USER MOD reduce.3.24.130724 H: found=0, std=0, add=1078, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1077 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 76 TYR OH : rot 9:sc= 0.459 USER MOD Set 1.2: A 103 HIS : no HD1:sc= -0.637 K(o=-0.87,f=-3.5) USER MOD Set 1.3: A 104 CYS SG : rot -12:sc= 0.152 USER MOD Set 1.4: A 107 ASN :FLIP amide:sc= -0.845 F(o=-4.2,f=-0.87) USER MOD Set 2.1: A 100 MET CE :methyl 169:sc= -0.361 (180deg=-0.602) USER MOD Set 2.2: A 114 MET CE :methyl -137:sc= -1.8 (180deg=-5.5!) USER MOD Set 3.1: A 89 THR OG1 : rot 180:sc= 0.042 USER MOD Set 3.2: A 92 ASN : amide:sc=0.000969 X(o=0.043,f=-0.43) USER MOD Set 4.1: A 90 TYR OH : rot -68:sc= 1.24 USER MOD Set 4.2: A 128 ASN :FLIP amide:sc= 1.03 F(o=-1.9,f=2.3) USER MOD Set 5.1: A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.2: A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.1: A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.2: A 74 TYR OH : rot 180:sc= 0 USER MOD Set 7.1: A 62 SER OG : rot -130:sc= 0.526 USER MOD Set 7.2: A 82 LYS NZ :NH3+ 153:sc= 0.649 (180deg=0) USER MOD Set 8.1: A 53 GLN : amide:sc= 0 X(o=-0.18,f=-0.45) USER MOD Set 8.2: A 57 ASN : amide:sc= -0.182 K(o=-0.18,f=-1.5!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 CYS SG : rot 125:sc= 0.152 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot -132:sc= 0.149 USER MOD Single : A 29 HIS : no HD1:sc= -3.65! C(o=-3.6!,f=-5.2!) USER MOD Single : A 30 CYS SG : rot 180:sc= -2.99! USER MOD Single : A 32 SER OG : rot 180:sc= -0.309 USER MOD Single : A 35 CYS SG : rot -3:sc= 0.339 USER MOD Single : A 37 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ -134:sc= -2.6! (180deg=-4.09!) USER MOD Single : A 58 GLN : amide:sc= -2.52! C(o=-2.5!,f=-2.6!) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 LYS NZ :NH3+ -179:sc= 0.887 (180deg=0.887) USER MOD Single : A 61 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.123) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot -169:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 HIS : no HD1:sc= -1.46 K(o=-1.5,f=-2.4!) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot -115:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 THR OG1 : rot -46:sc= 0.672 USER MOD Single : A 113 SER OG : rot 9:sc= -0.221 USER MOD Single : A 125 GLN : amide:sc= 0 X(o=0,f=-0.051) USER MOD Single : A 130 SER OG : rot -78:sc= 0.384 USER MOD Single : A 132 MET CE :methyl 149:sc= -2.33 (180deg=-5.85!) USER MOD Single : A 140 THR OG1 : rot -58:sc= 1.17 USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 THR OG1 : rot 43:sc= 0.674 USER MOD ----------------------------------------------------------------- ATOM 108 N ILE A 11 11.733 -3.927 5.510 1.00 0.00 N ATOM 109 CA ILE A 11 11.657 -2.936 4.444 1.00 0.00 C ATOM 110 C ILE A 11 13.046 -2.572 3.930 1.00 0.00 C ATOM 111 O ILE A 11 13.956 -2.295 4.712 1.00 0.00 O ATOM 112 CB ILE A 11 10.944 -1.654 4.916 1.00 0.00 C ATOM 113 CG1 ILE A 11 9.538 -1.983 5.422 1.00 0.00 C ATOM 114 CG2 ILE A 11 10.882 -0.636 3.787 1.00 0.00 C ATOM 115 CD1 ILE A 11 8.941 -0.900 6.292 1.00 0.00 C ATOM 0 HA ILE A 11 11.080 -3.386 3.636 1.00 0.00 H new ATOM 0 HB ILE A 11 11.513 -1.221 5.738 1.00 0.00 H new ATOM 0 HG12 ILE A 11 8.883 -2.153 4.567 1.00 0.00 H new ATOM 0 HG13 ILE A 11 9.573 -2.914 5.987 1.00 0.00 H new ATOM 0 HG21 ILE A 11 10.376 0.264 4.136 1.00 0.00 H new ATOM 0 HG22 ILE A 11 11.893 -0.383 3.469 1.00 0.00 H new ATOM 0 HG23 ILE A 11 10.332 -1.059 2.946 1.00 0.00 H new ATOM 0 HD11 ILE A 11 7.944 -1.201 6.615 1.00 0.00 H new ATOM 0 HD12 ILE A 11 9.574 -0.745 7.166 1.00 0.00 H new ATOM 0 HD13 ILE A 11 8.874 0.028 5.724 1.00 0.00 H new ATOM 127 N THR A 12 13.202 -2.573 2.610 1.00 0.00 N ATOM 128 CA THR A 12 14.480 -2.243 1.992 1.00 0.00 C ATOM 129 C THR A 12 14.354 -1.022 1.088 1.00 0.00 C ATOM 130 O THR A 12 13.324 -0.817 0.445 1.00 0.00 O ATOM 131 CB THR A 12 15.027 -3.424 1.167 1.00 0.00 C ATOM 132 OG1 THR A 12 15.191 -4.572 2.006 1.00 0.00 O ATOM 133 CG2 THR A 12 16.358 -3.064 0.525 1.00 0.00 C ATOM 0 H THR A 12 12.459 -2.799 1.948 1.00 0.00 H new ATOM 0 HA THR A 12 15.175 -2.022 2.802 1.00 0.00 H new ATOM 0 HB THR A 12 14.311 -3.651 0.377 1.00 0.00 H new ATOM 0 HG1 THR A 12 15.537 -5.319 1.474 1.00 0.00 H new ATOM 0 HG21 THR A 12 16.725 -3.913 -0.052 1.00 0.00 H new ATOM 0 HG22 THR A 12 16.224 -2.207 -0.135 1.00 0.00 H new ATOM 0 HG23 THR A 12 17.081 -2.814 1.302 1.00 0.00 H new ATOM 141 N TYR A 13 15.407 -0.214 1.042 1.00 0.00 N ATOM 142 CA TYR A 13 15.413 0.988 0.217 1.00 0.00 C ATOM 143 C TYR A 13 16.382 0.842 -0.952 1.00 0.00 C ATOM 144 O TYR A 13 17.563 0.551 -0.763 1.00 0.00 O ATOM 145 CB TYR A 13 15.794 2.207 1.059 1.00 0.00 C ATOM 146 CG TYR A 13 15.016 2.317 2.351 1.00 0.00 C ATOM 147 CD1 TYR A 13 13.654 2.591 2.343 1.00 0.00 C ATOM 148 CD2 TYR A 13 15.643 2.149 3.579 1.00 0.00 C ATOM 149 CE1 TYR A 13 12.939 2.693 3.521 1.00 0.00 C ATOM 150 CE2 TYR A 13 14.936 2.248 4.762 1.00 0.00 C ATOM 151 CZ TYR A 13 13.585 2.520 4.728 1.00 0.00 C ATOM 152 OH TYR A 13 12.877 2.621 5.904 1.00 0.00 O ATOM 0 H TYR A 13 16.268 -0.370 1.567 1.00 0.00 H new ATOM 0 HA TYR A 13 14.409 1.129 -0.182 1.00 0.00 H new ATOM 0 HB2 TYR A 13 16.859 2.161 1.288 1.00 0.00 H new ATOM 0 HB3 TYR A 13 15.633 3.110 0.470 1.00 0.00 H new ATOM 0 HD1 TYR A 13 13.145 2.727 1.400 1.00 0.00 H new ATOM 0 HD2 TYR A 13 16.702 1.937 3.610 1.00 0.00 H new ATOM 0 HE1 TYR A 13 11.881 2.907 3.497 1.00 0.00 H new ATOM 0 HE2 TYR A 13 15.439 2.113 5.708 1.00 0.00 H new ATOM 0 HH TYR A 13 13.479 2.472 6.662 1.00 0.00 H new ATOM 162 N VAL A 14 15.873 1.046 -2.163 1.00 0.00 N ATOM 163 CA VAL A 14 16.691 0.939 -3.365 1.00 0.00 C ATOM 164 C VAL A 14 16.713 2.255 -4.134 1.00 0.00 C ATOM 165 O VAL A 14 15.773 3.046 -4.060 1.00 0.00 O ATOM 166 CB VAL A 14 16.180 -0.178 -4.295 1.00 0.00 C ATOM 167 CG1 VAL A 14 17.033 -0.258 -5.552 1.00 0.00 C ATOM 168 CG2 VAL A 14 16.163 -1.512 -3.565 1.00 0.00 C ATOM 0 H VAL A 14 14.897 1.286 -2.337 1.00 0.00 H new ATOM 0 HA VAL A 14 17.702 0.695 -3.039 1.00 0.00 H new ATOM 0 HB VAL A 14 15.159 0.059 -4.593 1.00 0.00 H new ATOM 0 HG11 VAL A 14 16.657 -1.052 -6.197 1.00 0.00 H new ATOM 0 HG12 VAL A 14 16.988 0.693 -6.083 1.00 0.00 H new ATOM 0 HG13 VAL A 14 18.066 -0.472 -5.278 1.00 0.00 H new ATOM 0 HG21 VAL A 14 15.799 -2.290 -4.237 1.00 0.00 H new ATOM 0 HG22 VAL A 14 17.172 -1.760 -3.236 1.00 0.00 H new ATOM 0 HG23 VAL A 14 15.505 -1.444 -2.699 1.00 0.00 H new ATOM 178 N LYS A 15 17.793 2.484 -4.873 1.00 0.00 N ATOM 179 CA LYS A 15 17.939 3.703 -5.659 1.00 0.00 C ATOM 180 C LYS A 15 17.754 3.418 -7.146 1.00 0.00 C ATOM 181 O LYS A 15 18.488 2.624 -7.732 1.00 0.00 O ATOM 182 CB LYS A 15 19.314 4.329 -5.416 1.00 0.00 C ATOM 183 CG LYS A 15 19.495 5.680 -6.087 1.00 0.00 C ATOM 184 CD LYS A 15 20.591 6.493 -5.418 1.00 0.00 C ATOM 185 CE LYS A 15 20.093 7.157 -4.144 1.00 0.00 C ATOM 186 NZ LYS A 15 21.203 7.787 -3.377 1.00 0.00 N ATOM 0 H LYS A 15 18.581 1.840 -4.944 1.00 0.00 H new ATOM 0 HA LYS A 15 17.166 4.404 -5.343 1.00 0.00 H new ATOM 0 HB2 LYS A 15 19.468 4.442 -4.343 1.00 0.00 H new ATOM 0 HB3 LYS A 15 20.083 3.647 -5.778 1.00 0.00 H new ATOM 0 HG2 LYS A 15 19.739 5.535 -7.139 1.00 0.00 H new ATOM 0 HG3 LYS A 15 18.557 6.234 -6.051 1.00 0.00 H new ATOM 0 HD2 LYS A 15 21.436 5.845 -5.185 1.00 0.00 H new ATOM 0 HD3 LYS A 15 20.954 7.254 -6.109 1.00 0.00 H new ATOM 0 HE2 LYS A 15 19.350 7.914 -4.395 1.00 0.00 H new ATOM 0 HE3 LYS A 15 19.594 6.416 -3.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 20.823 8.229 -2.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 21.900 7.061 -3.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 21.663 8.512 -3.964 1.00 0.00 H new ATOM 200 N GLY A 16 16.768 4.074 -7.751 1.00 0.00 N ATOM 201 CA GLY A 16 16.505 3.878 -9.165 1.00 0.00 C ATOM 202 C GLY A 16 15.025 3.759 -9.469 1.00 0.00 C ATOM 203 O GLY A 16 14.186 3.969 -8.593 1.00 0.00 O ATOM 0 H GLY A 16 16.147 4.737 -7.287 1.00 0.00 H new ATOM 0 HA2 GLY A 16 16.922 4.713 -9.728 1.00 0.00 H new ATOM 0 HA3 GLY A 16 17.016 2.977 -9.505 1.00 0.00 H new ATOM 207 N ASP A 17 14.703 3.424 -10.713 1.00 0.00 N ATOM 208 CA ASP A 17 13.314 3.278 -11.131 1.00 0.00 C ATOM 209 C ASP A 17 12.536 2.416 -10.141 1.00 0.00 C ATOM 210 O ASP A 17 13.120 1.784 -9.259 1.00 0.00 O ATOM 211 CB ASP A 17 13.241 2.663 -12.529 1.00 0.00 C ATOM 212 CG ASP A 17 14.356 3.149 -13.434 1.00 0.00 C ATOM 213 OD1 ASP A 17 14.193 4.221 -14.053 1.00 0.00 O ATOM 214 OD2 ASP A 17 15.392 2.457 -13.523 1.00 0.00 O ATOM 0 H ASP A 17 15.386 3.248 -11.450 1.00 0.00 H new ATOM 0 HA ASP A 17 12.862 4.270 -11.155 1.00 0.00 H new ATOM 0 HB2 ASP A 17 13.290 1.577 -12.448 1.00 0.00 H new ATOM 0 HB3 ASP A 17 12.279 2.906 -12.980 1.00 0.00 H new ATOM 219 N LEU A 18 11.217 2.394 -10.292 1.00 0.00 N ATOM 220 CA LEU A 18 10.358 1.610 -9.412 1.00 0.00 C ATOM 221 C LEU A 18 9.473 0.663 -10.215 1.00 0.00 C ATOM 222 O LEU A 18 9.080 -0.398 -9.730 1.00 0.00 O ATOM 223 CB LEU A 18 9.490 2.535 -8.557 1.00 0.00 C ATOM 224 CG LEU A 18 8.167 1.948 -8.064 1.00 0.00 C ATOM 225 CD1 LEU A 18 8.411 0.676 -7.266 1.00 0.00 C ATOM 226 CD2 LEU A 18 7.410 2.968 -7.226 1.00 0.00 C ATOM 0 H LEU A 18 10.718 2.911 -11.016 1.00 0.00 H new ATOM 0 HA LEU A 18 10.997 1.015 -8.759 1.00 0.00 H new ATOM 0 HB2 LEU A 18 10.072 2.847 -7.690 1.00 0.00 H new ATOM 0 HB3 LEU A 18 9.273 3.433 -9.135 1.00 0.00 H new ATOM 0 HG LEU A 18 7.558 1.697 -8.932 1.00 0.00 H new ATOM 0 HD11 LEU A 18 7.458 0.273 -6.924 1.00 0.00 H new ATOM 0 HD12 LEU A 18 8.910 -0.059 -7.897 1.00 0.00 H new ATOM 0 HD13 LEU A 18 9.040 0.902 -6.405 1.00 0.00 H new ATOM 0 HD21 LEU A 18 6.471 2.533 -6.884 1.00 0.00 H new ATOM 0 HD22 LEU A 18 8.014 3.251 -6.364 1.00 0.00 H new ATOM 0 HD23 LEU A 18 7.202 3.852 -7.829 1.00 0.00 H new ATOM 238 N PHE A 19 9.166 1.052 -11.448 1.00 0.00 N ATOM 239 CA PHE A 19 8.328 0.237 -12.321 1.00 0.00 C ATOM 240 C PHE A 19 9.178 -0.525 -13.333 1.00 0.00 C ATOM 241 O PHE A 19 8.873 -1.665 -13.683 1.00 0.00 O ATOM 242 CB PHE A 19 7.309 1.114 -13.051 1.00 0.00 C ATOM 243 CG PHE A 19 6.836 2.285 -12.238 1.00 0.00 C ATOM 244 CD1 PHE A 19 5.994 2.098 -11.153 1.00 0.00 C ATOM 245 CD2 PHE A 19 7.233 3.574 -12.558 1.00 0.00 C ATOM 246 CE1 PHE A 19 5.557 3.174 -10.405 1.00 0.00 C ATOM 247 CE2 PHE A 19 6.799 4.654 -11.813 1.00 0.00 C ATOM 248 CZ PHE A 19 5.960 4.453 -10.734 1.00 0.00 C ATOM 0 H PHE A 19 9.485 1.926 -11.866 1.00 0.00 H new ATOM 0 HA PHE A 19 7.796 -0.485 -11.702 1.00 0.00 H new ATOM 0 HB2 PHE A 19 7.753 1.480 -13.977 1.00 0.00 H new ATOM 0 HB3 PHE A 19 6.450 0.504 -13.329 1.00 0.00 H new ATOM 0 HD1 PHE A 19 5.676 1.100 -10.889 1.00 0.00 H new ATOM 0 HD2 PHE A 19 7.890 3.736 -13.400 1.00 0.00 H new ATOM 0 HE1 PHE A 19 4.900 3.015 -9.563 1.00 0.00 H new ATOM 0 HE2 PHE A 19 7.115 5.653 -12.074 1.00 0.00 H new ATOM 0 HZ PHE A 19 5.620 5.295 -10.149 1.00 0.00 H new ATOM 258 N ALA A 20 10.246 0.114 -13.801 1.00 0.00 N ATOM 259 CA ALA A 20 11.141 -0.503 -14.772 1.00 0.00 C ATOM 260 C ALA A 20 12.034 -1.546 -14.110 1.00 0.00 C ATOM 261 O ALA A 20 12.465 -2.505 -14.751 1.00 0.00 O ATOM 262 CB ALA A 20 11.986 0.559 -15.460 1.00 0.00 C ATOM 0 H ALA A 20 10.512 1.059 -13.523 1.00 0.00 H new ATOM 0 HA ALA A 20 10.532 -1.008 -15.521 1.00 0.00 H new ATOM 0 HB1 ALA A 20 12.650 0.084 -16.182 1.00 0.00 H new ATOM 0 HB2 ALA A 20 11.335 1.265 -15.975 1.00 0.00 H new ATOM 0 HB3 ALA A 20 12.580 1.090 -14.716 1.00 0.00 H new ATOM 268 N CYS A 21 12.309 -1.353 -12.825 1.00 0.00 N ATOM 269 CA CYS A 21 13.154 -2.277 -12.076 1.00 0.00 C ATOM 270 C CYS A 21 12.521 -3.663 -12.013 1.00 0.00 C ATOM 271 O CYS A 21 13.085 -4.652 -12.482 1.00 0.00 O ATOM 272 CB CYS A 21 13.394 -1.748 -10.661 1.00 0.00 C ATOM 273 SG CYS A 21 14.914 -0.786 -10.481 1.00 0.00 S ATOM 0 H CYS A 21 11.959 -0.565 -12.280 1.00 0.00 H new ATOM 0 HA CYS A 21 14.110 -2.357 -12.593 1.00 0.00 H new ATOM 0 HB2 CYS A 21 12.547 -1.127 -10.368 1.00 0.00 H new ATOM 0 HB3 CYS A 21 13.426 -2.591 -9.970 1.00 0.00 H new ATOM 0 HG CYS A 21 14.631 0.386 -9.994 1.00 0.00 H new ATOM 279 N PRO A 22 11.320 -3.739 -11.420 1.00 0.00 N ATOM 280 CA PRO A 22 10.585 -4.999 -11.280 1.00 0.00 C ATOM 281 C PRO A 22 10.065 -5.518 -12.617 1.00 0.00 C ATOM 282 O PRO A 22 10.190 -4.851 -13.644 1.00 0.00 O ATOM 283 CB PRO A 22 9.418 -4.629 -10.361 1.00 0.00 C ATOM 284 CG PRO A 22 9.223 -3.167 -10.566 1.00 0.00 C ATOM 285 CD PRO A 22 10.589 -2.601 -10.839 1.00 0.00 C ATOM 0 HA PRO A 22 11.216 -5.798 -10.890 1.00 0.00 H new ATOM 0 HB2 PRO A 22 8.519 -5.188 -10.619 1.00 0.00 H new ATOM 0 HB3 PRO A 22 9.647 -4.856 -9.320 1.00 0.00 H new ATOM 0 HG2 PRO A 22 8.548 -2.977 -11.400 1.00 0.00 H new ATOM 0 HG3 PRO A 22 8.778 -2.705 -9.684 1.00 0.00 H new ATOM 0 HD2 PRO A 22 10.544 -1.758 -11.529 1.00 0.00 H new ATOM 0 HD3 PRO A 22 11.065 -2.242 -9.927 1.00 0.00 H new ATOM 293 N LYS A 23 9.482 -6.712 -12.597 1.00 0.00 N ATOM 294 CA LYS A 23 8.941 -7.320 -13.806 1.00 0.00 C ATOM 295 C LYS A 23 7.502 -7.777 -13.590 1.00 0.00 C ATOM 296 O LYS A 23 6.655 -7.634 -14.472 1.00 0.00 O ATOM 297 CB LYS A 23 9.806 -8.509 -14.234 1.00 0.00 C ATOM 298 CG LYS A 23 11.082 -8.106 -14.952 1.00 0.00 C ATOM 299 CD LYS A 23 11.713 -9.285 -15.672 1.00 0.00 C ATOM 300 CE LYS A 23 12.751 -8.829 -16.686 1.00 0.00 C ATOM 301 NZ LYS A 23 14.078 -8.594 -16.054 1.00 0.00 N ATOM 0 H LYS A 23 9.372 -7.278 -11.756 1.00 0.00 H new ATOM 0 HA LYS A 23 8.949 -6.568 -14.595 1.00 0.00 H new ATOM 0 HB2 LYS A 23 10.065 -9.095 -13.352 1.00 0.00 H new ATOM 0 HB3 LYS A 23 9.221 -9.157 -14.887 1.00 0.00 H new ATOM 0 HG2 LYS A 23 10.863 -7.315 -15.670 1.00 0.00 H new ATOM 0 HG3 LYS A 23 11.791 -7.696 -14.233 1.00 0.00 H new ATOM 0 HD2 LYS A 23 12.181 -9.949 -14.945 1.00 0.00 H new ATOM 0 HD3 LYS A 23 10.938 -9.861 -16.177 1.00 0.00 H new ATOM 0 HE2 LYS A 23 12.850 -9.582 -17.468 1.00 0.00 H new ATOM 0 HE3 LYS A 23 12.410 -7.912 -17.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 14.757 -8.285 -16.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 13.990 -7.858 -15.