USER MOD reduce.3.24.130724 H: found=0, std=0, add=1027, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1026 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 34 CYS SG : rot 2:sc= 2.12 USER MOD Set 1.2: A 83 THR OG1 : rot 129:sc= 1.25 USER MOD Set 1.3: A 85 LYS NZ :NH3+ -177:sc= 0.641 (180deg=0.636) USER MOD Set 2.1: A 46 CYS SG : rot 170:sc= -4.58! USER MOD Set 2.2: A 136 LYS NZ :NH3+ 172:sc= -0.4! (180deg=-0.523!) USER MOD Set 3.1: A 12 GLN : amide:sc= -1.71 K(o=-3.4,f=-3.9) USER MOD Set 3.2: A 15 SER OG : rot 180:sc= -1.69 USER MOD Single : A 21 ASN : amide:sc= -0.336 K(o=-0.34,f=-15!) USER MOD Single : A 26 SER OG : rot 180:sc= -0.0355 USER MOD Single : A 28 HIS : no HD1:sc= -0.412 K(o=-0.41,f=-1.1) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 HIS : no HD1:sc= -4.26! C(o=-4.3!,f=-4.4!) USER MOD Single : A 36 MET CE :methyl -124:sc= -1.57 (180deg=-6.75!) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 88:sc= 0.649 USER MOD Single : A 44 THR OG1 : rot 100:sc= -0.253 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.194 USER MOD Single : A 72 THR OG1 : rot 111:sc= 0.214 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 TYR OH : rot -161:sc= -0.122 USER MOD Single : A 77 GLN :FLIP amide:sc= -0.0595 F(o=-1.1,f=-0.059) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 ASN : amide:sc= 0.339 K(o=0.34,f=-1.1) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 91 HIS : no HE2:sc= -6.09! C(o=-6.1!,f=-10!) USER MOD Single : A 93 ASN : amide:sc= -2.48! C(o=-2.5!,f=-3.2!) USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 SER OG : rot 180:sc= 0.0273 USER MOD Single : A 105 ASN : amide:sc= -1.03 K(o=-1,f=-4.1!) USER MOD Single : A 106 GLN : amide:sc= 0.0098 K(o=0.0098,f=-2.4!) USER MOD Single : A 109 THR OG1 : rot 180:sc= -0.0216 USER MOD Single : A 111 SER OG : rot 180:sc= 0.0211 USER MOD Single : A 114 MET CE :methyl -113:sc= -0.0514 (180deg=-1.55) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 MET CE :methyl -118:sc= -10.5! (180deg=-11.5!) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 125 MET CE :methyl -125:sc= -4.76! (180deg=-6.18!) USER MOD Single : A 126 GLN : amide:sc=-0.00399 X(o=-0.004,f=-0.026) USER MOD Single : A 129 THR OG1 : rot 180:sc= 0.137 USER MOD Single : A 134 ASN : amide:sc= -0.0426 X(o=-0.043,f=0) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ -176:sc= -0.566 (180deg=-0.593) USER MOD ----------------------------------------------------------------- ATOM 127 N GLN A 12 13.099 13.693 3.580 1.00 0.00 N ATOM 128 CA GLN A 12 13.664 12.450 4.079 1.00 0.00 C ATOM 129 C GLN A 12 12.634 11.322 3.979 1.00 0.00 C ATOM 130 O GLN A 12 11.482 11.492 4.375 1.00 0.00 O ATOM 131 CB GLN A 12 14.163 12.612 5.516 1.00 0.00 C ATOM 132 CG GLN A 12 14.321 11.251 6.197 1.00 0.00 C ATOM 133 CD GLN A 12 15.634 11.180 6.980 1.00 0.00 C ATOM 134 OE1 GLN A 12 16.157 12.174 7.458 1.00 0.00 O ATOM 135 NE2 GLN A 12 16.136 9.953 7.084 1.00 0.00 N ATOM 0 HA GLN A 12 14.522 12.189 3.460 1.00 0.00 H new ATOM 0 HB2 GLN A 12 15.119 13.136 5.516 1.00 0.00 H new ATOM 0 HB3 GLN A 12 13.462 13.227 6.081 1.00 0.00 H new ATOM 0 HG2 GLN A 12 13.482 11.078 6.871 1.00 0.00 H new ATOM 0 HG3 GLN A 12 14.297 10.460 5.447 1.00 0.00 H new ATOM 0 HE21 GLN A 12 15.647 9.164 6.660 1.00 0.00 H new ATOM 0 HE22 GLN A 12 17.010 9.800 7.588 1.00 0.00 H new ATOM 144 N PRO A 13 13.099 10.166 3.435 1.00 0.00 N ATOM 145 CA PRO A 13 12.232 9.011 3.278 1.00 0.00 C ATOM 146 C PRO A 13 11.990 8.321 4.623 1.00 0.00 C ATOM 147 O PRO A 13 12.887 7.677 5.164 1.00 0.00 O ATOM 148 CB PRO A 13 12.942 8.119 2.273 1.00 0.00 C ATOM 149 CG PRO A 13 14.390 8.582 2.255 1.00 0.00 C ATOM 150 CD PRO A 13 14.458 9.929 2.955 1.00 0.00 C ATOM 0 HA PRO A 13 11.237 9.277 2.921 1.00 0.00 H new ATOM 0 HB2 PRO A 13 12.871 7.071 2.563 1.00 0.00 H new ATOM 0 HB3 PRO A 13 12.491 8.208 1.285 1.00 0.00 H new ATOM 0 HG2 PRO A 13 15.029 7.857 2.760 1.00 0.00 H new ATOM 0 HG3 PRO A 13 14.751 8.666 1.230 1.00 0.00 H new ATOM 0 HD2 PRO A 13 15.172 9.912 3.779 1.00 0.00 H new ATOM 0 HD3 PRO A 13 14.779 10.715 2.271 1.00 0.00 H new ATOM 158 N VAL A 14 10.773 8.480 5.122 1.00 0.00 N ATOM 159 CA VAL A 14 10.402 7.880 6.392 1.00 0.00 C ATOM 160 C VAL A 14 11.664 7.620 7.217 1.00 0.00 C ATOM 161 O VAL A 14 12.253 6.543 7.134 1.00 0.00 O ATOM 162 CB VAL A 14 9.573 6.617 6.152 1.00 0.00 C ATOM 163 CG1 VAL A 14 8.119 6.967 5.833 1.00 0.00 C ATOM 164 CG2 VAL A 14 10.187 5.761 5.043 1.00 0.00 C ATOM 0 H VAL A 14 10.032 9.015 4.670 1.00 0.00 H new ATOM 0 HA VAL A 14 9.773 8.560 6.966 1.00 0.00 H new ATOM 0 HB VAL A 14 9.582 6.031 7.071 1.00 0.00 H new ATOM 0 HG11 VAL A 14 7.552 6.051 5.667 1.00 0.00 H new ATOM 0 HG12 VAL A 14 7.685 7.516 6.669 1.00 0.00 H new ATOM 0 HG13 VAL A 14 8.082 7.584 4.935 1.00 0.00 H new ATOM 0 HG21 VAL A 14 9.578 4.869 4.892 1.00 0.00 H new ATOM 0 HG22 VAL A 14 10.224 6.336 4.118 1.00 0.00 H new ATOM 0 HG23 VAL A 14 11.197 5.467 5.328 1.00 0.00 H new ATOM 174 N SER A 15 12.042 8.624 7.994 1.00 0.00 N ATOM 175 CA SER A 15 13.224 8.517 8.833 1.00 0.00 C ATOM 176 C SER A 15 13.161 7.234 9.664 1.00 0.00 C ATOM 177 O SER A 15 14.188 6.613 9.933 1.00 0.00 O ATOM 178 CB SER A 15 13.362 9.736 9.748 1.00 0.00 C ATOM 179 OG SER A 15 14.411 10.603 9.326 1.00 0.00 O ATOM 0 H SER A 15 11.551 9.516 8.060 1.00 0.00 H new ATOM 0 HA SER A 15 14.101 8.481 8.186 1.00 0.00 H new ATOM 0 HB2 SER A 15 12.421 10.286 9.764 1.00 0.00 H new ATOM 0 HB3 SER A 15 13.554 9.404 10.768 1.00 0.00 H new ATOM 0 HG SER A 15 14.466 11.370 9.934 1.00 0.00 H new ATOM 185 N LEU A 16 11.945 6.875 10.049 1.00 0.00 N ATOM 186 CA LEU A 16 11.735 5.677 10.844 1.00 0.00 C ATOM 187 C LEU A 16 10.534 4.907 10.290 1.00 0.00 C ATOM 188 O LEU A 16 9.845 5.386 9.392 1.00 0.00 O ATOM 189 CB LEU A 16 11.606 6.033 12.326 1.00 0.00 C ATOM 190 CG LEU A 16 11.578 7.527 12.657 1.00 0.00 C ATOM 191 CD1 LEU A 16 10.322 8.190 12.089 1.00 0.00 C ATOM 192 CD2 LEU A 16 11.717 7.758 14.163 1.00 0.00 C ATOM 0 H LEU A 16 11.095 7.393 9.825 1.00 0.00 H new ATOM 0 HA LEU A 16 12.599 5.016 10.773 1.00 0.00 H new ATOM 0 HB2 LEU A 16 10.693 5.579 12.710 1.00 0.00 H new ATOM 0 HB3 LEU A 16 12.439 5.578 12.862 1.00 0.00 H new ATOM 0 HG LEU A 16 12.436 7.999 12.179 1.00 0.00 H new ATOM 0 HD11 LEU A 16 10.326 9.251 12.338 1.00 0.00 H new ATOM 0 HD12 LEU A 16 10.306 8.072 11.006 1.00 0.00 H new ATOM 0 HD13 LEU A 16 9.437 7.720 12.518 1.00 0.00 H new ATOM 0 HD21 LEU A 16 11.694 8.828 14.371 1.00 0.00 H new ATOM 0 HD22 LEU A 16 10.893 7.270 14.684 1.00 0.00 H new ATOM 0 HD23 LEU A 16 12.663 7.341 14.509 1.00 0.00 H new ATOM 204 N PRO A 17 10.315 3.694 10.865 1.00 0.00 N ATOM 205 CA PRO A 17 9.210 2.852 10.439 1.00 0.00 C ATOM 206 C PRO A 17 7.878 3.384 10.973 1.00 0.00 C ATOM 207 O PRO A 17 6.815 3.024 10.470 1.00 0.00 O ATOM 208 CB PRO A 17 9.547 1.465 10.961 1.00 0.00 C ATOM 209 CG PRO A 17 10.587 1.671 12.051 1.00 0.00 C ATOM 210 CD PRO A 17 11.111 3.093 11.932 1.00 0.00 C ATOM 0 HA PRO A 17 9.087 2.836 9.356 1.00 0.00 H new ATOM 0 HB2 PRO A 17 8.660 0.970 11.356 1.00 0.00 H new ATOM 0 HB3 PRO A 17 9.937 0.832 10.164 1.00 0.00 H new ATOM 0 HG2 PRO A 17 10.147 1.507 13.035 1.00 0.00 H new ATOM 0 HG3 PRO A 17 11.401 0.954 11.943 1.00 0.00 H new ATOM 0 HD2 PRO A 17 10.993 3.638 12.869 1.00 0.00 H new ATOM 0 HD3 PRO A 17 12.173 3.104 11.688 1.00 0.00 H new ATOM 218 N GLU A 18 7.980 4.234 11.984 1.00 0.00 N ATOM 219 CA GLU A 18 6.797 4.819 12.592 1.00 0.00 C ATOM 220 C GLU A 18 6.032 5.657 11.565 1.00 0.00 C ATOM 221 O GLU A 18 4.821 5.507 11.414 1.00 0.00 O ATOM 222 CB GLU A 18 7.167 5.657 13.817 1.00 0.00 C ATOM 223 CG GLU A 18 8.014 4.847 14.800 1.00 0.00 C ATOM 224 CD GLU A 18 7.742 5.278 16.243 1.00 0.00 C ATOM 225 OE1 GLU A 18 6.719 4.814 16.790 1.00 0.00 O ATOM 226 OE2 GLU A 18 8.565 6.061 16.766 1.00 0.00 O ATOM 0 H GLU A 18 8.864 4.532 12.397 1.00 0.00 H new ATOM 0 HA GLU A 18 6.148 4.011 12.929 1.00 0.00 H new ATOM 0 HB2 GLU A 18 7.717 6.544 13.503 1.00 0.00 H new ATOM 0 HB3 GLU A 18 6.260 6.003 14.313 1.00 0.00 H new ATOM 0 HG2 GLU A 18 7.794 3.785 14.686 1.00 0.00 H new ATOM 0 HG3 GLU A 18 9.071 4.980 14.570 1.00 0.00 H new ATOM 233 N GLU A 19 6.772 6.521 10.885 1.00 0.00 N ATOM 234 CA GLU A 19 6.178 7.383 9.877 1.00 0.00 C ATOM 235 C GLU A 19 5.339 6.557 8.900 1.00 0.00 C ATOM 236 O GLU A 19 4.253 6.976 8.502 1.00 0.00 O ATOM 237 CB GLU A 19 7.254 8.181 9.137 1.00 0.00 C ATOM 238 CG GLU A 19 8.063 9.043 10.108 1.00 0.00 C ATOM 239 CD GLU A 19 7.410 10.414 10.299 1.00 0.00 C ATOM 240 OE1 GLU A 19 6.413 10.671 9.590 1.00 0.00 O ATOM 241 OE2 GLU A 19 7.924 11.173 11.149 1.00 0.00 O ATOM 0 H GLU A 19 7.777 6.642 11.012 1.00 0.00 H new ATOM 0 HA GLU A 19 5.522 8.096 10.376 1.00 0.00 H new ATOM 0 HB2 GLU A 19 7.920 7.498 8.610 1.00 0.00 H new ATOM 0 HB3 GLU A 19 6.787 8.816 8.384 1.00 0.00 H new ATOM 0 HG2 GLU A 19 8.142 8.537 11.070 1.00 0.00 H new ATOM 0 HG3 GLU A 19 9.077 9.169 9.730 1.00 0.00 H new ATOM 248 N LEU A 20 5.874 5.399 8.542 1.00 0.00 N ATOM 249 CA LEU A 20 5.187 4.511 7.620 1.00 0.00 C ATOM 250 C LEU A 20 3.937 3.947 8.297 1.00 0.00 C ATOM 251 O LEU A 20 3.008 3.503 7.623 1.00 0.00 O ATOM 252 CB LEU A 20 6.143 3.436 7.099 1.00 0.00 C ATOM 253 CG LEU A 20 5.830 2.875 5.711 1.00 0.00 C ATOM 254 CD1 LEU A 20 5.505 3.999 4.725 1.00 0.00 C ATOM 255 CD2 LEU A 20 6.968 1.984 5.210 1.00 0.00 C ATOM 0 H LEU A 20 6.775 5.055 8.874 1.00 0.00 H new ATOM 0 HA LEU A 20 4.852 5.060 6.740 1.00 0.00 H new ATOM 0 HB2 LEU A 20 7.151 3.851 7.082 1.00 0.00 H new ATOM 0 HB3 LEU A 20 6.151 2.610 7.810 1.00 0.00 H new ATOM 0 HG LEU A 20 4.941 2.249 5.789 1.00 0.00 H new ATOM 0 HD11 LEU A 20 5.286 3.572 3.746 1.00 0.00 H new ATOM 0 HD12 LEU A 20 4.638 4.555 5.080 1.00 0.00 H new ATOM 0 HD13 LEU A 20 6.359 4.671 4.645 1.00 0.00 H new ATOM 0 HD21 LEU A 20 6.720 1.598 4.221 1.00 0.00 H new ATOM 0 HD22 LEU A 20 7.888 2.566 5.152 1.00 0.00 H new ATOM 0 HD23 LEU A 20 7.109 1.152 5.899 1.00 0.00 H new ATOM 267 N ASN A 21 3.953 3.981 9.621 1.00 0.00 N ATOM 268 CA ASN A 21 2.832 3.479 10.397 1.00 0.00 C ATOM 269 C ASN A 21 1.768 4.572 10.514 1.00 0.00 C ATOM 270 O ASN A 21 0.654 4.312 10.968 1.00 0.00 O ATOM 271 CB ASN A 21 3.270 3.093 11.811 1.00 0.00 C ATOM 272 CG ASN A 21 3.275 1.573 11.988 1.00 0.00 C ATOM 273 OD1 ASN A 21 2.492 0.851 11.393 1.00 0.00 O ATOM 274 ND2 ASN A 21 4.198 1.130 12.837 1.00 0.00 N ATOM 0 H ASN A 21 4.725 4.349 10.177 1.00 0.00 H new ATOM 0 HA ASN A 21 2.437 2.599 9.889 1.00 0.00 H new ATOM 0 HB2 ASN A 21 4.266 3.489 12.008 1.00 0.00 H new ATOM 0 HB3 ASN A 21 2.598 3.545 12.540 1.00 0.00 H new ATOM 0 HD21 ASN A 21 4.282 0.131 13.023 1.00 0.00 H new ATOM 0 HD22 ASN A 21 4.822 1.790 13.302 1.00 0.00 H new ATOM 281 N ARG A 22 2.148 5.770 10.097 1.00 0.00 N ATOM 282 CA ARG A 22 1.239 6.903 10.149 1.00 0.00 C ATOM 283 C ARG A 22 0.392 6.963 8.876 1.00 0.00 C ATOM 284 O ARG A 22 -0.428 7.866 8.714 1.00 0.00 O ATOM 285 CB ARG A 22 2.007 8.218 10.305 1.00 0.00 C ATOM 286 CG ARG A 22 3.053 8.113 11.416 1.00 0.00 C ATOM 287 CD ARG A 22 3.688 9.476 11.702 1.00 0.00 C ATOM 288 NE ARG A 22 3.220 9.988 13.009 1.00 0.00 N ATOM 289 CZ ARG A 22 3.495 11.212 13.478 1.00 0.00 C ATOM 290 NH1 ARG A 22 4.236 12.058 12.749 1.00 0.00 N ATOM 291 NH2 ARG A 22 3.028 11.592 14.675 1.00 0.00 N ATOM 0 H ARG A 22 3.073 5.981 9.722 1.00 0.00 H new ATOM 0 HA ARG A 22 0.591 6.769 11.015 1.00 0.00 H new ATOM 0 HB2 ARG A 22 2.495 8.472 9.364 1.00 0.00 H new ATOM 0 HB3 ARG A 22 1.311 9.025 10.531 1.00 0.00 H new ATOM 0 HG2 ARG A 22 2.588 7.727 12.323 1.00 0.00 H new ATOM 0 HG3 ARG A 22 3.826 7.401 11.126 1.00 0.00 H new ATOM 0 HD2 ARG A 22 4.774 9.387 11.705 1.00 0.00 H new ATOM 0 HD3 ARG A 22 3.428 10.181 10.912 1.00 0.00 H new ATOM 0 HE ARG A 22 2.652 9.370 13.589 1.00 0.00 H new ATOM 0 HH11 ARG A 22 4.590 11.770 11.837 1.00 0.00 H new ATOM 0 HH12 ARG A 22 4.445 12.990 13.106 1.00 0.00 H new ATOM 0 HH21 ARG A 22 2.463 10.949 15.229 1.00 0.00 H new ATOM 0 HH22 ARG A 22 3.238 12.524 15.032 1.00 0.00 H new ATOM 305 N VAL A 23 0.620 5.991 8.005 1.00 0.00 N ATOM 306 CA VAL A 23 -0.113 5.922 6.752 1.00 0.00 C ATOM 307 C VAL A 23 -0.291 4.456 6.351 1.00 0.00 C ATOM 308 O VAL A 23 -0.529 4.153 5.183 1.00 0.00 O ATOM 309 CB VAL A 23 0.601 6.751 5.683 1.00 0.00 C ATOM 310 CG1 VAL A 23 0.422 8.249 5.941 1.00 0.00 C ATOM 311 CG2 VAL A 23 2.083 6.382 5.601 1.00 0.00 C ATOM 0 H VAL A 23 1.302 5.245 8.142 1.00 0.00 H new ATOM 0 HA VAL A 23 -1.108 6.351 6.867 1.00 0.00 H new ATOM 0 HB VAL A 23 0.145 6.520 4.720 1.00 0.00 H new ATOM 0 HG11 VAL A 23 0.939 8.816 5.167 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -0.639 8.497 5.924 1.00 0.00 H new ATOM 0 HG13 VAL A 23 0.838 8.503 6.916 1.00 0.00 H new ATOM 0 HG21 VAL A 23 2.566 6.986 4.833 1.00 0.00 H new ATOM 0 HG22 VAL A 23 2.559 6.570 6.564 1.00 0.00 H new ATOM 0 HG23 VAL A 23 2.182 5.326 5.348 1.00 0.00 H new ATOM 321 N ARG A 24 -0.171 3.586 7.343 1.00 0.00 N ATOM 322 CA ARG A 24 -0.316 2.159 7.108 1.00 0.00 C ATOM 323 C ARG A 24 -1.797 1.775 7.071 1.00 0.00 C ATOM 324 O ARG A 24 -2.347 1.315 8.070 1.00 0.00 O ATOM 325 CB ARG A 24 0.388 1.347 8.197 1.00 0.00 C ATOM 326 CG ARG A 24 -0.128 1.730 9.586 1.00 0.00 C ATOM 327 CD ARG A 24 -0.338 0.488 10.454 1.00 0.00 C ATOM 328 NE ARG A 24 -1.507 -0.278 9.968 1.00 0.00 N ATOM 329 CZ ARG A 24 -2.382 -0.902 10.768 1.00 0.00 C ATOM 330 NH1 ARG A 24 -2.225 -0.855 12.098 1.00 0.00 N ATOM 331 NH2 ARG A 24 -3.413 -1.574 10.238 1.00 0.00 N ATOM 0 H ARG A 24 0.025 3.841 8.311 1.00 0.00 H new ATOM 0 HA ARG A 24 0.146 1.932 6.147 1.00 0.00 H new ATOM 0 HB2 