -25.572 1.00 24.35 O ATOM 2003 NE2 GLN A 130 16.999 5.022 -26.626 1.00 21.13 N ATOM 0 H GLN A 130 16.067 7.267 -22.342 1.00 22.23 H new ATOM 0 HA GLN A 130 16.722 4.704 -23.242 1.00 12.30 H new ATOM 0 HB2 GLN A 130 18.172 7.330 -22.941 1.00 3.31 H new ATOM 0 HB3 GLN A 130 19.080 5.906 -23.406 1.00 3.31 H new ATOM 0 HG2 GLN A 130 16.582 6.771 -24.886 1.00 1.33 H new ATOM 0 HG3 GLN A 130 18.166 7.406 -25.283 1.00 1.33 H new ATOM 0 HE21 GLN A 130 16.161 5.597 -26.715 1.00 21.13 H new ATOM 0 HE22 GLN A 130 17.128 4.212 -27.233 1.00 21.13 H new ATOM 2012 N ALA A 131 17.907 5.454 -20.300 1.00 23.12 N ATOM 2013 CA ALA A 131 18.597 4.917 -19.133 1.00 43.44 C ATOM 2014 C ALA A 131 17.847 3.724 -18.552 1.00 53.02 C ATOM 2015 O ALA A 131 18.454 2.725 -18.167 1.00 32.23 O ATOM 2016 CB ALA A 131 18.770 6.000 -18.078 1.00 33.20 C ATOM 0 H ALA A 131 17.445 6.350 -20.142 1.00 23.12 H new ATOM 0 HA ALA A 131 19.582 4.573 -19.450 1.00 43.44 H new ATOM 0 HB1 ALA A 131 19.286 5.585 -17.212 1.00 33.20 H new ATOM 0 HB2 ALA A 131 19.356 6.821 -18.492 1.00 33.20 H new ATOM 0 HB3 ALA A 131 17.791 6.371 -17.773 1.00 33.20 H new ATOM 2022 N ARG A 132 16.524 3.835 -18.492 1.00 12.43 N ATOM 2023 CA ARG A 132 15.691 2.766 -17.955 1.00 72.25 C ATOM 2024 C ARG A 132 15.958 1.452 -18.684 1.00 35.21 C ATOM 2025 O ARG A 132 16.128 0.405 -18.057 1.00 0.41 O ATOM 2026 CB ARG A 132 14.211 3.135 -18.073 1.00 51.22 C ATOM 2027 CG ARG A 132 13.387 2.745 -16.857 1.00 2.53 C ATOM 2028 CD ARG A 132 12.039 3.449 -16.848 1.00 61.01 C ATOM 2029 NE ARG A 132 10.934 2.512 -16.666 1.00 72.12 N ATOM 2030 CZ ARG A 132 10.511 1.681 -17.613 1.00 25.04 C ATOM 2031 NH1 ARG A 132 11.099 1.671 -18.801 1.00 63.30 N ATOM 2032 NH2 ARG A 132 9.499 0.858 -17.371 1.00 64.40 N ATOM 0 H ARG A 132 16.006 4.655 -18.809 1.00 12.43 H new ATOM 0 HA ARG A 132 15.943 2.637 -16.902 1.00 72.25 H new ATOM 0 HB2 ARG A 132 14.125 4.210 -18.230 1.00 51.22 H new ATOM 0 HB3 ARG A 132 13.793 2.650 -18.955 1.00 51.22 H new ATOM 0 HG2 ARG A 132 13.235 1.666 -16.850 1.00 2.53 H new ATOM 0 HG3 ARG A 132 13.936 2.995 -15.949 1.00 2.53 H new ATOM 0 HD2 ARG A 132 12.022 4.189 -16.048 1.00 61.01 H new ATOM 0 HD3 ARG A 132 11.906 3.989 -17.785 1.00 61.01 H new ATOM 0 HE ARG A 132 10.461 2.494 -15.763 1.00 72.12 H new ATOM 0 HH11 ARG A 132 11.878 2.302 -18.990 1.00 63.30 H new ATOM 0 HH12 ARG A 132 10.773 1.032 -19.526 1.00 63.30 H new ATOM 0 HH21 ARG A 132 9.045 0.863 -16.458 1.00 64.40 H new ATOM 0 HH22 ARG A 132 9.175 0.221 -18.098 1.00 64.40 H new ATOM 2046 N LEU A 133 15.992 1.513 -20.010 1.00 53.35 N ATOM 2047 CA LEU A 133 16.237 0.328 -20.825 1.00 43.32 C ATOM 2048 C LEU A 133 17.693 -0.115 -20.717 1.00 34.24 C ATOM 2049 O LEU A 133 18.003 -1.300 -20.840 1.00 70.20 O ATOM 2050 CB LEU A 133 15.885 0.609 -22.287 1.00 63.42 C ATOM 2051 CG LEU A 133 14.453 0.278 -22.708 1.00 50.01 C ATOM 2052 CD1 LEU A 133 13.548 1.484 -22.514 1.00 14.33 C ATOM 2053 CD2 LEU A 133 14.417 -0.190 -24.156 1.00 21.45 C ATOM 0 H LEU A 133 15.853 2.371 -20.544 1.00 53.35 H new ATOM 0 HA LEU A 133 15.603 -0.477 -20.453 1.00 43.32 H new ATOM 0 HB2 LEU A 133 16.066 1.665 -22.487 1.00 63.42 H new ATOM 0 HB3 LEU A 133 16.569 0.043 -22.920 1.00 63.42 H new ATOM 0 HG LEU A 133 14.087 -0.531 -22.076 1.00 50.01 H new ATOM 0 HD11 LEU A 133 12.533 1.230 -22.819 1.00 14.33 H new ATOM 0 HD12 LEU A 133 13.549 1.775 -21.463 1.00 14.33 H new ATOM 0 HD13 LEU A 133 13.912 2.313 -23.120 1.00 14.33 H new ATOM 0 HD21 LEU A 133 13.390 -0.421 -24.438 1.00 21.45 H new ATOM 0 HD22 LEU A 133 14.802 0.598 -24.803 1.00 21.45 H new ATOM 0 HD23 LEU A 133 15.033 -1.083 -24.265 1.00 21.45 H new ATOM 2065 N LYS A 134 18.582 0.844 -20.483 1.00 21.22 N ATOM 2066 CA LYS A 134 20.005 0.553 -20.354 1.00 0.35 C ATOM 2067 C LYS A 134 20.252 -0.482 -19.261 1.00 71.20 C ATOM 2068 O LYS A 134 21.069 -1.388 -19.425 1.00 10.34 O ATOM 2069 CB LYS A 134 20.782 1.834 -20.042 1.00 12.44 C ATOM 2070 CG LYS A 134 22.249 1.765 -20.428 1.00 2.32 C ATOM 2071 CD LYS A 134 23.153 2.050 -19.240 1.00 35.45 C ATOM 2072 CE LYS A 134 23.553 3.516 -19.182 1.00 65.43 C ATOM 2073 NZ LYS A 134 24.934 3.693 -18.653 1.00 61.22 N ATOM 0 H LYS A 134 18.342 1.830 -20.379 1.00 21.22 H new ATOM 0 HA LYS A 134 20.354 0.145 -21.302 1.00 0.35 H new ATOM 0 HB2 LYS A 134 20.316 2.668 -20.566 1.00 12.44 H new ATOM 0 HB3 LYS A 134 20.705 2.045 -18.975 1.00 12.44 H new ATOM 0 HG2 LYS A 134 22.474 0.777 -20.829 1.00 2.32 H new ATOM 0 HG3 LYS A 134 22.452 2.485 -21.221 1.00 2.32 H new ATOM 0 HD2 LYS A 134 22.641 1.775 -18.318 1.00 35.45 H new ATOM 0 HD3 LYS A 134 24.047 1.430 -19.305 1.00 35.45 H new ATOM 0 HE2 LYS A 134 23.488 3.950 -20.180 1.00 65.43 H new ATOM 0 HE3 LYS A 134 22.850 4.060 -18.551 1.00 65.43 H new ATOM 0 HZ1 LYS A 134 24.924 4.393 -17.884 1.00 61.22 H new ATOM 0 HZ2 LYS A 134 25.286 2.784 -18.289 1.00 61.22 H new ATOM 0 HZ3 LYS