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 14.415 -9.475 -15.617 1.00 0.00 H new ATOM 315 N THR A 24 7.231 -8.325 -12.409 1.00 0.00 N ATOM 316 CA THR A 24 5.895 -8.802 -12.077 1.00 0.00 C ATOM 317 C THR A 24 5.414 -8.213 -10.755 1.00 0.00 C ATOM 318 O THR A 24 4.213 -8.079 -10.525 1.00 0.00 O ATOM 319 CB THR A 24 5.853 -10.339 -11.986 1.00 0.00 C ATOM 320 OG1 THR A 24 6.774 -10.797 -10.990 1.00 0.00 O ATOM 321 CG2 THR A 24 6.195 -10.970 -13.328 1.00 0.00 C ATOM 0 H THR A 24 7.920 -8.449 -11.667 1.00 0.00 H new ATOM 0 HA THR A 24 5.234 -8.475 -12.880 1.00 0.00 H new ATOM 0 HB THR A 24 4.842 -10.637 -11.709 1.00 0.00 H new ATOM 0 HG1 THR A 24 6.740 -11.775 -10.938 1.00 0.00 H new ATOM 0 HG21 THR A 24 6.159 -12.056 -13.239 1.00 0.00 H new ATOM 0 HG22 THR A 24 5.475 -10.643 -14.078 1.00 0.00 H new ATOM 0 HG23 THR A 24 7.197 -10.664 -13.629 1.00 0.00 H new ATOM 329 N ASP A 25 6.360 -7.864 -9.890 1.00 0.00 N ATOM 330 CA ASP A 25 6.033 -7.287 -8.591 1.00 0.00 C ATOM 331 C ASP A 25 4.878 -6.297 -8.711 1.00 0.00 C ATOM 332 O ASP A 25 4.802 -5.531 -9.671 1.00 0.00 O ATOM 333 CB ASP A 25 7.257 -6.591 -7.995 1.00 0.00 C ATOM 334 CG ASP A 25 8.126 -7.537 -7.189 1.00 0.00 C ATOM 335 OD1 ASP A 25 8.390 -8.658 -7.673 1.00 0.00 O ATOM 336 OD2 ASP A 25 8.542 -7.157 -6.076 1.00 0.00 O ATOM 0 H ASP A 25 7.359 -7.971 -10.065 1.00 0.00 H new ATOM 0 HA ASP A 25 5.727 -8.097 -7.929 1.00 0.00 H new ATOM 0 HB2 ASP A 25 7.850 -6.153 -8.798 1.00 0.00 H new ATOM 0 HB3 ASP A 25 6.930 -5.770 -7.357 1.00 0.00 H new ATOM 341 N SER A 26 3.981 -6.321 -7.731 1.00 0.00 N ATOM 342 CA SER A 26 2.827 -5.429 -7.729 1.00 0.00 C ATOM 343 C SER A 26 3.163 -4.108 -7.045 1.00 0.00 C ATOM 344 O SER A 26 4.160 -4.001 -6.330 1.00 0.00 O ATOM 345 CB SER A 26 1.643 -6.095 -7.026 1.00 0.00 C ATOM 346 OG SER A 26 1.218 -7.251 -7.726 1.00 0.00 O ATOM 0 H SER A 26 4.031 -6.948 -6.928 1.00 0.00 H new ATOM 0 HA SER A 26 2.556 -5.223 -8.764 1.00 0.00 H new ATOM 0 HB2 SER A 26 1.926 -6.366 -6.009 1.00 0.00 H new ATOM 0 HB3 SER A 26 0.817 -5.388 -6.950 1.00 0.00 H new ATOM 0 HG SER A 26 0.245 -7.227 -7.837 1.00 0.00 H new ATOM 352 N LEU A 27 2.323 -3.103 -7.269 1.00 0.00 N ATOM 353 CA LEU A 27 2.529 -1.787 -6.674 1.00 0.00 C ATOM 354 C LEU A 27 1.426 -1.464 -5.671 1.00 0.00 C ATOM 355 O LEU A 27 0.312 -1.976 -5.773 1.00 0.00 O ATOM 356 CB LEU A 27 2.574 -0.714 -7.764 1.00 0.00 C ATOM 357 CG LEU A 27 3.623 -0.912 -8.858 1.00 0.00 C ATOM 358 CD1 LEU A 27 3.501 0.172 -9.918 1.00 0.00 C ATOM 359 CD2 LEU A 27 5.022 -0.920 -8.260 1.00 0.00 C ATOM 0 H LEU A 27 1.493 -3.174 -7.858 1.00 0.00 H new ATOM 0 HA LEU A 27 3.482 -1.799 -6.146 1.00 0.00 H new ATOM 0 HB2 LEU A 27 1.592 -0.662 -8.235 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.751 0.251 -7.289 1.00 0.00 H new ATOM 0 HG LEU A 27 3.447 -1.877 -9.333 1.00 0.00 H new ATOM 0 HD11 LEU A 27 4.256 0.014 -10.688 1.00 0.00 H new ATOM 0 HD12 LEU A 27 2.509 0.131 -10.368 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.650 1.149 -9.458 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.756 -1.062 -9.053 1.00 0.00 H new ATOM 0 HD22 LEU A 27 5.209 0.030 -7.759 1.00 0.00 H new ATOM 0 HD23 LEU A 27 5.105 -1.733 -7.539 1.00 0.00 H new ATOM 371 N ALA A 28 1.745 -0.609 -4.705 1.00 0.00 N ATOM 372 CA ALA A 28 0.780 -0.214 -3.686 1.00 0.00 C ATOM 373 C ALA A 28 0.905 1.270 -3.357 1.00 0.00 C ATOM 374 O ALA A 28 1.990 1.755 -3.035 1.00 0.00 O ATOM 375 CB ALA A 28 0.965 -1.052 -2.430 1.00 0.00 C ATOM 0 H ALA A 28 2.664 -0.177 -4.607 1.00 0.00 H new ATOM 0 HA ALA A 28 -0.220 -0.389 -4.082 1.00 0.00 H new ATOM 0 HB1 ALA A 28 0.238 -0.746 -1.678 1.00 0.00 H new ATOM 0 HB2 ALA A 28 0.817 -2.105 -2.670 1.00 0.00 H new ATOM 0 HB3 ALA A 28 1.973 -0.906 -2.041 1.00 0.00 H new ATOM 381 N HIS A 29 -0.211 1.987 -3.441 1.00 0.00 N ATOM 382 CA HIS A 29 -0.226 3.416 -3.152 1.00 0.00 C ATOM 383 C HIS A 29 -1.485 3.803 -2.383 1.00 0.00 C ATOM 384 O HIS A 29 -2.486 3.086 -2.413 1.00 0.00 O ATOM 385 CB HIS A 29 -0.139 4.221 -4.449 1.00 0.00 C ATOM 386 CG HIS A 29 -0.406 5.683 -4.266 1.00 0.00 C ATOM 387 ND1 HIS A 29 0.334 6.484 -3.421 1.00 0.00 N ATOM 388 CD2 HIS A 29 -1.338 6.490 -4.826 1.00 0.00 C ATOM 389 CE1 HIS A 29 -0.133 7.719 -3.468 1.00 0.00 C ATOM 390 NE2 HIS A 29 -1.147 7.750 -4.314 1.00 0.00 N ATOM 0 H HIS A 29 -1.117 1.601 -3.707 1.00 0.00 H new ATOM 0 HA HIS A 29 0.641 3.645 -2.532 1.00 0.00 H new ATOM 0 HB2 HIS A 29 0.854 4.093 -4.881 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -0.853 3.817 -5.166 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -2.092 6.197 -5.542 1.00 0.00 H new ATOM 0 HE1 HIS A 29 0.249 8.561 -2.909 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -1.698 8.575 -4.549 1.00 0.00 H new ATOM 398 N CYS A 30 -1.428 4.938 -1.696 1.00 0.00 N ATOM 399 CA CYS A 30 -2.565 5.418 -0.918 1.00 0.00 C ATOM 400 C CYS A 30 -3.266 6.568 -1.633 1.00 0.00 C ATOM 401 O CYS A 30 -2.635 7.559 -2.004 1.00 0.00 O ATOM 402 CB CYS A 30 -2.105 5.869 0.469 1.00 0.00 C ATOM 403 SG CYS A 30 -1.126 4.637 1.360 1.00 0.00 S ATOM 0 H CYS A 30 -0.607 5.543 -1.662 1.00 0.00 H new ATOM 0 HA CYS A 30 -3.273 4.596 -0.809 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -1.516 6.780 0.366 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -2.981 6.122 1.066 1.00 0.00 H new ATOM 0 HG CYS A 30 -0.782 5.112 2.520 1.00 0.00 H new ATOM 409 N ILE A 31 -4.574 6.429 -1.825 1.00 0.00 N ATOM 410 CA ILE A 31 -5.360 7.456 -2.497 1.00 0.00 C ATOM 411 C ILE A 31 -6.669 7.716 -1.759 1.00 0.00 C ATOM 412 O ILE A 31 -6.916 7.151 -0.693 1.00 0.00 O ATOM 413 CB ILE A 31 -5.673 7.063 -3.952 1.00 0.00 C ATOM 414 CG1 ILE A 31 -6.292 5.665 -4.004 1.00 0.00 C ATOM 415 CG2 ILE A 31 -4.411 7.121 -4.800 1.00 0.00 C ATOM 416 CD1 ILE A 31 -7.110 5.412 -5.251 1.00 0.00 C ATOM 0 H ILE A 31 -5.111 5.616 -1.525 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.759 8.365 -2.497 1.00 0.00 H new ATOM 0 HB ILE A 31 -6.393 7.774 -4.358 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -5.497 4.922 -3.944 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -6.926 5.525 -3.129 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -4.649 6.840 -5.826 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -4.009 8.134 -4.785 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -3.670 6.430 -4.397 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -7.518 4.402 -5.220 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -7.927 6.132 -5.303 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -6.475 5.520 -6.131 1.00 0.00 H new ATOM 428 N SER A 32 -7.507 8.573 -2.335 1.00 0.00 N ATOM 429 CA SER A 32 -8.791 8.909 -1.731 1.00 0.00 C ATOM 430 C SER A 32 -9.939 8.272 -2.507 1.00 0.00 C ATOM 431 O SER A 32 -9.838 8.048 -3.713 1.00 0.00 O ATOM 432 CB SER A 32 -8.973 10.427 -1.683 1.00 0.00 C ATOM 433 OG SER A 32 -7.725 11.088 -1.570 1.00 0.00 O ATOM 0 H SER A 32 -7.320 9.047 -3.219 1.00 0.00 H new ATOM 0 HA SER A 32 -8.801 8.516 -0.714 1.00 0.00 H new ATOM 0 HB2 SER A 32 -9.486 10.763 -2.584 1.00 0.00 H new ATOM 0 HB3 SER A 32 -9.607 10.694 -0.837 1.00 0.00 H new ATOM 0 HG SER A 32 -7.869 12.057 -1.543 1.00 0.00 H new ATOM 439 N GLU A 33 -11.031 7.982 -1.805 1.00 0.00 N ATOM 440 CA GLU A 33 -12.198 7.370 -2.428 1.00 0.00 C ATOM 441 C GLU A 33 -12.531 8.054 -3.751 1.00 0.00 C ATOM 442 O GLU A 33 -13.131 7.450 -4.640 1.00 0.00 O ATOM 443 CB GLU A 33 -13.403 7.442 -1.487 1.00 0.00 C ATOM 444 CG GLU A 33 -13.375 6.400 -0.382 1.00 0.00 C ATOM 445 CD GLU A 33 -14.763 6.013 0.090 1.00 0.00 C ATOM 446 OE1 GLU A 33 -15.715 6.121 -0.711 1.00 0.00 O ATOM 447 OE2 GLU A 33 -14.898 5.603 1.262 1.00 0.00 O ATOM 0 H GLU A 33 -11.131 8.161 -0.806 1.00 0.00 H new ATOM 0 HA GLU A 33 -11.964 6.324 -2.628 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -13.444 8.434 -1.038 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -14.316 7.318 -2.069 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -12.856 5.511 -0.739 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -12.803 6.786 0.462 1.00 0.00 H new ATOM 454 N ASP A 34 -12.138 9.317 -3.872 1.00 0.00 N ATOM 455 CA ASP A 34 -12.393 10.084 -5.086 1.00 0.00 C ATOM 456 C ASP A 34 -11.211 9.991 -6.046 1.00 0.00 C ATOM 457 O ASP A 34 -10.921 10.935 -6.782 1.00 0.00 O ATOM 458 CB ASP A 34 -12.672 11.547 -4.741 1.00 0.00 C ATOM 459 CG ASP A 34 -14.144 11.814 -4.495 1.00 0.00 C ATOM 460 OD1 ASP A 34 -14.911 11.863 -5.479 1.00 0.00 O ATOM 461 OD2 ASP A 34 -14.529 11.972 -3.318 1.00 0.00 O ATOM 0 H ASP A 34 -11.642 9.832 -3.144 1.00 0.00 H new ATOM 0 HA ASP A 34 -13.270 9.661 -5.576 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -12.103 11.823 -3.853 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -12.322 12.182 -5.555 1.00 0.00 H new ATOM 466 N CYS A 35 -10.533 8.849 -6.032 1.00 0.00 N ATOM 467 CA CYS A 35 -9.380 8.634 -6.901 1.00 0.00 C ATOM 468 C CYS A 35 -8.568 9.916 -7.054 1.00 0.00 C ATOM 469 O CYS A 35 -8.166 10.279 -8.160 1.00 0.00 O ATOM 470 CB CYS A 35 -9.836 8.137 -8.273 1.00 0.00 C ATOM 471 SG CYS A 35 -10.825 9.333 -9.201 1.00 0.00 S ATOM 0 H CYS A 35 -10.761 8.058 -5.430 1.00 0.00 H new ATOM 0 HA CYS A 35 -8.745 7.877 -6.441 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -8.958 7.873 -8.862 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -10.418 7.225 -8.142 1.00 0.00 H new ATOM 0 HG CYS A 35 -11.009 10.398 -8.478 1.00 0.00 H new ATOM 477 N ARG A 36 -8.332 10.598 -5.938 1.00 0.00 N ATOM 478 CA ARG A 36 -7.571 11.841 -5.949 1.00 0.00 C ATOM 479 C ARG A 36 -6.122 11.587 -6.354 1.00 0.00 C ATOM 480 O ARG A 36 -5.239 11.482 -5.503 1.00 0.00 O ATOM 481 CB ARG A 36 -7.618 12.505 -4.572 1.00 0.00 C ATOM 482 CG ARG A 36 -8.987 13.057 -4.208 1.00 0.00 C ATOM 483 CD ARG A 36 -9.224 14.419 -4.841 1.00 0.00 C ATOM 484 NE ARG A 36 -8.521 15.483 -4.129 1.00 0.00 N ATOM 485 CZ ARG A 36 -8.678 16.774 -4.397 1.00 0.00 C ATOM 486 NH1 ARG A 36 -9.510 17.160 -5.354 1.00 0.00 N ATOM 487 NH2 ARG A 36 -8.003 17.683 -3.705 1.00 0.00 N ATOM 0 H ARG A 36 -8.657 10.310 -5.015 1.00 0.00 H new ATOM 0 HA ARG A 36 -8.024 12.509 -6.682 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -7.316 11.779 -3.817 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -6.890 13.315 -4.544 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -9.760 12.362 -4.537 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -9.071 13.138 -3.124 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -8.894 14.398 -5.880 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -10.293 14.634 -4.850 1.00 0.00 H new ATOM 0 HE ARG A 36 -7.874 15.220 -3.385 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -10.032 16.464 -5.887 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -9.628 18.153 -5.557 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -7.363 17.390 -2.967 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -8.124 18.675 -3.911 1.00 0.00 H new ATOM 501 N MET A 37 -5.885 11.489 -7.658 1.00 0.00 N ATOM 502 CA MET A 37 -4.543 11.248 -8.175 1.00 0.00 C ATOM 503 C MET A 37 -4.118 12.364 -9.125 1.00 0.00 C ATOM 504 O MET A 37 -4.620 12.466 -10.243 1.00 0.00 O ATOM 505 CB MET A 37 -4.486 9.900 -8.897 1.00 0.00 C ATOM 506 CG MET A 37 -4.161 8.733 -7.978 1.00 0.00 C ATOM 507 SD MET A 37 -3.407 7.349 -8.853 1.00 0.00 S ATOM 508 CE MET A 37 -4.815 6.714 -9.760 1.00 0.00 C ATOM 0 H MET A 37 -6.605 11.573 -8.376 1.00 0.00 H new ATOM 0 HA MET A 37 -3.853 11.230 -7.331 1.00 0.00 H new ATOM 0 HB2 MET A 37 -5.445 9.715 -9.381 1.00 0.00 H new ATOM 0 HB3 MET A 37 -3.736 9.951 -9.686 1.00 0.00 H new ATOM 0 HG2 MET A 37 -3.486 9.072 -7.192 1.00 0.00 H new ATOM 0 HG3 MET A 37 -5.075 8.395 -7.490 1.00 0.00 H new ATOM 0 HE1 MET A 37 -4.508 5.852 -10.352 1.00 0.00 H new ATOM 0 HE2 MET A 37 -5.594 6.414 -9.059 1.00 0.00 H new ATOM 0 HE3 MET A 37 -5.201 7.489 -10.422 1.00 0.00 H new ATOM 518 N GLY A 38 -3.189 13.200 -8.670 1.00 0.00 N ATOM 519 CA GLY A 38 -2.713 14.298 -9.491 1.00 0.00 C ATOM 520 C GLY A 38 -1.683 15.151 -8.778 1.00 0.00 C ATOM 521 O GLY A 38 -1.665 16.372 -8.932 1.00 0.00 O ATOM 0 H GLY A 38 -2.758 13.136 -7.748 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -2.279 13.900 -10.408 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -3.558 14.922 -9.783 1.00 0.00 H new ATOM 525 N ALA A 39 -0.824 14.507 -7.995 1.00 0.00 N ATOM 526 CA ALA A 39 0.214 15.215 -7.255 1.00 0.00 C ATOM 527 C ALA A 39 1.419 14.315 -7.003 1.00 0.00 C ATOM 528 O ALA A 39 1.286 13.223 -6.452 1.00 0.00 O ATOM 529 CB ALA A 39 -0.340 15.740 -5.939 1.00 0.00 C ATOM 0 H ALA A 39 -0.826 13.496 -7.857 1.00 0.00 H new ATOM 0 HA ALA A 39 0.544 16.060 -7.859 1.00 0.00 H new ATOM 0 HB1 ALA A 39 0.446 16.266 -5.397 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -1.164 16.425 -6.139 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -0.699 14.906 -5.337 1.00 0.00 H new ATOM 535 N GLY A 40 2.596 14.781 -7.411 1.00 0.00 N ATOM 536 CA GLY A 40 3.807 14.005 -7.220 1.00 0.00 C ATOM 537 C GLY A 40 3.815 12.732 -8.043 1.00 0.00 C ATOM 538 O GLY A 40 3.233 12.682 -9.127 1.00 0.00 O ATOM 0 H GLY A 40 2.732 15.682 -7.870 1.00 0.00 H new ATOM 0 HA2 GLY A 40 4.671 14.613 -7.489 1.00 0.00 H new ATOM 0 HA3 GLY A 40 3.911 13.753 -6.165 1.00 0.00 H new ATOM 542 N ILE A 41 4.477 11.701 -7.528 1.00 0.00 N ATOM 543 CA ILE A 41 4.558 10.422 -8.223 1.00 0.00 C ATOM 544 C ILE A 41 3.169 9.869 -8.520 1.00 0.00 C ATOM 545 O ILE A 41 2.916 9.349 -9.607 1.00 0.00 O ATOM 546 CB ILE A 41 5.347 9.385 -7.402 1.00 0.00 C ATOM 547 CG1 ILE A 41 5.785 8.222 -8.295 1.00 0.00 C ATOM 548 CG2 ILE A 41 4.507 8.880 -6.239 1.00 0.00 C ATOM 549 CD1 ILE A 41 6.945 7.431 -7.732 1.00 0.00 C ATOM 0 H ILE A 41 4.965 11.726 -6.633 1.00 0.00 H new ATOM 0 HA ILE A 41 5.081 10.605 -9.161 1.00 0.00 H new ATOM 0 HB ILE A 41 6.239 9.865 -6.999 1.00 0.00 H new ATOM 0 HG12 ILE A 41 4.939 7.552 -8.446 1.00 0.00 H new ATOM 0 HG13 ILE A 41 6.063 8.611 -9.275 1.00 0.00 H new ATOM 0 HG21 ILE A 41 5.078 8.148 -5.668 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.241 9.716 -5.593 1.00 0.00 H new ATOM 0 HG23 ILE A 41 3.599 8.413 -6.621 1.00 0.00 H new ATOM 0 HD11 ILE A 41 7.201 6.623 -8.417 1.00 0.00 H new ATOM 0 HD12 ILE A 41 7.806 8.087 -7.607 1.00 0.00 H new ATOM 0 HD13 ILE A 41 6.665 7.012 -6.766 1.00 0.00 H new ATOM 561 N ALA A 42 2.271 9.986 -7.548 1.00 0.00 N ATOM 562 CA ALA A 42 0.906 9.501 -7.706 1.00 0.00 C ATOM 563 C ALA A 42 0.422 9.681 -9.141 1.00 0.00 C ATOM 564 O ALA A 42 -0.202 8.787 -9.714 1.00 0.00 O ATOM 565 CB ALA A 42 -0.025 10.218 -6.740 1.00 0.00 C ATOM 0 H ALA A 42 2.465 10.413 -6.642 1.00 0.00 H new ATOM 0 HA ALA A 42 0.898 8.435 -7.478 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -1.041 9.845 -6.870 1.00 0.00 H new ATOM 0 HB2 ALA A 42 0.301 10.034 -5.716 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -0.003 11.289 -6.941 1.00 0.00 H new ATOM 571 N VAL A 43 0.714 10.843 -9.718 1.00 0.00 N ATOM 572 CA VAL A 43 0.309 11.140 -11.087 1.00 0.00 C ATOM 573 C VAL A 43 0.731 10.026 -12.039 1.00 0.00 C ATOM 574 O VAL A 43 -0.100 9.438 -12.732 1.00 0.00 O ATOM 575 CB VAL A 43 0.910 12.472 -11.573 1.00 0.00 C ATOM 576 CG1 VAL A 43 0.564 12.712 -13.035 1.00 0.00 C ATOM 577 CG2 VAL A 43 0.426 13.623 -10.705 1.00 0.00 C ATOM 0 H VAL A 43 1.229 11.594 -9.258 1.00 0.00 H new ATOM 0 HA VAL A 43 -0.778 11.220 -11.086 1.00 0.00 H new ATOM 0 HB VAL A 43 1.995 12.414 -11.487 1.00 0.00 H new ATOM 0 HG11 VAL A 43 0.997 13.658 -13.361 1.00 0.00 H new ATOM 0 HG12 VAL A 43 0.966 11.901 -13.642 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -0.519 12.750 -13.151 1.00 0.00 H new ATOM 0 HG21 VAL A 43 0.861 14.556 -11.063 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -0.661 13.686 -10.757 1.00 0.00 H new ATOM 0 HG23 VAL A 43 0.731 13.453 -9.672 1.00 0.00 H new ATOM 587 N LEU A 44 2.028 9.740 -12.067 1.00 0.00 N ATOM 588 CA LEU A 44 2.562 8.696 -12.934 1.00 0.00 C ATOM 589 C LEU A 44 1.658 7.467 -12.927 1.00 0.00 C ATOM 590 O LEU A 44 1.308 6.935 -13.981 1.00 0.00 O ATOM 591 CB LEU A 44 3.973 8.307 -12.488 1.00 0.00 C ATOM 592 CG LEU A 44 5.085 9.295 -12.845 1.00 0.00 C ATOM 593 CD1 LEU A 44 6.404 8.859 -12.226 1.00 0.00 C ATOM 594 CD2 LEU A 44 5.219 9.424 -14.355 1.00 0.00 C ATOM 0 H LEU A 44 2.729 10.216 -11.499 1.00 0.00 H new ATOM 0 HA LEU A 44 2.604 9.088 -13.950 1.00 0.00 H new ATOM 0 HB2 LEU A 44 3.967 8.173 -11.406 1.00 0.00 H new ATOM 0 HB3 LEU A 44 4.218 7.340 -12.928 1.00 0.00 H new ATOM 0 HG LEU A 44 4.822 10.272 -12.439 1.00 0.00 H new ATOM 0 HD11 LEU A 44 7.184 9.573 -12.490 1.00 0.00 H new ATOM 0 HD12 LEU A 44 6.301 8.819 -11.142 1.00 0.00 H new ATOM 0 HD13 LEU A 44 6.674 7.872 -12.602 1.00 0.00 H new ATOM 0 HD21 LEU A 44 6.015 10.131 -14.591 1.00 0.00 H new ATOM 0 HD22 LEU A 44 5.459 8.451 -14.783 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.279 9.783 -14.774 1.00 0.00 H new ATOM 606 N PHE A 45 1.282 7.023 -11.733 1.00 0.00 N ATOM 607 CA PHE A 45 0.417 5.857 -11.589 1.00 0.00 C ATOM 608 C PHE A 45 -0.880 6.042 -12.371 1.00 0.00 C ATOM 609 O PHE A 45 -1.432 5.086 -12.916 1.00 0.00 O ATOM 610 CB PHE A 45 0.104 5.608 -10.112 1.00 0.00 C ATOM 611 CG PHE A 45 1.222 4.939 -9.366 1.00 0.00 C ATOM 612 CD1 PHE A 45 2.323 5.666 -8.941 1.00 0.00 C ATOM 613 CD2 PHE A 45 1.174 3.582 -9.090 1.00 0.00 C ATOM 614 CE1 PHE A 45 3.354 5.052 -8.256 1.00 0.00 C ATOM 615 CE2 PHE A 45 2.202 2.962 -8.404 1.00 0.00 C ATOM 616 CZ PHE A 45 3.293 3.699 -7.986 1.00 0.00 C ATOM 0 H PHE A 45 1.562 7.452 -10.851 1.00 0.00 H new ATOM 0 HA PHE A 45 0.944 4.992 -11.993 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.124 6.560 -9.632 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -0.792 4.991 -10.038 1.00 0.00 H new ATOM 0 HD1 PHE A 45 2.376 6.725 -9.148 1.00 0.00 H new ATOM 0 HD2 PHE A 45 0.323 3.001 -9.415 1.00 0.00 H new ATOM 0 HE1 PHE A 45 4.207 5.630 -7.932 1.00 0.00 H new ATOM 0 HE2 PHE A 45 2.152 1.904 -8.195 1.00 0.00 H new ATOM 0 HZ PHE A 45 4.097 3.218 -7.449 1.00 0.00 H new ATOM 626 N LYS A 46 -1.361 7.279 -12.423 1.00 0.00 N ATOM 627 CA LYS A 46 -2.592 7.593 -13.138 1.00 0.00 C ATOM 628 C LYS A 46 -2.383 7.502 -14.646 1.00 0.00 C ATOM 629 O LYS A 46 -3.343 7.419 -15.413 1.00 0.00 O ATOM 630 CB LYS A 46 -3.082 8.993 -12.764 1.00 0.00 C ATOM 631 CG LYS A 46 -4.293 9.448 -13.561 1.00 0.00 C ATOM 632 CD LYS A 46 -4.772 10.818 -13.114 1.00 0.00 C ATOM 633 CE LYS A 46 -4.005 11.932 -13.810 1.00 0.00 C ATOM 634 NZ LYS A 46 -4.812 13.178 -13.918 1.00 0.00 N ATOM 0 H LYS A 46 -0.916 8.082 -11.978 1.00 0.00 H new ATOM 0 HA LYS A 46 -3.347 6.862 -12.848 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -3.329 9.011 -11.702 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -2.270 9.705 -12.914 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -4.042 9.478 -14.621 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -5.099 8.724 -13.445 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -5.836 10.920 -13.327 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -4.652 10.912 -12.035 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -3.088 12.140 -13.259 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -3.711 11.603 -14.