ARG A 24 0.225 0.283 8.025 1.00 0.00 H new ATOM 0 HB3 ARG A 24 1.463 1.517 8.145 1.00 0.00 H new ATOM 0 HG2 ARG A 24 0.582 2.400 10.070 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -1.067 2.275 9.492 1.00 0.00 H new ATOM 0 HD2 ARG A 24 0.554 -0.138 10.429 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -0.492 0.782 11.492 1.00 0.00 H new ATOM 0 HE ARG A 24 -1.656 -0.335 8.961 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -1.439 -0.344 12.501 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -2.891 -1.330 12.707 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -3.532 -1.610 9.226 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -4.079 -2.049 10.847 1.00 0.00 H new ATOM 345 N LEU A 25 -2.399 1.978 5.909 1.00 0.00 N ATOM 346 CA LEU A 25 -3.805 1.659 5.729 1.00 0.00 C ATOM 347 C LEU A 25 -4.131 0.367 6.481 1.00 0.00 C ATOM 348 O LEU A 25 -3.254 -0.470 6.692 1.00 0.00 O ATOM 349 CB LEU A 25 -4.158 1.611 4.241 1.00 0.00 C ATOM 350 CG LEU A 25 -4.777 2.882 3.657 1.00 0.00 C ATOM 351 CD1 LEU A 25 -5.266 2.646 2.227 1.00 0.00 C ATOM 352 CD2 LEU A 25 -5.889 3.416 4.562 1.00 0.00 C ATOM 0 H LEU A 25 -1.939 2.360 5.082 1.00 0.00 H new ATOM 0 HA LEU A 25 -4.431 2.443 6.156 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -3.252 1.381 3.680 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.851 0.786 4.079 1.00 0.00 H new ATOM 0 HG LEU A 25 -4.004 3.649 3.611 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -5.702 3.565 1.835 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.426 2.346 1.600 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -6.019 1.858 2.225 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -6.312 4.320 4.124 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -6.670 2.662 4.663 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -5.479 3.647 5.545 1.00 0.00 H new ATOM 364 N SER A 26 -5.393 0.244 6.863 1.00 0.00 N ATOM 365 CA SER A 26 -5.845 -0.932 7.586 1.00 0.00 C ATOM 366 C SER A 26 -7.068 -1.535 6.892 1.00 0.00 C ATOM 367 O SER A 26 -7.991 -0.814 6.516 1.00 0.00 O ATOM 368 CB SER A 26 -6.175 -0.592 9.041 1.00 0.00 C ATOM 369 OG SER A 26 -6.526 -1.749 9.794 1.00 0.00 O ATOM 0 H SER A 26 -6.117 0.940 6.685 1.00 0.00 H new ATOM 0 HA SER A 26 -5.037 -1.664 7.587 1.00 0.00 H new ATOM 0 HB2 SER A 26 -5.316 -0.106 9.503 1.00 0.00 H new ATOM 0 HB3 SER A 26 -6.998 0.122 9.069 1.00 0.00 H new ATOM 0 HG SER A 26 -6.728 -1.490 10.717 1.00 0.00 H new ATOM 375 N ARG A 27 -7.036 -2.852 6.744 1.00 0.00 N ATOM 376 CA ARG A 27 -8.130 -3.560 6.103 1.00 0.00 C ATOM 377 C ARG A 27 -9.469 -2.927 6.486 1.00 0.00 C ATOM 378 O ARG A 27 -10.330 -2.721 5.632 1.00 0.00 O ATOM 379 CB ARG A 27 -8.139 -5.037 6.501 1.00 0.00 C ATOM 380 CG ARG A 27 -8.243 -5.937 5.267 1.00 0.00 C ATOM 381 CD ARG A 27 -8.615 -7.367 5.662 1.00 0.00 C ATOM 382 NE ARG A 27 -9.724 -7.350 6.642 1.00 0.00 N ATOM 383 CZ ARG A 27 -9.553 -7.369 7.971 1.00 0.00 C ATOM 384 NH1 ARG A 27 -8.317 -7.406 8.487 1.00 0.00 N ATOM 385 NH2 ARG A 27 -10.618 -7.350 8.784 1.00 0.00 N ATOM 0 H ARG A 27 -6.269 -3.447 7.057 1.00 0.00 H new ATOM 0 HA ARG A 27 -7.985 -3.487 5.025 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -7.229 -5.274 7.053 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -8.978 -5.232 7.170 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -8.992 -5.538 4.583 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -7.293 -5.939 4.733 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -8.909 -7.932 4.778 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -7.749 -7.872 6.090 1.00 0.00 H new ATOM 0 HE ARG A 27 -10.678 -7.322 6.283 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -7.506 -7.420 7.868 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -8.187 -7.420 9.499 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -11.559 -7.321 8.391 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -10.488 -7.364 9.796 1.00 0.00 H new ATOM 399 N HIS A 28 -9.603 -2.637 7.772 1.00 0.00 N ATOM 400 CA HIS A 28 -10.823 -2.032 8.279 1.00 0.00 C ATOM 401 C HIS A 28 -11.117 -0.744 7.507 1.00 0.00 C ATOM 402 O HIS A 28 -12.156 -0.629 6.859 1.00 0.00 O ATOM 403 CB HIS A 28 -10.732 -1.809 9.790 1.00 0.00 C ATOM 404 CG HIS A 28 -11.760 -2.575 10.587 1.00 0.00 C ATOM 405 ND1 HIS A 28 -13.074 -2.717 10.175 1.00 0.00 N ATOM 406 CD2 HIS A 28 -11.655 -3.239 11.774 1.00 0.00 C ATOM 407 CE1 HIS A 28 -13.721 -3.435 11.082 1.00 0.00 C ATOM 408 NE2 HIS A 28 -12.840 -3.757 12.072 1.00 0.00 N ATOM 0 H HIS A 28 -8.887 -2.810 8.478 1.00 0.00 H new ATOM 0 HA HIS A 28 -11.662 -2.710 8.120 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -9.737 -2.095 10.130 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -10.846 -0.745 9.997 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -10.759 -3.328 12.370 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -14.763 -3.716 11.044 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -13.056 -4.306 12.904 1.00 0.00 H new ATOM 416 N LYS A 29 -10.183 0.191 7.601 1.00 0.00 N ATOM 417 CA LYS A 29 -10.329 1.466 6.920 1.00 0.00 C ATOM 418 C LYS A 29 -10.679 1.217 5.451 1.00 0.00 C ATOM 419 O LYS A 29 -11.563 1.871 4.900 1.00 0.00 O ATOM 420 CB LYS A 29 -9.079 2.325 7.117 1.00 0.00 C ATOM 421 CG LYS A 29 -9.205 3.198 8.367 1.00 0.00 C ATOM 422 CD LYS A 29 -7.905 3.958 8.638 1.00 0.00 C ATOM 423 CE LYS A 29 -8.177 5.252 9.408 1.00 0.00 C ATOM 424 NZ LYS A 29 -8.079 5.018 10.866 1.00 0.00 N ATOM 0 H LYS A 29 -9.322 0.091 8.139 1.00 0.00 H new ATOM 0 HA LYS A 29 -11.151 2.037 7.352 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -8.202 1.683 7.204 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -8.926 2.957 6.242 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -10.024 3.906 8.240 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -9.452 2.575 9.227 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -7.223 3.328 9.209 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -7.411 4.189 7.694 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -7.462 6.018 9.108 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -9.170 5.628 9.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -8.266 5.906 11.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -8.778 4.303 11.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -7.124 4.681 11.100 1.00 0.00 H new ATOM 438 N LEU A 30 -9.968 0.269 4.859 1.00 0.00 N ATOM 439 CA LEU A 30 -10.192 -0.075 3.465 1.00 0.00 C ATOM 440 C LEU A 30 -11.626 -0.581 3.293 1.00 0.00 C ATOM 441 O LEU A 30 -12.313 -0.201 2.347 1.00 0.00 O ATOM 442 CB LEU A 30 -9.129 -1.062 2.979 1.00 0.00 C ATOM 443 CG LEU A 30 -7.694 -0.533 2.933 1.00 0.00 C ATOM 444 CD1 LEU A 30 -6.685 -1.682 2.958 1.00 0.00 C ATOM 445 CD2 LEU A 30 -7.486 0.386 1.727 1.00 0.00 C ATOM 0 H LEU A 30 -9.236 -0.272 5.319 1.00 0.00 H new ATOM 0 HA LEU A 30 -10.087 0.807 2.833 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.152 -1.938 3.627 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -9.404 -1.398 1.979 1.00 0.00 H new ATOM 0 HG LEU A 30 -7.523 0.066 3.827 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -5.673 -1.278 2.924 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -6.815 -2.260 3.873 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -6.847 -2.327 2.095 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -6.458 0.748 1.718 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -7.683 -0.168 0.809 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -8.168 1.233 1.793 1.00 0.00 H new ATOM 457 N GLU A 31 -12.034 -1.432 4.224 1.00 0.00 N ATOM 458 CA GLU A 31 -13.373 -1.994 4.187 1.00 0.00 C ATOM 459 C GLU A 31 -14.419 -0.880 4.263 1.00 0.00 C ATOM 460 O GLU A 31 -15.512 -1.011 3.713 1.00 0.00 O ATOM 461 CB GLU A 31 -13.572 -3.010 5.314 1.00 0.00 C ATOM 462 CG GLU A 31 -14.734 -3.956 5.001 1.00 0.00 C ATOM 463 CD GLU A 31 -15.896 -3.737 5.972 1.00 0.00 C ATOM 464 OE1 GLU A 31 -16.733 -2.861 5.666 1.00 0.00 O ATOM 465 OE2 GLU A 31 -15.920 -4.451 6.997 1.00 0.00 O ATOM 0 H GLU A 31 -11.461 -1.745 5.008 1.00 0.00 H new ATOM 0 HA GLU A 31 -13.499 -2.520 3.241 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -12.657 -3.586 5.455 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -13.767 -2.487 6.250 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -15.074 -3.794 3.978 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -14.393 -4.989 5.063 1.00 0.00 H new ATOM 472 N ARG A 32 -14.048 0.191 4.949 1.00 0.00 N ATOM 473 CA ARG A 32 -14.940 1.327 5.103 1.00 0.00 C ATOM 474 C ARG A 32 -14.819 2.265 3.901 1.00 0.00 C ATOM 475 O ARG A 32 -15.824 2.656 3.309 1.00 0.00 O ATOM 476 CB ARG A 32 -14.625 2.105 6.382 1.00 0.00 C ATOM 477 CG ARG A 32 -14.092 1.174 7.473 1.00 0.00 C ATOM 478 CD ARG A 32 -14.720 1.504 8.830 1.00 0.00 C ATOM 479 NE ARG A 32 -14.148 0.629 9.877 1.00 0.00 N ATOM 480 CZ ARG A 32 -14.700 0.443 11.084 1.00 0.00 C ATOM 481 NH1 ARG A 32 -15.840 1.071 11.403 1.00 0.00 N ATOM 482 NH2 ARG A 32 -14.112 -0.369 11.973 1.00 0.00 N ATOM 0 H ARG A 32 -13.141 0.296 5.404 1.00 0.00 H new ATOM 0 HA ARG A 32 -15.958 0.942 5.166 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -13.889 2.880 6.169 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -15.524 2.609 6.736 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -14.308 0.139 7.210 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -13.008 1.267 7.538 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -14.539 2.550 9.079 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -15.801 1.370 8.782 1.00 0.00 H new ATOM 0 HE ARG A 32 -13.280 0.137 9.667 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -16.287 1.690 10.727 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -16.260 0.930 12.322 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -13.243 -0.846 11.731 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -14.533 -0.510 12.891 1.00 0.00 H new ATOM 496 N TRP A 33 -13.579 2.600 3.575 1.00 0.00 N ATOM 497 CA TRP A 33 -13.313 3.484 2.453 1.00 0.00 C ATOM 498 C TRP A 33 -13.689 2.745 1.168 1.00 0.00 C ATOM 499 O TRP A 33 -13.816 3.358 0.109 1.00 0.00 O ATOM 500 CB TRP A 33 -11.860 3.962 2.465 1.00 0.00 C ATOM 501 CG TRP A 33 -11.406 4.544 3.805 1.00 0.00 C ATOM 502 CD1 TRP A 33 -12.121 4.677 4.931 1.00 0.00 C ATOM 503 CD2 TRP A 33 -10.098 5.068 4.117 1.00 0.00 C ATOM 504 NE1 TRP A 33 -11.373 5.246 5.941 1.00 0.00 N ATOM 505 CE2 TRP A 33 -10.103 5.491 5.430 1.00 0.00 C ATOM 506 CE3 TRP A 33 -8.949 5.180 3.315 1.00 0.00 C ATOM 507 CZ2 TRP A 33 -8.987 6.056 6.058 1.00 0.00 C ATOM 508 CZ3 TRP A 33 -7.841 5.747 3.958 1.00 0.00 C ATOM 509 CH2 TRP A 33 -7.830 6.178 5.279 1.00 0.00 C ATOM 0 H TRP A 33 -12.748 2.275 4.068 1.00 0.00 H new ATOM 0 HA TRP A 33 -13.918 4.388 2.523 1.00 0.00 H new ATOM 0 HB2 TRP A 33 -11.211 3.125 2.206 1.00 0.00 H new ATOM 0 HB3 TRP A 33 -11.731 4.718 1.690 1.00 0.00 H new ATOM 0 HD1 TRP A 33 -13.153 4.376 5.035 1.00 0.00 H new ATOM 0 HE1 TRP A 33 -11.693 5.449 6.888 1.00 0.00 H new ATOM 0 HE3 TRP A 33 -8.923 4.855 2.285 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 -9.017 6.380 7.088 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 -6.931 5.857 3.387 1.00 0.00 H new ATOM 0 HH2 TRP A 33 -6.933 6.605 5.703 1.00 0.00 H new ATOM 520 N CYS A 34 -13.856 1.437 1.303 1.00 0.00 N ATOM 521 CA CYS A 34 -14.215 0.607 0.165 1.00 0.00 C ATOM 522 C CYS A 34 -15.618 1.006 -0.297 1.00 0.00 C ATOM 523 O CYS A 34 -16.017 0.698 -1.419 1.00 0.00 O ATOM 524 CB CYS A 34 -14.127 -0.883 0.502 1.00 0.00 C ATOM 525 SG CYS A 34 -15.253 -1.836 -0.580 1.00 0.00 S ATOM 0 H CYS A 34 -13.749 0.932 2.183 1.00 0.00 H new ATOM 0 HA CYS A 34 -13.506 0.771 -0.647 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -13.103 -1.233 0.374 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -14.391 -1.044 1.547 1.00 0.00 H new ATOM 0 HG CYS A 34 -15.834 -1.030 -1.419 1.00 0.00 H new ATOM 531 N HIS A 35 -16.329 1.685 0.592 1.00 0.00 N ATOM 532 CA HIS A 35 -17.679 2.129 0.290 1.00 0.00 C ATOM 533 C HIS A 35 -17.685 3.644 0.076 1.00 0.00 C ATOM 534 O HIS A 35 -18.743 4.245 -0.101 1.00 0.00 O ATOM 535 CB HIS A 35 -18.655 1.680 1.379 1.00 0.00 C ATOM 536 CG HIS A 35 -18.546 2.466 2.663 1.00 0.00 C ATOM 537 ND1 HIS A 35 -18.146 1.896 3.859 1.00 0.00 N ATOM 538 CD2 HIS A 35 -18.788 3.783 2.926 1.00 0.00 C ATOM 539 CE1 HIS A 35 -18.152 2.836 4.793 1.00 0.00 C ATOM 540 NE2 HIS A 35 -18.550 4.004 4.213 1.00 0.00 N ATOM 0 H HIS A 35 -15.995 1.938 1.522 1.00 0.00 H new ATOM 0 HA HIS A 35 -18.020 1.665 -0.635 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -19.673 1.765 0.998 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -18.483 0.626 1.595 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -19.117 4.520 2.209 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -17.888 2.701 5.831 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -18.649 4.900 4.690 1.00 0.00 H new ATOM 548 N MET A 36 -16.491 4.218 0.099 1.00 0.00 N ATOM 549 CA MET A 36 -16.345 5.651 -0.090 1.00 0.00 C ATOM 550 C MET A 36 -15.910 5.974 -1.521 1.00 0.00 C ATOM 551 O MET A 36 -15.378 5.113 -2.221 1.00 0.00 O ATOM 552 CB MET A 36 -15.307 6.193 0.894 1.00 0.00 C ATOM 553 CG MET A 36 -15.724 5.915 2.340 1.00 0.00 C ATOM 554 SD MET A 36 -17.200 6.837 2.737 1.00 0.00 S ATOM 555 CE MET A 36 -16.494 8.135 3.739 1.00 0.00 C ATOM 0 H MET A 36 -15.615 3.716 0.246 1.00 0.00 H new ATOM 0 HA MET A 36 -17.311 6.122 0.091 1.00 0.00 H new ATOM 0 HB2 MET A 36 -14.339 5.733 0.696 1.00 0.00 H new ATOM 0 HB3 MET A 36 -15.187 7.266 0.746 1.00 0.00 H new