A 134 25.558 4.025 -19.416 1.00 61.22 H new ATOM 2087 N MET A 135 19.539 -0.343 -18.148 1.00 4.41 N ATOM 2088 CA MET A 135 19.680 -1.268 -17.030 1.00 30.31 C ATOM 2089 C MET A 135 18.867 -2.537 -17.269 1.00 1.32 C ATOM 2090 O MET A 135 19.393 -3.647 -17.183 1.00 53.02 O ATOM 2091 CB MET A 135 19.234 -0.600 -15.728 1.00 20.43 C ATOM 2092 CG MET A 135 19.731 -1.311 -14.479 1.00 51.12 C ATOM 2093 SD MET A 135 19.056 -0.606 -12.963 1.00 55.44 S ATOM 2094 CE MET A 135 17.310 -0.945 -13.180 1.00 43.03 C ATOM 0 H MET A 135 18.858 0.401 -17.997 1.00 4.41 H new ATOM 0 HA MET A 135 20.732 -1.542 -16.947 1.00 30.31 H new ATOM 0 HB2 MET A 135 19.591 0.430 -15.717 1.00 20.43 H new ATOM 0 HB3 MET A 135 18.145 -0.560 -15.704 1.00 20.43 H new ATOM 0 HG2 MET A 135 19.463 -2.366 -14.535 1.00 51.12 H new ATOM 0 HG3 MET A 135 20.819 -1.260 -14.446 1.00 51.12 H new ATOM 0 HE1 MET A 135 16.893 -1.321 -12.246 1.00 43.03 H new ATOM 0 HE2 MET A 135 16.794 -0.028 -13.464 1.00 43.03 H new ATOM 0 HE3 MET A 135 17.179 -1.692 -13.962 1.00 43.03 H new ATOM 2104 N ILE A 136 17.584 -2.364 -17.568 1.00 30.22 N ATOM 2105 CA ILE A 136 16.700 -3.496 -17.819 1.00 50.54 C ATOM 2106 C ILE A 136 17.290 -4.432 -18.868 1.00 45.12 C ATOM 2107 O ILE A 136 17.526 -5.610 -18.601 1.00 71.20 O ATOM 2108 CB ILE A 136 15.309 -3.030 -18.289 1.00 0.45 C ATOM 2109 CG1 ILE A 136 14.674 -2.113 -17.241 1.00 1.21 C ATOM 2110 CG2 ILE A 136 14.414 -4.229 -18.563 1.00 53.54 C ATOM 2111 CD1 ILE A 136 13.536 -1.275 -17.781 1.00 62.21 C ATOM 0 H ILE A 136 17.134 -1.452 -17.642 1.00 30.22 H new ATOM 0 HA ILE A 136 16.596 -4.031 -16.875 1.00 50.54 H new ATOM 0 HB ILE A 136 15.424 -2.467 -19.216 1.00 0.45 H new ATOM 0 HG12 ILE A 136 14.307 -2.720 -16.414 1.00 1.21 H new ATOM 0 HG13 ILE A 136 15.440 -1.452 -16.836 1.00 1.21 H new ATOM 0 HG21 ILE A 136 13.435 -3.884 -18.894 1.00 53.54 H new ATOM 0 HG22 ILE A 136 14.863 -4.848 -19.340 1.00 53.54 H new ATOM 0 HG23 ILE A 136 14.303 -4.816 -17.651 1.00 53.54 H new ATOM 0 HD11 ILE A 136 13.134 -0.650 -16.984 1.00 62.21 H new ATOM 0 HD12 ILE A 136 13.902 -0.642 -18.589 1.00 62.21 H new ATOM 0 HD13 ILE A 136 12.751 -1.929 -18.160 1.00 62.21 H new ATOM 2123 N SER A 137 17.529 -3.899 -20.062 1.00 43.12 N ATOM 2124 CA SER A 137 18.091 -4.687 -21.153 1.00 30.33 C ATOM 2125 C SER A 137 19.594 -4.876 -20.969 1.00 52.50 C ATOM 2126 O SER A 137 20.397 -4.244 -21.655 1.00 11.10 O ATOM 2127 CB SER A 137 17.811 -4.011 -22.496 1.00 73.01 C ATOM 2128 OG SER A 137 18.079 -4.890 -23.575 1.00 40.42 O ATOM 0 H SER A 137 17.342 -2.925 -20.299 1.00 43.12 H new ATOM 0 HA SER A 137 17.615 -5.668 -21.142 1.00 30.33 H new ATOM 0 HB2 SER A 137 16.770 -3.689 -22.535 1.00 73.01 H new ATOM 0 HB3 SER A 137 18.425 -3.116 -22.591 1.00 73.01 H new ATOM 0 HG SER A 137 17.891 -4.435 -24.422 1.00 40.42 H new ATOM 2272 N GLU A 162 2.185 10.647 -30.850 1.00 31.02 N ATOM 2273 CA GLU A 162 1.023 11.457 -30.501 1.00 25.55 C ATOM 2274 C GLU A 162 1.422 12.913 -30.281 1.00 12.14 C ATOM 2275 O GLU A 162 0.822 13.826 -30.851 1.00 22.43 O ATOM 2276 CB GLU A 162 0.349 10.905 -29.242 1.00 44.24 C ATOM 2277 CG GLU A 162 -1.127 10.598 -29.428 1.00 60.40 C ATOM 2278 CD GLU A 162 -1.936 10.839 -28.168 1.00 70.24 C ATOM 2279 OE1 GLU A 162 -2.154 12.018 -27.821 1.00 4.53 O ATOM 2280 OE2 GLU A 162 -2.351 9.849 -27.530 1.00 71.15 O ATOM 0 HA GLU A 162 0.318 11.413 -31.331 1.00 25.55 H new ATOM 0 HB2 GLU A 162 0.865 9.996 -28.933 1.00 44.24 H new ATOM 0 HB3 GLU A 162 0.462 11.627 -28.433 1.00 44.24 H new ATOM 0 HG2 GLU A 162 -1.524 11.215 -30.234 1.00 60.40 H new ATOM 0 HG3 GLU A 162 -1.242 9.559 -29.736 1.00 60.40 H new ATOM 2287 N LEU A 163 2.437 13.124 -29.450 1.00 31.51 N ATOM 2288 CA LEU A 163 2.916 14.469 -29.153 1.00 63.00 C ATOM 2289 C LEU A 163 3.559 15.102 -30.383 1.00 72.22 C ATOM 2290 O LEU A 163 3.423 16.303 -30.618 1.00 63.31 O ATOM 2291 CB LEU A 163 3.922 14.431 -28.001 1.00 60.30 C ATOM 2292 CG LEU A 163 3.431 13.790 -26.703 1.00 21.45 C ATOM 2293 CD1 LEU A 163 4.233 12.536 -26.390 1.00 22.04 C ATOM 2294 CD2 LEU A 163 3.518 14.782 -25.552 1.00 20.31 C ATOM 0 H LEU A 163 2.944 12.380 -28.970 1.00 31.51 H new ATOM 0 HA LEU A 163 2.060 15.076 -28.860 1.00 63.00 H new ATOM 0 HB2 LEU A 163 4.808 13.892 -28.336 1.00 60.30 H new ATOM 0 HB3 LEU A 163 4.234 15.453 -27.783 1.00 60.30 H new ATOM 0 HG LEU A 163 2.387 13.506 -26.833 1.00 21.45 H new ATOM 0 HD11 LEU A 163 3.869 12.094 -25.463 1.00 22.04 H new ATOM 0 HD12 LEU A 163 4.119 11.819 -27.203 1.00 22.04 H new ATOM 0 HD13 LEU A 163 5.286 12.796 -26.280 1.00 22.04 H new ATOM 0 HD21 LEU A 163 3.164 14.309 -24.636 1.00 20.31 H new ATOM 0 HD22 LEU A 163 4.553 15.098 -25.421 1.00 20.31 H new ATOM 0 HD23 LEU A 163 2.899 15.651 -25.773 1.00 20.31 H new ATOM 2306 N ASP A 164 4.256 14.286 -31.166 1.00 23.13 N ATOM 2307 CA ASP A 164 4.917 14.765 -32.374 1.00 61.12 C ATOM 2308 C ASP