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -4.254 13.913 -14.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -5.675 12.986 -14.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -5.072 13.507 -12.966 1.00 0.00 H new ATOM 648 N LYS A 47 -1.123 7.517 -15.066 1.00 0.00 N ATOM 649 CA LYS A 47 -0.786 7.434 -16.482 1.00 0.00 C ATOM 650 C LYS A 47 -0.491 5.993 -16.888 1.00 0.00 C ATOM 651 O LYS A 47 -0.916 5.537 -17.950 1.00 0.00 O ATOM 652 CB LYS A 47 0.422 8.320 -16.794 1.00 0.00 C ATOM 653 CG LYS A 47 0.101 9.804 -16.808 1.00 0.00 C ATOM 654 CD LYS A 47 1.335 10.639 -17.104 1.00 0.00 C ATOM 655 CE LYS A 47 1.189 12.057 -16.573 1.00 0.00 C ATOM 656 NZ LYS A 47 0.550 12.959 -17.571 1.00 0.00 N ATOM 0 H LYS A 47 -0.317 7.586 -14.445 1.00 0.00 H new ATOM 0 HA LYS A 47 -1.644 7.786 -17.054 1.00 0.00 H new ATOM 0 HB2 LYS A 47 1.200 8.132 -16.054 1.00 0.00 H new ATOM 0 HB3 LYS A 47 0.829 8.036 -17.764 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -0.664 10.005 -17.558 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -0.314 10.096 -15.844 1.00 0.00 H new ATOM 0 HD2 LYS A 47 2.210 10.169 -16.654 1.00 0.00 H new ATOM 0 HD3 LYS A 47 1.506 10.668 -18.180 1.00 0.00 H new ATOM 0 HE2 LYS A 47 0.592 12.044 -15.661 1.00 0.00 H new ATOM 0 HE3 LYS A 47 2.171 12.448 -16.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 0.468 13.916 -17.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 1.132 12.992 -18.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -0.397 12.600 -17.807 1.00 0.00 H new ATOM 670 N LYS A 48 0.237 5.281 -16.036 1.00 0.00 N ATOM 671 CA LYS A 48 0.587 3.891 -16.303 1.00 0.00 C ATOM 672 C LYS A 48 -0.660 3.012 -16.329 1.00 0.00 C ATOM 673 O LYS A 48 -0.861 2.230 -17.259 1.00 0.00 O ATOM 674 CB LYS A 48 1.564 3.376 -15.244 1.00 0.00 C ATOM 675 CG LYS A 48 3.023 3.577 -15.614 1.00 0.00 C ATOM 676 CD LYS A 48 3.561 4.890 -15.069 1.00 0.00 C ATOM 677 CE LYS A 48 4.215 4.702 -13.709 1.00 0.00 C ATOM 678 NZ LYS A 48 3.207 4.614 -12.616 1.00 0.00 N ATOM 0 H LYS A 48 0.597 5.644 -15.153 1.00 0.00 H new ATOM 0 HA LYS A 48 1.065 3.845 -17.282 1.00 0.00 H new ATOM 0 HB2 LYS A 48 1.364 3.883 -14.300 1.00 0.00 H new ATOM 0 HB3 LYS A 48 1.382 2.314 -15.080 1.00 0.00 H new ATOM 0 HG2 LYS A 48 3.616 2.750 -15.223 1.00 0.00 H new ATOM 0 HG3 LYS A 48 3.130 3.561 -16.699 1.00 0.00 H new ATOM 0 HD2 LYS A 48 4.286 5.306 -15.768 1.00 0.00 H new ATOM 0 HD3 LYS A 48 2.748 5.611 -14.987 1.00 0.00 H new ATOM 0 HE2 LYS A 48 4.820 3.795 -13.719 1.00 0.00 H new ATOM 0 HE3 LYS A 48 4.891 5.534 -13.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 3.501 5.219 -11.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 2.282 4.933 -12.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 3.132 3.629 -12.291 1.00 0.00 H new ATOM 692 N PHE A 49 -1.494 3.146 -15.304 1.00 0.00 N ATOM 693 CA PHE A 49 -2.722 2.364 -15.211 1.00 0.00 C ATOM 694 C PHE A 49 -3.949 3.268 -15.277 1.00 0.00 C ATOM 695 O PHE A 49 -4.806 3.108 -16.145 1.00 0.00 O ATOM 696 CB PHE A 49 -2.739 1.556 -13.911 1.00 0.00 C ATOM 697 CG PHE A 49 -1.376 1.108 -13.466 1.00 0.00 C ATOM 698 CD1 PHE A 49 -0.729 0.068 -14.112 1.00 0.00 C ATOM 699 CD2 PHE A 49 -0.744 1.727 -12.400 1.00 0.00 C ATOM 700 CE1 PHE A 49 0.526 -0.346 -13.705 1.00 0.00 C ATOM 701 CE2 PHE A 49 0.511 1.318 -11.988 1.00 0.00 C ATOM 702 CZ PHE A 49 1.145 0.279 -12.641 1.00 0.00 C ATOM 0 H PHE A 49 -1.343 3.788 -14.526 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.752 1.678 -16.058 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -3.189 2.160 -13.123 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -3.375 0.681 -14.045 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -1.210 -0.426 -14.943 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -1.237 2.538 -11.885 1.00 0.00 H new ATOM 0 HE1 PHE A 49 1.021 -1.157 -14.219 1.00 0.00 H new ATOM 0 HE2 PHE A 49 0.995 1.810 -11.157 1.00 0.00 H new ATOM 0 HZ PHE A 49 2.124 -0.044 -12.319 1.00 0.00 H new ATOM 712 N GLY A 50 -4.027 4.219 -14.351 1.00 0.00 N ATOM 713 CA GLY A 50 -5.153 5.135 -14.320 1.00 0.00 C ATOM 714 C GLY A 50 -6.428 4.470 -13.842 1.00 0.00 C ATOM 715 O GLY A 50 -6.749 4.507 -12.655 1.00 0.00 O ATOM 0 H GLY A 50 -3.331 4.372 -13.622 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -4.917 5.974 -13.665 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -5.312 5.544 -15.318 1.00 0.00 H new ATOM 719 N GLY A 51 -7.160 3.860 -14.770 1.00 0.00 N ATOM 720 CA GLY A 51 -8.400 3.194 -14.418 1.00 0.00 C ATOM 721 C GLY A 51 -9.139 3.899 -13.298 1.00 0.00 C ATOM 722 O GLY A 51 -9.707 3.254 -12.417 1.00 0.00 O ATOM 0 H GLY A 51 -6.916 3.816 -15.759 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -9.043 3.142 -15.297 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -8.186 2.168 -14.118 1.00 0.00 H new ATOM 726 N VAL A 52 -9.129 5.228 -13.329 1.00 0.00 N ATOM 727 CA VAL A 52 -9.802 6.021 -12.308 1.00 0.00 C ATOM 728 C VAL A 52 -11.281 5.662 -12.219 1.00 0.00 C ATOM 729 O VAL A 52 -11.899 5.794 -11.163 1.00 0.00 O ATOM 730 CB VAL A 52 -9.668 7.530 -12.590 1.00 0.00 C ATOM 731 CG1 VAL A 52 -8.239 7.992 -12.354 1.00 0.00 C ATOM 732 CG2 VAL A 52 -10.112 7.847 -14.010 1.00 0.00 C ATOM 0 H VAL A 52 -8.662 5.778 -14.050 1.00 0.00 H new ATOM 0 HA VAL A 52 -9.317 5.791 -11.359 1.00 0.00 H new ATOM 0 HB VAL A 52 -10.317 8.070 -11.901 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -8.164 9.060 -12.558 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -7.961 7.800 -11.318 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -7.566 7.448 -13.017 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -10.011 8.917 -14.193 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -9.490 7.298 -14.717 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -11.154 7.554 -14.140 1.00 0.00 H new ATOM 742 N GLN A 53 -11.842 5.206 -13.334 1.00 0.00 N ATOM 743 CA GLN A 53 -13.249 4.827 -13.382 1.00 0.00 C ATOM 744 C GLN A 53 -13.444 3.396 -12.893 1.00 0.00 C ATOM 745 O GLN A 53 -14.482 3.062 -12.323 1.00 0.00 O ATOM 746 CB GLN A 53 -13.790 4.970 -14.806 1.00 0.00 C ATOM 747 CG GLN A 53 -15.204 4.440 -14.975 1.00 0.00 C ATOM 748 CD GLN A 53 -16.232 5.272 -14.234 1.00 0.00 C ATOM 749 OE1 GLN A 53 -16.209 6.502 -14.288 1.00 0.00 O ATOM 750 NE2 GLN A 53 -17.142 4.604 -13.535 1.00 0.00 N ATOM 0 H GLN A 53 -11.344 5.090 -14.216 1.00 0.00 H new ATOM 0 HA GLN A 53 -13.802 5.496 -12.722 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -13.769 6.022 -15.090 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -13.128 4.441 -15.492 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -15.456 4.419 -16.035 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -15.248 3.412 -14.616 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -17.124 3.584 -13.518 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -17.859 5.111 -13.015 1.00 0.00 H new ATOM 759 N GLU A 54 -12.439 2.556 -13.119 1.00 0.00 N ATOM 760 CA GLU A 54 -12.502 1.160 -12.702 1.00 0.00 C ATOM 761 C GLU A 54 -12.453 1.044 -11.181 1.00 0.00 C ATOM 762 O GLU A 54 -13.178 0.247 -10.584 1.00 0.00 O ATOM 763 CB GLU A 54 -11.351 0.367 -13.323 1.00 0.00 C ATOM 764 CG GLU A 54 -11.644 -0.135 -14.727 1.00 0.00 C ATOM 765 CD GLU A 54 -12.410 -1.443 -14.731 1.00 0.00 C ATOM 766 OE1 GLU A 54 -13.490 -1.500 -14.106 1.00 0.00 O ATOM 767 OE2 GLU A 54 -11.931 -2.410 -15.359 1.00 0.00 O ATOM 0 H GLU A 54 -11.572 2.818 -13.588 1.00 0.00 H new ATOM 0 HA GLU A 54 -13.448 0.745 -13.050 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -10.461 0.996 -13.350 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -11.121 -0.485 -12.683 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -12.217 0.619 -15.266 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.705 -0.266 -15.265 1.00 0.00 H new ATOM 774 N LEU A 55 -11.593 1.844 -10.561 1.00 0.00 N ATOM 775 CA LEU A 55 -11.447 1.832 -9.109 1.00 0.00 C ATOM 776 C LEU A 55 -12.721 2.324 -8.430 1.00 0.00 C ATOM 777 O LEU A 55 -13.259 1.662 -7.541 1.00 0.00 O ATOM 778 CB LEU A 55 -10.262 2.703 -8.689 1.00 0.00 C ATOM 779 CG LEU A 55 -8.926 2.391 -9.364 1.00 0.00 C ATOM 780 CD1 LEU A 55 -7.904 3.471 -9.048 1.00 0.00 C ATOM 781 CD2 LEU A 55 -8.415 1.026 -8.927 1.00 0.00 C ATOM 0 H LEU A 55 -10.986 2.509 -11.040 1.00 0.00 H new ATOM 0 HA LEU A 55 -11.264 0.804 -8.795 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -10.513 3.744 -8.890 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -10.132 2.609 -7.611 1.00 0.00 H new ATOM 0 HG LEU A 55 -9.081 2.371 -10.443 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.959 3.232 -9.537 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -8.267 4.433 -9.410 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.752 3.524 -7.970 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.463 0.820 -9.417 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.276 1.019 -7.846 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -9.139 0.260 -9.205 1.00 0.00 H new ATOM 793 N LEU A 56 -13.201 3.487 -8.855 1.00 0.00 N ATOM 794 CA LEU A 56 -14.414 4.068 -8.290 1.00 0.00 C ATOM 795 C LEU A 56 -15.557 3.058 -8.300 1.00 0.00 C ATOM 796 O LEU A 56 -16.366 3.012 -7.375 1.00 0.00 O ATOM 797 CB LEU A 56 -14.817 5.319 -9.072 1.00 0.00 C ATOM 798 CG LEU A 56 -13.848 6.500 -8.994 1.00 0.00 C ATOM 799 CD1 LEU A 56 -14.177 7.531 -10.062 1.00 0.00 C ATOM 800 CD2 LEU A 56 -13.887 7.131 -7.610 1.00 0.00 C ATOM 0 H LEU A 56 -12.769 4.047 -9.590 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.207 4.345 -7.256 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.940 5.044 -10.120 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -15.791 5.650 -8.712 1.00 0.00 H new ATOM 0 HG LEU A 56 -12.839 6.130 -9.174 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -13.477 8.364 -9.991 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -14.097 7.072 -11.048 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -15.193 7.897 -9.914 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -13.192 7.969 -7.573 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -14.896 7.487 -7.401 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.602 6.389 -6.864 1.00 0.00 H new ATOM 812 N ASN A 57 -15.615 2.248 -9.353 1.00 0.00 N ATOM 813 CA ASN A 57 -16.657 1.237 -9.484 1.00 0.00 C ATOM 814 C ASN A 57 -16.666 0.305 -8.276 1.00 0.00 C ATOM 815 O ASN A 57 -17.720 -0.168 -7.852 1.00 0.00 O ATOM 816 CB ASN A 57 -16.454 0.427 -10.765 1.00 0.00 C ATOM 817 CG ASN A 57 -16.952 1.159 -11.997 1.00 0.00 C ATOM 818 OD1 ASN A 57 -17.928 1.906 -11.936 1.00 0.00 O ATOM 819 ND2 ASN A 57 -16.281 0.945 -13.123 1.00 0.00 N ATOM 0 H ASN A 57 -14.952 2.273 -10.128 1.00 0.00 H new ATOM 0 HA ASN A 57 -17.619 1.748 -9.534 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -15.395 0.200 -10.884 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -16.976 -0.526 -10.676 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -16.569 1.409 -13.985 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -15.477 0.317 -13.126 1.00 0.00 H new ATOM 826 N GLN A 58 -15.483 0.047 -7.726 1.00 0.00 N ATOM 827 CA GLN A 58 -15.355 -0.828 -6.567 1.00 0.00 C ATOM 828 C GLN A 58 -16.066 -0.235 -5.355 1.00 0.00 C ATOM 829 O GLN A 58 -16.396 -0.948 -4.408 1.00 0.00 O ATOM 830 CB GLN A 58 -13.879 -1.065 -6.242 1.00 0.00 C ATOM 831 CG GLN A 58 -13.060 -1.529 -7.435 1.00 0.00 C ATOM 832 CD GLN A 58 -11.786 -2.243 -7.027 1.00 0.00 C ATOM 833 OE1 GLN A 58 -11.823 -3.232 -6.294 1.00 0.00 O ATOM 834 NE2 GLN A 58 -10.650 -1.744 -7.500 1.00 0.00 N ATOM 0 H GLN A 58 -14.601 0.431 -8.064 1.00 0.00 H new ATOM 0 HA GLN A 58 -15.825 -1.781 -6.809 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -13.449 -0.142 -5.853 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -13.805 -1.810 -5.450 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -13.665 -2.196 -8.049 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -12.807 -0.668 -8.054 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -10.666 -0.923 -8.104 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -9.761 -2.182 -7.259 1.00 0.00 H new ATOM 843 N GLN A 59 -16.298 1.073 -5.393 1.00 0.00 N ATOM 844 CA GLN A 59 -16.969 1.762 -4.297 1.00 0.00 C ATOM 845 C GLN A 59 -16.388 1.339 -2.952 1.00 0.00 C ATOM 846 O GLN A 59 -17.123 0.988 -2.028 1.00 0.00 O ATOM 847 CB GLN A 59 -18.471 1.475 -4.330 1.00 0.00 C ATOM 848 CG GLN A 59 -19.185 2.108 -5.513 1.00 0.00 C ATOM 849 CD GLN A 59 -20.694 2.002 -5.409 1.00 0.00 C ATOM 850 OE1 GLN A 59 -21.245 0.906 -5.305 1.00 0.00 O ATOM 851 NE2 GLN A 59 -21.371 3.144 -5.435 1.00 0.00 N ATOM 0 H GLN A 59 -16.031 1.677 -6.171 1.00 0.00 H new ATOM 0 HA GLN A 59 -16.808 2.833 -4.421 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -18.626 0.396 -4.357 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -18.922 1.838 -3.407 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -18.902 3.158 -5.583 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -18.853 1.626 -6.433 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -20.873 4.030 -5.522 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -22.389 3.135 -5.367 1.00 0.00 H new ATOM 860 N LYS A 60 -15.064 1.374 -2.848 1.00 0.00 N ATOM 861 CA LYS A 60 -14.382 0.996 -1.615 1.00 0.00 C ATOM 862 C LYS A 60 -14.798 1.905 -0.463 1.00 0.00 C ATOM 863 O LYS A 60 -15.569 2.847 -0.648 1.00 0.00 O ATOM 864 CB LYS A 60 -12.865 1.058 -1.807 1.00 0.00 C ATOM 865 CG LYS A 60 -12.320 -0.040 -2.703 1.00 0.00 C ATOM 866 CD LYS A 60 -12.354 -1.392 -2.011 1.00 0.00 C ATOM 867 CE LYS A 60 -12.534 -2.525 -3.011 1.00 0.00 C ATOM 868 NZ LYS A 60 -12.332 -3.859 -2.380 1.00 0.00 N ATOM 0 H LYS A 60 -14.441 1.660 -3.603 1.00 0.00 H new ATOM 0 HA LYS A 60 -14.669 -0.026 -1.369 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -12.600 2.026 -2.231 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -12.381 0.994 -0.832 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -12.905 -0.085 -3.621 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -11.295 0.198 -2.989 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -11.429 -1.540 -1.454 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -13.169 -1.411 -1.287 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -13.534 -2.474 -3.441 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -11.828 -2.401 -3.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -12.446 -4.603 -3.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -11.375 -3.911 -1.