ATOM 0 HG2 MET A 36 -15.903 4.849 2.477 1.00 0.00 H new ATOM 0 HG3 MET A 36 -14.918 6.192 3.019 1.00 0.00 H new ATOM 0 HE1 MET A 36 -16.983 8.150 4.713 1.00 0.00 H new ATOM 0 HE2 MET A 36 -15.427 7.953 3.871 1.00 0.00 H new ATOM 0 HE3 MET A 36 -16.640 9.096 3.245 1.00 0.00 H new ATOM 565 N PRO A 37 -16.158 7.249 -1.923 1.00 0.00 N ATOM 566 CA PRO A 37 -15.798 7.696 -3.258 1.00 0.00 C ATOM 567 C PRO A 37 -14.288 7.917 -3.373 1.00 0.00 C ATOM 568 O PRO A 37 -13.662 7.463 -4.330 1.00 0.00 O ATOM 569 CB PRO A 37 -16.603 8.967 -3.478 1.00 0.00 C ATOM 570 CG PRO A 37 -17.025 9.437 -2.095 1.00 0.00 C ATOM 571 CD PRO A 37 -16.786 8.295 -1.121 1.00 0.00 C ATOM 0 HA PRO A 37 -16.028 6.957 -4.026 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -16.005 9.726 -3.983 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -17.472 8.775 -4.107 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -16.453 10.316 -1.800 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -18.076 9.726 -2.094 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -16.141 8.604 -0.299 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -17.721 7.948 -0.680 1.00 0.00 H new ATOM 579 N PHE A 38 -13.748 8.614 -2.385 1.00 0.00 N ATOM 580 CA PHE A 38 -12.323 8.901 -2.364 1.00 0.00 C ATOM 581 C PHE A 38 -11.535 7.720 -1.795 1.00 0.00 C ATOM 582 O PHE A 38 -10.655 7.903 -0.954 1.00 0.00 O ATOM 583 CB PHE A 38 -12.125 10.116 -1.455 1.00 0.00 C ATOM 584 CG PHE A 38 -12.845 10.011 -0.109 1.00 0.00 C ATOM 585 CD1 PHE A 38 -12.237 9.395 0.940 1.00 0.00 C ATOM 586 CD2 PHE A 38 -14.092 10.533 0.037 1.00 0.00 C ATOM 587 CE1 PHE A 38 -12.905 9.297 2.189 1.00 0.00 C ATOM 588 CE2 PHE A 38 -14.760 10.435 1.287 1.00 0.00 C ATOM 589 CZ PHE A 38 -14.153 9.820 2.336 1.00 0.00 C ATOM 0 H PHE A 38 -14.271 8.989 -1.593 1.00 0.00 H new ATOM 0 HA PHE A 38 -11.966 9.088 -3.377 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -11.059 10.252 -1.275 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -12.477 11.007 -1.975 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -11.247 8.981 0.823 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -14.574 11.022 -0.797 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -12.423 8.808 3.022 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -15.751 10.849 1.404 1.00 0.00 H new ATOM 0 HZ PHE A 38 -14.661 9.746 3.286 1.00 0.00 H new ATOM 599 N PHE A 39 -11.878 6.534 -2.275 1.00 0.00 N ATOM 600 CA PHE A 39 -11.214 5.323 -1.825 1.00 0.00 C ATOM 601 C PHE A 39 -9.858 5.153 -2.513 1.00 0.00 C ATOM 602 O PHE A 39 -8.813 5.332 -1.888 1.00 0.00 O ATOM 603 CB PHE A 39 -12.117 4.148 -2.206 1.00 0.00 C ATOM 604 CG PHE A 39 -11.540 2.777 -1.848 1.00 0.00 C ATOM 605 CD1 PHE A 39 -11.310 2.456 -0.546 1.00 0.00 C ATOM 606 CD2 PHE A 39 -11.257 1.880 -2.830 1.00 0.00 C ATOM 607 CE1 PHE A 39 -10.774 1.183 -0.213 1.00 0.00 C ATOM 608 CE2 PHE A 39 -10.722 0.608 -2.497 1.00 0.00 C ATOM 609 CZ PHE A 39 -10.492 0.286 -1.196 1.00 0.00 C ATOM 0 H PHE A 39 -12.608 6.386 -2.972 1.00 0.00 H new ATOM 0 HA PHE A 39 -11.042 5.371 -0.750 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -13.079 4.267 -1.708 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -12.307 4.182 -3.279 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -11.535 3.168 0.234 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -11.439 2.135 -3.863 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -10.591 0.928 0.820 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -10.498 -0.104 -3.277 1.00 0.00 H new ATOM 0 HZ PHE A 39 -10.085 -0.682 -0.943 1.00 0.00 H new ATOM 619 N ALA A 40 -9.918 4.809 -3.791 1.00 0.00 N ATOM 620 CA ALA A 40 -8.708 4.614 -4.572 1.00 0.00 C ATOM 621 C ALA A 40 -7.832 5.864 -4.469 1.00 0.00 C ATOM 622 O ALA A 40 -6.624 5.764 -4.262 1.00 0.00 O ATOM 623 CB ALA A 40 -9.081 4.280 -6.018 1.00 0.00 C ATOM 0 H ALA A 40 -10.786 4.660 -4.306 1.00 0.00 H new ATOM 0 HA ALA A 40 -8.131 3.775 -4.183 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -8.173 4.134 -6.603 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -9.677 3.368 -6.039 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -9.659 5.100 -6.443 1.00 0.00 H new ATOM 629 N LYS A 41 -8.476 7.012 -4.618 1.00 0.00 N ATOM 630 CA LYS A 41 -7.770 8.280 -4.544 1.00 0.00 C ATOM 631 C LYS A 41 -6.984 8.346 -3.233 1.00 0.00 C ATOM 632 O LYS A 41 -5.798 8.672 -3.232 1.00 0.00 O ATOM 633 CB LYS A 41 -8.742 9.446 -4.738 1.00 0.00 C ATOM 634 CG LYS A 41 -8.197 10.451 -5.755 1.00 0.00 C ATOM 635 CD LYS A 41 -8.924 10.323 -7.096 1.00 0.00 C ATOM 636 CE LYS A 41 -10.098 11.300 -7.178 1.00 0.00 C ATOM 637 NZ LYS A 41 -10.978 10.958 -8.318 1.00 0.00 N ATOM 0 H LYS A 41 -9.478 7.091 -4.790 1.00 0.00 H new ATOM 0 HA LYS A 41 -7.045 8.361 -5.354 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -9.707 9.068 -5.076 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -8.912 9.945 -3.784 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -8.314 11.464 -5.369 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -7.129 10.286 -5.899 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -8.227 10.517 -7.911 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -9.286 9.303 -7.222 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -10.668 11.271 -6.249 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -9.725 12.318 -7.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -11.770 11.631 -8.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -10.435 11.008 -9.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -11.349 9.994 -8.193 1.00 0.00 H new ATOM 651 N THR A 42 -7.677 8.033 -2.149 1.00 0.00 N ATOM 652 CA THR A 42 -7.059 8.052 -0.834 1.00 0.00 C ATOM 653 C THR A 42 -6.057 6.904 -0.698 1.00 0.00 C ATOM 654 O THR A 42 -4.848 7.127 -0.691 1.00 0.00 O ATOM 655 CB THR A 42 -8.173 8.013 0.214 1.00 0.00 C ATOM 656 OG1 THR A 42 -8.898 9.220 -0.006 1.00 0.00 O ATOM 657 CG2 THR A 42 -7.640 8.153 1.641 1.00 0.00 C ATOM 0 H THR A 42 -8.661 7.765 -2.154 1.00 0.00 H new ATOM 0 HA THR A 42 -6.482 8.965 -0.682 1.00 0.00 H new ATOM 0 HB THR A 42 -8.724 7.077 0.123 1.00 0.00 H new ATOM 0 HG1 THR A 42 -9.593 9.066 -0.680 1.00 0.00 H new ATOM 0 HG21 THR A 42 -8.472 8.119 2.345 1.00 0.00 H new ATOM 0 HG22 THR A 42 -6.951 7.336 1.854 1.00 0.00 H new ATOM 0 HG23 THR A 42 -7.117 9.104 1.743 1.00 0.00 H new ATOM 665 N VAL A 43 -6.598 5.699 -0.594 1.00 0.00 N ATOM 666 CA VAL A 43 -5.767 4.514 -0.459 1.00 0.00 C ATOM 667 C VAL A 43 -4.494 4.693 -1.289 1.00 0.00 C ATOM 668 O VAL A 43 -3.413 4.279 -0.871 1.00 0.00 O ATOM 669 CB VAL A 43 -6.565 3.268 -0.849 1.00 0.00 C ATOM 670 CG1 VAL A 43 -7.923 3.245 -0.146 1.00 0.00 C ATOM 671 CG2 VAL A 43 -6.731 3.176 -2.367 1.00 0.00 C ATOM 0 H VAL A 43 -7.602 5.517 -0.600 1.00 0.00 H new ATOM 0 HA VAL A 43 -5.462 4.377 0.579 1.00 0.00 H new ATOM 0 HB VAL A 43 -6.003 2.394 -0.520 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -8.470 2.349 -0.440 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -7.774 3.241 0.934 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -8.495 4.129 -0.430 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -7.302 2.282 -2.617 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -7.260 4.057 -2.729 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -5.749 3.123 -2.838 1.00 0.00 H new ATOM 681 N THR A 44 -4.663 5.309 -2.449 1.00 0.00 N ATOM 682 CA THR A 44 -3.541 5.548 -3.341 1.00 0.00 C ATOM 683 C THR A 44 -2.512 6.460 -2.671 1.00 0.00 C ATOM 684 O THR A 44 -2.766 7.647 -2.470 1.00 0.00 O ATOM 685 CB THR A 44 -4.091 6.112 -4.652 1.00 0.00 C ATOM 686 OG1 THR A 44 -4.656 4.980 -5.308 1.00 0.00 O ATOM 687 CG2 THR A 44 -2.984 6.577 -5.600 1.00 0.00 C ATOM 0 H THR A 44 -5.561 5.650 -2.792 1.00 0.00 H new ATOM 0 HA THR A 44 -3.011 4.623 -3.566 1.00 0.00 H new ATOM 0 HB THR A 44 -4.758 6.946 -4.436 1.00 0.00 H new ATOM 0 HG1 THR A 44 -5.626 4.972 -5.169 1.00 0.00 H new ATOM 0 HG21 THR A 44 -3.429 6.968 -6.515 1.00 0.00 H new ATOM 0 HG22 THR A 44 -2.397 7.359 -5.118 1.00 0.00 H new ATOM 0 HG23 THR A 44 -2.336 5.735 -5.843 1.00 0.00 H new ATOM 695 N GLY A 45 -1.371 5.871 -2.343 1.00 0.00 N ATOM 696 CA GLY A 45 -0.302 6.616 -1.700 1.00 0.00 C ATOM 697 C GLY A 45 -0.081 6.130 -0.266 1.00 0.00 C ATOM 698 O GLY A 45 0.833 6.592 0.416 1.00 0.00 O ATOM 0 H GLY A 45 -1.164 4.886 -2.511 1.00 0.00 H new ATOM 0 HA2 GLY A 45 0.619 6.504 -2.272 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -0.546 7.678 -1.694 1.00 0.00 H new ATOM 702 N CYS A 46 -0.934 5.205 0.149 1.00 0.00 N ATOM 703 CA CYS A 46 -0.843 4.652 1.490 1.00 0.00 C ATOM 704 C CYS A 46 -0.032 3.357 1.421 1.00 0.00 C ATOM 705 O CYS A 46 0.409 2.952 0.346 1.00 0.00 O ATOM 706 CB CYS A 46 -2.227 4.427 2.103 1.00 0.00 C ATOM 707 SG CYS A 46 -2.746 5.912 3.038 1.00 0.00 S ATOM 0 H CYS A 46 -1.691 4.825 -0.419 1.00 0.00 H new ATOM 0 HA CYS A 46 -0.338 5.361 2.146 1.00 0.00 H new ATOM 0 HB2 CYS A 46 -2.951 4.210 1.317 1.00 0.00 H new ATOM 0 HB3 CYS A 46 -2.205 3.560 2.764 1.00 0.00 H new ATOM 0 HG CYS A 46 -3.997 5.799 3.372 1.00 0.00 H new ATOM 713 N PHE A 47 0.142 2.742 2.582 1.00 0.00 N ATOM 714 CA PHE A 47 0.892 1.501 2.667 1.00 0.00 C ATOM 715 C PHE A 47 0.114 0.441 3.449 1.00 0.00 C ATOM 716 O PHE A 47 -0.528 0.751 4.452 1.00 0.00 O ATOM 717 CB PHE A 47 2.192 1.815 3.412 1.00 0.00 C ATOM 718 CG PHE A 47 3.210 2.601 2.583 1.00 0.00 C ATOM 719 CD1 PHE A 47 3.002 3.919 2.323 1.00 0.00 C ATOM 720 CD2 PHE A 47 4.322 1.981 2.106 1.00 0.00 C ATOM 721 CE1 PHE A 47 3.947 4.649 1.554 1.00 0.00 C ATOM 722 CE2 PHE A 47 5.267 2.710 1.337 1.00 0.00 C ATOM 723 CZ PHE A 47 5.059 4.029 1.077 1.00 0.00 C ATOM 0 H PHE A 47 -0.224 3.081 3.472 1.00 0.00 H new ATOM 0 HA PHE A 47 1.079 1.111 1.667 1.00 0.00 H new ATOM 0 HB2 PHE A 47 1.955 2.383 4.312 1.00 0.00 H new ATOM 0 HB3 PHE A 47 2.648 0.880 3.737 1.00 0.00 H new ATOM 0 HD1 PHE A 47 2.118 4.411 2.701 1.00 0.00 H new ATOM 0 HD2 PHE A 47 4.487 0.934 2.312 1.00 0.00 H new ATOM 0 HE1 PHE A 47 3.782 5.696 1.348 1.00 0.00 H new ATOM 0 HE2 PHE A 47 6.151 2.218 0.959 1.00 0.00 H new ATOM 0 HZ PHE A 47 5.777 4.584 0.492 1.00 0.00 H new ATOM 733 N VAL A 48 0.195 -0.787 2.960 1.00 0.00 N ATOM 734 CA VAL A 48 -0.495 -1.894 3.600 1.00 0.00 C ATOM 735 C VAL A 48 0.438 -3.106 3.658 1.00 0.00 C ATOM 736 O VAL A 48 1.254 -3.308 2.760 1.00 0.00 O ATOM 737 CB VAL A 48 -1.808 -2.185 2.871 1.00 0.00 C ATOM 738 CG1 VAL A 48 -2.714 -0.952 2.860 1.00 0.00 C ATOM 739 CG2 VAL A 48 -1.546 -2.686 1.449 1.00 0.00 C ATOM 0 H VAL A 48 0.728 -1.040 2.128 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.759 -1.637 4.626 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.325 -2.976 3.415 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.641 -1.186 2.336 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -2.941 -0.658 3.885 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.207 -0.132 2.352 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.496 -2.885 0.953 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -0.997 -1.927 0.891 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.958 -3.603 1.489 1.00 0.00 H new ATOM 749 N ARG A 49 0.286 -3.880 4.723 1.00 0.00 N ATOM 750 CA ARG A 49 1.105 -5.065 4.909 1.00 0.00 C ATOM 751 C ARG A 49 0.483 -6.259 4.181 1.00 0.00 C ATOM 752 O ARG A 49 -0.586 -6.735 4.562 1.00 0.00 O ATOM 753 CB ARG A 49 1.255 -5.403 6.394 1.00 0.00 C ATOM 754 CG ARG A 49 2.730 -5.461 6.797 1.00 0.00 C ATOM 755 CD ARG A 49 3.052 -6.776 7.510 1.00 0.00 C ATOM 756 NE ARG A 49 2.449 -6.779 8.862 1.00 0.00 N ATOM 757 CZ ARG A 49 2.550 -7.797 9.727 1.00 0.00 C ATOM 758 NH1 ARG A 49 3.230 -8.900 9.387 1.00 0.00 N ATOM 759 NH2 ARG A 49 1.971 -7.712 10.933 1.00 0.00 N ATOM 0 H ARG A 49 -0.392 -3.709 5.466 1.00 0.00 H new ATOM 0 HA ARG A 49 2.091 -4.856 4.494 1.00 0.00 H new ATOM 0 HB2 ARG A 49 0.739 -4.654 6.995 1.00 0.00 H new ATOM 0 HB3 ARG A 49 0.779 -6.361 6.602 1.00 0.00 H new ATOM 0 HG2 ARG A 49 3.357 -5.360 5.911 1.00 0.00 H new ATOM 0 HG3 ARG A 49 2.965 -4.621 7.451 1.00 0.00 H new ATOM 0 HD2 ARG A 49 2.670 -7.617 6.931 1.00 0.00 H new ATOM 0 HD3 ARG A 49 4.132 -6.904 7.584 1.00 0.00 H new ATOM 0 HE ARG A 49 1.924 -5.954 9.153 1.00 0.00 H new ATOM 0 HH11 ARG A 49 3.671 -8.965 8.469 1.00 0.00 H new ATOM 0 HH12 ARG A 49 3.307 -9.675 10.046 1.00 0.00 H new ATOM 0 HH21 ARG A 49 1.453 -6.872 11.192 1.00 0.00 H new ATOM 0 HH22 ARG A 49 2.048 -8.487 11.591 1.00 0.00 H new ATOM 773 N ILE A 50 1.180 -6.710 3.148 1.00 0.00 N ATOM 774 CA ILE A 50 0.709 -7.839 2.364 1.00 0.00 C ATOM 775 C ILE A 50 1.489 -9.093 2.765 1.00 0.00 C ATOM 776 O ILE A 50 2.658 -9.009 3.138 1.00 0.00 O ATOM 777 CB ILE A 50 0.783 -7.521 0.869 1.00 0.00 C ATOM 778 CG1 ILE A 50 -0.160 -8.422 0.069 1.00 0.00 C ATOM 779 CG2 ILE A 50 2.224 -7.605 0.361 1.00 0.00 C ATOM 780 CD1 ILE A 50 -1.615 -7.980 0.238 1.00 0.00 C ATOM 0 H ILE A 50 2.067 -6.314 2.836 1.00 0.00 H new ATOM 0 HA ILE A 50 -0.342 -8.036 2.573 1.00 0.00 H new ATOM 0 HB ILE A 50 0.449 -6.494 0.722 1.00 0.00 H new ATOM 0 HG12 ILE A 50 0.112 -8.394 -0.986 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.049 -9.455 0.399 1.00 0.00 H new ATOM 0 HG21 ILE A 50 2.248 -7.375 -0.704 1.00 0.00 H new ATOM 0 HG22 ILE A 50 2.843 -6.889 0.901 1.00 0.00 H new ATOM 0 HG23 ILE A 50 2.609 -8.612 0.523 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -2.264 -8.637 -0.341 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.891 -8.033 1.291 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.727 -6.955 -0.116 1.00 0.00 H new ATOM 792 N GLY A 51 0.809 -10.227 2.676 1.00 0.00 