A 164 3.904 15.352 -33.351 1.00 55.15 C ATOM 2309 O ASP A 164 3.991 16.522 -33.724 1.00 4.22 O ATOM 2310 CB ASP A 164 5.690 13.627 -33.044 1.00 11.43 C ATOM 2311 CG ASP A 164 6.869 13.161 -32.213 1.00 32.24 C ATOM 2312 OD1 ASP A 164 6.740 13.118 -30.971 1.00 3.51 O ATOM 2313 OD2 ASP A 164 7.920 12.837 -32.804 1.00 12.01 O ATOM 0 H ASP A 164 4.378 13.289 -30.986 1.00 23.13 H new ATOM 0 HA ASP A 164 5.617 15.550 -32.088 1.00 61.12 H new ATOM 0 HB2 ASP A 164 5.017 12.787 -33.218 1.00 11.43 H new ATOM 0 HB3 ASP A 164 6.045 13.958 -34.020 1.00 11.43 H new ATOM 2318 N ARG A 165 2.943 14.532 -33.764 1.00 32.53 N ATOM 2319 CA ARG A 165 1.914 14.969 -34.700 1.00 30.14 C ATOM 2320 C ARG A 165 1.248 16.253 -34.214 1.00 33.10 C ATOM 2321 O ARG A 165 1.168 17.239 -34.947 1.00 54.34 O ATOM 2322 CB ARG A 165 0.862 13.873 -34.883 1.00 11.44 C ATOM 2323 CG ARG A 165 0.344 13.758 -36.307 1.00 10.31 C ATOM 2324 CD ARG A 165 -1.056 14.338 -36.439 1.00 64.03 C ATOM 2325 NE ARG A 165 -2.084 13.303 -36.385 1.00 33.31 N ATOM 2326 CZ ARG A 165 -3.325 13.476 -36.826 1.00 33.12 C ATOM 2327 NH1 ARG A 165 -3.690 14.637 -37.351 1.00 44.43 N ATOM 2328 NH2 ARG A 165 -4.205 12.486 -36.742 1.00 23.21 N ATOM 0 H ARG A 165 2.856 13.561 -33.465 1.00 32.53 H new ATOM 0 HA ARG A 165 2.391 15.168 -35.660 1.00 30.14 H new ATOM 0 HB2 ARG A 165 1.290 12.917 -34.583 1.00 11.44 H new ATOM 0 HB3 ARG A 165 0.024 14.071 -34.215 1.00 11.44 H new ATOM 0 HG2 ARG A 165 1.020 14.279 -36.985 1.00 10.31 H new ATOM 0 HG3 ARG A 165 0.335 12.711 -36.609 1.00 10.31 H new ATOM 0 HD2 ARG A 165 -1.226 15.060 -35.640 1.00 64.03 H new ATOM 0 HD3 ARG A 165 -1.136 14.880 -37.381 1.00 64.03 H new ATOM 0 HE ARG A 165 -1.836 12.397 -35.987 1.00 33.31 H new ATOM 0 HH11 ARG A 165 -3.017 15.401 -37.417 1.00 44.43 H new ATOM 0 HH12 ARG A 165 -4.644 14.767 -37.689 1.00 44.43 H new ATOM 0 HH21 ARG A 165 -3.929 11.591 -36.338 1.00 23.21 H new ATOM 0 HH22 ARG A 165 -5.158 12.620 -37.081 1.00 23.21 H new ATOM 2342 N LEU A 166 0.771 16.233 -32.974 1.00 55.24 N ATOM 2343 CA LEU A 166 0.110 17.396 -32.390 1.00 63.42 C ATOM 2344 C LEU A 166 0.978 18.642 -32.531 1.00 13.41 C ATOM 2345 O LEU A 166 0.483 19.722 -32.858 1.00 43.03 O ATOM 2346 CB LEU A 166 -0.202 17.141 -30.914 1.00 43.34 C ATOM 2347 CG LEU A 166 -1.683 17.047 -30.548 1.00 73.22 C ATOM 2348 CD1 LEU A 166 -2.348 18.411 -30.656 1.00 23.43 C ATOM 2349 CD2 LEU A 166 -2.390 16.036 -31.440 1.00 25.35 C