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -13.034 -3.996 -1.625 1.00 0.00 H new ATOM 882 N LYS A 61 -14.281 1.618 0.727 1.00 0.00 N ATOM 883 CA LYS A 61 -14.595 2.411 1.910 1.00 0.00 C ATOM 884 C LYS A 61 -13.348 2.639 2.759 1.00 0.00 C ATOM 885 O LYS A 61 -12.430 1.820 2.762 1.00 0.00 O ATOM 886 CB LYS A 61 -15.672 1.714 2.744 1.00 0.00 C ATOM 887 CG LYS A 61 -15.322 0.285 3.119 1.00 0.00 C ATOM 888 CD LYS A 61 -14.558 0.224 4.431 1.00 0.00 C ATOM 889 CE LYS A 61 -15.476 0.451 5.622 1.00 0.00 C ATOM 890 NZ LYS A 61 -16.372 -0.714 5.863 1.00 0.00 N ATOM 0 H LYS A 61 -13.642 0.841 0.898 1.00 0.00 H new ATOM 0 HA LYS A 61 -14.970 3.380 1.579 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -15.842 2.288 3.655 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -16.609 1.715 2.186 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -16.235 -0.305 3.201 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -14.723 -0.164 2.327 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -14.072 -0.747 4.525 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -13.770 0.977 4.429 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -14.876 0.638 6.513 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -16.079 1.343 5.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -16.820 -0.620 6.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -17.107 -0.744 5.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -15.816 -1.592 5.833 1.00 0.00 H new ATOM 904 N SER A 62 -13.324 3.757 3.477 1.00 0.00 N ATOM 905 CA SER A 62 -12.189 4.094 4.328 1.00 0.00 C ATOM 906 C SER A 62 -11.792 2.907 5.201 1.00 0.00 C ATOM 907 O SER A 62 -12.494 2.558 6.149 1.00 0.00 O ATOM 908 CB SER A 62 -12.525 5.299 5.209 1.00 0.00 C ATOM 909 OG SER A 62 -12.952 6.401 4.426 1.00 0.00 O ATOM 0 H SER A 62 -14.077 4.445 3.486 1.00 0.00 H new ATOM 0 HA SER A 62 -11.347 4.347 3.684 1.00 0.00 H new ATOM 0 HB2 SER A 62 -13.307 5.028 5.918 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.649 5.582 5.793 1.00 0.00 H new ATOM 0 HG SER A 62 -12.453 7.202 4.689 1.00 0.00 H new ATOM 915 N GLY A 63 -10.661 2.290 4.871 1.00 0.00 N ATOM 916 CA GLY A 63 -10.190 1.149 5.633 1.00 0.00 C ATOM 917 C GLY A 63 -9.992 -0.082 4.771 1.00 0.00 C ATOM 918 O GLY A 63 -9.291 -1.015 5.162 1.00 0.00 O ATOM 0 H GLY A 63 -10.063 2.560 4.090 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -9.248 1.404 6.119 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -10.906 0.924 6.424 1.00 0.00 H new ATOM 922 N GLU A 64 -10.613 -0.085 3.596 1.00 0.00 N ATOM 923 CA GLU A 64 -10.503 -1.213 2.678 1.00 0.00 C ATOM 924 C GLU A 64 -9.497 -0.916 1.569 1.00 0.00 C ATOM 925 O GLU A 64 -9.030 0.214 1.426 1.00 0.00 O ATOM 926 CB GLU A 64 -11.868 -1.538 2.068 1.00 0.00 C ATOM 927 CG GLU A 64 -12.760 -2.364 2.980 1.00 0.00 C ATOM 928 CD GLU A 64 -12.465 -3.849 2.897 1.00 0.00 C ATOM 929 OE1 GLU A 64 -12.453 -4.390 1.771 1.00 0.00 O ATOM 930 OE2 GLU A 64 -12.247 -4.470 3.958 1.00 0.00 O ATOM 0 H GLU A 64 -11.197 0.680 3.257 1.00 0.00 H new ATOM 0 HA GLU A 64 -10.151 -2.075 3.244 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -12.378 -0.607 1.821 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -11.720 -2.078 1.133 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -12.631 -2.029 4.009 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -13.803 -2.189 2.717 1.00 0.00 H new ATOM 937 N VAL A 65 -9.167 -1.939 0.788 1.00 0.00 N ATOM 938 CA VAL A 65 -8.217 -1.789 -0.308 1.00 0.00 C ATOM 939 C VAL A 65 -8.845 -2.190 -1.638 1.00 0.00 C ATOM 940 O VAL A 65 -9.730 -3.044 -1.687 1.00 0.00 O ATOM 941 CB VAL A 65 -6.952 -2.637 -0.075 1.00 0.00 C ATOM 942 CG1 VAL A 65 -7.297 -4.118 -0.062 1.00 0.00 C ATOM 943 CG2 VAL A 65 -5.905 -2.334 -1.136 1.00 0.00 C ATOM 0 H VAL A 65 -9.543 -2.881 0.894 1.00 0.00 H new ATOM 0 HA VAL A 65 -7.938 -0.736 -0.343 1.00 0.00 H new ATOM 0 HB VAL A 65 -6.535 -2.377 0.898 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.391 -4.701 0.104 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.009 -4.319 0.738 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.738 -4.397 -1.019 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -5.018 -2.942 -0.956 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -6.309 -2.564 -2.122 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -5.637 -1.278 -1.091 1.00 0.00 H new ATOM 953 N ALA A 66 -8.381 -1.567 -2.717 1.00 0.00 N ATOM 954 CA ALA A 66 -8.895 -1.859 -4.049 1.00 0.00 C ATOM 955 C ALA A 66 -7.902 -2.695 -4.849 1.00 0.00 C ATOM 956 O ALA A 66 -6.689 -2.548 -4.699 1.00 0.00 O ATOM 957 CB ALA A 66 -9.216 -0.568 -4.786 1.00 0.00 C ATOM 0 H ALA A 66 -7.650 -0.856 -2.694 1.00 0.00 H new ATOM 0 HA ALA A 66 -9.812 -2.438 -3.939 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -9.599 -0.802 -5.779 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -9.968 -0.009 -4.230 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -8.311 0.033 -4.878 1.00 0.00 H new ATOM 963 N VAL A 67 -8.425 -3.573 -5.700 1.00 0.00 N ATOM 964 CA VAL A 67 -7.584 -4.432 -6.524 1.00 0.00 C ATOM 965 C VAL A 67 -7.865 -4.217 -8.007 1.00 0.00 C ATOM 966 O VAL A 67 -9.016 -4.247 -8.443 1.00 0.00 O ATOM 967 CB VAL A 67 -7.796 -5.919 -6.184 1.00 0.00 C ATOM 968 CG1 VAL A 67 -7.060 -6.805 -7.177 1.00 0.00 C ATOM 969 CG2 VAL A 67 -7.344 -6.210 -4.761 1.00 0.00 C ATOM 0 H VAL A 67 -9.427 -3.707 -5.836 1.00 0.00 H new ATOM 0 HA VAL A 67 -6.550 -4.162 -6.309 1.00 0.00 H new ATOM 0 HB VAL A 67 -8.861 -6.141 -6.256 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -7.222 -7.852 -6.920 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -7.436 -6.616 -8.182 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -5.993 -6.583 -7.141 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -7.501 -7.265 -4.538 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -6.285 -5.971 -4.660 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -7.921 -5.602 -4.064 1.00 0.00 H new ATOM 979 N LEU A 68 -6.805 -3.999 -8.779 1.00 0.00 N ATOM 980 CA LEU A 68 -6.937 -3.778 -10.215 1.00 0.00 C ATOM 981 C LEU A 68 -5.980 -4.676 -10.993 1.00 0.00 C ATOM 982 O LEU A 68 -4.762 -4.587 -10.837 1.00 0.00 O ATOM 983 CB LEU A 68 -6.667 -2.311 -10.552 1.00 0.00 C ATOM 984 CG LEU A 68 -7.372 -1.767 -11.795 1.00 0.00 C ATOM 985 CD1 LEU A 68 -8.878 -1.738 -11.584 1.00 0.00 C ATOM 986 CD2 LEU A 68 -6.853 -0.379 -12.138 1.00 0.00 C ATOM 0 H LEU A 68 -5.845 -3.971 -8.434 1.00 0.00 H new ATOM 0 HA LEU A 68 -7.958 -4.028 -10.505 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -6.961 -1.703 -9.697 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -5.593 -2.181 -10.682 1.00 0.00 H new ATOM 0 HG LEU A 68 -7.155 -2.431 -12.632 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -9.363 -1.348 -12.479 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -9.237 -2.748 -11.387 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -9.114 -1.097 -10.735 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -7.366 -0.008 -13.025 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -7.039 0.296 -11.302 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -5.782 -0.429 -12.333 1.00 0.00 H new ATOM 998 N LYS A 69 -6.539 -5.539 -11.835 1.00 0.00 N ATOM 999 CA LYS A 69 -5.737 -6.451 -12.641 1.00 0.00 C ATOM 1000 C LYS A 69 -5.264 -5.771 -13.922 1.00 0.00 C ATOM 1001 O LYS A 69 -6.005 -5.687 -14.902 1.00 0.00 O ATOM 1002 CB LYS A 69 -6.544 -7.705 -12.985 1.00 0.00 C ATOM 1003 CG LYS A 69 -5.905 -8.563 -14.063 1.00 0.00 C ATOM 1004 CD LYS A 69 -4.617 -9.204 -13.575 1.00 0.00 C ATOM 1005 CE LYS A 69 -4.352 -10.527 -14.277 1.00 0.00 C ATOM 1006 NZ LYS A 69 -3.214 -11.264 -13.661 1.00 0.00 N ATOM 0 H LYS A 69 -7.545 -5.626 -11.977 1.00 0.00 H new ATOM 0 HA LYS A 69 -4.862 -6.738 -12.058 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -6.671 -8.304 -12.083 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -7.540 -7.407 -13.312 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -6.604 -9.340 -14.373 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -5.698 -7.951 -14.941 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -3.783 -8.525 -13.749 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -4.676 -9.367 -12.499 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -5.249 -11.145 -14.237 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -4.138 -10.343 -15.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -3.066 -12.160 -14.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -2.352 -10.685 -13.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -3.429 -11.462 -12.663 1.00 0.00 H new ATOM 1020 N ARG A 70 -4.026 -5.289 -13.908 1.00 0.00 N ATOM 1021 CA ARG A 70 -3.454 -4.618 -15.069 1.00 0.00 C ATOM 1022 C ARG A 70 -1.961 -4.911 -15.187 1.00 0.00 C ATOM 1023 O ARG A 70 -1.353 -5.465 -14.271 1.00 0.00 O ATOM 1024 CB ARG A 70 -3.682 -3.108 -14.975 1.00 0.00 C ATOM 1025 CG ARG A 70 -5.071 -2.731 -14.487 1.00 0.00 C ATOM 1026 CD ARG A 70 -5.531 -1.409 -15.081 1.00 0.00 C ATOM 1027 NE ARG A 70 -6.243 -1.594 -16.342 1.00 0.00 N ATOM 1028 CZ ARG A 70 -6.932 -0.631 -16.945 1.00 0.00 C ATOM 1029 NH1 ARG A 70 -7.001 0.577 -16.405 1.00 0.00 N ATOM 1030 NH2 ARG A 70 -7.553 -0.877 -18.092 1.00 0.00 N ATOM 0 H ARG A 70 -3.400 -5.351 -13.105 1.00 0.00 H new ATOM 0 HA ARG A 70 -3.953 -5.000 -15.960 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -2.940 -2.678 -14.301 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -3.517 -2.662 -15.956 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -5.777 -3.517 -14.755 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -5.069 -2.661 -13.399 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -6.180 -0.898 -14.370 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -4.667 -0.765 -15.244 1.00 0.00 H new ATOM 0 HE ARG A 70 -6.210 -2.513 -16.784 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -6.524 0.770 -15.524 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -7.531 1.314 -16.870 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -7.501 -1.806 -18.511 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -8.082 -0.137 -18.554 1.00 0.00 H new ATOM 1044 N ASP A 71 -1.378 -4.537 -16.320 1.00 0.00 N ATOM 1045 CA ASP A 71 0.044 -4.759 -16.558 1.00 0.00 C ATOM 1046 C ASP A 71 0.462 -6.149 -16.090 1.00 0.00 C ATOM 1047 O ASP A 71 1.619 -6.375 -15.739 1.00 0.00 O ATOM 1048 CB ASP A 71 0.875 -3.694 -15.841 1.00 0.00 C ATOM 1049 CG ASP A 71 1.127 -2.476 -16.708 1.00 0.00 C ATOM 1050 OD1 ASP A 71 0.146 -1.906 -17.229 1.00 0.00 O ATOM 1051 OD2 ASP A 71 2.306 -2.094 -16.866 1.00 0.00 O ATOM 0 H ASP A 71 -1.868 -4.079 -17.088 1.00 0.00 H new ATOM 0 HA ASP A 71 0.224 -4.687 -17.631 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.360 -3.388 -14.930 1.00 0.00 H new ATOM 0 HB3 ASP A 71 1.829 -4.125 -15.538 1.00 0.00 H new ATOM 1056 N GLY A 72 -0.489 -7.079 -16.086 1.00 0.00 N ATOM 1057 CA GLY A 72 -0.200 -8.435 -15.658 1.00 0.00 C ATOM 1058 C GLY A 72 0.163 -8.513 -14.188 1.00 0.00 C ATOM 1059 O GLY A 72 1.169 -9.122 -13.822 1.00 0.00 O ATOM 0 H GLY A 72 -1.455 -6.917 -16.372 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -1.068 -9.066 -15.849 1.00 0.00 H new ATOM 0 HA3 GLY A 72 0.621 -8.834 -16.254 1.00 0.00 H new ATOM 1063 N ARG A 73 -0.656 -7.895 -13.344 1.00 0.00 N ATOM 1064 CA ARG A 73 -0.414 -7.896 -11.906 1.00 0.00 C ATOM 1065 C ARG A 73 -1.592 -7.281 -11.156 1.00 0.00 C ATOM 1066 O ARG A 73 -2.474 -6.669 -11.760 1.00 0.00 O ATOM 1067 CB ARG A 73 0.868 -7.126 -11.583 1.00 0.00 C ATOM 1068 CG ARG A 73 0.730 -5.620 -11.739 1.00 0.00 C ATOM 1069 CD ARG A 73 2.088 -4.944 -11.848 1.00 0.00 C ATOM 1070 NE ARG A 73 2.734 -5.221 -13.128 1.00 0.00 N ATOM 1071 CZ ARG A 73 3.659 -4.435 -13.669 1.00 0.00 C ATOM 1072 NH1 ARG A 73 4.043 -3.330 -13.044 1.00 0.00 N ATOM 1073 NH2 ARG A 73 4.201 -4.754 -14.837 1.00 0.00 N ATOM 0 H ARG A 73 -1.493 -7.387 -13.631 1.00 0.00 H new ATOM 0 HA ARG A 73 -0.300 -8.931 -11.583 1.00 0.00 H new ATOM 0 HB2 ARG A 73 1.169 -7.351 -10.560 1.00 0.00 H new ATOM 0 HB3 ARG A 73 1.667 -7.479 -12.235 1.00 0.00 H new ATOM 0 HG2 ARG A 73 0.139 -5.398 -12.628 1.00 0.00 H new ATOM 0 HG3 ARG A 73 0.187 -5.213 -10.886 1.00 0.00 H new ATOM 0 HD2 ARG A 73 1.968 -3.867 -11.728 1.00 0.00 H new ATOM 0 HD3 ARG A 73 2.730 -5.286 -11.036 1.00 0.00 H new ATOM 0 HE ARG A 73 2.460 -6.063 -13.634 1.00 0.00 H new ATOM 0 HH11 ARG A 73 3.628 -3.082 -12.146 1.00 0.00 H new ATOM 0 HH12 ARG A 73 4.753 -2.729 -13.461 1.00 0.00 H new ATOM 0 HH21 ARG A 73 3.908 -5.603 -15.320 1.00 0.00 H new ATOM 0 HH22 ARG A 73 4.911 -4.150 -15.252 1.00 0.00 H new ATOM 1087 N TYR A 74 -1.600 -7.448 -9.839 1.00 0.00 N ATOM 1088 CA TYR A 74 -2.671 -6.913 -9.007 1.00 0.00 C ATOM 1089 C TYR A 74 -2.192 -5.699 -8.216 1.00 0.00 C ATOM 1090 O TYR A 74 -1.355 -5.820 -7.320 1.00 0.00 O ATOM 1091 CB TYR A 74 -3.188 -7.988 -8.049 1.00 0.00 C ATOM 1092 CG TYR A 74 -3.634 -9.254 -8.744 1.00 0.00 C ATOM 1093 CD1 TYR A 74 -4.613 -9.220 -9.730 1.00 0.00 C ATOM 1094 CD2 TYR A 74 -3.078 -10.484 -8.415 1.00 0.00 C ATOM 1095 CE1 TYR A 74 -5.025 -10.375 -10.368 1.00 0.00 C ATOM 1096 CE2 TYR A 74 -3.483 -11.643 -9.049 1.00 0.00 C ATOM 1097 CZ TYR A 74 -4.456 -11.583 -10.024 1.00 0.00 C ATOM 1098 OH TYR A 74 -4.863 -12.736 -10.656 1.00 0.00 O ATOM 0 H TYR A 74 -0.877 -7.950 -9.324 1.00 0.00 H new ATOM 0 HA TYR A 74 -3.483 -6.600 -9.663 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -2.403 -8.233 -7.334 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -4.024 -7.583 -7.478 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -5.059 -8.275 -10.002 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -2.316 -10.535 -7.651 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -5.788 -10.332 -11.131 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -3.040 -12.591 -8.782 1.00 0.00 H new ATOM 0 HH TYR A 74 -4.363 -13.499 -10.298 1.00 0.00 H new ATOM 1108 N ILE A 75 -2.728 -4.532 -8.554 1.00 0.00 N ATOM 1109 CA ILE A 75 -2.357 -3.296 -7.875 1.00 0.00 C ATOM 1110 C ILE A 75 -3.295 -3.007 -6.708 1.00 0.00 C ATOM 1111 O ILE A 75 -4.510 -3.172 -6.820 1.00 0.00 O ATOM 1112 CB ILE A 75 -2.372 -2.097 -8.841 1.00 0.00 C ATOM 1113 CG1 ILE A 75 -1.444 -2.359 -10.029 1.00 0.00 C ATOM 1114 CG2 ILE A 75 -1.963 -0.825 -8.113 1.00 0.00 C ATOM 1115 CD1 ILE A 75 -1.345 -1.193 -10.988 1.00 0.00 C ATOM 0 H ILE A 75 -3.421 -4.416 -9.294 1.00 0.00 H new ATOM 0 HA ILE A 75 -1.344 -3.435 -7.497 1.00 0.00 H new ATOM 0 HB ILE A 75 -3.386 -1.966 -9.218 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -0.448 -2.597 -9.656 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -1.800 -3.235 -10.571 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -1.978 0.014 -8.809 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -2.660 -0.632 -7.297 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -0.957 -0.944 -7.710 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -0.671 -1.450 -11.805 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.333 -0.968 -11.390 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -0.960 -0.320 -10.461 1.00 0.00 H new ATOM 1127 N TYR A 76 -2.723 -2.573 -5.590 1.00 0.00 N ATOM 1128 CA TYR A 76 -3.508 -2.261 -4.402 1.00 0.00 C ATOM 1129 C TYR A 76 -3.625 -0.752 -4.207 1.00 0.00 C ATOM 1130 O TYR A 76 -2.674 -0.008 -4.446 1.00 0.00 O ATOM 1131 CB TYR A 76 -2.874 -2.898 -3.165 1.00 0.00 C ATOM 1132 CG TYR A 76 -2.752 -4.403 -3.254 1.00 0.00 C ATOM 1133 CD1 TYR A 76 -3.875 -5.217 -3.164 1.00 0.00 C ATOM 1134 CD2 TYR A 76 -1.515 -5.010 -3.426 1.00 0.00 C ATOM 1135 CE1 TYR A 76 -3.768 -6.592 -3.245 1.00 0.00 C ATOM 1136 CE2 TYR A 76 -1.399 -6.384 -3.508 1.00 0.00 C ATOM 1137 CZ TYR A 76 -2.528 -7.171 -3.417 1.00 0.00 C ATOM 1138 OH TYR A 76 -2.416 -8.540 -3.498 1.00 0.00 O ATOM 0 H TYR A 76 -1.719 -2.429 -5.482 1.00 0.00 H new ATOM 0 HA TYR A 76 -4.509 -2.670 -4.541 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -1.883 -2.470 -3.014 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -3.469 -2.641 -2.289 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -4.847 -4.767 -3.028 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -0.628 -4.397 -3.497 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -4.651 -7.210 -3.174 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -0.429 -6.840 -3.643 1.00 0.00 H new ATOM 0 HH TYR A 76 -3.309 -8.938 -3.560 1.00 0.00 H new ATOM 1148 N TYR A 77 -4.799 -0.308 -3.772 1.00 0.00 N ATOM 1149 CA TYR A 77 -5.043 1.112 -3.547 1.00 0.00 C ATOM 1150 C TYR A 77 -5.523 1.362 -2.120 1.00 0.00 C ATOM 1151 O TYR A 77 -6.723 1.330 -1.842 1.00 0.00 O ATOM 1152 CB TYR A 77 -6.077 1.638 -4.544 1.00 0.00 C ATOM 1153 CG TYR A 77 -5.636 1.528 -5.987 1.00 0.00 C ATOM 1154 CD1 TYR A 77 -5.764 0.333 -6.683 1.00 0.00 C ATOM 1155 CD2 TYR A 77 -5.092 2.620 -6.652 1.00 0.00 C ATOM 1156 CE1 TYR A 77 -5.362 0.228 -8.001 1.00 0.00 C ATOM 1157 CE2 TYR A 77 -4.689 2.524 -7.970 1.00 0.00 C ATOM 1158 CZ TYR A 77 -4.826 1.326 -8.640 1.00 0.00 C ATOM 1159 OH TYR A 77 -4.425 1.227 -9.953 1.00 0.00 O ATOM 0 H TYR A 77 -5.596 -0.911 -3.568 1.00 0.00 H new ATOM 0 HA TYR A 77 -4.103 1.644 -3.694 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -7.008 1.087 -4.414 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -6.291 2.682 -4.316 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -6.185 -0.529 -6.186 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -4.982 3.559 -6.130 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -5.467 -0.709 -8.528 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -4.269 3.382 -8.473 1.00 0.00 H new ATOM 0 HH TYR A 77 -4.071 2.090 -10.253 1.00 0.00 H new ATOM 1169 N LEU A 78 -4.579 1.612 -1.221 1.00 0.00 N ATOM 1170 CA LEU A 78 -4.903 1.869 0.178 1.00 0.00 C ATOM 1171 C LEU A 78 -5.784 3.107 0.314 1.00 0.00 C ATOM 1172 O LEU A 78 -5.376 4.213 -0.042 1.00 0.00 O ATOM 1173 CB LEU A 78 -3.622 2.048 0.995 1.00 0.00 C ATOM 1174 CG LEU A 78 -2.603 0.912 0.903 1.00 0.00 C ATOM 1175 CD1 LEU A 78 -1.257 1.355 1.454 1.00 0.00 C ATOM 1176 CD2 LEU A 78 -3.107 -0.317 1.646 1.00 0.00 C ATOM 0 H LEU A 78 -3.582 1.642 -1.435 1.00 0.00 H new ATOM 0 HA LEU A 78 -5.453 1.010 0.561 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -3.137 2.971 0.676 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -3.898 2.178 2.042 1.00 0.00 H new ATOM 0 HG LEU A 78 -2.473 0.650 -0.147 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.545 0.533 1.380 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -0.890 2.205 0.879 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.369 1.645 2.499 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -2.369 -1.116 1.570 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -3.266 -0.068 2.695 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -4.047 -0.648 1.205 1.00 0.00 H new ATOM 1188 N ILE A 79 -6.991 2.914 0.834 1.00 0.00 N ATOM 1189 CA ILE A 79 -7.928 4.015 1.020 1.00 0.00 C ATOM 1190 C ILE A 79 -8.166 4.290 2.501 1.00 0.00 C ATOM 1191 O ILE A 79 -8.792 3.493 3.199 1.00 0.00 O ATOM 1192 CB ILE A 79 -9.279 3.727 0.339 1.00 0.00 C ATOM 1193 CG1 ILE A 79 -9.096 3.603 -1.175 1.00 0.00 C ATOM 1194 CG2 ILE A 79 -10.282 4.821 0.669 1.00 0.00 C ATOM 1195 CD1 ILE A 79 -10.203 2.830 -1.856 1.00 0.00 C ATOM 0 H ILE A 79 -7.343 2.005 1.134 1.00 0.00 H new ATOM 0 HA ILE A 79 -7.478 4.893 0.557 1.00 0.00 H new ATOM 0 HB ILE A 79 -9.665 2.781 0.718 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -9.041 4.601 -1.609 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -8.144 3.114 -1.379 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -11.232 4.603 0.180 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -10.431 4.865 1.748 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -9.904 5.780 0.315 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -10.008 2.782 -2.927 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -10.245 1.820 -1.449 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -11.156 3.330 -1.683 1.00 0.00 H new ATOM 1207 N THR A 80 -7.662 5.425 2.975 1.00 0.00 N ATOM 1208 CA THR A 80 -7.820 5.807 4.373 1.00 0.00 C ATOM 1209 C THR A 80 -8.788 6.975 4.518 1.00 0.00 C ATOM 1210 O THR A 80 -9.526 7.066 5.500 1.00 0.00 O ATOM 1211 CB THR A 80 -6.470 6.192 5.006 1.00 0.00 C ATOM 1212 OG1 THR A 80 -5.920 7.330 4.333 1.00 0.00 O ATOM 1213 CG2 THR A 80 -5.488 5.032 4.935 1.00 0.00 C ATOM 0 H THR A 80 -7.141 6.096 2.411 1.00 0.00 H new ATOM 0 HA THR A 80 -8.223 4.939 4.894 1.00 0.00 H new ATOM 0 HB THR A 80 -6.643 6.438 6.054 1.00 0.00 H new ATOM 0 HG1 THR A 80 -4.992 7.463 4.620 1.00 0.00 H new ATOM 0 HG21 THR A 80 -4.542 5.328 5.388 1.00 0.00 H new ATOM 0 HG22 THR A 80 -5.896 4.176 5.473 1.00 0.00 H new ATOM 0 HG23 THR A 80 -5.321 4.760 3.893 1.00 0.00 H new ATOM 1221 N LYS A 81 -8.783 7.868 3.534 1.00 0.00 N ATOM 1222 CA LYS A 81 -9.662 9.031 3.550 1.00 0.00 C ATOM 1223 C LYS A 81 -10.537 9.069 2.301 1.00 0.00 C ATOM 1224 O LYS A 81 -10.121 8.638 1.226 1.00 0.00 O ATOM 1225 CB LYS A 81 -8.839 10.317 3.649 1.00 0.00 C ATOM 1226 CG LYS A 81 -8.094 10.662 2.371 1.00 0.00 C ATOM 1227 CD LYS A 81 -6.803 11.408 2.663 1.00 0.00 C ATOM 1228 CE LYS A 81 -5.769 11.182 1.570 1.00 0.00 C ATOM 1229 NZ LYS A 81 -4.781 12.294 1.503 1.00 0.00 N ATOM 0 H LYS A 81 -8.179 7.808 2.714 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.310 8.954 4.423 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -9.501 11.143 3.908 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -8.121 10.217 4.463 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -7.871 9.748 1.821 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -8.731 11.272 1.731 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -7.010 12.474 2.754 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -6.400 11.079 3.621 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -5.247 10.243 1.753 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -6.272 11.085 0.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -4.094 12.103 0.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -5.276 13.187 1.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -4.282 12.370 2.412 1.00 0.00 H new ATOM 1243 N LYS A 82 -11.751 9.589 2.450 1.00 0.00 N ATOM 1244 CA LYS A 82 -12.684 9.686 1.334 1.00 0.00 C ATOM 1245 C LYS A 82 -12.305 10.837 0.407 1.00 0.00 C ATOM 1246 O LYS A 82 -11.776 10.620 -0.683 1.00 0.00 O ATOM 1247 CB LYS A 82 -14.111 9.882 1.851 1.00 0.00 C ATOM 1248 CG LYS A 82 -14.781 8.592 2.289 1.00 0.00 C ATOM 1249 CD LYS A 82 -16.025 8.864 3.119 1.00 0.00 C ATOM 1250 CE LYS A 82 -16.273 7.756 4.131 1.00 0.00 C ATOM 1251 NZ LYS A 82 -15.384 7.882 5.320 1.00 0.00 N ATOM 0 H LYS A 82 -12.112 9.950 3.333 1.00 0.00 H new ATOM 0 HA LYS A 82 -12.634 8.755 0.769 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -14.092 10.575 2.692 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -14.711 10.346 1.069 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -15.049 8.004 1.411 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -14.078 7.995 2.870 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -15.916 9.816 3.639 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -16.889 8.958 2.461 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -17.314 7.783 4.452 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -16.111 6.788 3.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -15.845 7.449 6.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -14.483 7.397 5.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -15.203 8.888 5.513 1.00 0.00 H new ATOM 1265 N ARG A 83 -12.578 12.061 0.849 1.00 0.00 N ATOM 1266 CA ARG A 83 -12.265 13.245 0.059 1.00 0.00 C ATOM 1267 C ARG A 83 -11.098 14.015 0.671 1.00 0.00 C ATOM 1268 O ARG A 83 -10.486 13.566 1.639 1.00 0.00 O ATOM 1269 CB ARG A 83 -13.491 14.154 -0.044 1.00 0.00 C ATOM 1270 CG ARG A 83 -14.734 13.446 -0.558 1.00 0.00 C ATOM 1271 CD ARG A 83 -15.546 12.849 0.581 1.00 0.00 C ATOM 1272 NE ARG A 83 -16.562 11.918 0.100 1.00 0.00 N ATOM 1273 CZ ARG A 83 -17.666 11.620 0.776 1.00 0.00 C ATOM 1274 NH1 ARG A 83 -17.895 12.179 1.957 1.00 0.00 N ATOM 1275 NH2 ARG A 83 -18.544 10.763 0.271 1.00 0.00 N ATOM 0 H ARG A 83 -13.015 12.258 1.749 1.00 0.00 H new ATOM 0 HA ARG A 83 -11.978 12.918 -0.940 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -13.704 14.575 0.938 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -13.259 14.989 -0.706 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -15.351 14.151 -1.116 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -14.444 12.657 -1.252 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -14.878 12.332 1.270 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -16.026 13.650 1.143 1.00 0.00 H new ATOM 0 HE ARG A 83 -16.416 11.471 -0.805 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -17.223 12.839 2.348 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -18.743 11.949 2.474 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -18.372 10.332 -0.637 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -19.391 10.535 0.791 1.00 0.00 H new ATOM 1289 N ALA A 84 -10.795 15.175 0.097 1.00 0.00 N ATOM 1290 CA ALA A 84 -9.703 16.007 0.587 1.00 0.00 C ATOM 1291 C ALA A 84 -10.046 16.623 1.940 1.00 0.00 C ATOM 1292 O ALA A 84 -9.189 16.735 2.816 1.00 0.00 O ATOM 1293 CB ALA A 84 -9.376 17.097 -0.423 1.00 0.00 C ATOM 0 H ALA A 84 -11.290 15.560 -0.707 1.00 0.00 H new ATOM 0 HA ALA A 84 -8.826 15.373 0.718 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -8.559 17.711 -0.044 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.079 16.641 -1.367 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -10.255 17.721 -0.582 1.00 0.00 H new ATOM 1299 N SER A 85 -11.304 17.020 2.102 1.00 0.00 N ATOM 1300 CA SER A 85 -11.759 17.628 3.347 1.00 0.00 C ATOM 1301 C SER A 85 -11.258 16.839 4.552 1.00 0.00 C ATOM 1302 O SER A 85 -10.884 17.414 5.575 1.00 0.00 O ATOM 1303 CB SER A 85 -13.286 17.707 3.373 1.00 0.00 C ATOM 1304 OG SER A 85 -13.756 18.072 4.659 1.00 0.00 O ATOM 0 H SER A 85 -12.026 16.932 1.387 1.00 0.00 H new ATOM 0 HA SER A 85 -11.350 18.637 3.400 1.00 0.00 H new ATOM 0 HB2 SER A 85 -13.628 18.435 2.637 1.00 0.00 H new ATOM 0 HB3 SER A 85 -13.708 16.743 3.088 1.00 0.00 H new ATOM 0 HG SER A 85 -14.735 18.117 4.649 1.00 0.00 H new ATOM 1310 N HIS A 86 -11.254 15.515 4.425 1.00 0.00 N ATOM 1311 CA HIS A 86 -10.799 14.645 5.503 1.00 0.00 C ATOM 1312 C HIS A 86 -9.313 14.334 5.359 1.00 0.00 C ATOM 1313 O HIS A 86 -8.779 14.300 4.251 1.00 0.00 O ATOM 1314 CB HIS A 86 -11.606 13.346 5.512 1.00 0.00 C ATOM 1315 CG HIS A 86 -13.030 13.521 5.083 1.00 0.00 C ATOM 1316 ND1 HIS A 86 -13.502 13.107 3.855 1.00 0.00 N ATOM 1317 CD2 HIS A 86 -14.087 14.069 5.726 1.00 0.00 C ATOM 1318 CE1 HIS A 86 -14.788 13.394 3.761 1.00 0.00 C ATOM 1319 NE2 HIS A 86 -15.168 13.978 4.884 1.00 0.00 N ATOM 0 H HIS A 86 -11.561 15.022 3.586 1.00 0.00 H new ATOM 0 HA HIS A 86 -10.953 15.166 6.448 1.00 0.00 H new ATOM 0 HB2 HIS A 86 -11.123 12.624 4.854 1.00 0.00 H new ATOM 0 HB3 HIS A 86 -11.587 12.924 6.517 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -14.081 14.498 6.717 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -15.421 13.187 2.911 1.00 0.00 H new ATOM 0 HE2 HIS A 86 -16.111 14.307 5.092 1.00 0.00 H new ATOM 1327 N LYS A 87 -8.649 14.108 6.488 1.00 0.00 N ATOM 1328 CA LYS A 87 -7.224 13.799 6.489 1.00 0.00 C ATOM 1329 C LYS A 87 -6.982 12.349 6.898 1.00 0.00 C ATOM 1330 O LYS A 87 -7.746 11.758 7.661 1.00 0.00 O ATOM 1331 CB LYS A 87 -6.478 14.739 7.439 1.00 0.00 C ATOM 1332 CG LYS A 87 -6.383 16.167 6.931 1.00 0.00 C ATOM 1333 CD LYS A 87 -5.253 16.327 5.927 1.00 0.00 C ATOM 1334 CE LYS A 87 -5.760 16.224 4.497 1.00 0.00 C ATOM 1335 NZ LYS A 87 -4.750 15.605 3.594 1.00 0.00 N ATOM 0 H LYS A 87 -9.075 14.133 7.414 1.00 0.00 H new ATOM 0 HA LYS A 87 -6.846 13.941 5.476 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -6.981 14.739 8.406 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.472 14.353 7.603 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -7.327 16.453 6.467 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -6.223 16.843 7.771 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -4.768 17.292 6.074 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -4.498 15.561 6.103 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -6.675 15.632 4.478 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -6.015 17.218 4.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -5.133 15.553 2.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -3.885 16.183 3.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -4.525 14.647 3.930 1.00 0.00 H new ATOM 1349 N PRO A 88 -5.893 11.762 6.381 1.00 0.00 N ATOM 1350 CA PRO A 88 -5.524 10.375 6.680 1.00 0.00 C ATOM 1351 C PRO A 88 -5.056 10.197 8.120 1.00 0.00 C ATOM 1352 O PRO A 88 -4.117 10.859 8.566 1.00 0.00 O ATOM 1353 CB PRO A 88 -4.376 10.095 5.707 1.00 0.00 C ATOM 1354 CG PRO A 88 -3.791 11.434 5.416 1.00 0.00 C ATOM 1355 CD PRO A 88 -4.937 12.406 5.464 1.00 0.00 C ATOM 0 HA PRO A 88 -6.370 9.696 6.570 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -3.636 9.427 6.149 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -4.736 9.614 4.798 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -3.028 11.694 6.149 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -3.310 11.446 4.438 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -4.621 13.382 5.833 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -5.371 12.564 4.477 1.00 0.00 H new ATOM 1363 N THR A 89 -5.715 9.300 8.846 1.00 0.00 N ATOM 1364 CA THR A 89 -5.367 9.036 10.236 1.00 0.00 C ATOM 1365 C THR A 89 -4.659 7.693 10.381 1.00 0.00 C ATOM 1366 O THR A 89 -4.990 6.729 9.690 1.00 0.00 O ATOM 1367 CB THR A 89 -6.615 9.045 11.139 1.00 0.00 C ATOM 1368 OG1 THR A 89 -7.614 8.169 10.604 1.00 0.00 O ATOM 1369 CG2 THR A 89 -7.181 10.451 11.265 1.00 0.00 C ATOM 0 H THR A 89 -6.494 8.743 8.494 1.00 0.00 H new ATOM 0 HA THR A 89 -4.694 9.834 10.550 1.00 0.00 H new ATOM 0 HB THR A 89 -6.322 8.698 12.130 1.00 0.00 H new ATOM 0 HG1 THR A 89 -8.403 8.179 11.185 1.00 0.00 H new ATOM 0 HG21 THR A 89 -8.062 10.433 11.907 1.00 0.00 H new ATOM 0 HG22 THR A 89 -6.428 11.109 11.700 1.00 0.00 H new ATOM 0 HG23 THR A 89 -7.459 10.821 10.278 1.00 0.00 H new ATOM 1377 N TYR A 90 -3.685 7.637 11.282 1.00 0.00 N ATOM 1378 CA TYR A 90 -2.929 6.412 11.515 1.00 0.00 C ATOM 1379 C TYR A 90 -3.866 5.234 11.766 1.00 0.00 C ATOM 1380 O TYR A 90 -3.617 4.121 11.304 1.00 0.00 O ATOM 1381 CB TYR A 90 -1.985 6.590 12.705 1.00 0.00 C ATOM 1382 CG TYR A 90 -0.897 7.613 12.468 1.00 0.00 C ATOM 1383 CD1 TYR A 90 -0.233 7.680 11.249 1.00 0.00 C ATOM 1384 CD2 TYR A 90 -0.535 8.513 13.462 1.00 0.00 C ATOM 1385 CE1 TYR A 90 0.762 8.612 11.029 1.00 0.00 C ATOM 1386 CE2 TYR A 90 0.458 9.450 13.250 1.00 0.00 C ATOM 1387 CZ TYR A 90 1.104 9.496 12.031 1.00 0.00 C ATOM 1388 OH TYR A 90 2.093 10.427 11.815 1.00 0.00 O ATOM 0 H TYR A 90 -3.400 8.425 11.863 1.00 0.00 H new ATOM 0 HA TYR A 90 -2.341 6.201 10.622 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -2.567 6.886 13.578 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.525 5.630 12.939 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -0.500 6.992 10.461 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -1.038 8.480 14.417 1.00 0.00 H new ATOM 0 HE1 TYR A 90 1.270 8.649 10.077 1.00 0.00 H new ATOM 0 HE2 TYR A 90 0.727 10.143 14.034 1.00 0.00 H new ATOM 0 HH TYR A 90 2.958 9.973 11.736 1.00 0.00 H new ATOM 1398 N GLU A 91 -4.944 5.489 12.501 1.00 0.00 N ATOM 1399 CA GLU A 91 -5.917 4.450 12.813 1.00 0.00 C ATOM 1400 C GLU A 91 -6.458 3.810 11.538 1.00 0.00 C ATOM 1401 O GLU A 91 -6.397 2.593 11.367 1.00 0.00 O ATOM 1402 CB GLU A 91 -7.071 5.031 13.634 1.00 0.00 C ATOM 1403 CG GLU A 91 -8.155 4.018 13.962 1.00 0.00 C ATOM 1404 