N ATOM 793 CA GLY A 51 1.423 -11.497 3.025 1.00 0.00 C ATOM 794 C GLY A 51 1.594 -12.382 1.789 1.00 0.00 C ATOM 795 O GLY A 51 0.629 -12.975 1.308 1.00 0.00 O ATOM 0 H GLY A 51 -0.161 -10.293 2.367 1.00 0.00 H new ATOM 0 HA2 GLY A 51 2.394 -11.320 3.487 1.00 0.00 H new ATOM 0 HA3 GLY A 51 0.808 -12.012 3.763 1.00 0.00 H new ATOM 799 N ILE A 52 2.827 -12.442 1.309 1.00 0.00 N ATOM 800 CA ILE A 52 3.136 -13.245 0.138 1.00 0.00 C ATOM 801 C ILE A 52 2.475 -14.618 0.277 1.00 0.00 C ATOM 802 O ILE A 52 1.346 -14.815 -0.171 1.00 0.00 O ATOM 803 CB ILE A 52 4.649 -13.311 -0.082 1.00 0.00 C ATOM 804 CG1 ILE A 52 5.396 -13.359 1.252 1.00 0.00 C ATOM 805 CG2 ILE A 52 5.125 -12.155 -0.965 1.00 0.00 C ATOM 806 CD1 ILE A 52 5.974 -11.988 1.606 1.00 0.00 C ATOM 0 H ILE A 52 3.624 -11.948 1.710 1.00 0.00 H new ATOM 0 HA ILE A 52 2.726 -12.783 -0.760 1.00 0.00 H new ATOM 0 HB ILE A 52 4.877 -14.236 -0.611 1.00 0.00 H new ATOM 0 HG12 ILE A 52 4.719 -13.687 2.041 1.00 0.00 H new ATOM 0 HG13 ILE A 52 6.200 -14.093 1.197 1.00 0.00 H new ATOM 0 HG21 ILE A 52 6.204 -12.225 -1.106 1.00 0.00 H new ATOM 0 HG22 ILE A 52 4.628 -12.209 -1.934 1.00 0.00 H new ATOM 0 HG23 ILE A 52 4.883 -11.207 -0.485 1.00 0.00 H new ATOM 0 HD11 ILE A 52 6.500 -12.050 2.559 1.00 0.00 H new ATOM 0 HD12 ILE A 52 6.669 -11.674 0.827 1.00 0.00 H new ATOM 0 HD13 ILE A 52 5.165 -11.261 1.685 1.00 0.00 H new ATOM 917 N VAL A 60 4.857 -14.532 6.607 1.00 0.00 N ATOM 918 CA VAL A 60 5.702 -13.641 5.831 1.00 0.00 C ATOM 919 C VAL A 60 4.864 -12.469 5.316 1.00 0.00 C ATOM 920 O VAL A 60 3.689 -12.636 4.993 1.00 0.00 O ATOM 921 CB VAL A 60 6.393 -14.420 4.709 1.00 0.00 C ATOM 922 CG1 VAL A 60 5.366 -15.092 3.795 1.00 0.00 C ATOM 923 CG2 VAL A 60 7.330 -13.514 3.908 1.00 0.00 C ATOM 0 HA VAL A 60 6.493 -13.225 6.455 1.00 0.00 H new ATOM 0 HB VAL A 60 6.996 -15.203 5.168 1.00 0.00 H new ATOM 0 HG11 VAL A 60 5.883 -15.639 3.007 1.00 0.00 H new ATOM 0 HG12 VAL A 60 4.758 -15.784 4.378 1.00 0.00 H new ATOM 0 HG13 VAL A 60 4.724 -14.332 3.349 1.00 0.00 H new ATOM 0 HG21 VAL A 60 7.808 -14.093 3.117 1.00 0.00 H new ATOM 0 HG22 VAL A 60 6.758 -12.699 3.466 1.00 0.00 H new ATOM 0 HG23 VAL A 60 8.093 -13.104 4.570 1.00 0.00 H new ATOM 933 N TYR A 61 5.502 -11.309 5.256 1.00 0.00 N ATOM 934 CA TYR A 61 4.830 -10.110 4.786 1.00 0.00 C ATOM 935 C TYR A 61 5.817 -9.157 4.109 1.00 0.00 C ATOM 936 O TYR A 61 6.994 -9.120 4.467 1.00 0.00 O ATOM 937 CB TYR A 61 4.257 -9.432 6.032 1.00 0.00 C ATOM 938 CG TYR A 61 2.899 -9.982 6.471 1.00 0.00 C ATOM 939 CD1 TYR A 61 1.740 -9.496 5.900 1.00 0.00 C ATOM 940 CD2 TYR A 61 2.832 -10.964 7.439 1.00 0.00 C ATOM 941 CE1 TYR A 61 0.462 -10.014 6.314 1.00 0.00 C ATOM 942 CE2 TYR A 61 1.554 -11.481 7.852 1.00 0.00 C ATOM 943 CZ TYR A 61 0.432 -10.981 7.269 1.00 0.00 C ATOM 944 OH TYR A 61 -0.776 -11.470 7.660 1.00 0.00 O ATOM 0 H TYR A 61 6.477 -11.174 5.525 1.00 0.00 H new ATOM 0 HA TYR A 61 4.061 -10.363 4.056 1.00 0.00 H new ATOM 0 HB2 TYR A 61 4.966 -9.545 6.853 1.00 0.00 H new ATOM 0 HB3 TYR A 61 4.160 -8.364 5.839 1.00 0.00 H new ATOM 0 HD1 TYR A 61 1.792 -8.727 5.143 1.00 0.00 H new ATOM 0 HD2 TYR A 61 3.739 -11.344 7.886 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -0.452 -9.643 5.876 1.00 0.00 H new ATOM 0 HE2 TYR A 61 1.488 -12.249 8.608 1.00 0.00 H new ATOM 0 HH TYR A 61 -0.644 -12.156 8.348 1.00 0.00 H new ATOM 954 N ARG A 62 5.303 -8.410 3.144 1.00 0.00 N ATOM 955 CA ARG A 62 6.125 -7.459 2.414 1.00 0.00 C ATOM 956 C ARG A 62 5.412 -6.109 2.313 1.00 0.00 C ATOM 957 O ARG A 62 4.285 -6.033 1.827 1.00 0.00 O ATOM 958 CB ARG A 62 6.439 -7.969 1.007 1.00 0.00 C ATOM 959 CG ARG A 62 7.165 -9.315 1.060 1.00 0.00 C ATOM 960 CD ARG A 62 8.658 -9.145 0.774 1.00 0.00 C ATOM 961 NE ARG A 62 9.300 -8.388 1.871 1.00 0.00 N ATOM 962 CZ ARG A 62 9.553 -8.894 3.086 1.00 0.00 C ATOM 963 NH1 ARG A 62 9.218 -10.161 3.366 1.00 0.00 N ATOM 964 NH2 ARG A 62 10.139 -8.133 4.020 1.00 0.00 N ATOM 0 H ARG A 62 4.327 -8.444 2.850 1.00 0.00 H new ATOM 0 HA ARG A 62 7.060 -7.340 2.962 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.514 -8.073 0.439 1.00 0.00 H new ATOM 0 HB3 ARG A 62 7.056 -7.240 0.481 1.00 0.00 H new ATOM 0 HG2 ARG A 62 7.029 -9.767 2.042 1.00 0.00 H new ATOM 0 HG3 ARG A 62 6.727 -9.997 0.331 1.00 0.00 H new ATOM 0 HD2 ARG A 62 9.130 -10.122 0.670 1.00 0.00 H new ATOM 0 HD3 ARG A 62 8.798 -8.621 -0.171 1.00 0.00 H new ATOM 0 HE ARG A 62 9.567 -7.420 1.691 1.00 0.00 H new ATOM 0 HH11 ARG A 62 8.771 -10.739 2.655 1.00 0.00 H new ATOM 0 HH12 ARG A 62 9.410 -10.547 4.290 1.00 0.00 H new ATOM 0 HH21 ARG A 62 10.393 -7.168 3.806 1.00 0.00 H new ATOM 0 HH22 ARG A 62 10.331 -8.518 4.945 1.00 0.00 H new ATOM 978 N VAL A 63 6.099 -5.077 2.780 1.00 0.00 N ATOM 979 CA VAL A 63 5.546 -3.734 2.748 1.00 0.00 C ATOM 980 C VAL A 63 5.347 -3.303 1.294 1.00 0.00 C ATOM 981 O VAL A 63 6.277 -3.367 0.491 1.00 0.00 O ATOM 982 CB VAL A 63 6.445 -2.779 3.537 1.00 0.00 C ATOM 983 CG1 VAL A 63 6.091 -1.321 3.238 1.00 0.00 C ATOM 984 CG2 VAL A 63 6.367 -3.066 5.038 1.00 0.00 C ATOM 0 H VAL A 63 7.034 -5.144 3.183 1.00 0.00 H new ATOM 0 HA VAL A 63 4.569 -3.712 3.230 1.00 0.00 H new ATOM 0 HB VAL A 63 7.474 -2.946 3.218 1.00 0.00 H new ATOM 0 HG11 VAL A 63 6.744 -0.663 3.811 1.00 0.00 H new ATOM 0 HG12 VAL A 63 6.222 -1.126 2.174 1.00 0.00 H new ATOM 0 HG13 VAL A 63 5.054 -1.134 3.516 1.00 0.00 H new ATOM 0 HG21 VAL A 63 7.015 -2.373 5.575 1.00 0.00 H new ATOM 0 HG22 VAL A 63 5.340 -2.940 5.380 1.00 0.00 H new ATOM 0 HG23 VAL A 63 6.691 -4.089 5.230 1.00 0.00 H new ATOM 994 N ALA A 64 4.129 -2.874 0.998 1.00 0.00 N ATOM 995 CA ALA A 64 3.796 -2.434 -0.346 1.00 0.00 C ATOM 996 C ALA A 64 3.079 -1.084 -0.272 1.00 0.00 C ATOM 997 O ALA A 64 2.392 -0.794 0.706 1.00 0.00 O ATOM 998 CB ALA A 64 2.953 -3.505 -1.040 1.00 0.00 C ATOM 0 H ALA A 64 3.360 -2.822 1.666 1.00 0.00 H new ATOM 0 HA ALA A 64 4.699 -2.296 -0.940 1.00 0.00 H new ATOM 0 HB1 ALA A 64 2.703 -3.175 -2.048 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.518 -4.435 -1.093 1.00 0.00 H new ATOM 0 HB3 ALA A 64 2.036 -3.669 -0.474 1.00 0.00 H new ATOM 1004 N GLU A 65 3.264 -0.294 -1.320 1.00 0.00 N ATOM 1005 CA GLU A 65 2.644 1.018 -1.386 1.00 0.00 C ATOM 1006 C GLU A 65 1.541 1.031 -2.447 1.00 0.00 C ATOM 1007 O GLU A 65 1.761 0.608 -3.581 1.00 0.00 O ATOM 1008 CB GLU A 65 3.685 2.104 -1.665 1.00 0.00 C ATOM 1009 CG GLU A 65 3.023 3.476 -1.804 1.00 0.00 C ATOM 1010 CD GLU A 65 3.893 4.423 -2.632 1.00 0.00 C ATOM 1011 OE1 GLU A 65 3.773 4.364 -3.875 1.00 0.00 O ATOM 1012 OE2 GLU A 65 4.659 5.186 -2.004 1.00 0.00 O ATOM 0 H GLU A 65 3.834 -0.538 -2.130 1.00 0.00 H new ATOM 0 HA GLU A 65 2.193 1.234 -0.417 1.00 0.00 H new ATOM 0 HB2 GLU A 65 4.415 2.129 -0.856 1.00 0.00 H new ATOM 0 HB3 GLU A 65 4.229 1.865 -2.579 1.00 0.00 H new ATOM 0 HG2 GLU A 65 2.047 3.367 -2.277 1.00 0.00 H new ATOM 0 HG3 GLU A 65 2.853 3.903 -0.816 1.00 0.00 H new ATOM 1019 N ILE A 66 0.379 1.521 -2.041 1.00 0.00 N ATOM 1020 CA ILE A 66 -0.758 1.595 -2.942 1.00 0.00 C ATOM 1021 C ILE A 66 -0.440 2.567 -4.080 1.00 0.00 C ATOM 1022 O ILE A 66 -0.001 3.690 -3.837 1.00 0.00 O ATOM 1023 CB ILE A 66 -2.032 1.947 -2.171 1.00 0.00 C ATOM 1024 CG1 ILE A 66 -2.145 1.116 -0.892 1.00 0.00 C ATOM 1025 CG2 ILE A 66 -3.269 1.803 -3.060 1.00 0.00 C ATOM 1026 CD1 ILE A 66 -3.555 1.205 -0.303 1.00 0.00 C ATOM 0 H ILE A 66 0.201 1.871 -1.100 1.00 0.00 H new ATOM 0 HA ILE A 66 -0.947 0.622 -3.396 1.00 0.00 H new ATOM 0 HB ILE A 66 -1.972 2.993 -1.871 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -1.902 0.075 -1.107 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -1.418 1.468 -0.160 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -4.160 2.059 -2.487 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -3.182 2.473 -3.915 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -3.347 0.774 -3.411 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -3.608 0.605 0.606 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -3.786 2.244 -0.066 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -4.277 0.829 -1.028 1.00 0.00 H new ATOM 1038 N THR A 67 -0.673 2.099 -5.298 1.00 0.00 N ATOM 1039 CA THR A 67 -0.416 2.913 -6.474 1.00 0.00 C ATOM 1040 C THR A 67 -1.728 3.255 -7.183 1.00 0.00 C ATOM 1041 O THR A 67 -1.767 4.148 -8.028 1.00 0.00 O ATOM 1042 CB THR A 67 0.577 2.161 -7.362 1.00 0.00 C ATOM 1043 OG1 THR A 67 -0.224 1.193 -8.035 1.00 0.00 O ATOM 1044 CG2 THR A 67 1.570 1.325 -6.552 1.00 0.00 C ATOM 0 H THR A 67 -1.037 1.167 -5.496 1.00 0.00 H new ATOM 0 HA THR A 67 0.029 3.870 -6.203 1.00 0.00 H new ATOM 0 HB THR A 67 1.123 2.873 -7.981 1.00 0.00 H new ATOM 0 HG1 THR A 67 0.340 0.661 -8.634 1.00 0.00 H new ATOM 0 HG21 THR A 67 2.252 0.812 -7.230 1.00 0.00 H new ATOM 0 HG22 THR A 67 2.139 1.977 -5.890 1.00 0.00 H new ATOM 0 HG23 THR A 67 1.027 0.590 -5.958 1.00 0.00 H new ATOM 1052 N GLY A 68 -2.771 2.525 -6.813 1.00 0.00 N ATOM 1053 CA GLY A 68 -4.081 2.739 -7.403 1.00 0.00 C ATOM 1054 C GLY A 68 -5.045 1.613 -7.023 1.00 0.00 C ATOM 1055 O GLY A 68 -4.739 0.798 -6.154 1.00 0.00 O ATOM 0 H GLY A 68 -2.735 1.785 -6.112 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -4.483 3.695 -7.068 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -3.990 2.794 -8.488 1.00 0.00 H new ATOM 1059 N VAL A 69 -6.188 1.605 -7.691 1.00 0.00 N ATOM 1060 CA VAL A 69 -7.199 0.593 -7.434 1.00 0.00 C ATOM 1061 C VAL A 69 -7.714 0.043 -8.765 1.00 0.00 C ATOM 1062 O VAL A 69 -8.229 0.793 -9.593 1.00 0.00 O ATOM 1063 CB VAL A 69 -8.310 1.174 -6.557 1.00 0.00 C ATOM 1064 CG1 VAL A 69 -9.480 0.196 -6.435 1.00 0.00 C ATOM 1065 CG2 VAL A 69 -7.773 1.561 -5.177 1.00 0.00 C ATOM 0 H VAL A 69 -6.437 2.283 -8.411 1.00 0.00 H new ATOM 0 HA VAL A 69 -6.771 -0.243 -6.881 1.00 0.00 H new ATOM 0 HB VAL A 69 -8.679 2.079 -7.039 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -10.256 0.633 -5.807 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -9.888 -0.009 -7.425 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -9.131 -0.734 -5.986 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -8.583 1.971 -4.573 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -7.365 0.678 -4.685 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -6.989 2.309 -5.289 1.00 0.00 H new ATOM 1075 N VAL A 70 -7.557 -1.262 -8.930 1.00 0.00 N ATOM 1076 CA VAL A 70 -8.000 -1.922 -10.147 1.00 0.00 C ATOM 1077 C VAL A 70 -9.364 -2.570 -9.903 1.00 0.00 C ATOM 1078 O VAL A 70 -9.864 -2.567 -8.779 1.00 0.00 O ATOM 1079 CB VAL A 70 -6.939 -2.919 -10.617 1.00 0.00 C ATOM 1080 CG1 VAL A 70 -5.639 -2.203 -10.988 1.00 0.00 C ATOM 1081 CG2 VAL A 70 -6.689 -3.995 -9.558 1.00 0.00 C ATOM 0 H VAL A 70 -7.129 -1.881 -8.241 1.00 0.00 H new ATOM 0 HA VAL A 70 -8.124 -1.197 -10.952 1.00 0.00 H new ATOM 0 HB VAL A 70 -7.317 -3.412 -11.513 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -4.902 -2.935 -11.319 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -5.831 -1.493 -11.792 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -5.256 -1.670 -10.118 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -5.931 -4.690 -9.918 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -6.343 -3.526 -8.637 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -7.615 -4.536 -9.364 1.00 0.00 H new ATOM 1091 N GLU A 71 -9.926 -3.111 -10.973 1.00 0.00 N ATOM 1092 CA GLU A 71 -11.222 -3.762 -10.890 1.00 0.00 C ATOM 1093 C GLU A 71 -11.107 -5.230 -11.305 1.00 0.00 C ATOM 1094 O GLU A 71 -10.266 -5.581 -12.130 1.00 0.00 O ATOM 1095 CB GLU A 71 -12.259 -3.031 -11.744 1.00 0.00 C ATOM 1096 CG GLU A 71 -12.977 -1.951 -10.931 1.00 0.00 C ATOM 1097 CD GLU A 71 -14.491 -2.023 -11.141 1.00 0.00 C ATOM 1098 OE1 GLU A 71 -15.121 -2.853 -10.451 1.00 0.00 O ATOM 1099 OE2 GLU A 71 -14.984 -1.245 -11.987 1.00 0.00 O ATOM 0 H GLU A 71 -9.507 -3.112 -11.903 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.560 -3.723 -9.854 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -11.770 -2.577 -12.606 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -12.987 -3.745 -12.129 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -12.747 -2.074 -9.873 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -12.612 -0.967 -11.224 1.00 0.00 H new ATOM 1106 N THR A 72 -11.965 -6.049 -10.713 1.00 0.00 N ATOM 1107 CA THR A 72 -11.970 -7.471 -11.011 1.00 0.00 C ATOM 1108 C THR A 72 -13.360 -7.915 -11.468 1.00 0.00 C ATOM 1109 O THR A 72 -14.286 -7.107 -11.526 1.00 0.00 O ATOM 1110 CB THR A 72 -11.471 -8.215 -9.771 1.00 0.00 C ATOM 1111 OG1 THR A 72 -12.401 -7.856 -8.753 1.00 0.00 O ATOM 1112 CG2 THR A 72 -10.134 -7.674 -9.261 1.00 0.00 C ATOM 0 H THR A 72 -12.661 -5.754 -10.028 1.00 0.00 H new ATOM 0 HA THR A 72 -11.301 -7.704 -11.839 1.00 0.00 H new ATOM 0 HB THR A 72 -11.369 -9.275 -10.001 1.00 0.00 H new ATOM 0 HG1 THR A 72 -12.943 -8.637 -8.515 1.00 0.00 H new ATOM 0 HG21 THR A 72 -9.826 -8.237 -8.380 1.00 0.00 H new ATOM 0 HG22 THR A 72 -9.379 -7.777 -10.040 1.00 0.00 H new ATOM 0 HG23 THR A 72 -10.243 -6.622 -8.999 1.00 0.00 H new ATOM 1120 N ALA A 73 -13.463 -9.199 -11.780 1.00 0.00 N ATOM 1121 CA ALA A 73 -14.726 -9.760 -12.231 1.00 0.00 C ATOM 1122 C ALA A 73 -15.329 -10.609 -11.110 1.00 0.00 C ATOM 1123 O ALA A 73 -16.549 -10.729 -11.006 1.00 0.00 O ATOM 1124 CB ALA A 73 -14.499 -10.563 -13.513 1.00 0.00 C ATOM 0 H ALA A 73 -12.693 -9.866 -11.729 1.00 0.00 H new ATOM 0 HA ALA A 73 -15.437 -8.968 -12.465 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -15.446 -10.984 -13.851 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -14.096 -9.908 -14.286 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.793 -11.370 -13.317 1.00 0.00 H new ATOM 1130 N LYS A 74 -14.447 -11.177 -10.301 1.00 0.00 N ATOM 1131 CA LYS A 74 -14.878 -12.012 -9.192 1.00 0.00 C ATOM 1132 C LYS A 74 -14.971 -11.160 -7.924 1.00 0.00 C ATOM 1133 O LYS A 74 -14.227 -10.193 -7.766 1.00 0.00 O ATOM 1134 CB LYS A 74 -13.962 -13.229 -9.050 1.00 0.00 C ATOM 1135 CG LYS A 74 -14.553 -14.249 -8.075 1.00 0.00 C ATOM 1136 CD LYS A 74 -14.417 -15.672 -8.622 1.00 0.00 C ATOM 1137 CE LYS A 74 -12.949 -16.096 -8.689 1.00 0.00 C ATOM 1138 NZ LYS A 74 -12.779 -17.464 -8.152 1.00 0.00 N ATOM 0 H LYS A 74 -13.436 -11.076 -10.391 1.00 0.00 H new ATOM 0 HA LYS A 74 -15.874 -12.413 -9.381 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -13.816 -13.695 -10.025 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -12.980 -12.911 -8.699 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -14.045 -14.175 -7.113 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -15.604 -14.022 -7.899 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -14.970 -16.364 -7.987 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -14.861 -15.727 -9.616 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -12.600 -16.058 -9.721 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -12.336 -15.397 -8.