ATOM 0 H LEU A 166 0.829 15.425 -32.354 1.00 55.24 H new ATOM 0 HA LEU A 166 -0.823 17.563 -32.928 1.00 63.42 H new ATOM 0 HB2 LEU A 166 0.285 16.213 -30.615 1.00 43.34 H new ATOM 0 HB3 LEU A 166 0.247 17.941 -30.325 1.00 43.34 H new ATOM 0 HG LEU A 166 -1.761 16.708 -29.515 1.00 73.22 H new ATOM 0 HD11 LEU A 166 -3.402 18.324 -30.392 1.00 23.43 H new ATOM 0 HD12 LEU A 166 -1.860 19.109 -29.976 1.00 23.43 H new ATOM 0 HD13 LEU A 166 -2.260 18.779 -31.678 1.00 23.43 H new ATOM 0 HD21 LEU A 166 -3.443 15.982 -31.165 1.00 25.35 H new ATOM 0 HD22 LEU A 166 -2.302 16.345 -32.481 1.00 25.35 H new ATOM 0 HD23 LEU A 166 -1.931 15.055 -31.313 1.00 25.35 H new ATOM 2361 N LEU A 167 2.273 18.486 -32.284 1.00 5.14 N ATOM 2362 CA LEU A 167 3.211 19.599 -32.385 1.00 23.11 C ATOM 2363 C LEU A 167 3.201 20.193 -33.790 1.00 4.34 C ATOM 2364 O LEU A 167 3.165 21.413 -33.959 1.00 74.21 O ATOM 2365 CB LEU A 167 4.624 19.135 -32.025 1.00 10.41 C ATOM 2366 CG LEU A 167 5.302 19.880 -30.874 1.00 40.35 C ATOM 2367 CD1 LEU A 167 5.407 21.365 -31.188 1.00 32.21 C ATOM 2368 CD2 LEU A 167 4.542 19.660 -29.575 1.00 14.11 C ATOM 0 H LEU A 167 2.698 17.600 -32.012 1.00 5.14 H new ATOM 0 HA LEU A 167 2.898 20.371 -31.682 1.00 23.11 H new ATOM 0 HB2 LEU A 167 4.584 18.076 -31.772 1.00 10.41 H new ATOM 0 HB3 LEU A 167 5.252 19.227 -32.911 1.00 10.41 H new ATOM 0 HG LEU A 167 6.310 19.483 -30.753 1.00 40.35 H new ATOM 0 HD11 LEU A 167 5.892 21.879 -30.358 1.00 32.21 H new ATOM 0 HD12 LEU A 167 5.996 21.504 -32.095 1.00 32.21 H new ATOM 0 HD13 LEU A 167 4.409 21.777 -31.336 1.00 32.21 H new ATOM 0 HD21 LEU A 167 5.039 20.197 -28.767 1.00 14.11 H new ATOM 0 HD22 LEU A 167 3.522 20.029 -29.683 1.00 14.11 H new ATOM 0 HD23 LEU A 167 4.520 18.595 -29.342 1.00 14.11 H new ATOM 2380 N LEU A 168 3.232 19.325 -34.794 1.00 62.41 N ATOM 2381 CA LEU A 168 3.224 19.763 -36.185 1.00 44.14 C ATOM 2382 C LEU A 168 2.074 20.730 -36.445 1.00 10.50 C ATOM 2383 O LEU A 168 2.249 21.754 -37.106 1.00 34.33 O ATOM 2384 CB LEU A 168 3.113 18.557 -37.120 1.00 53.41 C ATOM 2385 CG LEU A 168 4.030 18.569 -38.343 1.00 40.35 C ATOM 2386 CD1 LEU A 168 5.232 17.665 -38.118 1.00 40.32 C ATOM 2387 CD2 LEU A 168 3.265 18.142 -39.588 1.00 1.42 C ATOM 0 H LEU A 168 3.263 18.313 -34.671 1.00 62.41 H new ATOM 0 HA LEU A 168 4.162 20.282 -36.382 1.00 44.14 H new ATOM 0 HB2 LEU A 168 3.321 17.656 -36.544 1.00 53.41 H new ATOM 0 HB3 LEU A 168 2.082 18.484 -37.465 1.00 53.41 H new ATOM 0 HG LEU A 168 4.390 19.587 -38.493 1.00 40.35 H new ATOM 0 HD11 LEU A 168 5.873 17.686 -38.999 1.00 40.32 H new ATOM 0 HD12 LEU A 168 5.794 18.015 -37.252 1.00 40.32 H new ATOM 0 HD13 LEU A 168 4.892 16.645 -37.941 1.00 40.32 H new ATOM 0 HD21 LEU A 168 3.934 18.156 -40.449 1.00 1.42 H new ATOM 0 HD22 LEU A 168 2.876 17.134 -39.448 1.00 1.42 H new ATOM 0 HD23 LEU A 168 2.437 18.830 -39.760 1.00 1.42 H new ATOM 2399 N GLU A 169 0.899 20.400 -35.918 1.00 70.44 N ATOM 2400 CA GLU A 169 -0.279 21.241 -36.093 1.00 34.44 C ATOM 2401 C GLU A 169 -0.043 22.635 -35.519 1.00 24.42 C ATOM 2402 O GLU A 169 -0.406 23.640 -36.131 1.00 5.23 O ATOM 2403 CB GLU A 169 -1.495 20.600 -35.419 1.00 62.33 C ATOM 2404 CG GLU A 169 -2.768 20.697 -36.242 1.00 54.32 C ATOM 2405 CD GLU A 169 -3.025 19.453 -37.070 1.00 42.02 C ATOM 2406 OE1 GLU A 169 -2.073 18.962 -37.712 1.00 64.30 O ATOM 2407 OE2 GLU A 169 -4.177 18.971 -37.077 1.00 24.13 O ATOM 0 H GLU A 169 0.738 19.557 -35.367 1.00 70.44 H new ATOM 0 HA GLU A 169 -0.471 21.335 -37.162 1.00 34.44 H new ATOM 0 HB2 GLU A 169 -1.279 19.550 -35.222 1.00 62.33 H new ATOM 0 HB3 GLU A 169 -1.659 21.079 -34.454 1.00 62.33 H new ATOM 0 HG2 GLU A 169 -3.614 20.867 -35.576 1.00 54.32 H new ATOM 0 HG3 GLU A 169 -2.704 21.562 -36.903 1.00 54.32 H new ATOM 2414 N LEU A 170 0.568 22.687 -34.340 1.00 73.31 N ATOM 2415 CA LEU A 170 0.853 23.957 -33.682 1.00 23.11 C ATOM 2416 C LEU A 170 1.585 24.907 -34.625 1.00 74.31 C ATOM 2417 O LEU A 170 1.245 26.085 -34.721 1.00 52.13 O ATOM 2418 CB LEU A 170 1.691 23.725 -32.423 1.00 70.42 C ATOM 2419 CG LEU A 170 2.011 24.967 -31.591 1.00 35.11 C ATOM 2420 CD1 LEU A 170 1.885 24.662 -30.106 1.00 72.44 C ATOM 2421 CD2 LEU A 170 3.405 25.482 -31.915 1.00 63.21 C ATOM 0 H LEU A 170 0.875 21.865 -33.821 1.00 73.31 H new ATOM 0 HA LEU A 170 -0.096 24.413 -33.401 1.00 23.11 H new ATOM 0 HB2 LEU A 170 1.166 23.012 -31.787 1.00 70.42 H new ATOM 0 HB3 LEU A 170 2.631 23.258 -32.717 1.00 70.42 H new ATOM 0 HG LEU A 170 1.291 25.745 -31.844 1.00 35.11 H new ATOM 0 HD11 LEU A 170 2.116 25.558 -29.530 1.00 72.44 H new ATOM 0 HD12 LEU A 170 0.867 24.342 -29.885 1.00 72.44 H new ATOM 0 HD13 LEU A 170 2.581 23.868 -29.837 1.00 72.44 H new ATOM 0 HD21 LEU A 170 3.615 26.366 -31.313 1.00 63.21 H new ATOM 0 HD22 LEU A 170 4.140 24.708 -31.692 1.00 63.21 H new ATOM 0 HD23 LEU A 170 3.461 25.741 -32.972 1.00 63.21 H new