CD GLU A 91 -9.221 4.581 14.882 1.00 0.00 C ATOM 1405 OE1 GLU A 91 -9.023 4.539 16.114 1.00 0.00 O ATOM 1406 OE2 GLU A 91 -10.252 5.064 14.370 1.00 0.00 O ATOM 0 H GLU A 91 -5.165 6.405 12.891 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.414 3.681 13.399 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -6.675 5.440 14.563 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -7.515 5.861 13.084 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -8.621 3.678 13.037 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -7.701 3.144 14.430 1.00 0.00 H new ATOM 1413 N ASN A 92 -6.989 4.639 10.645 1.00 0.00 N ATOM 1414 CA ASN A 92 -7.542 4.155 9.386 1.00 0.00 C ATOM 1415 C ASN A 92 -6.461 3.493 8.536 1.00 0.00 C ATOM 1416 O ASN A 92 -6.689 2.447 7.928 1.00 0.00 O ATOM 1417 CB ASN A 92 -8.182 5.308 8.609 1.00 0.00 C ATOM 1418 CG ASN A 92 -9.629 5.535 9.002 1.00 0.00 C ATOM 1419 OD1 ASN A 92 -10.420 4.594 9.075 1.00 0.00 O ATOM 1420 ND2 ASN A 92 -9.983 6.790 9.256 1.00 0.00 N ATOM 0 H ASN A 92 -7.048 5.650 10.770 1.00 0.00 H new ATOM 0 HA ASN A 92 -8.306 3.412 9.615 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -7.613 6.221 8.784 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -8.127 5.098 7.541 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -10.943 7.005 9.524 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -9.294 7.539 9.183 1.00 0.00 H new ATOM 1427 N LEU A 93 -5.285 4.110 8.499 1.00 0.00 N ATOM 1428 CA LEU A 93 -4.168 3.580 7.724 1.00 0.00 C ATOM 1429 C LEU A 93 -3.886 2.128 8.097 1.00 0.00 C ATOM 1430 O LEU A 93 -4.049 1.225 7.277 1.00 0.00 O ATOM 1431 CB LEU A 93 -2.916 4.430 7.952 1.00 0.00 C ATOM 1432 CG LEU A 93 -1.624 3.901 7.329 1.00 0.00 C ATOM 1433 CD1 LEU A 93 -1.593 4.192 5.837 1.00 0.00 C ATOM 1434 CD2 LEU A 93 -0.411 4.509 8.019 1.00 0.00 C ATOM 0 H LEU A 93 -5.080 4.977 8.996 1.00 0.00 H new ATOM 0 HA LEU A 93 -4.439 3.618 6.669 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -3.103 5.429 7.559 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -2.762 4.534 9.026 1.00 0.00 H new ATOM 0 HG LEU A 93 -1.592 2.820 7.468 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.666 3.808 5.411 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -2.442 3.708 5.354 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -1.649 5.268 5.675 1.00 0.00 H new ATOM 0 HD21 LEU A 93 0.500 4.121 7.563 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -0.437 5.593 7.912 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -0.426 4.248 9.077 1.00 0.00 H new ATOM 1446 N GLN A 94 -3.466 1.913 9.339 1.00 0.00 N ATOM 1447 CA GLN A 94 -3.164 0.570 9.821 1.00 0.00 C ATOM 1448 C GLN A 94 -4.114 -0.454 9.209 1.00 0.00 C ATOM 1449 O GLN A 94 -3.681 -1.452 8.631 1.00 0.00 O ATOM 1450 CB GLN A 94 -3.254 0.520 11.347 1.00 0.00 C ATOM 1451 CG GLN A 94 -2.333 -0.513 11.977 1.00 0.00 C ATOM 1452 CD GLN A 94 -2.758 -0.892 13.382 1.00 0.00 C ATOM 1453 OE1 GLN A 94 -2.999 -0.028 14.225 1.00 0.00 O ATOM 1454 NE2 GLN A 94 -2.851 -2.191 13.642 1.00 0.00 N ATOM 0 H GLN A 94 -3.327 2.651 10.030 1.00 0.00 H new ATOM 0 HA GLN A 94 -2.147 0.322 9.517 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -3.012 1.504 11.749 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -4.282 0.302 11.635 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -2.315 -1.407 11.353 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -1.316 -0.121 12.002 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -2.642 -2.873 12.913 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -3.132 -2.506 14.571 1.00 0.00 H new ATOM 1463 N LYS A 95 -5.412 -0.202 9.341 1.00 0.00 N ATOM 1464 CA LYS A 95 -6.425 -1.101 8.801 1.00 0.00 C ATOM 1465 C LYS A 95 -6.165 -1.391 7.326 1.00 0.00 C ATOM 1466 O LYS A 95 -6.004 -2.545 6.930 1.00 0.00 O ATOM 1467 CB LYS A 95 -7.819 -0.495 8.975 1.00 0.00 C ATOM 1468 CG LYS A 95 -8.184 -0.213 10.422 1.00 0.00 C ATOM 1469 CD LYS A 95 -8.658 -1.469 11.132 1.00 0.00 C ATOM 1470 CE LYS A 95 -9.224 -1.152 12.508 1.00 0.00 C ATOM 1471 NZ LYS A 95 -10.606 -0.604 12.426 1.00 0.00 N ATOM 0 H LYS A 95 -5.787 0.618 9.818 1.00 0.00 H new ATOM 0 HA LYS A 95 -6.373 -2.040 9.352 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -7.876 0.434 8.407 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -8.557 -1.175 8.549 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -7.319 0.196 10.943 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -8.967 0.545 10.460 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -9.420 -1.963 10.529 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -7.827 -2.168 11.231 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -9.227 -2.056 13.117 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -8.577 -0.432 13.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -10.956 -0.401 13.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -10.599 0.273 11.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -11.229 -1.301 11.970 1.00 0.00 H new ATOM 1485 N SER A 96 -6.125 -0.336 6.519 1.00 0.00 N ATOM 1486 CA SER A 96 -5.886 -0.478 5.087 1.00 0.00 C ATOM 1487 C SER A 96 -4.759 -1.470 4.820 1.00 0.00 C ATOM 1488 O SER A 96 -4.830 -2.272 3.888 1.00 0.00 O ATOM 1489 CB SER A 96 -5.544 0.879 4.469 1.00 0.00 C ATOM 1490 OG SER A 96 -6.619 1.791 4.612 1.00 0.00 O ATOM 0 H SER A 96 -6.255 0.626 6.832 1.00 0.00 H new ATOM 0 HA SER A 96 -6.798 -0.859 4.627 1.00 0.00 H new ATOM 0 HB2 SER A 96 -4.653 1.285 4.947 1.00 0.00 H new ATOM 0 HB3 SER A 96 -5.309 0.752 3.412 1.00 0.00 H new ATOM 0 HG SER A 96 -6.975 2.018 3.728 1.00 0.00 H new ATOM 1496 N LEU A 97 -3.719 -1.410 5.644 1.00 0.00 N ATOM 1497 CA LEU A 97 -2.575 -2.303 5.498 1.00 0.00 C ATOM 1498 C LEU A 97 -2.976 -3.751 5.764 1.00 0.00 C ATOM 1499 O LEU A 97 -2.498 -4.669 5.099 1.00 0.00 O ATOM 1500 CB LEU A 97 -1.454 -1.889 6.453 1.00 0.00 C ATOM 1501 CG LEU A 97 -0.805 -0.532 6.178 1.00 0.00 C ATOM 1502 CD1 LEU A 97 -0.022 -0.058 7.393 1.00 0.00 C ATOM 1503 CD2 LEU A 97 0.100 -0.612 4.957 1.00 0.00 C ATOM 0 H LEU A 97 -3.644 -0.752 6.420 1.00 0.00 H new ATOM 0 HA LEU A 97 -2.216 -2.228 4.472 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -1.853 -1.880 7.467 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -0.678 -2.653 6.423 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.594 0.192 5.975 1.00 0.00 H new ATOM 0 HD11 LEU A 97 0.433 0.909 7.178 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -0.695 0.039 8.245 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.759 -0.782 7.628 1.00 0.00 H new ATOM 0 HD21 LEU A 97 0.554 0.362 4.776 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.883 -1.350 5.132 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -0.488 -0.906 4.087 1.00 0.00 H new ATOM 1515 N GLU A 98 -3.858 -3.945 6.740 1.00 0.00 N ATOM 1516 CA GLU A 98 -4.324 -5.281 7.092 1.00 0.00 C ATOM 1517 C GLU A 98 -5.151 -5.885 5.961 1.00 0.00 C ATOM 1518 O GLU A 98 -5.078 -7.084 5.696 1.00 0.00 O ATOM 1519 CB GLU A 98 -5.155 -5.233 8.376 1.00 0.00 C ATOM 1520 CG GLU A 98 -4.316 -5.199 9.643 1.00 0.00 C ATOM 1521 CD GLU A 98 -5.014 -5.850 10.822 1.00 0.00 C ATOM 1522 OE1 GLU A 98 -5.018 -7.097 10.895 1.00 0.00 O ATOM 1523 OE2 GLU A 98 -5.555 -5.112 11.672 1.00 0.00 O ATOM 0 H GLU A 98 -4.263 -3.195 7.300 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.450 -5.911 7.256 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -5.796 -4.352 8.351 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -5.810 -6.103 8.407 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -3.369 -5.706 9.461 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.081 -4.164 9.891 1.00 0.00 H new ATOM 1530 N ALA A 99 -5.938 -5.044 5.297 1.00 0.00 N ATOM 1531 CA ALA A 99 -6.778 -5.493 4.194 1.00 0.00 C ATOM 1532 C ALA A 99 -5.937 -5.833 2.968 1.00 0.00 C ATOM 1533 O ALA A 99 -6.230 -6.788 2.249 1.00 0.00 O ATOM 1534 CB ALA A 99 -7.811 -4.430 3.850 1.00 0.00 C ATOM 0 H ALA A 99 -6.011 -4.048 5.504 1.00 0.00 H new ATOM 0 HA ALA A 99 -7.297 -6.398 4.509 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -8.431 -4.779 3.024 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -8.439 -4.238 4.720 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -7.304 -3.510 3.559 1.00 0.00 H new ATOM 1540 N MET A 100 -4.893 -5.045 2.734 1.00 0.00 N ATOM 1541 CA MET A 100 -4.010 -5.263 1.595 1.00 0.00 C ATOM 1542 C MET A 100 -3.367 -6.645 1.663 1.00 0.00 C ATOM 1543 O MET A 100 -3.632 -7.507 0.825 1.00 0.00 O ATOM 1544 CB MET A 100 -2.927 -4.185 1.547 1.00 0.00 C ATOM 1545 CG MET A 100 -1.888 -4.414 0.462 1.00 0.00 C ATOM 1546 SD MET A 100 -0.764 -3.017 0.268 1.00 0.00 S ATOM 1547 CE MET A 100 0.033 -3.000 1.872 1.00 0.00 C ATOM 0 H MET A 100 -4.638 -4.249 3.319 1.00 0.00 H new ATOM 0 HA MET A 100 -4.609 -5.205 0.686 1.00 0.00 H new ATOM 0 HB2 MET A 100 -3.398 -3.215 1.388 1.00 0.00 H new ATOM 0 HB3 MET A 100 -2.426 -4.141 2.514 1.00 0.00 H new ATOM 0 HG2 MET A 100 -1.312 -5.308 0.699 1.00 0.00 H new ATOM 0 HG3 MET A 100 -2.393 -4.603 -0.485 1.00 0.00 H new ATOM 0 HE1 MET A 100 0.888 -2.324 1.847 1.00 0.00 H new ATOM 0 HE2 MET A 100 -0.676 -2.660 2.627 1.00 0.00 H new ATOM 0 HE3 MET A 100 0.373 -4.005 2.120 1.00 0.00 H new ATOM 1557 N LYS A 101 -2.519 -6.849 2.665 1.00 0.00 N ATOM 1558 CA LYS A 101 -1.838 -8.125 2.844 1.00 0.00 C ATOM 1559 C LYS A 101 -2.813 -9.288 2.696 1.00 0.00 C ATOM 1560 O LYS A 101 -2.597 -10.193 1.890 1.00 0.00 O ATOM 1561 CB LYS A 101 -1.167 -8.181 4.218 1.00 0.00 C ATOM 1562 CG LYS A 101 -2.134 -7.998 5.375 1.00 0.00 C ATOM 1563 CD LYS A 101 -1.400 -7.730 6.678 1.00 0.00 C ATOM 1564 CE LYS A 101 -2.229 -8.150 7.882 1.00 0.00 C ATOM 1565 NZ LYS A 101 -2.081 -9.602 8.178 1.00 0.00 N ATOM 0 H LYS A 101 -2.287 -6.146 3.366 1.00 0.00 H new ATOM 0 HA LYS A 101 -1.075 -8.212 2.070 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -0.661 -9.140 4.327 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -0.400 -7.408 4.270 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -2.808 -7.169 5.159 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -2.750 -8.891 5.480 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -0.453 -8.270 6.681 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -1.162 -6.669 6.751 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -1.925 -7.569 8.753 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -3.279 -7.922 7.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -2.661 -9.849 9.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -2.395 -10.157 7.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -1.083 -9.815 8.379 1.00 0.00 H new ATOM 1579 N SER A 102 -3.888 -9.257 3.477 1.00 0.00 N ATOM 1580 CA SER A 102 -4.896 -10.309 3.435 1.00 0.00 C ATOM 1581 C SER A 102 -5.067 -10.840 2.014 1.00 0.00 C ATOM 1582 O SER A 102 -5.035 -12.050 1.783 1.00 0.00 O ATOM 1583 CB SER A 102 -6.234 -9.786 3.959 1.00 0.00 C ATOM 1584 OG SER A 102 -7.023 -10.838 4.486 1.00 0.00 O ATOM 0 H SER A 102 -4.083 -8.513 4.147 1.00 0.00 H new ATOM 0 HA SER A 102 -4.559 -11.126 4.073 1.00 0.00 H new ATOM 0 HB2 SER A 102 -6.058 -9.038 4.732 1.00 0.00 H new ATOM 0 HB3 SER A 102 -6.775 -9.291 3.153 1.00 0.00 H new ATOM 0 HG SER A 102 -7.872 -10.477 4.816 1.00 0.00 H new ATOM 1590 N HIS A 103 -5.248 -9.927 1.066 1.00 0.00 N ATOM 1591 CA HIS A 103 -5.424 -10.302 -0.333 1.00 0.00 C ATOM 1592 C HIS A 103 -4.227 -11.105 -0.834 1.00 0.00 C ATOM 1593 O HIS A 103 -4.389 -12.159 -1.451 1.00 0.00 O ATOM 1594 CB HIS A 103 -5.615 -9.055 -1.197 1.00 0.00 C ATOM 1595 CG HIS A 103 -6.221 -9.342 -2.536 1.00 0.00 C ATOM 1596 ND1 HIS A 103 -5.474 -9.482 -3.686 1.00 0.00 N ATOM 1597 CD2 HIS A 103 -7.512 -9.516 -2.905 1.00 0.00 C ATOM 1598 CE1 HIS A 103 -6.279 -9.729 -4.705 1.00 0.00 C ATOM 1599 NE2 HIS A 103 -7.521 -9.755 -4.257 1.00 0.00 N ATOM 0 H HIS A 103 -5.277 -8.922 1.240 1.00 0.00 H new ATOM 0 HA HIS A 103 -6.315 -10.926 -0.408 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -6.250 -8.347 -0.664 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -4.649 -8.571 -1.341 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -8.375 -9.475 -2.256 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -5.973 -9.883 -5.729 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -8.352 -9.925 -4.823 1.00 0.00 H new ATOM 1607 N CYS A 104 -3.028 -10.599 -0.567 1.00 0.00 N ATOM 1608 CA CYS A 104 -1.804 -11.268 -0.993 1.00 0.00 C ATOM 1609 C CYS A 104 -1.865 -12.761 -0.686 1.00 0.00 C ATOM 1610 O CYS A 104 -1.823 -13.595 -1.592 1.00 0.00 O ATOM 1611 CB CYS A 104 -0.590 -10.643 -0.304 1.00 0.00 C ATOM 1612 SG CYS A 104 -0.312 -8.908 -0.730 1.00 0.00 S ATOM 0 H CYS A 104 -2.877 -9.728 -0.058 1.00 0.00 H new ATOM 0 HA CYS A 104 -1.706 -11.141 -2.071 1.00 0.00 H new ATOM 0 HB2 CYS A 104 -0.716 -10.725 0.776 1.00 0.00 H new ATOM 0 HB3 CYS A 104 0.299 -11.217 -0.566 1.00 0.00 H new ATOM 0 HG CYS A 104 -1.049 -8.589 -1.752 1.00 0.00 H new ATOM 1618 N LEU A 105 -1.964 -13.092 0.597 1.00 0.00 N ATOM 1619 CA LEU A 105 -2.029 -14.485 1.025 1.00 0.00 C ATOM 1620 C LEU A 105 -3.148 -15.226 0.299 1.00 0.00 C ATOM 1621 O LEU A 105 -2.930 -16.291 -0.278 1.00 0.00 O ATOM 1622 CB LEU A 105 -2.246 -14.565 2.537 1.00 0.00 C ATOM 1623 CG LEU A 105 -1.350 -13.669 3.392 1.00 0.00 C ATOM 1624 CD1 LEU A 105 -1.989 -12.302 3.583 1.00 0.00 C ATOM 1625 CD2 LEU A 105 -1.071 -14.322 4.738 1.00 0.00 C ATOM 0 H LEU A 105 -2.001 -12.415 1.359 1.00 0.00 H new ATOM 0 HA LEU A 105 -1.081 -14.961 0.775 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -3.285 -14.313 2.748 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -2.098 -15.598 2.851 1.00 0.00 H new ATOM 0 HG LEU A 105 -0.401 -13.535 2.872 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -1.337 -11.678 4.194 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -2.137 -11.830 2.611 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -2.952 -12.417 4.081 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -0.432 -13.670 5.333 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -2.011 -14.487 5.264 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -0.570 -15.277 4.582 1.00 0.00 H new ATOM 1637 N LYS A 106 -4.347 -14.653 0.330 1.00 0.00 N ATOM 1638 CA LYS A 106 -5.500 -15.256 -0.327 1.00 0.00 C ATOM 1639 C LYS A 106 -5.113 -15.832 -1.685 1.00 0.00 C ATOM 1640 O LYS A 106 -5.275 -17.027 -1.932 1.00 0.00 O ATOM 1641 CB LYS A 106 -6.614 -14.220 -0.500 1.00 0.00 C ATOM 1642 CG LYS A 106 -7.557 -14.137 0.688 1.00 0.00 C ATOM 1643 CD LYS A 106 -8.519 -12.968 0.555 1.00 0.00 C ATOM 1644 CE LYS A 106 -9.678 -13.303 -0.370 1.00 0.00 C ATOM 1645 NZ LYS A 106 -10.818 -13.915 0.367 1.00 0.00 N ATOM 0 H LYS A 106 -4.545 -13.771 0.803 1.00 0.00 H new ATOM 0 HA LYS A 106 -5.862 -16.069 0.303 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -6.165 -13.241 -0.666 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -7.189 -14.463 -1.393 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -8.121 -15.066 0.772 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -6.979 -14.031 1.606 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -8.903 -12.698 1.539 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -7.986 -12.098 0.171 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -10.015 -12.396 -0.872 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -9.337 -13.989 -1.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -11.588 -14.129 -0.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -10.503 -14.794 0.