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -11.777 -17.736 -8.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -13.093 -17.489 -7.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -13.348 -18.130 -8.712 1.00 0.00 H new ATOM 1152 N VAL A 75 -15.890 -11.550 -7.054 1.00 0.00 N ATOM 1153 CA VAL A 75 -16.090 -10.835 -5.805 1.00 0.00 C ATOM 1154 C VAL A 75 -15.751 -11.758 -4.633 1.00 0.00 C ATOM 1155 O VAL A 75 -15.940 -12.971 -4.719 1.00 0.00 O ATOM 1156 CB VAL A 75 -17.516 -10.285 -5.739 1.00 0.00 C ATOM 1157 CG1 VAL A 75 -17.898 -9.923 -4.302 1.00 0.00 C ATOM 1158 CG2 VAL A 75 -17.684 -9.084 -6.671 1.00 0.00 C ATOM 0 H VAL A 75 -16.505 -12.352 -7.189 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.421 -9.976 -5.746 1.00 0.00 H new ATOM 0 HB VAL A 75 -18.194 -11.069 -6.078 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -18.916 -9.535 -4.283 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.837 -10.812 -3.674 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -17.213 -9.164 -3.924 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -18.707 -8.712 -6.605 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -16.992 -8.295 -6.377 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -17.474 -9.387 -7.697 1.00 0.00 H new ATOM 1168 N TYR A 76 -15.255 -11.150 -3.566 1.00 0.00 N ATOM 1169 CA TYR A 76 -14.887 -11.902 -2.378 1.00 0.00 C ATOM 1170 C TYR A 76 -15.345 -11.181 -1.109 1.00 0.00 C ATOM 1171 O TYR A 76 -15.637 -9.986 -1.140 1.00 0.00 O ATOM 1172 CB TYR A 76 -13.359 -11.979 -2.384 1.00 0.00 C ATOM 1173 CG TYR A 76 -12.668 -10.616 -2.453 1.00 0.00 C ATOM 1174 CD1 TYR A 76 -12.484 -9.877 -1.303 1.00 0.00 C ATOM 1175 CD2 TYR A 76 -12.227 -10.126 -3.666 1.00 0.00 C ATOM 1176 CE1 TYR A 76 -11.833 -8.594 -1.368 1.00 0.00 C ATOM 1177 CE2 TYR A 76 -11.576 -8.844 -3.731 1.00 0.00 C ATOM 1178 CZ TYR A 76 -11.411 -8.141 -2.578 1.00 0.00 C ATOM 1179 OH TYR A 76 -10.796 -6.929 -2.640 1.00 0.00 O ATOM 0 H TYR A 76 -15.099 -10.144 -3.499 1.00 0.00 H new ATOM 0 HA TYR A 76 -15.355 -12.886 -2.387 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -13.028 -12.498 -1.484 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -13.039 -12.581 -3.235 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -12.828 -10.260 -0.354 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -12.371 -10.705 -4.566 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -11.683 -8.005 -0.475 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -11.226 -8.449 -4.674 1.00 0.00 H new ATOM 0 HH TYR A 76 -10.826 -6.594 -3.560 1.00 0.00 H new ATOM 1189 N GLN A 77 -15.392 -11.937 -0.022 1.00 0.00 N ATOM 1190 CA GLN A 77 -15.808 -11.384 1.256 1.00 0.00 C ATOM 1191 C GLN A 77 -14.675 -10.563 1.874 1.00 0.00 C ATOM 1192 O GLN A 77 -13.501 -10.874 1.679 1.00 0.00 O ATOM 1193 CB GLN A 77 -16.267 -12.491 2.208 1.00 0.00 C ATOM 1194 CG GLN A 77 -17.320 -11.970 3.188 1.00 0.00 C ATOM 1195 CD GLN A 77 -17.653 -13.023 4.246 1.00 0.00 C ATOM 1196 OE1 GLN A 77 -17.736 -12.540 5.483 1.00 0.00 O flip ATOM 1197 NE2 GLN A 77 -17.824 -14.197 3.959 1.00 0.00 N flip ATOM 0 H GLN A 77 -15.149 -12.927 0.000 1.00 0.00 H new ATOM 0 HA GLN A 77 -16.657 -10.722 1.085 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -16.678 -13.321 1.634 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -15.411 -12.878 2.761 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -16.954 -11.065 3.673 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -18.224 -11.697 2.644 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -17.746 -14.501 2.989 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -18.045 -14.874 4.690 1.00 0.00 H new ATOM 1206 N LEU A 78 -15.067 -9.532 2.608 1.00 0.00 N ATOM 1207 CA LEU A 78 -14.098 -8.664 3.256 1.00 0.00 C ATOM 1208 C LEU A 78 -14.679 -8.156 4.577 1.00 0.00 C ATOM 1209 O LEU A 78 -15.136 -7.017 4.662 1.00 0.00 O ATOM 1210 CB LEU A 78 -13.661 -7.546 2.307 1.00 0.00 C ATOM 1211 CG LEU A 78 -12.826 -6.426 2.930 1.00 0.00 C ATOM 1212 CD1 LEU A 78 -11.399 -6.899 3.215 1.00 0.00 C ATOM 1213 CD2 LEU A 78 -12.849 -5.172 2.053 1.00 0.00 C ATOM 0 H LEU A 78 -16.042 -9.278 2.768 1.00 0.00 H new ATOM 0 HA LEU A 78 -13.191 -9.219 3.497 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -13.087 -7.990 1.494 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -14.553 -7.104 1.863 1.00 0.00 H new ATOM 0 HG LEU A 78 -13.274 -6.159 3.887 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -10.827 -6.084 3.658 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -11.426 -7.741 3.907 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -10.926 -7.210 2.284 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -12.248 -4.391 2.519 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -12.440 -5.408 1.071 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -13.876 -4.823 1.944 1.00 0.00 H new ATOM 1225 N GLY A 79 -14.642 -9.026 5.576 1.00 0.00 N ATOM 1226 CA GLY A 79 -15.159 -8.680 6.889 1.00 0.00 C ATOM 1227 C GLY A 79 -16.686 -8.598 6.873 1.00 0.00 C ATOM 1228 O GLY A 79 -17.284 -7.933 7.717 1.00 0.00 O ATOM 0 H GLY A 79 -14.262 -9.970 5.502 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -14.839 -9.425 7.618 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -14.743 -7.724 7.207 1.00 0.00 H new ATOM 1232 N GLY A 80 -17.274 -9.283 5.903 1.00 0.00 N ATOM 1233 CA GLY A 80 -18.720 -9.295 5.765 1.00 0.00 C ATOM 1234 C GLY A 80 -19.150 -8.681 4.431 1.00 0.00 C ATOM 1235 O GLY A 80 -20.054 -9.190 3.772 1.00 0.00 O ATOM 0 H GLY A 80 -16.775 -9.834 5.205 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -19.087 -10.319 5.833 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -19.172 -8.740 6.587 1.00 0.00 H new ATOM 1239 N THR A 81 -18.480 -7.595 4.074 1.00 0.00 N ATOM 1240 CA THR A 81 -18.781 -6.906 2.830 1.00 0.00 C ATOM 1241 C THR A 81 -18.042 -7.564 1.663 1.00 0.00 C ATOM 1242 O THR A 81 -16.915 -8.031 1.822 1.00 0.00 O ATOM 1243 CB THR A 81 -18.433 -5.427 3.013 1.00 0.00 C ATOM 1244 OG1 THR A 81 -19.013 -4.792 1.877 1.00 0.00 O ATOM 1245 CG2 THR A 81 -16.935 -5.156 2.868 1.00 0.00 C ATOM 0 H THR A 81 -17.730 -7.175 4.624 1.00 0.00 H new ATOM 0 HA THR A 81 -19.841 -6.978 2.584 1.00 0.00 H new ATOM 0 HB THR A 81 -18.768 -5.093 3.995 1.00 0.00 H new ATOM 0 HG1 THR A 81 -18.837 -3.829 1.915 1.00 0.00 H new ATOM 0 HG21 THR A 81 -16.743 -4.092 3.007 1.00 0.00 H new ATOM 0 HG22 THR A 81 -16.388 -5.725 3.620 1.00 0.00 H new ATOM 0 HG23 THR A 81 -16.605 -5.458 1.874 1.00 0.00 H new ATOM 1253 N ARG A 82 -18.707 -7.581 0.517 1.00 0.00 N ATOM 1254 CA ARG A 82 -18.127 -8.174 -0.676 1.00 0.00 C ATOM 1255 C ARG A 82 -17.667 -7.081 -1.642 1.00 0.00 C ATOM 1256 O ARG A 82 -18.488 -6.353 -2.198 1.00 0.00 O ATOM 1257 CB ARG A 82 -19.134 -9.081 -1.385 1.00 0.00 C ATOM 1258 CG ARG A 82 -18.891 -10.550 -1.034 1.00 0.00 C ATOM 1259 CD ARG A 82 -19.527 -11.475 -2.074 1.00 0.00 C ATOM 1260 NE ARG A 82 -20.445 -12.428 -1.411 1.00 0.00 N ATOM 1261 CZ ARG A 82 -21.350 -13.174 -2.059 1.00 0.00 C ATOM 1262 NH1 ARG A 82 -21.464 -13.081 -3.391 1.00 0.00 N ATOM 1263 NH2 ARG A 82 -22.141 -14.011 -1.375 1.00 0.00 N ATOM 0 H ARG A 82 -19.642 -7.194 0.389 1.00 0.00 H new ATOM 0 HA ARG A 82 -17.271 -8.773 -0.366 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -20.147 -8.798 -1.100 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -19.056 -8.943 -2.463 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -17.819 -10.742 -0.978 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -19.305 -10.765 -0.049 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -20.072 -10.886 -2.812 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -18.751 -12.019 -2.611 1.00 0.00 H new ATOM 0 HE ARG A 82 -20.385 -12.523 -0.397 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -20.862 -12.443 -3.911 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -22.153 -13.649 -3.885 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -22.054 -14.080 -0.361 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -22.830 -14.579 -1.868 1.00 0.00 H new ATOM 1277 N THR A 83 -16.355 -7.000 -1.813 1.00 0.00 N ATOM 1278 CA THR A 83 -15.776 -6.008 -2.702 1.00 0.00 C ATOM 1279 C THR A 83 -15.099 -6.690 -3.893 1.00 0.00 C ATOM 1280 O THR A 83 -14.682 -7.843 -3.798 1.00 0.00 O ATOM 1281 CB THR A 83 -14.825 -5.135 -1.881 1.00 0.00 C ATOM 1282 OG1 THR A 83 -14.546 -4.028 -2.735 1.00 0.00 O ATOM 1283 CG2 THR A 83 -13.461 -5.794 -1.669 1.00 0.00 C ATOM 0 H THR A 83 -15.677 -7.606 -1.351 1.00 0.00 H new ATOM 0 HA THR A 83 -16.544 -5.364 -3.130 1.00 0.00 H new ATOM 0 HB THR A 83 -15.277 -4.917 -0.913 1.00 0.00 H new ATOM 0 HG1 THR A 83 -14.707 -3.192 -2.250 1.00 0.00 H new ATOM 0 HG21 THR A 83 -12.825 -5.133 -1.081 1.00 0.00 H new ATOM 0 HG22 THR A 83 -13.591 -6.738 -1.139 1.00 0.00 H new ATOM 0 HG23 THR A 83 -12.994 -5.982 -2.636 1.00 0.00 H new ATOM 1291 N ASN A 84 -15.012 -5.948 -4.988 1.00 0.00 N ATOM 1292 CA ASN A 84 -14.394 -6.467 -6.196 1.00 0.00 C ATOM 1293 C ASN A 84 -13.350 -5.467 -6.699 1.00 0.00 C ATOM 1294 O ASN A 84 -13.185 -5.291 -7.905 1.00 0.00 O ATOM 1295 CB ASN A 84 -15.430 -6.666 -7.303 1.00 0.00 C ATOM 1296 CG ASN A 84 -15.753 -5.341 -7.997 1.00 0.00 C ATOM 1297 OD1 ASN A 84 -16.246 -4.400 -7.396 1.00 0.00 O ATOM 1298 ND2 ASN A 84 -15.449 -5.320 -9.291 1.00 0.00 N ATOM 0 H ASN A 84 -15.359 -4.992 -5.063 1.00 0.00 H new ATOM 0 HA ASN A 84 -13.936 -7.426 -5.955 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -15.053 -7.381 -8.034 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -16.341 -7.091 -6.881 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -15.626 -4.481 -9.843 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -15.038 -6.143 -9.732 1.00 0.00 H new ATOM 1305 N LYS A 85 -12.673 -4.838 -5.749 1.00 0.00 N ATOM 1306 CA LYS A 85 -11.651 -3.861 -6.081 1.00 0.00 C ATOM 1307 C LYS A 85 -10.276 -4.420 -5.706 1.00 0.00 C ATOM 1308 O LYS A 85 -10.052 -4.813 -4.562 1.00 0.00 O ATOM 1309 CB LYS A 85 -11.965 -2.514 -5.427 1.00 0.00 C ATOM 1310 CG LYS A 85 -13.231 -1.897 -6.025 1.00 0.00 C ATOM 1311 CD LYS A 85 -13.262 -0.383 -5.801 1.00 0.00 C ATOM 1312 CE LYS A 85 -13.614 -0.051 -4.350 1.00 0.00 C ATOM 1313 NZ LYS A 85 -15.083 -0.039 -4.163 1.00 0.00 N ATOM 0 H LYS A 85 -12.813 -4.986 -4.750 1.00 0.00 H new ATOM 0 HA LYS A 85 -11.638 -3.673 -7.155 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -12.094 -2.648 -4.353 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -11.124 -1.834 -5.565 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -13.275 -2.111 -7.093 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -14.111 -2.353 -5.572 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -12.291 0.045 -6.051 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -13.993 0.072 -6.470 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -13.162 -0.785 -3.683 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -13.199 0.921 -4.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -15.306 0.238 -3.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -15.511 0.642 -4.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -15.464 -0.988 -4.350 1.00 0.00 H new ATOM 1327 N GLY A 86 -9.392 -4.439 -6.693 1.00 0.00 N ATOM 1328 CA GLY A 86 -8.046 -4.943 -6.482 1.00 0.00 C ATOM 1329 C GLY A 86 -7.102 -3.821 -6.043 1.00 0.00 C ATOM 1330 O GLY A 86 -6.883 -2.864 -6.784 1.00 0.00 O ATOM 0 H GLY A 86 -9.582 -4.113 -7.641 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -8.062 -5.727 -5.725 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -7.675 -5.396 -7.402 1.00 0.00 H new ATOM 1334 N LEU A 87 -6.570 -3.976 -4.839 1.00 0.00 N ATOM 1335 CA LEU A 87 -5.655 -2.988 -4.293 1.00 0.00 C ATOM 1336 C LEU A 87 -4.293 -3.128 -4.976 1.00 0.00 C ATOM 1337 O LEU A 87 -3.598 -4.124 -4.784 1.00 0.00 O ATOM 1338 CB LEU A 87 -5.593 -3.101 -2.769 1.00 0.00 C ATOM 1339 CG LEU A 87 -6.384 -2.051 -1.986 1.00 0.00 C ATOM 1340 CD1 LEU A 87 -6.091 -2.148 -0.487 1.00 0.00 C ATOM 1341 CD2 LEU A 87 -6.121 -0.646 -2.531 1.00 0.00 C ATOM 0 H LEU A 87 -6.755 -4.771 -4.227 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.014 -1.980 -4.501 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -5.955 -4.088 -2.483 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -4.549 -3.044 -2.462 1.00 0.00 H new ATOM 0 HG LEU A 87 -7.446 -2.255 -2.121 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -6.666 -1.391 0.046 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -6.371 -3.137 -0.125 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -5.027 -1.985 -0.313 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -6.696 0.081 -1.956 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.059 -0.416 -2.448 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.421 -0.600 -3.578 1.00 0.00 H new ATOM 1353 N GLN A 88 -3.953 -2.115 -5.759 1.00 0.00 N ATOM 1354 CA GLN A 88 -2.687 -2.112 -6.472 1.00 0.00 C ATOM 1355 C GLN A 88 -1.539 -1.792 -5.512 1.00 0.00 C ATOM 1356 O GLN A 88 -1.428 -0.669 -5.023 1.00 0.00 O ATOM 1357 CB GLN A 88 -2.717 -1.123 -7.639 1.00 0.00 C ATOM 1358 CG GLN A 88 -2.297 -1.803 -8.944 1.00 0.00 C ATOM 1359 CD GLN A 88 -2.046 -0.770 -10.044 1.00 0.00 C ATOM 1360 OE1 GLN A 88 -2.605 0.314 -10.053 1.00 0.00 O ATOM 1361 NE2 GLN A 88 -1.175 -1.165 -10.969 1.00 0.00 N ATOM 0 H GLN A 88 -4.532 -1.290 -5.915 1.00 0.00 H new ATOM 0 HA GLN A 88 -2.523 -3.107 -6.886 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -3.721 -0.711 -7.746 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -2.050 -0.287 -7.429 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -1.394 -2.390 -8.778 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -3.074 -2.498 -9.263 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -0.743 -2.086 -10.902 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -0.940 -0.546 -11.745 1.00 0.00 H new ATOM 1370 N LEU A 89 -0.713 -2.800 -5.271 1.00 0.00 N ATOM 1371 CA LEU A 89 0.422 -2.641 -4.379 1.00 0.00 C ATOM 1372 C LEU A 89 1.718 -2.813 -5.174 1.00 0.00 C ATOM 1373 O LEU A 89 1.918 -3.836 -5.828 1.00 0.00 O ATOM 1374 CB LEU A 89 0.303 -3.590 -3.185 1.00 0.00 C ATOM 1375 CG LEU A 89 -1.089 -3.709 -2.559 1.00 0.00 C ATOM 1376 CD1 LEU A 89 -1.064 -4.630 -1.338 1.00 0.00 C ATOM 1377 CD2 LEU A 89 -1.659 -2.329 -2.225 1.00 0.00 C ATOM 0 H LEU A 89 -0.808 -3.730 -5.679 1.00 0.00 H new ATOM 0 HA LEU A 89 0.437 -1.636 -3.957 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.623 -4.583 -3.502 1.00 0.00 H new ATOM 0 HB3 LEU A 89 1.000 -3.261 -2.414 1.00 0.00 H new ATOM 0 HG LEU A 89 -1.756 -4.164 -3.291 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -2.065 -4.697 -0.912 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.730 -5.623 -1.638 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -0.379 -4.227 -0.592 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -2.648 -2.442 -1.782 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -1.000 -1.824 -1.518 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -1.735 -1.736 -3.137 1.00 0.00 H new ATOM 1389 N ARG A 90 2.565 -1.798 -5.092 1.00 0.00 N ATOM 1390 CA ARG A 90 3.836 -1.824 -5.795 1.00 0.00 C ATOM 1391 C ARG A 90 4.995 -1.829 -4.797 1.00 0.00 C ATOM 1392 O ARG A 90 5.064 -0.974 -3.916 1.00 0.00 O ATOM 1393 CB ARG A 90 3.977 -0.615 -6.723 1.00 0.00 C ATOM 1394 CG ARG A 90 5.268 -0.698 -7.539 1.00 0.00 C ATOM 1395 CD ARG A 90 5.882 0.689 -7.737 1.00 0.00 C ATOM 1396 NE ARG A 90 6.291 1.253 -6.431 1.00 0.00 N ATOM 1397 CZ ARG A 90 6.638 2.533 -6.240 1.00 0.00 C ATOM 1398 NH1 ARG A 90 6.627 3.390 -7.270 1.00 0.00 N ATOM 1399 NH2 ARG A 90 6.995 2.956 -5.020 1.00 0.00 N ATOM 0 H ARG A 90 2.396 -0.951 -4.549 1.00 0.00 H new ATOM 0 HA ARG A 90 3.864 -2.734 -6.395 1.00 0.00 H new ATOM 0 HB2 ARG A 90 3.120 -0.566 -7.395 1.00 0.00 H new ATOM 0 HB3 ARG A 90 3.973 0.302 -6.134 1.00 0.00 H new ATOM 0 HG2 ARG A 90 5.982 -1.347 -7.031 1.00 0.00 H new ATOM 0 HG3 ARG A 90 5.061 -1.150 -8.509 1.00 0.00 H new ATOM 0 HD2 ARG A 90 6.745 0.623 -8.400 1.00 0.00 H new ATOM 0 HD3 ARG A 90 5.161 1.350 -8.218 1.00 0.00 H new ATOM 0 HE ARG A 90 6.310 0.628 -5.625 1.00 0.00 H new ATOM 0 HH11 ARG A 90 6.355 3.068 -8.199 1.00 0.00 H new ATOM 0 HH12 ARG A 90 6.891 4.365 -7.125 1.00 0.00 H new ATOM 0 HH21 ARG A 90 7.003 2.304 -4.236 1.00 0.00 H new ATOM 0 HH22 ARG A 90 7.259 3.931 -4.875 1.00 0.00 H new ATOM 1413 N HIS A 91 5.877 -2.803 -4.968 1.00 0.00 N ATOM 1414 CA HIS A 91 7.030 -2.931 -4.093 1.00 0.00 C ATOM 1415 C HIS A 91 8.314 -2.844 -4.920 1.00 0.00 C ATOM 1416 O HIS A 91 8.500 -3.608 -5.867 1.00 0.00 O ATOM 1417 CB HIS A 91 6.944 -4.215 -3.266 1.00 0.00 C ATOM 1418 CG HIS A 91 8.145 -4.460 -2.384 1.00 0.00 C ATOM 1419 ND1 HIS A 91 8.387 -5.674 -1.767 1.00 0.00 N ATOM 1420 CD2 HIS A 91 9.170 -3.634 -2.025 1.00 0.00 C ATOM 1421 CE1 HIS A 91 9.509 -5.572 -1.069 1.00 0.00 C ATOM 1422 NE2 HIS A 91 9.992 -4.307 -1.230 1.00 0.00 N ATOM 0 H HIS A 91 5.816 -3.511 -5.700 1.00 0.00 H new ATOM 0 HA HIS A 91 7.042 -2.108 -3.379 1.00 0.00 H new ATOM 0 HB2 HIS A 91 6.051 -4.174 -2.643 1.00 0.00 H new ATOM 0 HB3 HIS A 91 6.823 -5.062 -3.941 1.00 0.00 H new ATOM 0 HD1 HIS A 91 7.802 -6.506 -1.837 1.00 0.00 H new ATOM 0 HD2 HIS A 91 9.292 -2.607 -2.335 1.00 0.00 H new ATOM 0 HE1 HIS A 91 9.961 -6.354 -0.477 1.00 0.00 H new ATOM 1430 N GLY A 92 9.167 -1.907 -4.533 1.00 0.00 N ATOM 1431 CA GLY A 92 10.428 -1.710 -5.227 1.00 0.00 C ATOM 1432 C GLY A 92 10.208 -1.568 -6.735 1.00 0.00 C ATOM 1433 O GLY A 92 9.326 -0.829 -7.170 1.00 0.00 O ATOM 0 H GLY A 92 9.009 -1.276 -3.747 1.00 0.00 H new ATOM 0 HA2 GLY A 92 10.923 -0.818 -4.843 1.00 0.00 H new ATOM 0 HA3 GLY A 92 11.091 -2.553 -5.030 1.00 0.00 H new ATOM 1437 N ASN A 93 11.026 -2.286 -7.490 1.00 0.00 N ATOM 1438 CA ASN A 93 10.932 -2.249 -8.939 1.00 0.00 C ATOM 1439 C ASN A 93 9.977 -3.347 -9.412 1.00 0.00 C ATOM 1440 O ASN A 93 10.013 -3.748 -10.575 1.00 0.00 O ATOM 1441 CB ASN A 93 12.296 -2.498 -9.586 1.00 0.00 C ATOM 1442 CG ASN A 93 12.733 -3.953 -9.403 1.00 0.00 C ATOM 1443 OD1 ASN A 93 12.035 -4.887 -9.763 1.00 0.00 O ATOM 1444 ND2 ASN A 93 13.922 -4.092 -8.825 1.00 0.00 N ATOM 0 H ASN A 93 11.757 -2.897 -7.125 1.00 0.00 H new ATOM 0 HA ASN A 93 10.570 -1.262 -9.228 1.00 0.00 H new ATOM 0 HB2 ASN A 93 12.247 -2.260 -10.649 1.00 0.00 H new ATOM 0 HB3 ASN A 93 13.039 -1.833 -9.144 1.00 0.00 H new ATOM 0 HD21 ASN A 93 14.302 -5.024 -8.658 1.00 0.00 H new ATOM 0 HD22 ASN A 93 14.454 -3.267 -8.548 1.00 0.00 H new ATOM 1451 N ASP A 94 9.146 -3.803 -8.487 1.00 0.00 N ATOM 1452 CA ASP A 94 8.183 -4.847 -8.795 1.00 0.00 C ATOM 1453 C ASP A 94 6.786 -4.386 -8.375 1.00 0.00 C ATOM 1454 O ASP A 94 6.569 -4.020 -7.221 1.00 0.00 O ATOM 1455 CB ASP A 94 8.504 -6.135 -8.033 1.00 0.00 C ATOM 1456 CG ASP A 94 9.130 -7.247 -8.878 1.00 0.00 C ATOM 1457 OD1 ASP A 94 8.485 -7.631 -9.877 1.00 0.00 O ATOM 1458 OD2 ASP A 94 10.238 -7.687 -8.505 1.00 0.00 O ATOM 0 H ASP A 94 9.119 -3.469 -7.524 1.00 0.00 H new ATOM 0 HA ASP A 94 8.227 -5.041 -9.867 1.00 0.00 H new ATOM 0 HB2 ASP A 94 9.183 -5.896 -7.214 1.00 0.00 H new ATOM 0 HB3 ASP A 94 7.585 -6.513 -7.585 1.00 0.00 H new ATOM 1463 N GLN A 95 5.874 -4.419 -9.336 1.00 0.00 N ATOM 1464 CA GLN A 95 4.503 -4.009 -9.080 1.00 0.00 C ATOM 1465 C GLN A 95 3.601 -5.236 -8.932 1.00 0.00 C ATOM 1466 O GLN A 95 3.856 -6.275 -9.538 1.00 0.00 O ATOM 1467 CB GLN A 95 3.993 -3.084 -10.186 1.00 0.00 C ATOM 1468 CG GLN A 95 3.539 -3.886 -11.407 1.00 0.00 C ATOM 1469 CD GLN A 95 4.072 -3.266 -12.700 1.00 0.00 C ATOM 1470 OE1 GLN A 95 5.231 -3.406 -13.055 1.00 0.00 O ATOM 1471 NE2 GLN A 95 3.164 -2.574 -13.383 1.00 0.00 N ATOM 0 H GLN A 95 6.057 -4.723 -10.292 1.00 0.00 H new ATOM 0 HA GLN A 95 4.480 -3.450 -8.144 1.00 0.00 H new ATOM 0 HB2 GLN A 95 3.163 -2.486 -9.810 1.00 0.00 H new ATOM 0 HB3 GLN A 95 4.781 -2.389 -10.476 1.00 0.00 H new ATOM 0 HG2 GLN A 95 3.889 -4.915 -11.322 1.00 0.00 H new ATOM 0 HG3 GLN A 95 2.450 -3.922 -11.439 1.00 0.00 H new ATOM 0 HE21 GLN A 95 2.210 -2.496 -13.030 1.00 0.00 H new ATOM 0 HE22 GLN A 95 3.421 -2.121 -14.260 1.00 0.00 H new ATOM 1480 N ARG A 96 2.565 -5.074 -8.122 1.00 0.00 N ATOM 1481 CA ARG A 96 1.623 -6.156 -7.887 1.00 0.00 C ATOM 1482 C ARG A 96 0.294 -5.600 -7.371 1.00 0.00 C ATOM 1483 O ARG A 96 0.127 -4.386 -7.259 1.00 0.00 O ATOM 1484 CB ARG A 96 2.178 -7.157 -6.872 1.00 0.00 C ATOM 1485 CG ARG A 96 2.957 -6.443 -5.766 1.00 0.00 C ATOM 1486 CD ARG A 96 3.827 -7.429 -4.984 1.00 0.00 C ATOM 1487 NE ARG A 96 5.246 -7.014 -5.049 1.00 0.00 N ATOM 1488 CZ ARG A 96 6.277 -7.812 -4.740 1.00 0.00 C ATOM 1489 NH1 ARG A 96 6.054 -9.072 -4.344 1.00 0.00 N ATOM 1490 NH2 ARG A 96 7.532 -7.350 -4.829 1.00 0.00 N ATOM 0 H ARG A 96 2.357 -4.211 -7.620 1.00 0.00 H new ATOM 0 HA ARG A 96 1.462 -6.668 -8.835 1.00 0.00 H new ATOM 0 HB2 ARG A 96 1.359 -7.728 -6.434 1.00 0.00 H new ATOM 0 HB3 ARG A 96 2.829 -7.870 -7.378 1.00 0.00 H new ATOM 0 HG2 ARG A 96 3.584 -5.665 -6.202 1.00 0.00 H new ATOM 0 HG3 ARG A 96 2.262 -5.949 -5.088 1.00 0.00 H new ATOM 0 HD2 ARG A 96 3.499 -7.471 -3.945 1.00 0.00 H new ATOM 0 HD3 ARG A 96 3.714 -8.432 -5.395 1.00 0.00 H new ATOM 0 HE ARG A 96 5.452 -6.061 -5.348 1.00 0.00 H new ATOM 0 HH11 ARG A 96 5.099 -9.424 -4.278 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.839 -9.679 -4.109 1.00 0.00 H new ATOM 0 HH21 ARG A 96 7.702 -6.391 -5.132 1.00 0.00 H new ATOM 0 HH22 ARG A 96 8.317 -7.957 -4.594 1.00 0.00 H new ATOM 1504 N VAL A 97 -0.616 -6.514 -7.070 1.00 0.00 N ATOM 1505 CA VAL A 97 -1.924 -6.130 -6.568 1.00 0.00 C ATOM 1506 C VAL A 97 -2.602 -7.349 -5.939 1.00 0.00 C ATOM 1507 O VAL A 97 -2.745 -8.387 -6.584 1.00 0.00 O ATOM 1508 CB VAL A 97 -2.751 -5.500 -7.690 1.00 0.00 C ATOM 1509 CG1 VAL A 97 -2.782 -6.405 -8.923 1.00 0.00 C ATOM 1510 CG2 VAL A 97 -4.168 -5.175 -7.212 1.00 0.00 C ATOM 0 H VAL A 97 -0.473 -7.520 -7.164 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.827 -5.373 -5.789 1.00 0.00 H new ATOM 0 HB VAL A 97 -2.271 -4.564 -7.974 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -3.376 -5.933 -9.706 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -1.766 -6.562 -9.284 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -3.226 -7.365 -8.659 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -4.734 -4.728 -8.029 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -4.661 -6.091 -6.887 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -4.119 -4.474 -6.379 1.00 0.00 H new ATOM 1520 N PHE A 98 -3.002 -7.184 -4.687 1.00 0.00 N ATOM 1521 CA PHE A 98 -3.661 -8.258 -3.963 1.00 0.00 C ATOM 1522 C PHE A 98 -5.094 -7.870 -3.593 1.00 0.00 C ATOM 1523 O PHE A 98 -5.643 -6.913 -4.137 1.00 0.00 O ATOM 1524 CB PHE A 98 -2.861 -8.490 -2.680 1.00 0.00 C ATOM 1525 CG PHE A 98 -1.372 -8.758 -2.915 1.00 0.00 C ATOM 1526 CD1 PHE A 98 -0.547 -7.739 -3.277 1.00 0.00 C ATOM 1527 CD2 PHE A 98 -0.875 -10.014 -2.762 1.00 0.00 C ATOM 1528 CE1 PHE A 98 0.834 -7.987 -3.495 1.00 0.00 C ATOM 1529 CE2 PHE A 98 0.506 -10.263 -2.980 1.00 0.00 C ATOM 1530 CZ PHE A 98 1.331 -9.244 -3.342 1.00 0.00 C ATOM 0 H PHE A 98 -2.882 -6.322 -4.155 1.00 0.00 H new ATOM 0 HA PHE A 98 -3.703 -9.153 -4.583 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -2.965 -7.617 -2.036 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -3.292 -9.335 -2.143 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -0.942 -6.741 -3.399 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -1.531 -10.823 -2.475 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.489 -7.178 -3.782 1.00 0.00 H new ATOM 0 HE2 PHE A 98 0.901 -11.261 -2.858 1.00 0.00 H new ATOM 0 HZ PHE A 98 2.381 -9.433 -3.508 1.00 0.00 H new ATOM 1540 N ARG A 99 -5.660 -8.634 -2.670 1.00 0.00 N ATOM 1541 CA ARG A 99 -7.018 -8.383 -2.220 1.00 0.00 C ATOM 1542 C ARG A 99 -7.009 -7.773 -0.817 1.00 0.00 C ATOM 1543 O ARG A 99 -6.035 -7.917 -0.080 1.00 0.00 O ATOM 1544 CB ARG A 99 -7.840 -9.673 -2.203 1.00 0.00 C ATOM 1545 CG ARG A 99 -8.066 -10.198 -3.622 1.00 0.00 C ATOM 1546 CD ARG A 99 -8.824 -9.175 -4.471 1.00 0.00 C ATOM 1547 NE ARG A 99 -7.911 -8.566 -5.464 1.00 0.00 N ATOM 1548 CZ ARG A 99 -7.464 -9.196 -6.559 1.00 0.00 C ATOM 1549 NH1 ARG A 99 -7.842 -10.457 -6.808 1.00 0.00 N ATOM 1550 NH2 ARG A 99 -6.638 -8.565 -7.404 1.00 0.00 N ATOM 0 H ARG A 99 -5.202 -9.427 -2.222 1.00 0.00 H new ATOM 0 HA ARG A 99 -7.475 -7.684 -2.920 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -7.325 -10.429 -1.610 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -8.801 -9.490 -1.722 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -7.106 -10.423 -4.088 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -8.628 -11.131 -3.583 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -9.658 -9.659 -4.980 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -9.247 -8.401 -3.831 1.00 0.00 H new ATOM 0 HE ARG A 99 -7.603 -7.607 -5.305 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -8.470 -10.938 -6.164 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -7.502 -10.936 -7.642 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -6.349 -7.605 -7.214 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -6.298 -9.044 -8.238 1.00 0.00 H new ATOM 1564 N LEU A 100 -8.106 -7.106 -0.489 1.00 0.00 N ATOM 1565 CA LEU A 100 -8.236 -6.474 0.813 1.00 0.00 C ATOM 1566 C LEU A 100 -8.193 -7.547 1.903 1.00 0.00 C ATOM 1567 O LEU A 100 -7.768 -7.280 3.026 1.00 0.00 O ATOM 1568 CB LEU A 100 -9.490 -5.599 0.861 1.00 0.00 C ATOM 1569 CG LEU A 100 -9.332 -4.171 0.337 1.00 0.00 C ATOM 1570 CD1 LEU A 100 -9.200 -4.157 -1.187 1.00 0.00 C ATOM 1571 CD2 LEU A 100 -10.478 -3.279 0.821 1.00 0.00 C ATOM 0 H LEU A 100 -8.913 -6.990 -1.102 1.00 0.00 H new ATOM 0 HA LEU A 100 -7.398 -5.801 0.995 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -10.274 -6.091 0.286 