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -11.161 -13.251 1.090 1.00 0.00 H new ATOM 1659 N ASN A 107 -4.599 -14.976 -2.562 1.00 0.00 N ATOM 1660 CA ASN A 107 -4.188 -15.401 -3.895 1.00 0.00 C ATOM 1661 C ASN A 107 -2.795 -16.023 -3.862 1.00 0.00 C ATOM 1662 O ASN A 107 -2.627 -17.210 -4.136 1.00 0.00 O ATOM 1663 CB ASN A 107 -4.206 -14.214 -4.860 1.00 0.00 C ATOM 1664 CG ASN A 107 -5.448 -13.359 -4.702 1.00 0.00 C ATOM 1665 OD1 ASN A 107 -5.385 -12.384 -3.801 1.00 0.00 O flip ATOM 1666 ND2 ASN A 107 -6.453 -13.572 -5.381 1.00 0.00 N flip ATOM 0 H ASN A 107 -4.457 -13.984 -2.373 1.00 0.00 H new ATOM 0 HA ASN A 107 -4.895 -16.154 -4.243 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -3.322 -13.599 -4.692 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -4.149 -14.581 -5.885 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -6.457 -14.332 -6.061 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -7.281 -12.988 -5.263 1.00 0.00 H new ATOM 1673 N GLY A 108 -1.798 -15.211 -3.524 1.00 0.00 N ATOM 1674 CA GLY A 108 -0.433 -15.699 -3.460 1.00 0.00 C ATOM 1675 C GLY A 108 0.575 -14.664 -3.920 1.00 0.00 C ATOM 1676 O GLY A 108 1.435 -14.951 -4.752 1.00 0.00 O ATOM 0 H GLY A 108 -1.911 -14.224 -3.293 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -0.204 -15.995 -2.436 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -0.340 -16.592 -4.078 1.00 0.00 H new ATOM 1680 N VAL A 109 0.468 -13.454 -3.378 1.00 0.00 N ATOM 1681 CA VAL A 109 1.376 -12.372 -3.738 1.00 0.00 C ATOM 1682 C VAL A 109 2.460 -12.190 -2.681 1.00 0.00 C ATOM 1683 O VAL A 109 2.235 -11.563 -1.645 1.00 0.00 O ATOM 1684 CB VAL A 109 0.622 -11.042 -3.918 1.00 0.00 C ATOM 1685 CG1 VAL A 109 1.598 -9.905 -4.180 1.00 0.00 C ATOM 1686 CG2 VAL A 109 -0.394 -11.154 -5.045 1.00 0.00 C ATOM 0 H VAL A 109 -0.239 -13.199 -2.688 1.00 0.00 H new ATOM 0 HA VAL A 109 1.838 -12.649 -4.685 1.00 0.00 H new ATOM 0 HB VAL A 109 0.085 -10.822 -2.996 1.00 0.00 H new ATOM 0 HG11 VAL A 109 1.046 -8.973 -4.305 1.00 0.00 H new ATOM 0 HG12 VAL A 109 2.282 -9.811 -3.337 1.00 0.00 H new ATOM 0 HG13 VAL A 109 2.166 -10.114 -5.087 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -0.918 -10.205 -5.158 1.00 0.00 H new ATOM 0 HG22 VAL A 109 0.120 -11.398 -5.975 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -1.113 -11.939 -4.810 1.00 0.00 H new ATOM 1696 N THR A 110 3.639 -12.743 -2.949 1.00 0.00 N ATOM 1697 CA THR A 110 4.759 -12.642 -2.021 1.00 0.00 C ATOM 1698 C THR A 110 5.785 -11.625 -2.506 1.00 0.00 C ATOM 1699 O THR A 110 6.986 -11.791 -2.295 1.00 0.00 O ATOM 1700 CB THR A 110 5.454 -14.004 -1.830 1.00 0.00 C ATOM 1701 OG1 THR A 110 6.414 -13.919 -0.771 1.00 0.00 O ATOM 1702 CG2 THR A 110 6.143 -14.445 -3.113 1.00 0.00 C ATOM 0 H THR A 110 3.843 -13.265 -3.801 1.00 0.00 H new ATOM 0 HA THR A 110 4.350 -12.313 -1.066 1.00 0.00 H new ATOM 0 HB THR A 110 4.694 -14.742 -1.573 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.952 -13.107 -0.882 1.00 0.00 H new ATOM 0 HG21 THR A 110 6.626 -15.409 -2.954 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.405 -14.537 -3.910 1.00 0.00 H new ATOM 0 HG23 THR A 110 6.892 -13.706 -3.396 1.00 0.00 H new ATOM 1710 N ASP A 111 5.304 -10.570 -3.156 1.00 0.00 N ATOM 1711 CA ASP A 111 6.180 -9.524 -3.669 1.00 0.00 C ATOM 1712 C ASP A 111 5.403 -8.234 -3.910 1.00 0.00 C ATOM 1713 O ASP A 111 4.501 -8.187 -4.748 1.00 0.00 O ATOM 1714 CB ASP A 111 6.849 -9.980 -4.967 1.00 0.00 C ATOM 1715 CG ASP A 111 5.930 -10.826 -5.826 1.00 0.00 C ATOM 1716 OD1 ASP A 111 4.921 -10.285 -6.326 1.00 0.00 O ATOM 1717 OD2 ASP A 111 6.220 -12.028 -5.999 1.00 0.00 O ATOM 0 H ASP A 111 4.312 -10.417 -3.340 1.00 0.00 H new ATOM 0 HA ASP A 111 6.949 -9.330 -2.921 1.00 0.00 H new ATOM 0 HB2 ASP A 111 7.169 -9.106 -5.534 1.00 0.00 H new ATOM 0 HB3 ASP A 111 7.746 -10.551 -4.729 1.00 0.00 H new ATOM 1722 N LEU A 112 5.756 -7.189 -3.169 1.00 0.00 N ATOM 1723 CA LEU A 112 5.091 -5.897 -3.301 1.00 0.00 C ATOM 1724 C LEU A 112 6.108 -4.761 -3.331 1.00 0.00 C ATOM 1725 O LEU A 112 7.222 -4.898 -2.824 1.00 0.00 O ATOM 1726 CB LEU A 112 4.109 -5.687 -2.147 1.00 0.00 C ATOM 1727 CG LEU A 112 3.049 -4.606 -2.356 1.00 0.00 C ATOM 1728 CD1 LEU A 112 2.144 -4.965 -3.524 1.00 0.00 C ATOM 1729 CD2 LEU A 112 2.232 -4.407 -1.088 1.00 0.00 C ATOM 0 H LEU A 112 6.499 -7.211 -2.471 1.00 0.00 H new ATOM 0 HA LEU A 112 4.542 -5.893 -4.243 1.00 0.00 H new ATOM 0 HB2 LEU A 112 3.602 -6.632 -1.951 1.00 0.00 H new ATOM 0 HB3 LEU A 112 4.679 -5.440 -1.252 1.00 0.00 H new ATOM 0 HG LEU A 112 3.555 -3.669 -2.589 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.396 -4.184 -3.658 1.00 0.00 H new ATOM 0 HD12 LEU A 112 2.740 -5.056 -4.432 1.00 0.00 H new ATOM 0 HD13 LEU A 112 1.646 -5.913 -3.321 1.00 0.00 H new ATOM 0 HD21 LEU A 112 1.482 -3.634 -1.256 1.00 0.00 H new ATOM 0 HD22 LEU A 112 1.737 -5.341 -0.824 1.00 0.00 H new ATOM 0 HD23 LEU A 112 2.891 -4.103 -0.275 1.00 0.00 H new ATOM 1741 N SER A 113 5.718 -3.640 -3.928 1.00 0.00 N ATOM 1742 CA SER A 113 6.596 -2.480 -4.026 1.00 0.00 C ATOM 1743 C SER A 113 5.796 -1.184 -3.936 1.00 0.00 C ATOM 1744 O SER A 113 4.691 -1.086 -4.468 1.00 0.00 O ATOM 1745 CB SER A 113 7.382 -2.518 -5.338 1.00 0.00 C ATOM 1746 OG SER A 113 6.566 -2.962 -6.408 1.00 0.00 O ATOM 0 H SER A 113 4.799 -3.510 -4.351 1.00 0.00 H new ATOM 0 HA SER A 113 7.296 -2.513 -3.191 1.00 0.00 H new ATOM 0 HB2 SER A 113 7.771 -1.525 -5.561 1.00 0.00 H new ATOM 0 HB3 SER A 113 8.241 -3.181 -5.232 1.00 0.00 H new ATOM 0 HG SER A 113 5.634 -3.014 -6.109 1.00 0.00 H new ATOM 1752 N MET A 114 6.364 -0.191 -3.260 1.00 0.00 N ATOM 1753 CA MET A 114 5.706 1.101 -3.101 1.00 0.00 C ATOM 1754 C MET A 114 6.718 2.189 -2.761 1.00 0.00 C ATOM 1755 O MET A 114 7.596 2.012 -1.916 1.00 0.00 O ATOM 1756 CB MET A 114 4.637 1.022 -2.009 1.00 0.00 C ATOM 1757 CG MET A 114 5.188 0.626 -0.648 1.00 0.00 C ATOM 1758 SD MET A 114 3.888 0.266 0.549 1.00 0.00 S ATOM 1759 CE MET A 114 3.338 -1.340 -0.021 1.00 0.00 C ATOM 0 H MET A 114 7.279 -0.256 -2.813 1.00 0.00 H new ATOM 0 HA MET A 114 5.230 1.357 -4.048 1.00 0.00 H new ATOM 0 HB2 MET A 114 4.143 1.990 -1.924 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.876 0.301 -2.308 1.00 0.00 H new ATOM 0 HG2 MET A 114 5.827 -0.250 -0.760 1.00 0.00 H new ATOM 0 HG3 MET A 114 5.816 1.431 -0.266 1.00 0.00 H new ATOM 0 HE1 MET A 114 2.249 -1.380 -0.000 1.00 0.00 H new ATOM 0 HE2 MET A 114 3.688 -1.504 -1.040 1.00 0.00 H new ATOM 0 HE3 MET A 114 3.742 -2.115 0.630 1.00 0.00 H new ATOM 1769 N PRO A 115 6.596 3.344 -3.433 1.00 0.00 N ATOM 1770 CA PRO A 115 7.492 4.484 -3.218 1.00 0.00 C ATOM 1771 C PRO A 115 7.280 5.140 -1.858 1.00 0.00 C ATOM 1772 O PRO A 115 6.610 4.583 -0.987 1.00 0.00 O ATOM 1773 CB PRO A 115 7.113 5.450 -4.343 1.00 0.00 C ATOM 1774 CG PRO A 115 5.703 5.106 -4.678 1.00 0.00 C ATOM 1775 CD PRO A 115 5.573 3.625 -4.454 1.00 0.00 C ATOM 0 HA PRO A 115 8.540 4.186 -3.229 1.00 0.00 H new ATOM 0 HB2 PRO A 115 7.202 6.487 -4.021 1.00 0.00 H new ATOM 0 HB3 PRO A 115 7.766 5.328 -5.207 1.00 0.00 H new ATOM 0 HG2 PRO A 115 5.006 5.659 -4.048 1.00 0.00 H new ATOM 0 HG3 PRO A 115 5.473 5.366 -5.711 1.00 0.00 H new ATOM 0 HD2 PRO A 115 4.575 3.357 -4.107 1.00 0.00 H new ATOM 0 HD3 PRO A 115 5.754 3.063 -5.370 1.00 0.00 H new ATOM 1783 N ARG A 116 7.853 6.326 -1.682 1.00 0.00 N ATOM 1784 CA ARG A 116 7.726 7.057 -0.427 1.00 0.00 C ATOM 1785 C ARG A 116 6.357 7.721 -0.321 1.00 0.00 C ATOM 1786 O ARG A 116 5.962 8.494 -1.194 1.00 0.00 O ATOM 1787 CB ARG A 116 8.828 8.112 -0.313 1.00 0.00 C ATOM 1788 CG ARG A 116 10.201 7.531 -0.023 1.00 0.00 C ATOM 1789 CD ARG A 116 11.134 8.574 0.573 1.00 0.00 C ATOM 1790 NE ARG A 116 10.773 8.909 1.948 1.00 0.00 N ATOM 1791 CZ ARG A 116 11.544 9.628 2.756 1.00 0.00 C ATOM 1792 NH1 ARG A 116 12.713 10.085 2.329 1.00 0.00 N ATOM 1793 NH2 ARG A 116 11.147 9.891 3.994 1.00 0.00 N ATOM 0 H ARG A 116 8.410 6.801 -2.393 1.00 0.00 H new ATOM 0 HA ARG A 116 7.829 6.345 0.392 1.00 0.00 H new ATOM 0 HB2 ARG A 116 8.872 8.680 -1.242 1.00 0.00 H new ATOM 0 HB3 ARG A 116 8.566 8.815 0.478 1.00 0.00 H new ATOM 0 HG2 ARG A 116 10.104 6.692 0.666 1.00 0.00 H new ATOM 0 HG3 ARG A 116 10.633 7.139 -0.944 1.00 0.00 H new ATOM 0 HD2 ARG A 116 12.158 8.201 0.548 1.00 0.00 H new ATOM 0 HD3 ARG A 116 11.108 9.476 -0.039 1.00 0.00 H new ATOM 0 HE ARG A 116 9.880 8.572 2.308 1.00 0.00 H new ATOM 0 HH11 ARG A 116 13.022 9.885 1.378 1.00 0.00 H new ATOM 0 HH12 ARG A 116 13.303 10.637 2.952 1.00 0.00 H new ATOM 0 HH21 ARG A 116 10.249 9.541 4.327 1.00 0.00 H new ATOM 0 HH22 ARG A 116 11.740 10.443 4.613 1.00 0.00 H new ATOM 1807 N ILE A 117 5.638 7.415 0.754 1.00 0.00 N ATOM 1808 CA ILE A 117 4.314 7.983 0.974 1.00 0.00 C ATOM 1809 C ILE A 117 4.259 8.757 2.287 1.00 0.00 C ATOM 1810 O ILE A 117 4.941 8.414 3.251 1.00 0.00 O ATOM 1811 CB ILE A 117 3.228 6.891 0.989 1.00 0.00 C ATOM 1812 CG1 ILE A 117 3.554 5.832 2.045 1.00 0.00 C ATOM 1813 CG2 ILE A 117 3.099 6.253 -0.386 1.00 0.00 C ATOM 1814 CD1 ILE A 117 2.484 4.772 2.187 1.00 0.00 C ATOM 0 H ILE A 117 5.950 6.777 1.486 1.00 0.00 H new ATOM 0 HA ILE A 117 4.121 8.664 0.145 1.00 0.00 H new ATOM 0 HB ILE A 117 2.274 7.352 1.245 1.00 0.00 H new ATOM 0 HG12 ILE A 117 4.498 5.352 1.787 1.00 0.00 H new ATOM 0 HG13 ILE A 117 3.698 6.323 3.008 1.00 0.00 H new ATOM 0 HG21 ILE A 117 2.328 5.483 -0.359 1.00 0.00 H new ATOM 0 HG22 ILE A 117 2.826 7.015 -1.116 1.00 0.00 H new ATOM 0 HG23 ILE A 117 4.051 5.803 -0.669 1.00 0.00 H new ATOM 0 HD11 ILE A 117 2.781 4.055 2.952 1.00 0.00 H new ATOM 0 HD12 ILE A 117 1.543 5.241 2.475 1.00 0.00 H new ATOM 0 HD13 ILE A 117 2.355 4.255 1.236 1.00 0.00 H new ATOM 1925 N GLN A 125 3.947 11.163 8.731 1.00 0.00 N ATOM 1926 CA GLN A 125 5.394 11.066 8.583 1.00 0.00 C ATOM 1927 C GLN A 125 5.812 9.639 8.243 1.00 0.00 C ATOM 1928 O GLN A 125 5.507 8.700 8.979 1.00 0.00 O ATOM 1929 CB GLN A 125 6.090 11.521 9.867 1.00 0.00 C ATOM 1930 CG GLN A 125 5.769 12.955 10.257 1.00 0.00 C ATOM 1931 CD GLN A 125 6.786 13.540 11.218 1.00 0.00 C ATOM 1932 OE1 GLN A 125 7.234 12.870 12.149 1.00 0.00 O ATOM 1933 NE2 GLN A 125 7.155 14.796 10.997 1.00 0.00 N ATOM 0 HA GLN A 125 5.695 11.718 7.763 1.00 0.00 H new ATOM 0 HB2 GLN A 125 5.800 10.858 10.682 1.00 0.00 H new ATOM 0 HB3 GLN A 125 7.168 11.420 9.742 1.00 0.00 H new ATOM 0 HG2 GLN A 125 5.727 13.571 9.359 1.00 0.00 H new ATOM 0 HG3 GLN A 125 4.780 12.991 10.714 1.00 0.00 H new ATOM 0 HE21 GLN A 125 6.758 15.314 10.213 1.00 0.00 H new ATOM 0 HE22 GLN A 125 7.836 15.243 11.611 1.00 0.00 H new ATOM 1942 N TRP A 126 6.511 9.483 7.125 1.00 0.00 N ATOM 1943 CA TRP A 126 6.970 8.170 6.687 1.00 0.00 C ATOM 1944 C TRP A 126 7.483 7.352 7.867 1.00 0.00 C ATOM 1945 O TRP A 126 7.444 6.122 7.843 1.00 0.00 O ATOM 1946 CB TRP A 126 8.071 8.317 5.635 1.00 0.00 C ATOM 1947 CG TRP A 126 8.736 7.019 5.286 1.00 0.00 C ATOM 1948 CD1 TRP A 126 10.022 6.655 5.569 1.00 0.00 C ATOM 1949 CD2 TRP A 126 8.148 5.916 4.589 1.00 0.00 C ATOM 1950 NE1 TRP A 126 10.269 5.392 5.088 1.00 0.00 N ATOM 1951 CE2 TRP A 126 9.135 4.916 4.484 1.00 0.00 C ATOM 1952 CE3 TRP A 126 6.884 5.674 4.044 1.00 0.00 C ATOM 1953 CZ2 TRP A 126 8.895 3.697 3.856 1.00 0.00 C ATOM 1954 CZ3 TRP A 126 6.648 4.463 3.421 1.00 0.00 C ATOM 1955 CH2 TRP A 126 7.649 3.487 3.332 1.00 0.00 C ATOM 0 H TRP A 126 6.773 10.250 6.505 1.00 0.00 H new ATOM 0 HA TRP A 126 6.123 7.645 6.245 1.00 0.00 H new ATOM 0 HB2 TRP A 126 7.645 8.753 4.732 1.00 0.00 H new ATOM 0 HB3 TRP A 126 8.823 9.015 6.002 1.00 0.00 H new ATOM 0 HD1 TRP A 126 10.739 7.269 6.093 1.00 0.00 H new ATOM 0 HE1 TRP A 126 11.153 4.890 5.168 1.00 0.00 H new ATOM 0 HE3 TRP A 126 6.106 6.420 4.108 1.00 0.00 H new ATOM 0 HZ2 TRP A 126 9.665 2.944 3.785 1.00 0.00 H new ATOM 0 HZ3 TRP A 126 5.675 4.266 2.995 1.00 0.00 H new ATOM 0 HH2 TRP A 126 7.433 2.550 2.840 1.00 0.00 H new ATOM 1966 N GLU A 127 7.962 8.042 8.897 1.00 0.00 N ATOM 1967 CA GLU A 127 8.482 7.376 10.085 1.00 0.00 C ATOM 1968 C GLU A 127 7.430 6.457 10.699 1.00 0.00 C ATOM 1969 O GLU A 127 7.709 5.302 11.015 1.00 0.00 O ATOM 1970 CB GLU A 127 8.937 8.410 11.118 1.00 0.00 C ATOM 1971 CG GLU A 127 10.050 7.914 12.026 1.00 0.00 C ATOM 1972 CD GLU A 127 11.326 7.603 11.269 1.00 0.00 C ATOM 1973 OE1 GLU A 127 11.427 6.494 10.705 1.00 0.00 O ATOM 1974 OE2 GLU A 127 12.224 8.471 11.240 1.00 0.00 O ATOM 0 H GLU A 127 8.001 9.061 8.933 1.00 0.00 H new ATOM 0 HA GLU A 127 9.337 6.771 9.785 1.00 0.00 H new ATOM 0 HB2 GLU A 127 9.276 9.306 10.598 1.00 0.00 H new ATOM 0 HB3 GLU A 127 8.083 8.700 11.730 1.00 0.00 H new ATOM 0 HG2 GLU A 127 10.257 8.668 12.785 1.00 0.00 H new ATOM 0 HG3 GLU A 127 9.715 7.018 12.549 1.00 0.00 H new ATOM 1981 N ASN A 128 6.220 6.981 10.864 1.00 0.00 N ATOM 1982 CA ASN A 128 5.125 6.208 11.441 1.00 0.00 C ATOM 1983 C ASN A 128 4.644 5.136 10.468 1.00 0.00 C ATOM 1984 O ASN A 128 4.627 3.949 10.795 1.00 0.00 O ATOM 1985 CB ASN A 128 3.963 7.131 11.814 1.00 0.00 C ATOM 1986 CG ASN A 128 4.330 8.105 12.918 1.00 0.00 C ATOM 1987 OD1 ASN A 128 4.385 9.388 12.581 1.00 0.00 O flip ATOM 1988 ND2 ASN A 128 4.562 7.707 14.060 1.00 0.00 N flip ATOM 0 H ASN A 128 5.973 7.937 10.607 1.00 0.00 H new ATOM 0 HA ASN A 128 5.495 5.717 12.341 1.00 0.00 H new ATOM 0 HB2 ASN A 128 3.647 7.688 10.932 1.00 0.00 H new ATOM 0 HB3 ASN A 128 3.112 6.529 12.132 1.00 0.00 H new ATOM 0 HD21 ASN A 128 4.508 6.711 14.274 1.00 0.00 H new ATOM 0 HD22 ASN A 128 4.808 8.373 14.792 1.00 0.00 H new ATOM 1995 N VAL A 129 4.255 5.562 9.271 1.00 0.00 N ATOM 1996 CA VAL A 129 3.776 4.639 8.249 1.00 0.00 C ATOM 1997 C VAL A 129 4.677 3.413 8.150 1.00 0.00 C ATOM 1998 O VAL A 129 4.226 2.282 8.333 1.00 0.00 O ATOM 1999 CB VAL A 129 3.699 5.319 6.869 1.00 0.00 C ATOM 2000 CG1 VAL A 129 3.090 4.377 5.842 1.00 0.00 C ATOM 2001 CG2 VAL A 129 2.902 6.612 6.957 1.00 0.00 C ATOM 0 H VAL A 129 4.262 6.541 8.985 1.00 0.00 H new ATOM 0 HA VAL A 129 2.775 4.328 8.548 1.00 0.00 H new ATOM 0 HB VAL A 129 4.711 5.563 6.547 1.00 0.00 H new ATOM 0 HG11 VAL A 129 3.044 4.875 4.874 1.00 0.00 H new ATOM 0 HG12 VAL A 129 3.705 3.481 5.760 1.00 0.00 H new ATOM 0 HG13 VAL A 129 2.084 4.099 6.155 1.00 0.00 H new ATOM 0 HG21 VAL A 129 2.857 7.080 5.973 1.00 0.00 H new ATOM 0 HG22 VAL A 129 1.891 6.394 7.301 1.00 0.00 H new ATOM 0 HG23 VAL A 129 3.386 7.290 7.660 1.00 0.00 H new ATOM 2011 N SER A 130 5.953 3.645 7.859 1.00 0.00 N ATOM 2012 CA SER A 130 6.918 2.560 7.732 1.00 0.00 C ATOM 2013 C SER A 130 6.776 1.569 8.884 1.00 0.00 C ATOM 2014 O SER A 130 6.819 0.356 8.682 1.00 0.00 O ATOM 2015 CB SER A 130 8.342 3.117 7.695 1.00 0.00 C ATOM 2016 OG SER A 130 8.691 3.706 8.935 1.00 0.00 O ATOM 0 H SER A 130 6.342 4.575 7.707 1.00 0.00 H new ATOM 0 HA SER A 130 6.717 2.035 6.798 1.00 0.00 H new ATOM 0 HB2 SER A 130 9.043 2.316 7.459 1.00 0.00 H new ATOM 0 HB3 SER A 130 8.425 3.858 6.900 1.00 0.00 H new ATOM 0 HG SER A 130 8.275 4.591 9.005 1.00 0.00 H new ATOM 2022 N ALA A 131 6.607 2.097 10.092 1.00 0.00 N ATOM 2023 CA ALA A 131 6.457 1.261 11.276 1.00 0.00 C ATOM 2024 C ALA A 131 5.195 0.410 11.191 1.00 0.00 C ATOM 2025 O ALA A 131 5.219 -0.784 11.487 1.00 0.00 O ATOM 2026 CB ALA A 131 6.432 2.122 12.530 1.00 0.00 C ATOM 0 H ALA A 131 6.571 3.100 10.276 1.00 0.00 H new ATOM 0 HA ALA A 131 7.314 0.589 11.327 1.00 0.00 H new ATOM 0 HB1 ALA A 131 6.319 1.484 13.407 1.00 0.00 H new ATOM 0 HB2 ALA A 131 7.364 2.682 12.606 1.00 0.00 H new ATOM 0 HB3 ALA A 131 5.594 2.817 12.477 1.00 0.00 H new ATOM 2032 N MET A 132 4.093 1.033 10.786 1.00 0.00 N ATOM 2033 CA MET A 132 2.820 0.331 10.662 1.00 0.00 C ATOM 2034 C MET A 132 2.955 -0.880 9.745 1.00 0.00 C ATOM 2035 O MET A 132 2.360 -1.929 9.996 1.00 0.00 O ATOM 2036 CB MET A 132 1.743 1.275 10.125 1.00 0.00 C ATOM 2037 CG MET A 132 1.002 2.035 11.214 1.00 0.00 C ATOM 2038 SD MET A 132 1.960 3.412 11.874 1.00 0.00 S ATOM 2039 CE MET A 132 0.928 4.798 11.403 1.00 0.00 C ATOM 0 H MET A 132 4.056 2.022 10.538 1.00 0.00 H new ATOM 0 HA MET A 132 2.527 -0.016 11.653 1.00 0.00 H new ATOM 0 HB2 MET A 132 2.205 1.990 9.444 1.00 0.00 H new ATOM 0 HB3 MET A 132 1.024 0.699 9.542 1.00 0.00 H new ATOM 0 HG2 MET A 132 0.061 2.411 10.813 1.00 0.00 H new ATOM 0 HG3 MET A 132 0.752 1.350 12.024 1.00 0.00 H new ATOM 0 HE1 MET A 132 1.032 5.595 12.139 1.00 0.00 H new ATOM 0 HE2 MET A 132 