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -9.835 -5.550 1.894 1.00 0.00 H new ATOM 0 HG LEU A 100 -8.409 -3.759 0.744 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.089 -3.129 -1.533 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -8.325 -4.736 -1.482 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -10.092 -4.596 -1.634 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -10.341 -2.269 0.434 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -11.427 -3.679 0.463 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -10.483 -3.253 1.911 1.00 0.00 H new ATOM 1583 N GLU A 101 -8.638 -8.739 1.533 1.00 0.00 N ATOM 1584 CA GLU A 101 -8.656 -9.854 2.464 1.00 0.00 C ATOM 1585 C GLU A 101 -7.229 -10.236 2.862 1.00 0.00 C ATOM 1586 O GLU A 101 -7.008 -10.792 3.936 1.00 0.00 O ATOM 1587 CB GLU A 101 -9.399 -11.053 1.871 1.00 0.00 C ATOM 1588 CG GLU A 101 -8.646 -11.624 0.668 1.00 0.00 C ATOM 1589 CD GLU A 101 -9.614 -12.249 -0.338 1.00 0.00 C ATOM 1590 OE1 GLU A 101 -10.399 -13.120 0.095 1.00 0.00 O ATOM 1591 OE2 GLU A 101 -9.548 -11.841 -1.518 1.00 0.00 O ATOM 0 H GLU A 101 -8.989 -8.957 0.600 1.00 0.00 H new ATOM 0 HA GLU A 101 -9.192 -9.544 3.361 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -9.516 -11.825 2.631 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -10.401 -10.750 1.567 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -8.073 -10.833 0.184 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -7.931 -12.375 1.005 1.00 0.00 H new ATOM 1598 N PHE A 102 -6.297 -9.921 1.974 1.00 0.00 N ATOM 1599 CA PHE A 102 -4.897 -10.224 2.219 1.00 0.00 C ATOM 1600 C PHE A 102 -4.163 -9.007 2.786 1.00 0.00 C ATOM 1601 O PHE A 102 -2.995 -9.100 3.159 1.00 0.00 O ATOM 1602 CB PHE A 102 -4.277 -10.597 0.871 1.00 0.00 C ATOM 1603 CG PHE A 102 -4.952 -11.785 0.183 1.00 0.00 C ATOM 1604 CD1 PHE A 102 -5.598 -12.723 0.925 1.00 0.00 C ATOM 1605 CD2 PHE A 102 -4.906 -11.903 -1.171 1.00 0.00 C ATOM 1606 CE1 PHE A 102 -6.225 -13.826 0.287 1.00 0.00 C ATOM 1607 CE2 PHE A 102 -5.532 -13.006 -1.810 1.00 0.00 C ATOM 1608 CZ PHE A 102 -6.178 -13.944 -1.067 1.00 0.00 C ATOM 0 H PHE A 102 -6.484 -9.459 1.084 1.00 0.00 H new ATOM 0 HA PHE A 102 -4.813 -11.034 2.943 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -4.324 -9.732 0.209 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -3.222 -10.828 1.019 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -5.634 -12.629 2.000 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -4.393 -11.158 -1.761 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -6.739 -14.571 0.877 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -5.495 -13.100 -2.885 1.00 0.00 H new ATOM 0 HZ PHE A 102 -6.654 -14.783 -1.552 1.00 0.00 H new ATOM 1618 N VAL A 103 -4.879 -7.893 2.832 1.00 0.00 N ATOM 1619 CA VAL A 103 -4.311 -6.659 3.347 1.00 0.00 C ATOM 1620 C VAL A 103 -4.310 -6.702 4.876 1.00 0.00 C ATOM 1621 O VAL A 103 -5.367 -6.661 5.503 1.00 0.00 O ATOM 1622 CB VAL A 103 -5.072 -5.457 2.783 1.00 0.00 C ATOM 1623 CG1 VAL A 103 -4.802 -4.200 3.611 1.00 0.00 C ATOM 1624 CG2 VAL A 103 -4.724 -5.230 1.311 1.00 0.00 C ATOM 0 H VAL A 103 -5.848 -7.819 2.521 1.00 0.00 H new ATOM 0 HA VAL A 103 -3.275 -6.552 3.024 1.00 0.00 H new ATOM 0 HB VAL A 103 -6.138 -5.676 2.845 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.355 -3.361 3.189 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -5.123 -4.366 4.639 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -3.735 -3.976 3.596 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -5.278 -4.370 0.935 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -3.654 -5.043 1.215 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -4.991 -6.115 0.733 1.00 0.00 H new ATOM 1634 N SER A 104 -3.110 -6.783 5.433 1.00 0.00 N ATOM 1635 CA SER A 104 -2.957 -6.832 6.877 1.00 0.00 C ATOM 1636 C SER A 104 -3.652 -5.629 7.518 1.00 0.00 C ATOM 1637 O SER A 104 -4.192 -4.774 6.817 1.00 0.00 O ATOM 1638 CB SER A 104 -1.480 -6.865 7.273 1.00 0.00 C ATOM 1639 OG SER A 104 -1.296 -7.324 8.610 1.00 0.00 O ATOM 0 H SER A 104 -2.235 -6.816 4.910 1.00 0.00 H new ATOM 0 HA SER A 104 -3.423 -7.748 7.240 1.00 0.00 H new ATOM 0 HB2 SER A 104 -0.935 -7.515 6.588 1.00 0.00 H new ATOM 0 HB3 SER A 104 -1.055 -5.867 7.171 1.00 0.00 H new ATOM 0 HG SER A 104 -0.340 -7.332 8.824 1.00 0.00 H new ATOM 1645 N ASN A 105 -3.616 -5.602 8.842 1.00 0.00 N ATOM 1646 CA ASN A 105 -4.236 -4.518 9.585 1.00 0.00 C ATOM 1647 C ASN A 105 -3.482 -4.310 10.900 1.00 0.00 C ATOM 1648 O ASN A 105 -4.095 -4.081 11.942 1.00 0.00 O ATOM 1649 CB ASN A 105 -5.693 -4.843 9.921 1.00 0.00 C ATOM 1650 CG ASN A 105 -5.812 -6.226 10.565 1.00 0.00 C ATOM 1651 OD1 ASN A 105 -5.209 -7.194 10.131 1.00 0.00 O ATOM 1652 ND2 ASN A 105 -6.619 -6.264 11.620 1.00 0.00 N ATOM 0 H ASN A 105 -3.167 -6.313 9.419 1.00 0.00 H new ATOM 0 HA ASN A 105 -4.200 -3.621 8.966 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -6.091 -4.087 10.598 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -6.296 -4.807 9.014 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -6.764 -7.141 12.120 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -7.093 -5.416 11.930 1.00 0.00 H new ATOM 1659 N GLN A 106 -2.163 -4.398 10.809 1.00 0.00 N ATOM 1660 CA GLN A 106 -1.320 -4.222 11.979 1.00 0.00 C ATOM 1661 C GLN A 106 -0.309 -3.099 11.741 1.00 0.00 C ATOM 1662 O GLN A 106 -0.312 -2.470 10.684 1.00 0.00 O ATOM 1663 CB GLN A 106 -0.611 -5.528 12.345 1.00 0.00 C ATOM 1664 CG GLN A 106 -0.792 -5.853 13.829 1.00 0.00 C ATOM 1665 CD GLN A 106 0.552 -6.166 14.489 1.00 0.00 C ATOM 1666 OE1 GLN A 106 1.419 -5.318 14.625 1.00 0.00 O ATOM 1667 NE2 GLN A 106 0.677 -7.428 14.891 1.00 0.00 N ATOM 0 H GLN A 106 -1.658 -4.589 9.944 1.00 0.00 H new ATOM 0 HA GLN A 106 -1.954 -3.942 12.820 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -1.007 -6.343 11.740 1.00 0.00 H new ATOM 0 HB3 GLN A 106 0.451 -5.447 12.114 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -1.262 -5.010 14.335 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -1.463 -6.705 13.939 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -0.088 -8.087 14.747 1.00 0.00 H new ATOM 0 HE22 GLN A 106 1.538 -7.736 15.344 1.00 0.00 H new ATOM 1676 N GLU A 107 0.531 -2.880 12.742 1.00 0.00 N ATOM 1677 CA GLU A 107 1.545 -1.843 12.655 1.00 0.00 C ATOM 1678 C GLU A 107 2.815 -2.395 12.006 1.00 0.00 C ATOM 1679 O GLU A 107 3.217 -3.525 12.282 1.00 0.00 O ATOM 1680 CB GLU A 107 1.846 -1.253 14.034 1.00 0.00 C ATOM 1681 CG GLU A 107 0.558 -1.030 14.828 1.00 0.00 C ATOM 1682 CD GLU A 107 0.382 0.447 15.186 1.00 0.00 C ATOM 1683 OE1 GLU A 107 1.210 0.940 15.983 1.00 0.00 O ATOM 1684 OE2 GLU A 107 -0.575 1.050 14.656 1.00 0.00 O ATOM 0 H GLU A 107 0.530 -3.403 13.618 1.00 0.00 H new ATOM 0 HA GLU A 107 1.160 -1.039 12.028 1.00 0.00 H new ATOM 0 HB2 GLU A 107 2.505 -1.924 14.585 1.00 0.00 H new ATOM 0 HB3 GLU A 107 2.376 -0.307 13.921 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -0.297 -1.370 14.244 1.00 0.00 H new ATOM 0 HG3 GLU A 107 0.580 -1.628 15.739 1.00 0.00 H new ATOM 1691 N PHE A 108 3.412 -1.574 11.154 1.00 0.00 N ATOM 1692 CA PHE A 108 4.629 -1.967 10.464 1.00 0.00 C ATOM 1693 C PHE A 108 5.763 -2.231 11.457 1.00 0.00 C ATOM 1694 O PHE A 108 6.153 -1.340 12.210 1.00 0.00 O ATOM 1695 CB PHE A 108 5.024 -0.801 9.555 1.00 0.00 C ATOM 1696 CG PHE A 108 4.331 -0.812 8.192 1.00 0.00 C ATOM 1697 CD1 PHE A 108 4.200 -1.978 7.505 1.00 0.00 C ATOM 1698 CD2 PHE A 108 3.845 0.345 7.666 1.00 0.00 C ATOM 1699 CE1 PHE A 108 3.556 -1.989 6.239 1.00 0.00 C ATOM 1700 CE2 PHE A 108 3.202 0.335 6.400 1.00 0.00 C ATOM 1701 CZ PHE A 108 3.071 -0.832 5.713 1.00 0.00 C ATOM 0 H PHE A 108 3.075 -0.638 10.926 1.00 0.00 H new ATOM 0 HA PHE A 108 4.457 -2.883 9.899 1.00 0.00 H new ATOM 0 HB2 PHE A 108 4.792 0.136 10.062 1.00 0.00 H new ATOM 0 HB3 PHE A 108 6.103 -0.822 9.403 1.00 0.00 H new ATOM 0 HD1 PHE A 108 4.586 -2.896 7.922 1.00 0.00 H new ATOM 0 HD2 PHE A 108 3.948 1.271 8.212 1.00 0.00 H new ATOM 0 HE1 PHE A 108 3.451 -2.916 5.694 1.00 0.00 H new ATOM 0 HE2 PHE A 108 2.817 1.254 5.983 1.00 0.00 H new ATOM 0 HZ PHE A 108 2.582 -0.840 4.750 1.00 0.00 H new ATOM 1711 N THR A 109 6.259 -3.459 11.427 1.00 0.00 N ATOM 1712 CA THR A 109 7.340 -3.851 12.315 1.00 0.00 C ATOM 1713 C THR A 109 8.688 -3.414 11.739 1.00 0.00 C ATOM 1714 O THR A 109 8.858 -3.356 10.523 1.00 0.00 O ATOM 1715 CB THR A 109 7.238 -5.360 12.546 1.00 0.00 C ATOM 1716 OG1 THR A 109 8.498 -5.711 13.110 1.00 0.00 O ATOM 1717 CG2 THR A 109 7.182 -6.151 11.237 1.00 0.00 C ATOM 0 H THR A 109 5.932 -4.196 10.802 1.00 0.00 H new ATOM 0 HA THR A 109 7.259 -3.353 13.281 1.00 0.00 H new ATOM 0 HB THR A 109 6.349 -5.577 13.139 1.00 0.00 H new ATOM 0 HG1 THR A 109 8.518 -6.674 13.293 1.00 0.00 H new ATOM 0 HG21 THR A 109 7.110 -7.216 11.458 1.00 0.00 H new ATOM 0 HG22 THR A 109 6.310 -5.840 10.661 1.00 0.00 H new ATOM 0 HG23 THR A 109 8.086 -5.961 10.658 1.00 0.00 H new ATOM 1725 N GLU A 110 9.613 -3.119 12.641 1.00 0.00 N ATOM 1726 CA GLU A 110 10.941 -2.689 12.238 1.00 0.00 C ATOM 1727 C GLU A 110 11.439 -3.535 11.065 1.00 0.00 C ATOM 1728 O GLU A 110 11.678 -3.014 9.977 1.00 0.00 O ATOM 1729 CB GLU A 110 11.918 -2.753 13.414 1.00 0.00 C ATOM 1730 CG GLU A 110 13.321 -2.320 12.985 1.00 0.00 C ATOM 1731 CD GLU A 110 14.252 -2.201 14.193 1.00 0.00 C ATOM 1732 OE1 GLU A 110 14.749 -3.260 14.633 1.00 0.00 O ATOM 1733 OE2 GLU A 110 14.445 -1.054 14.650 1.00 0.00 O ATOM 0 H GLU A 110 9.469 -3.169 13.649 1.00 0.00 H new ATOM 0 HA GLU A 110 10.883 -1.650 11.913 1.00 0.00 H new ATOM 0 HB2 GLU A 110 11.565 -2.109 14.220 1.00 0.00 H new ATOM 0 HB3 GLU A 110 11.952 -3.768 13.809 1.00 0.00 H new ATOM 0 HG2 GLU A 110 13.728 -3.043 12.278 1.00 0.00 H new ATOM 0 HG3 GLU A 110 13.267 -1.362 12.467 1.00 0.00 H new ATOM 1740 N SER A 111 11.582 -4.826 11.327 1.00 0.00 N ATOM 1741 CA SER A 111 12.048 -5.750 10.306 1.00 0.00 C ATOM 1742 C SER A 111 11.451 -5.374 8.948 1.00 0.00 C ATOM 1743 O SER A 111 12.170 -4.949 8.046 1.00 0.00 O ATOM 1744 CB SER A 111 11.688 -7.193 10.663 1.00 0.00 C ATOM 1745 OG SER A 111 11.925 -7.478 12.039 1.00 0.00 O ATOM 0 H SER A 111 11.383 -5.254 12.231 1.00 0.00 H new ATOM 0 HA SER A 111 13.134 -5.679 10.250 1.00 0.00 H new ATOM 0 HB2 SER A 111 10.638 -7.373 10.431 1.00 0.00 H new ATOM 0 HB3 SER A 111 12.272 -7.876 10.046 1.00 0.00 H new ATOM 0 HG SER A 111 11.681 -8.408 12.227 1.00 0.00 H new ATOM 1751 N GLU A 112 10.141 -5.543 8.847 1.00 0.00 N ATOM 1752 CA GLU A 112 9.438 -5.227 7.615 1.00 0.00 C ATOM 1753 C GLU A 112 10.039 -3.978 6.967 1.00 0.00 C ATOM 1754 O GLU A 112 10.562 -4.042 5.855 1.00 0.00 O ATOM 1755 CB GLU A 112 7.940 -5.046 7.868 1.00 0.00 C ATOM 1756 CG GLU A 112 7.193 -6.372 7.707 1.00 0.00 C ATOM 1757 CD GLU A 112 6.985 -6.708 6.229 1.00 0.00 C ATOM 1758 OE1 GLU A 112 8.005 -6.749 5.508 1.00 0.00 O ATOM 1759 OE2 GLU A 112 5.811 -6.916 5.854 1.00 0.00 O ATOM 0 H GLU A 112 9.548 -5.895 9.598 1.00 0.00 H new ATOM 0 HA GLU A 112 9.558 -6.064 6.927 1.00 0.00 H new ATOM 0 HB2 GLU A 112 7.782 -4.655 8.873 1.00 0.00 H new ATOM 0 HB3 GLU A 112 7.536 -4.310 7.173 1.00 0.00 H new ATOM 0 HG2 GLU A 112 7.755 -7.171 8.190 1.00 0.00 H new ATOM 0 HG3 GLU A 112 6.228 -6.313 8.210 1.00 0.00 H new ATOM 1766 N PHE A 113 9.944 -2.872 7.689 1.00 0.00 N ATOM 1767 CA PHE A 113 10.472 -1.610 7.199 1.00 0.00 C ATOM 1768 C PHE A 113 11.839 -1.807 6.539 1.00 0.00 C ATOM 1769 O PHE A 113 12.008 -1.517 5.356 1.00 0.00 O ATOM 1770 CB PHE A 113 10.632 -0.690 8.411 1.00 0.00 C ATOM 1771 CG PHE A 113 10.926 0.768 8.052 1.00 0.00 C ATOM 1772 CD1 PHE A 113 10.177 1.399 7.108 1.00 0.00 C ATOM 1773 CD2 PHE A 113 11.935 1.432 8.675 1.00 0.00 C ATOM 1774 CE1 PHE A 113 10.449 2.753 6.775 1.00 0.00 C ATOM 1775 CE2 PHE A 113 12.208 2.785 8.342 1.00 0.00 C ATOM 1776 CZ PHE A 113 11.459 3.417 7.399 1.00 0.00 C ATOM 0 H PHE A 113 9.509 -2.823 8.610 1.00 0.00 H new ATOM 0 HA PHE A 113 9.796 -1.188 6.455 1.00 0.00 H new ATOM 0 HB2 PHE A 113 9.720 -0.730 9.007 1.00 0.00 H new ATOM 0 HB3 PHE A 113 11.439 -1.069 9.038 1.00 0.00 H new ATOM 0 HD1 PHE A 113 9.376 0.871 6.612 1.00 0.00 H new ATOM 0 HD2 PHE A 113 12.530 0.930 9.424 1.00 0.00 H new ATOM 0 HE1 PHE A 113 9.854 3.255 6.027 1.00 0.00 H new ATOM 0 HE2 PHE A 113 13.010 3.312 8.837 1.00 0.00 H new ATOM 0 HZ PHE A 113 11.666 4.446 7.146 1.00 0.00 H new ATOM 1786 N MET A 114 12.778 -2.298 7.333 1.00 0.00 N ATOM 1787 CA MET A 114 14.124 -2.537 6.841 1.00 0.00 C ATOM 1788 C MET A 114 14.115 -3.535 5.681 1.00 0.00 C ATOM 1789 O MET A 114 14.544 -3.211 4.574 1.00 0.00 O ATOM 1790 CB MET A 114 14.994 -3.082 7.975 1.00 0.00 C ATOM 1791 CG MET A 114 15.134 -2.054 9.100 1.00 0.00 C ATOM 1792 SD MET A 114 16.069 -0.646 8.528 1.00 0.00 S ATOM 1793 CE MET A 114 15.388 0.626 9.578 1.00 0.00 C ATOM 0 H MET A 114 12.634 -2.537 8.314 1.00 0.00 H new ATOM 0 HA MET A 114 14.531 -1.592 6.481 1.00 0.00 H new ATOM 0 HB2 MET A 114 14.554 -3.999 8.368 1.00 0.00 H new ATOM 0 HB3 MET A 114 15.980 -3.341 7.590 1.00 0.00 H new ATOM 0 HG2 MET A 114 14.148 -1.734 9.436 1.00 0.00 H new ATOM 0 HG3 MET A 114 15.631 -2.507 9.958 1.00 0.00 H new ATOM 0 HE1 MET A 114 14.824 1.335 8.972 1.00 0.00 H new ATOM 0 HE2 MET A 114 14.726 0.173 10.316 1.00 0.00 H new ATOM 0 HE3 MET A 114 16.197 1.148 10.089 1.00 0.00 H new ATOM 1803 N LYS A 115 13.621 -4.729 5.973 1.00 0.00 N ATOM 1804 CA LYS A 115 13.550 -5.776 4.968 1.00 0.00 C ATOM 1805 C LYS A 115 12.983 -5.195 3.672 1.00 0.00 C ATOM 1806 O LYS A 115 13.514 -5.447 2.591 1.00 0.00 O ATOM 1807 CB LYS A 115 12.764 -6.977 5.500 1.00 0.00 C ATOM 1808 CG LYS A 115 13.667 -7.909 6.309 1.00 0.00 C ATOM 1809 CD LYS A 115 14.193 -7.210 7.565 1.00 0.00 C ATOM 1810 CE LYS A 115 15.140 -8.124 8.345 1.00 0.00 C ATOM 1811 NZ LYS A 115 16.413 -7.427 8.632 1.00 0.00 N ATOM 0 H LYS A 115 13.266 -4.995 6.892 1.00 0.00 H new ATOM 0 HA LYS A 115 14.547 -6.153 4.739 1.00 0.00 H new ATOM 0 HB2 LYS A 115 11.941 -6.630 6.125 1.00 0.00 H new ATOM 0 HB3 LYS A 115 12.323 -7.525 4.667 1.00 0.00 H new ATOM 0 HG2 LYS A 115 13.112 -8.804 6.592 1.00 0.00 H new ATOM 0 HG3 LYS A 115 14.505 -8.235 5.692 1.00 0.00 H new ATOM 0 HD2 LYS A 115 14.714 -6.295 7.285 1.00 0.00 H new ATOM 0 HD3 LYS A 115 13.357 -6.919 8.201 1.00 0.00 H new ATOM 0 HE2 LYS A 115 14.670 -8.434 9.278 1.00 0.00 H new ATOM 0 HE3 LYS A 115 15.336 -9.030 7.