1.237 5.165 10.424 1.00 0.00 H new ATOM 0 HE3 MET A 132 -0.113 4.478 11.359 1.00 0.00 H new ATOM 2049 N ILE A 133 3.739 -0.729 8.683 1.00 0.00 N ATOM 2050 CA ILE A 133 3.951 -1.811 7.730 1.00 0.00 C ATOM 2051 C ILE A 133 4.733 -2.956 8.364 1.00 0.00 C ATOM 2052 O ILE A 133 4.587 -4.113 7.970 1.00 0.00 O ATOM 2053 CB ILE A 133 4.704 -1.320 6.479 1.00 0.00 C ATOM 2054 CG1 ILE A 133 3.924 -0.194 5.797 1.00 0.00 C ATOM 2055 CG2 ILE A 133 4.934 -2.473 5.513 1.00 0.00 C ATOM 2056 CD1 ILE A 133 4.769 0.648 4.867 1.00 0.00 C ATOM 0 H ILE A 133 4.238 0.132 8.461 1.00 0.00 H new ATOM 0 HA ILE A 133 2.965 -2.168 7.433 1.00 0.00 H new ATOM 0 HB ILE A 133 5.674 -0.930 6.786 1.00 0.00 H new ATOM 0 HG12 ILE A 133 3.097 -0.625 5.233 1.00 0.00 H new ATOM 0 HG13 ILE A 133 3.487 0.449 6.561 1.00 0.00 H new ATOM 0 HG21 ILE A 133 5.467 -2.110 4.634 1.00 0.00 H new ATOM 0 HG22 ILE A 133 5.526 -3.246 6.003 1.00 0.00 H new ATOM 0 HG23 ILE A 133 3.974 -2.890 5.209 1.00 0.00 H new ATOM 0 HD11 ILE A 133 4.151 1.426 4.419 1.00 0.00 H new ATOM 0 HD12 ILE A 133 5.581 1.108 5.430 1.00 0.00 H new ATOM 0 HD13 ILE A 133 5.184 0.017 4.081 1.00 0.00 H new ATOM 2068 N GLU A 134 5.562 -2.625 9.349 1.00 0.00 N ATOM 2069 CA GLU A 134 6.367 -3.627 10.038 1.00 0.00 C ATOM 2070 C GLU A 134 5.516 -4.426 11.021 1.00 0.00 C ATOM 2071 O GLU A 134 5.494 -5.656 10.981 1.00 0.00 O ATOM 2072 CB GLU A 134 7.529 -2.961 10.777 1.00 0.00 C ATOM 2073 CG GLU A 134 8.426 -2.129 9.876 1.00 0.00 C ATOM 2074 CD GLU A 134 9.838 -2.002 10.414 1.00 0.00 C ATOM 2075 OE1 GLU A 134 9.992 -1.630 11.596 1.00 0.00 O ATOM 2076 OE2 GLU A 134 10.789 -2.277 9.653 1.00 0.00 O ATOM 0 H GLU A 134 5.694 -1.672 9.688 1.00 0.00 H new ATOM 0 HA GLU A 134 6.767 -4.311 9.290 1.00 0.00 H new ATOM 0 HB2 GLU A 134 7.129 -2.324 11.566 1.00 0.00 H new ATOM 0 HB3 GLU A 134 8.129 -3.731 11.262 1.00 0.00 H new ATOM 0 HG2 GLU A 134 8.458 -2.581 8.885 1.00 0.00 H new ATOM 0 HG3 GLU A 134 7.995 -1.135 9.759 1.00 0.00 H new ATOM 2083 N GLU A 135 4.818 -3.717 11.903 1.00 0.00 N ATOM 2084 CA GLU A 135 3.967 -4.360 12.897 1.00 0.00 C ATOM 2085 C GLU A 135 2.830 -5.126 12.227 1.00 0.00 C ATOM 2086 O GLU A 135 2.349 -6.130 12.751 1.00 0.00 O ATOM 2087 CB GLU A 135 3.396 -3.319 13.862 1.00 0.00 C ATOM 2088 CG GLU A 135 2.302 -2.459 13.252 1.00 0.00 C ATOM 2089 CD GLU A 135 1.824 -1.369 14.192 1.00 0.00 C ATOM 2090 OE1 GLU A 135 2.586 -0.408 14.423 1.00 0.00 O ATOM 2091 OE2 GLU A 135 0.687 -1.479 14.696 1.00 0.00 O ATOM 0 H GLU A 135 4.825 -2.698 11.949 1.00 0.00 H new ATOM 0 HA GLU A 135 4.578 -5.068 13.457 1.00 0.00 H new ATOM 0 HB2 GLU A 135 2.999 -3.829 14.740 1.00 0.00 H new ATOM 0 HB3 GLU A 135 4.204 -2.674 14.207 1.00 0.00 H new ATOM 0 HG2 GLU A 135 2.672 -2.004 12.333 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.458 -3.092 12.977 1.00 0.00 H new ATOM 2098 N VAL A 136 2.405 -4.643 11.063 1.00 0.00 N ATOM 2099 CA VAL A 136 1.325 -5.281 10.320 1.00 0.00 C ATOM 2100 C VAL A 136 1.801 -6.567 9.653 1.00 0.00 C ATOM 2101 O VAL A 136 1.208 -7.630 9.836 1.00 0.00 O ATOM 2102 CB VAL A 136 0.752 -4.340 9.244 1.00 0.00 C ATOM 2103 CG1 VAL A 136 -0.167 -5.103 8.302 1.00 0.00 C ATOM 2104 CG2 VAL A 136 0.017 -3.176 9.891 1.00 0.00 C ATOM 0 H VAL A 136 2.792 -3.813 10.615 1.00 0.00 H new ATOM 0 HA VAL A 136 0.542 -5.517 11.041 1.00 0.00 H new ATOM 0 HB VAL A 136 1.580 -3.938 8.660 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -0.562 -4.422 7.549 1.00 0.00 H new ATOM 0 HG12 VAL A 136 0.394 -5.900 7.813 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -0.992 -5.535 8.869 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -0.381 -2.521 9.116 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -0.802 -3.557 10.501 1.00 0.00 H new ATOM 0 HG23 VAL A 136 0.707 -2.615 10.521 1.00 0.00 H new ATOM 2114 N PHE A 137 2.877 -6.463 8.880 1.00 0.00 N ATOM 2115 CA PHE A 137 3.434 -7.617 8.185 1.00 0.00 C ATOM 2116 C PHE A 137 4.311 -8.444 9.121 1.00 0.00 C ATOM 2117 O PHE A 137 4.842 -9.484 8.732 1.00 0.00 O ATOM 2118 CB PHE A 137 4.249 -7.165 6.972 1.00 0.00 C ATOM 2119 CG PHE A 137 3.403 -6.736 5.807 1.00 0.00 C ATOM 2120 CD1 PHE A 137 2.613 -5.601 5.888 1.00 0.00 C ATOM 2121 CD2 PHE A 137 3.398 -7.469 4.631 1.00 0.00 C ATOM 2122 CE1 PHE A 137 1.833 -5.205 4.818 1.00 0.00 C ATOM 2123 CE2 PHE A 137 2.620 -7.078 3.558 1.00 0.00 C ATOM 2124 CZ PHE A 137 1.837 -5.944 3.651 1.00 0.00 C ATOM 0 H PHE A 137 3.381 -5.591 8.719 1.00 0.00 H new ATOM 0 HA PHE A 137 2.606 -8.239 7.846 1.00 0.00 H new ATOM 0 HB2 PHE A 137 4.895 -6.337 7.266 1.00 0.00 H new ATOM 0 HB3 PHE A 137 4.900 -7.981 6.657 1.00 0.00 H new ATOM 0 HD1 PHE A 137 2.607 -5.019 6.798 1.00 0.00 H new ATOM 0 HD2 PHE A 137 4.009 -8.356 4.552 1.00 0.00 H new ATOM 0 HE1 PHE A 137 1.221 -4.318 4.894 1.00 0.00 H new ATOM 0 HE2 PHE A 137 2.624 -7.659 2.647 1.00 0.00 H new ATOM 0 HZ PHE A 137 1.229 -5.636 2.813 1.00 0.00 H new ATOM 2134 N GLU A 138 4.457 -7.973 10.355 1.00 0.00 N ATOM 2135 CA GLU A 138 5.271 -8.669 11.346 1.00 0.00 C ATOM 2136 C GLU A 138 5.031 -10.174 11.287 1.00 0.00 C ATOM 2137 O GLU A 138 5.961 -10.968 11.427 1.00 0.00 O ATOM 2138 CB GLU A 138 4.960 -8.146 12.751 1.00 0.00 C ATOM 2139 CG GLU A 138 3.737 -8.789 13.382 1.00 0.00 C ATOM 2140 CD GLU A 138 3.350 -8.139 14.697 1.00 0.00 C ATOM 2141 OE1 GLU A 138 4.239 -7.960 15.555 1.00 0.00 O ATOM 2142 OE2 GLU A 138 2.157 -7.810 14.867 1.00 0.00 O ATOM 0 H GLU A 138 4.023 -7.114 10.693 1.00 0.00 H new ATOM 0 HA GLU A 138 6.319 -8.477 11.118 1.00 0.00 H new ATOM 0 HB2 GLU A 138 5.823 -8.319 13.393 1.00 0.00 H new ATOM 0 HB3 GLU A 138 4.809 -7.068 12.703 1.00 0.00 H new ATOM 0 HG2 GLU A 138 2.899 -8.725 12.688 1.00 0.00 H new ATOM 0 HG3 GLU A 138 3.933 -9.848 13.548 1.00 0.00 H new ATOM 2149 N ALA A 139 3.776 -10.560 11.079 1.00 0.00 N ATOM 2150 CA ALA A 139 3.414 -11.970 11.000 1.00 0.00 C ATOM 2151 C ALA A 139 2.866 -12.319 9.621 1.00 0.00 C ATOM 2152 O ALA A 139 1.704 -12.704 9.481 1.00 0.00 O ATOM 2153 CB ALA A 139 2.395 -12.314 12.077 1.00 0.00 C ATOM 0 H ALA A 139 2.993 -9.916 10.962 1.00 0.00 H new ATOM 0 HA ALA A 139 4.315 -12.561 11.165 1.00 0.00 H new ATOM 0 HB1 ALA A 139 2.133 -13.370 12.007 1.00 0.00 H new ATOM 0 HB2 ALA A 139 2.821 -12.110 13.059 1.00 0.00 H new ATOM 0 HB3 ALA A 139 1.500 -11.708 11.937 1.00 0.00 H new ATOM 2159 N THR A 140 3.709 -12.181 8.602 1.00 0.00 N ATOM 2160 CA THR A 140 3.309 -12.480 7.233 1.00 0.00 C ATOM 2161 C THR A 140 4.480 -13.024 6.423 1.00 0.00 C ATOM 2162 O THR A 140 5.631 -12.953 6.855 1.00 0.00 O ATOM 2163 CB THR A 140 2.747 -11.232 6.526 1.00 0.00 C ATOM 2164 OG1 THR A 140 3.797 -10.288 6.290 1.00 0.00 O ATOM 2165 CG2 THR A 140 1.654 -10.583 7.362 1.00 0.00 C ATOM 0 H THR A 140 4.674 -11.864 8.700 1.00 0.00 H new ATOM 0 HA THR A 140 2.528 -13.238 7.292 1.00 0.00 H new ATOM 0 HB THR A 140 2.318 -11.543 5.574 1.00 0.00 H new ATOM 0 HG1 THR A 140 4.215 -10.044 7.142 1.00 0.00 H new ATOM 0 HG21 THR A 140 1.272 -9.704 6.843 1.00 0.00 H new ATOM 0 HG22 THR A 140 0.843 -11.294 7.516 1.00 0.00 H new ATOM 0 HG23 THR A 140 2.063 -10.285 8.327 1.00 0.00 H new ATOM 2173 N ASP A 141 4.181 -13.565 5.248 1.00 0.00 N ATOM 2174 CA ASP A 141 5.211 -14.120 4.377 1.00 0.00 C ATOM 2175 C ASP A 141 5.355 -13.287 3.107 1.00 0.00 C ATOM 2176 O ASP A 141 5.607 -13.822 2.027 1.00 0.00 O ATOM 2177 CB ASP A 141 4.878 -15.568 4.016 1.00 0.00 C ATOM 2178 CG ASP A 141 4.620 -16.425 5.240 1.00 0.00 C ATOM 2179 OD1 ASP A 141 5.159 -16.097 6.318 1.00 0.00 O ATOM 2180 OD2 ASP A 141 3.881 -17.424 5.120 1.00 0.00 O ATOM 0 H ASP A 141 3.234 -13.631 4.876 1.00 0.00 H new ATOM 0 HA ASP A 141 6.158 -14.097 4.915 1.00 0.00 H new ATOM 0 HB2 ASP A 141 3.999 -15.586 3.372 1.00 0.00 H new ATOM 0 HB3 ASP A 141 5.701 -15.995 3.444 1.00 0.00 H new ATOM 2185 N ILE A 142 5.191 -11.975 3.244 1.00 0.00 N ATOM 2186 CA ILE A 142 5.303 -11.069 2.108 1.00 0.00 C ATOM 2187 C ILE A 142 6.503 -10.141 2.261 1.00 0.00 C ATOM 2188 O ILE A 142 6.964 -9.881 3.373 1.00 0.00 O ATOM 2189 CB ILE A 142 4.030 -10.219 1.938 1.00 0.00 C ATOM 2190 CG1 ILE A 142 2.787 -11.112 1.963 1.00 0.00 C ATOM 2191 CG2 ILE A 142 4.092 -9.424 0.643 1.00 0.00 C ATOM 2192 CD1 ILE A 142 1.533 -10.391 2.405 1.00 0.00 C ATOM 0 H ILE A 142 4.980 -11.516 4.130 1.00 0.00 H new ATOM 0 HA ILE A 142 5.437 -11.690 1.222 1.00 0.00 H new ATOM 0 HB ILE A 142 3.967 -9.517 2.769 1.00 0.00 H new ATOM 0 HG12 ILE A 142 2.627 -11.525 0.967 1.00 0.00 H new ATOM 0 HG13 ILE A 142 2.968 -11.953 2.632 1.00 0.00 H new ATOM 0 HG21 ILE A 142 3.185 -8.829 0.538 1.00 0.00 H new ATOM 0 HG22 ILE A 142 4.959 -8.764 0.662 1.00 0.00 H new ATOM 0 HG23 ILE A 142 4.176 -10.109 -0.201 1.00 0.00 H new ATOM 0 HD11 ILE A 142 0.693 -11.085 2.399 1.00 0.00 H new ATOM 0 HD12 ILE A 142 1.674 -10.001 3.413 1.00 0.00 H new ATOM 0 HD13 ILE A 142 1.328 -9.566 1.722 1.00 0.00 H new ATOM 2204 N LYS A 143 7.006 -9.642 1.137 1.00 0.00 N ATOM 2205 CA LYS A 143 8.151 -8.740 1.144 1.00 0.00 C ATOM 2206 C LYS A 143 7.806 -7.417 0.466 1.00 0.00 C ATOM 2207 O LYS A 143 7.216 -7.399 -0.614 1.00 0.00 O ATOM 2208 CB LYS A 143 9.343 -9.390 0.439 1.00 0.00 C ATOM 2209 CG LYS A 143 9.703 -10.759 0.991 1.00 0.00 C ATOM 2210 CD LYS A 143 10.398 -10.652 2.338 1.00 0.00 C ATOM 2211 CE LYS A 143 11.876 -10.332 2.179 1.00 0.00 C ATOM 2212 NZ LYS A 143 12.474 -9.828 3.446 1.00 0.00 N ATOM 0 H LYS A 143 6.638 -9.848 0.208 1.00 0.00 H new ATOM 0 HA LYS A 143 8.416 -8.538 2.182 1.00 0.00 H new ATOM 0 HB2 LYS A 143 9.119 -9.483 -0.624 1.00 0.00 H new ATOM 0 HB3 LYS A 143 10.208 -8.733 0.526 1.00 0.00 H new ATOM 0 HG2 LYS A 143 8.799 -11.360 1.093 1.00 0.00 H new ATOM 0 HG3 LYS A 143 10.352 -11.277 0.286 1.00 0.00 H new ATOM 0 HD2 LYS A 143 9.919 -9.876 2.935 1.00 0.00 H new ATOM 0 HD3 LYS A 143 10.284 -11.589 2.883 1.00 0.00 H new ATOM 0 HE2 LYS A 143 12.409 -11.227 1.857 1.00 0.00 H new ATOM 0 HE3 LYS A 143 12.004 -9.585 1.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 13.482 -9.621 3.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 11.983 -8.960 3.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 12.375 -10.550 4.188 1.00 0.00 H new ATOM 2226 N ILE A 144 8.178 -6.315 1.107 1.00 0.00 N ATOM 2227 CA ILE A 144 7.910 -4.989 0.564 1.00 0.00 C ATOM 2228 C ILE A 144 9.207 -4.252 0.248 1.00 0.00 C ATOM 2229 O ILE A 144 10.192 -4.363 0.978 1.00 0.00 O ATOM 2230 CB ILE A 144 7.075 -4.139 1.540 1.00 0.00 C ATOM 2231 CG1 ILE A 144 5.648 -4.683 1.632 1.00 0.00 C ATOM 2232 CG2 ILE A 144 7.066 -2.683 1.100 1.00 0.00 C ATOM 2233 CD1 ILE A 144 4.957 -4.352 2.936 1.00 0.00 C ATOM 0 H ILE A 144 8.666 -6.314 2.003 1.00 0.00 H new ATOM 0 HA ILE A 144 7.343 -5.134 -0.356 1.00 0.00 H new ATOM 0 HB ILE A 144 7.530 -4.196 2.529 1.00 0.00 H new ATOM 0 HG12 ILE A 144 5.061 -4.280 0.807 1.00 0.00 H new ATOM 0 HG13 ILE A 144 5.672 -5.766 1.508 1.00 0.00 H new ATOM 0 HG21 ILE A 144 6.472 -2.095 1.800 1.00 0.00 H new ATOM 0 HG22 ILE A 144 8.087 -2.302 1.082 1.00 0.00 H new ATOM 0 HG23 ILE A 144 6.633 -2.607 0.103 1.00 0.00 H new ATOM 0 HD11 ILE A 144 3.950 -4.769 2.930 1.00 0.00 H new ATOM 0 HD12 ILE A 144 5.522 -4.778 3.765 1.00 0.00 H new ATOM 0 HD13 ILE A 144 4.901 -3.270 3.053 1.00 0.00 H new ATOM 2245 N THR A 145 9.200 -3.496 -0.846 1.00 0.00 N ATOM 2246 CA THR A 145 10.375 -2.739 -1.259 1.00 0.00 C ATOM 2247 C THR A 145 10.033 -1.270 -1.482 1.00 0.00 C ATOM 2248 O THR A 145 8.927 -0.938 -1.907 1.00 0.00 O ATOM 2249 CB THR A 145 10.987 -3.313 -2.551 1.00 0.00 C ATOM 2250 OG1 THR A 145 10.886 -4.742 -2.549 1.00 0.00 O ATOM 2251 CG2 THR A 145 12.446 -2.904 -2.688 1.00 0.00 C ATOM 0 H THR A 145 8.393 -3.392 -1.462 1.00 0.00 H new ATOM 0 HA THR A 145 11.103 -2.821 -0.452 1.00 0.00 H new ATOM 0 HB THR A 145 10.432 -2.911 -3.398 1.00 0.00 H new ATOM 0 HG1 THR A 145 11.276 -5.099 -3.374 1.00 0.00 H new ATOM 0 HG21 THR A 145 12.856 -3.321 -3.608 1.00 0.00 H new ATOM 0 HG22 THR A 145 12.518 -1.817 -2.719 1.00 0.00 H new ATOM 0 HG23 THR A 145 13.011 -3.281 -1.835 1.00 0.00 H new ATOM 2259 N VAL A 146 10.990 -0.394 -1.192 1.00 0.00 N ATOM 2260 CA VAL A 146 10.791 1.040 -1.362 1.00 0.00 C ATOM 2261 C VAL A 146 11.887 1.648 -2.229 1.00 0.00 C ATOM 2262 O VAL A 146 13.051 1.702 -1.830 1.00 0.00 O ATOM 2263 CB VAL A 146 10.761 1.768 -0.005 1.00 0.00 C ATOM 2264 CG1 VAL A 146 10.596 3.266 -0.206 1.00 0.00 C ATOM 2265 CG2 VAL A 146 9.649 1.213 0.872 1.00 0.00 C ATOM 0 H VAL A 146 11.911 -0.653 -0.838 1.00 0.00 H new ATOM 0 HA VAL A 146 9.828 1.169 -1.856 1.00 0.00 H new ATOM 0 HB VAL A 146 11.711 1.597 0.501 1.00 0.00 H new ATOM 0 HG11 VAL A 146 10.577 3.763 0.764 1.00 0.00 H new ATOM 0 HG12 VAL A 146 11.431 3.648 -0.794 1.00 0.00 H new ATOM 0 HG13 VAL A 146 9.662 3.462 -0.733 1.00 0.00 H new ATOM 0 HG21 VAL A 146 9.642 1.739 1.827 1.00 0.00 H new ATOM 0 HG22 VAL A 146 8.689 1.352 0.374 1.00 0.00 H new ATOM 0 HG23 VAL A 146 9.818 0.150 1.044 1.00 0.00 H new ATOM 2275 N TYR A 147 11.508 2.106 -3.417 1.00 0.00 N ATOM 2276 CA TYR A 147 12.460 2.710 -4.343 1.00 0.00 C ATOM 2277 C TYR A 147 12.467 4.229 -4.203 1.00 0.00 C ATOM 2278 O TYR A 147 11.415 4.860 -4.093 1.00 0.00 O ATOM 2279 CB TYR A 147 12.121 2.320 -5.782 1.00 0.00 C ATOM 2280 CG TYR A 147 12.244 0.838 -6.054 1.00 0.00 C ATOM 2281 CD1 TYR A 147 11.369 -0.071 -5.472 1.00 0.00 C ATOM 2282 CD2 TYR A 147 13.237 0.346 -6.893 1.00 0.00 C ATOM 2283 CE1 TYR A 147 11.479 -1.426 -5.717 1.00 0.00 C ATOM 2284 CE2 TYR A 147 13.353 -1.007 -7.144 1.00 0.00 C ATOM 2285 CZ TYR A 147 12.472 -1.889 -6.553 1.00 0.00 C ATOM 2286 OH TYR A 147 12.584 -3.238 -6.801 1.00 0.00 O ATOM 0 H TYR A 147 10.549 2.071 -3.762 1.00 0.00 H new ATOM 0 HA TYR A 147 13.454 2.337 -4.098 1.00 0.00 H new ATOM 0 HB2 TYR A 147 11.103 2.638 -6.005 1.00 0.00 H new ATOM 0 HB3 TYR A 147 12.780 2.861 -6.461 1.00 0.00 H new ATOM 0 HD1 TYR A 147 10.589 0.288 -4.817 1.00 0.00 H new ATOM 0 HD2 TYR A 147 13.929 1.033 -7.356 1.00 0.00 H new ATOM 0 HE1 TYR A 147 10.791 -2.119 -5.256 1.00 0.00 H new ATOM 0 HE2 TYR A 147 14.129 -1.373 -7.800 1.00 0.00 H new ATOM 0 HH TYR A 147 13.334 -3.397 -7.411 1.00 0.00 H new ATOM 2296 N THR A 148 13.662 4.812 -4.209 1.00 0.00 N ATOM 2297 CA THR A 148 13.808 6.257 -4.083 1.00 0.00 C ATOM 2298 C THR A 148 14.590 6.835 -5.257 1.00 0.00 C ATOM 2299 O THR A 148 15.809 6.679 -5.342 1.00 0.00 O ATOM 2300 CB THR A 148 14.519 6.637 -2.771 1.00 0.00 C ATOM 2301 OG1 THR A 148 15.788 5.977 -2.692 1.00 0.00 O ATOM 2302 CG2 THR A 148 13.670 6.259 -1.566 1.00 0.00 C ATOM 0 H THR A 148 14.543 4.305 -4.300 1.00 0.00 H new ATOM 0 HA THR A 148 12.802 6.677 -4.078 1.00 0.00 H new ATOM 0 HB THR A 148 14.670 7.716 -2.765 1.00 0.00 H new ATOM 0 HG1 THR A 148 16.235 6.022 -3.563 1.00 0.00 H new ATOM 0 HG21 THR A 148 14.193 6.537 -0.651 1.00 0.00 H new ATOM 0 HG22 THR A 148 12.717 6.785 -1.613 1.00 0.00 H new ATOM 0 HG23 THR A 148 13.492 5.184 -1.569 1.00 0.00 H new ATOM 2310 N LEU A 149 13.882 7.503 -6.161 1.00 0.00 N ATOM 2311 CA LEU A 149 14.510 8.106 -7.332 1.00 0.00 C ATOM 2312 C LEU A 149 14.083 9.561 -7.490 1.00 0.00 C ATOM 2313 O LEU A 149 14.078 10.100 -8.597 1.00 0.00 O ATOM 2314 CB LEU A 149 14.150 7.317 -8.592 1.00 0.00 C ATOM 2315 CG LEU A 149 12.765 7.587 -9.180 1.00 0.00 C ATOM 2316 CD1 LEU A 149 12.775 7.378 -10.687 1.00 0.00 C ATOM 2317 CD2 LEU A 149 11.723 6.695 -8.523 1.00 0.00 C ATOM 0 H LEU A 149 12.873 7.641 -6.106 1.00 0.00 H new ATOM 0 HA LEU A 149 15.590 8.077 -7.189 1.00 0.00 H new ATOM 0 HB2 LEU A 149 14.896 7.533 -9.357 1.00 0.00 H new ATOM 0 HB3 LEU A 149 14.225 6.254 -8.364 1.00 0.00 H new ATOM 0 HG LEU A 149 12.503 8.626 -8.979 1.00 0.00 H new ATOM 0 HD11 LEU A 149 11.781 7.575 -11.088 1.00 0.00 H new ATOM 0 HD12 LEU A 149 13.492 8.060 -11.144 1.00 0.00 H new ATOM 0 HD13 LEU A 149 13.059 6.350 -10.910 1.00 0.00 H new ATOM 0 HD21 LEU A 149 10.743 6.901 -8.954 1.00 0.00 H new ATOM 0 HD22 LEU A 149 11.981 5.649 -8.692 1.00 0.00 H new ATOM 0 HD23 LEU A 149 11.697 6.894 -7.452 1.00 0.00 H new