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 17.044 -8.061 9.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 16.868 -7.153 7.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 16.223 -6.576 9.198 1.00 0.00 H new ATOM 1825 N TRP A 116 11.912 -4.429 3.822 1.00 0.00 N ATOM 1826 CA TRP A 116 11.268 -3.811 2.676 1.00 0.00 C ATOM 1827 C TRP A 116 12.223 -2.759 2.107 1.00 0.00 C ATOM 1828 O TRP A 116 12.495 -2.747 0.908 1.00 0.00 O ATOM 1829 CB TRP A 116 9.904 -3.234 3.060 1.00 0.00 C ATOM 1830 CG TRP A 116 9.440 -2.083 2.164 1.00 0.00 C ATOM 1831 CD1 TRP A 116 8.970 -2.151 0.912 1.00 0.00 C ATOM 1832 CD2 TRP A 116 9.422 -0.681 2.506 1.00 0.00 C ATOM 1833 NE1 TRP A 116 8.651 -0.900 0.423 1.00 0.00 N ATOM 1834 CE2 TRP A 116 8.935 0.022 1.424 1.00 0.00 C ATOM 1835 CE3 TRP A 116 9.805 -0.029 3.691 1.00 0.00 C ATOM 1836 CZ2 TRP A 116 8.785 1.414 1.418 1.00 0.00 C ATOM 1837 CZ3 TRP A 116 9.649 1.363 3.670 1.00 0.00 C ATOM 1838 CH2 TRP A 116 9.160 2.085 2.588 1.00 0.00 C ATOM 0 H TRP A 116 11.474 -4.223 4.720 1.00 0.00 H new ATOM 0 HA TRP A 116 11.064 -4.551 1.902 1.00 0.00 H new ATOM 0 HB2 TRP A 116 9.161 -4.031 3.024 1.00 0.00 H new ATOM 0 HB3 TRP A 116 9.947 -2.884 4.091 1.00 0.00 H new ATOM 0 HD1 TRP A 116 8.855 -3.069 0.355 1.00 0.00 H new ATOM 0 HE1 TRP A 116 8.276 -0.691 -0.502 1.00 0.00 H new ATOM 0 HE3 TRP A 116 10.189 -0.559 4.550 1.00 0.00 H new ATOM 0 HZ2 TRP A 116 8.401 1.941 0.557 1.00 0.00 H new ATOM 0 HZ3 TRP A 116 9.928 1.913 4.556 1.00 0.00 H new ATOM 0 HH2 TRP A 116 9.070 3.159 2.649 1.00 0.00 H new ATOM 1849 N LYS A 117 12.706 -1.902 2.995 1.00 0.00 N ATOM 1850 CA LYS A 117 13.624 -0.850 2.596 1.00 0.00 C ATOM 1851 C LYS A 117 14.683 -1.432 1.657 1.00 0.00 C ATOM 1852 O LYS A 117 14.998 -0.838 0.627 1.00 0.00 O ATOM 1853 CB LYS A 117 14.209 -0.154 3.827 1.00 0.00 C ATOM 1854 CG LYS A 117 13.575 1.223 4.031 1.00 0.00 C ATOM 1855 CD LYS A 117 13.802 1.725 5.459 1.00 0.00 C ATOM 1856 CE LYS A 117 15.249 2.183 5.656 1.00 0.00 C ATOM 1857 NZ LYS A 117 15.299 3.634 5.942 1.00 0.00 N ATOM 0 H LYS A 117 12.478 -1.915 3.989 1.00 0.00 H new ATOM 0 HA LYS A 117 13.097 -0.075 2.041 1.00 0.00 H new ATOM 0 HB2 LYS A 117 14.042 -0.770 4.711 1.00 0.00 H new ATOM 0 HB3 LYS A 117 15.288 -0.048 3.711 1.00 0.00 H new ATOM 0 HG2 LYS A 117 14.000 1.932 3.321 1.00 0.00 H new ATOM 0 HG3 LYS A 117 12.506 1.169 3.826 1.00 0.00 H new ATOM 0 HD2 LYS A 117 13.123 2.551 5.670 1.00 0.00 H new ATOM 0 HD3 LYS A 117 13.568 0.931 6.169 1.00 0.00 H new ATOM 0 HE2 LYS A 117 15.704 1.629 6.477 1.00 0.00 H new ATOM 0 HE3 LYS A 117 15.831 1.962 4.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 16.288 3.928 6.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 14.884 4.159 5.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 14.760 3.836 6.808 1.00 0.00 H new ATOM 1871 N GLU A 118 15.203 -2.586 2.047 1.00 0.00 N ATOM 1872 CA GLU A 118 16.220 -3.255 1.253 1.00 0.00 C ATOM 1873 C GLU A 118 15.833 -3.241 -0.227 1.00 0.00 C ATOM 1874 O GLU A 118 16.617 -2.814 -1.073 1.00 0.00 O ATOM 1875 CB GLU A 118 16.448 -4.685 1.746 1.00 0.00 C ATOM 1876 CG GLU A 118 17.032 -4.691 3.161 1.00 0.00 C ATOM 1877 CD GLU A 118 17.594 -6.069 3.516 1.00 0.00 C ATOM 1878 OE1 GLU A 118 18.251 -6.659 2.632 1.00 0.00 O ATOM 1879 OE2 GLU A 118 17.353 -6.501 4.664 1.00 0.00 O ATOM 0 H GLU A 118 14.939 -3.075 2.902 1.00 0.00 H new ATOM 0 HA GLU A 118 17.158 -2.712 1.368 1.00 0.00 H new ATOM 0 HB2 GLU A 118 15.505 -5.232 1.736 1.00 0.00 H new ATOM 0 HB3 GLU A 118 17.125 -5.204 1.067 1.00 0.00 H new ATOM 0 HG2 GLU A 118 17.821 -3.942 3.236 1.00 0.00 H new ATOM 0 HG3 GLU A 118 16.260 -4.413 3.878 1.00 0.00 H new ATOM 1886 N ALA A 119 14.623 -3.712 -0.494 1.00 0.00 N ATOM 1887 CA ALA A 119 14.122 -3.758 -1.857 1.00 0.00 C ATOM 1888 C ALA A 119 14.262 -2.375 -2.495 1.00 0.00 C ATOM 1889 O ALA A 119 14.683 -2.257 -3.645 1.00 0.00 O ATOM 1890 CB ALA A 119 12.675 -4.255 -1.852 1.00 0.00 C ATOM 0 H ALA A 119 13.975 -4.065 0.211 1.00 0.00 H new ATOM 0 HA ALA A 119 14.705 -4.457 -2.457 1.00 0.00 H new ATOM 0 HB1 ALA A 119 12.299 -4.290 -2.874 1.00 0.00 H new ATOM 0 HB2 ALA A 119 12.635 -5.253 -1.416 1.00 0.00 H new ATOM 0 HB3 ALA A 119 12.059 -3.576 -1.262 1.00 0.00 H new ATOM 1896 N MET A 120 13.902 -1.362 -1.720 1.00 0.00 N ATOM 1897 CA MET A 120 13.982 0.009 -2.195 1.00 0.00 C ATOM 1898 C MET A 120 15.438 0.442 -2.378 1.00 0.00 C ATOM 1899 O MET A 120 15.772 1.112 -3.353 1.00 0.00 O ATOM 1900 CB MET A 120 13.296 0.938 -1.192 1.00 0.00 C ATOM 1901 CG MET A 120 11.867 0.472 -0.901 1.00 0.00 C ATOM 1902 SD MET A 120 10.743 1.164 -2.103 1.00 0.00 S ATOM 1903 CE MET A 120 11.090 2.901 -1.888 1.00 0.00 C ATOM 0 H MET A 120 13.554 -1.463 -0.766 1.00 0.00 H new ATOM 0 HA MET A 120 13.480 0.068 -3.161 1.00 0.00 H new ATOM 0 HB2 MET A 120 13.869 0.965 -0.265 1.00 0.00 H new ATOM 0 HB3 MET A 120 13.278 1.954 -1.586 1.00 0.00 H new ATOM 0 HG2 MET A 120 11.818 -0.617 -0.929 1.00 0.00 H new ATOM 0 HG3 MET A 120 11.573 0.778 0.103 1.00 0.00 H new ATOM 0 HE1 MET A 120 10.189 3.413 -1.550 1.00 0.00 H new ATOM 0 HE2 MET A 120 11.878 3.025 -1.145 1.00 0.00 H new ATOM 0 HE3 MET A 120 11.415 3.327 -2.837 1.00 0.00 H new ATOM 1913 N PHE A 121 16.266 0.040 -1.424 1.00 0.00 N ATOM 1914 CA PHE A 121 17.678 0.378 -1.468 1.00 0.00 C ATOM 1915 C PHE A 121 18.378 -0.338 -2.626 1.00 0.00 C ATOM 1916 O PHE A 121 19.293 0.210 -3.237 1.00 0.00 O ATOM 1917 CB PHE A 121 18.292 -0.093 -0.148 1.00 0.00 C ATOM 1918 CG PHE A 121 18.146 0.910 0.999 1.00 0.00 C ATOM 1919 CD1 PHE A 121 16.920 1.402 1.320 1.00 0.00 C ATOM 1920 CD2 PHE A 121 19.243 1.309 1.696 1.00 0.00 C ATOM 1921 CE1 PHE A 121 16.784 2.332 2.384 1.00 0.00 C ATOM 1922 CE2 PHE A 121 19.108 2.240 2.760 1.00 0.00 C ATOM 1923 CZ PHE A 121 17.881 2.731 3.082 1.00 0.00 C ATOM 0 H PHE A 121 15.985 -0.516 -0.616 1.00 0.00 H new ATOM 0 HA PHE A 121 17.799 1.451 -1.613 1.00 0.00 H new ATOM 0 HB2 PHE A 121 17.824 -1.033 0.143 1.00 0.00 H new ATOM 0 HB3 PHE A 121 19.351 -0.299 -0.305 1.00 0.00 H new ATOM 0 HD1 PHE A 121 16.049 1.085 0.765 1.00 0.00 H new ATOM 0 HD2 PHE A 121 20.217 0.918 1.441 1.00 0.00 H new ATOM 0 HE1 PHE A 121 15.810 2.722 2.639 1.00 0.00 H new ATOM 0 HE2 PHE A 121 19.979 2.558 3.313 1.00 0.00 H new ATOM 0 HZ PHE A 121 17.778 3.438 3.892 1.00 0.00 H new ATOM 1933 N SER A 122 17.919 -1.552 -2.892 1.00 0.00 N ATOM 1934 CA SER A 122 18.489 -2.349 -3.965 1.00 0.00 C ATOM 1935 C SER A 122 18.010 -1.821 -5.319 1.00 0.00 C ATOM 1936 O SER A 122 18.794 -1.718 -6.261 1.00 0.00 O ATOM 1937 CB SER A 122 18.121 -3.826 -3.811 1.00 0.00 C ATOM 1938 OG SER A 122 19.028 -4.677 -4.504 1.00 0.00 O ATOM 0 H SER A 122 17.159 -2.003 -2.383 1.00 0.00 H new ATOM 0 HA SER A 122 19.575 -2.267 -3.912 1.00 0.00 H new ATOM 0 HB2 SER A 122 18.113 -4.089 -2.753 1.00 0.00 H new ATOM 0 HB3 SER A 122 17.111 -3.989 -4.188 1.00 0.00 H new ATOM 0 HG SER A 122 18.760 -5.611 -4.380 1.00 0.00 H new ATOM 1944 N ALA A 123 16.726 -1.502 -5.373 1.00 0.00 N ATOM 1945 CA ALA A 123 16.133 -0.988 -6.596 1.00 0.00 C ATOM 1946 C ALA A 123 16.554 0.471 -6.788 1.00 0.00 C ATOM 1947 O ALA A 123 16.211 1.092 -7.793 1.00 0.00 O ATOM 1948 CB ALA A 123 14.613 -1.153 -6.536 1.00 0.00 C ATOM 0 H ALA A 123 16.079 -1.589 -4.589 1.00 0.00 H new ATOM 0 HA ALA A 123 16.488 -1.550 -7.460 1.00 0.00 H new ATOM 0 HB1 ALA A 123 14.169 -0.767 -7.454 1.00 0.00 H new ATOM 0 HB2 ALA A 123 14.366 -2.209 -6.429 1.00 0.00 H new ATOM 0 HB3 ALA A 123 14.220 -0.600 -5.683 1.00 0.00 H new ATOM 1954 N GLY A 124 17.291 0.974 -5.809 1.00 0.00 N ATOM 1955 CA GLY A 124 17.762 2.348 -5.857 1.00 0.00 C ATOM 1956 C GLY A 124 16.589 3.328 -5.914 1.00 0.00 C ATOM 1957 O GLY A 124 16.692 4.390 -6.526 1.00 0.00 O ATOM 0 H GLY A 124 17.574 0.455 -4.978 1.00 0.00 H new ATOM 0 HA2 GLY A 124 18.373 2.558 -4.979 1.00 0.00 H new ATOM 0 HA3 GLY A 124 18.400 2.487 -6.730 1.00 0.00 H new ATOM 1961 N MET A 125 15.501 2.937 -5.267 1.00 0.00 N ATOM 1962 CA MET A 125 14.310 3.768 -5.236 1.00 0.00 C ATOM 1963 C MET A 125 14.287 4.647 -3.984 1.00 0.00 C ATOM 1964 O MET A 125 15.244 4.657 -3.211 1.00 0.00 O ATOM 1965 CB MET A 125 13.065 2.878 -5.258 1.00 0.00 C ATOM 1966 CG MET A 125 12.572 2.661 -6.690 1.00 0.00 C ATOM 1967 SD MET A 125 10.854 3.129 -6.821 1.00 0.00 S ATOM 1968 CE MET A 125 10.078 1.561 -6.471 1.00 0.00 C ATOM 0 H MET A 125 15.419 2.056 -4.760 1.00 0.00 H new ATOM 0 HA MET A 125 14.320 4.416 -6.112 1.00 0.00 H new ATOM 0 HB2 MET A 125 13.293 1.916 -4.798 1.00 0.00 H new ATOM 0 HB3 MET A 125 12.275 3.337 -4.663 1.00 0.00 H new ATOM 0 HG2 MET A 125 13.172 3.250 -7.383 1.00 0.00 H new ATOM 0 HG3 MET A 125 12.695 1.615 -6.971 1.00 0.00 H new ATOM 0 HE1 MET A 125 9.400 1.301 -7.284 1.00 0.00 H new ATOM 0 HE2 MET A 125 10.843 0.790 -6.375 1.00 0.00 H new ATOM 0 HE3 MET A 125 9.516 1.633 -5.540 1.00 0.00 H new ATOM 1978 N GLN A 126 13.184 5.363 -3.822 1.00 0.00 N ATOM 1979 CA GLN A 126 13.024 6.243 -2.677 1.00 0.00 C ATOM 1980 C GLN A 126 11.758 5.878 -1.900 1.00 0.00 C ATOM 1981 O GLN A 126 10.779 5.413 -2.483 1.00 0.00 O ATOM 1982 CB GLN A 126 12.996 7.710 -3.112 1.00 0.00 C ATOM 1983 CG GLN A 126 14.316 8.111 -3.773 1.00 0.00 C ATOM 1984 CD GLN A 126 14.184 9.456 -4.490 1.00 0.00 C ATOM 1985 OE1 GLN A 126 13.594 10.400 -3.990 1.00 0.00 O ATOM 1986 NE2 GLN A 126 14.765 9.491 -5.686 1.00 0.00 N ATOM 0 H GLN A 126 12.392 5.352 -4.465 1.00 0.00 H new ATOM 0 HA GLN A 126 13.882 6.110 -2.019 1.00 0.00 H new ATOM 0 HB2 GLN A 126 12.173 7.871 -3.808 1.00 0.00 H new ATOM 0 HB3 GLN A 126 12.810 8.346 -2.247 1.00 0.00 H new ATOM 0 HG2 GLN A 126 15.101 8.172 -3.019 1.00 0.00 H new ATOM 0 HG3 GLN A 126 14.618 7.343 -4.485 1.00 0.00 H new ATOM 0 HE21 GLN A 126 15.243 8.664 -6.045 1.00 0.00 H new ATOM 0 HE22 GLN A 126 14.733 10.344 -6.244 1.00 0.00 H new ATOM 1995 N LEU A 127 11.818 6.101 -0.595 1.00 0.00 N ATOM 1996 CA LEU A 127 10.689 5.801 0.268 1.00 0.00 C ATOM 1997 C LEU A 127 9.797 7.039 0.383 1.00 0.00 C ATOM 1998 O LEU A 127 10.033 8.043 -0.288 1.00 0.00 O ATOM 1999 CB LEU A 127 11.173 5.264 1.617 1.00 0.00 C ATOM 2000 CG LEU A 127 12.509 4.519 1.602 1.00 0.00 C ATOM 2001 CD1 LEU A 127 13.329 4.838 2.853 1.00 0.00 C ATOM 2002 CD2 LEU A 127 12.295 3.014 1.425 1.00 0.00 C ATOM 0 H LEU A 127 12.631 6.486 -0.115 1.00 0.00 H new ATOM 0 HA LEU A 127 10.079 5.008 -0.165 1.00 0.00 H new ATOM 0 HB2 LEU A 127 11.254 6.101 2.311 1.00 0.00 H new ATOM 0 HB3 LEU A 127 10.410 4.594 2.014 1.00 0.00 H new ATOM 0 HG LEU A 127 13.084 4.866 0.744 1.00 0.00 H new ATOM 0 HD11 LEU A 127 14.274 4.295 2.817 1.00 0.00 H new ATOM 0 HD12 LEU A 127 13.527 5.909 2.895 1.00 0.00 H new ATOM 0 HD13 LEU A 127 12.771 4.537 3.740 1.00 0.00 H new ATOM 0 HD21 LEU A 127 13.260 2.508 1.418 1.00 0.00 H new ATOM 0 HD22 LEU A 127 11.692 2.633 2.249 1.00 0.00 H new ATOM 0 HD23 LEU A 127 11.781 2.828 0.482 1.00 0.00 H new ATOM 2014 N PRO A 128 8.765 6.925 1.262 1.00 0.00 N ATOM 2015 CA PRO A 128 7.837 8.023 1.473 1.00 0.00 C ATOM 2016 C PRO A 128 8.478 9.127 2.316 1.00 0.00 C ATOM 2017 O PRO A 128 9.021 8.860 3.387 1.00 0.00 O ATOM 2018 CB PRO A 128 6.627 7.391 2.142 1.00 0.00 C ATOM 2019 CG PRO A 128 7.105 6.061 2.700 1.00 0.00 C ATOM 2020 CD PRO A 128 8.455 5.751 2.074 1.00 0.00 C ATOM 0 HA PRO A 128 7.550 8.517 0.545 1.00 0.00 H new ATOM 0 HB2 PRO A 128 6.241 8.031 2.935 1.00 0.00 H new ATOM 0 HB3 PRO A 128 5.817 7.246 1.427 1.00 0.00 H new ATOM 0 HG2 PRO A 128 7.190 6.111 3.786 1.00 0.00 H new ATOM 0 HG3 PRO A 128 6.388 5.272 2.472 1.00 0.00 H new ATOM 0 HD2 PRO A 128 9.216 5.584 2.836 1.00 0.00 H new ATOM 0 HD3 PRO A 128 8.411 4.848 1.465 1.00 0.00 H new ATOM 2028 N THR A 129 8.392 10.345 1.802 1.00 0.00 N ATOM 2029 CA THR A 129 8.957 11.491 2.494 1.00 0.00 C ATOM 2030 C THR A 129 8.033 11.937 3.629 1.00 0.00 C ATOM 2031 O THR A 129 6.813 11.955 3.471 1.00 0.00 O ATOM 2032 CB THR A 129 9.219 12.587 1.459 1.00 0.00 C ATOM 2033 OG1 THR A 129 8.186 12.407 0.494 1.00 0.00 O ATOM 2034 CG2 THR A 129 10.509 12.351 0.671 1.00 0.00 C ATOM 0 H THR A 129 7.939 10.563 0.914 1.00 0.00 H new ATOM 0 HA THR A 129 9.905 11.238 2.968 1.00 0.00 H new ATOM 0 HB THR A 129 9.270 13.554 1.959 1.00 0.00 H new ATOM 0 HG1 THR A 129 8.279 13.078 -0.214 1.00 0.00 H new ATOM 0 HG21 THR A 129 10.648 13.157 -0.050 1.00 0.00 H new ATOM 0 HG22 THR A 129 11.356 12.328 1.357 1.00 0.00 H new ATOM 0 HG23 THR A 129 10.444 11.400 0.143 1.00 0.00 H new ATOM 2042 N LEU A 130 8.649 12.285 4.749 1.00 0.00 N ATOM 2043 CA LEU A 130 7.898 12.729 5.910 1.00 0.00 C ATOM 2044 C LEU A 130 6.721 13.592 5.451 1.00 0.00 C ATOM 2045 O LEU A 130 5.624 13.496 6.000 1.00 0.00 O ATOM 2046 CB LEU A 130 8.820 13.430 6.910 1.00 0.00 C ATOM 2047 CG LEU A 130 9.782 12.525 7.683 1.00 0.00 C ATOM 2048 CD1 LEU A 130 9.065 11.276 8.199 1.00 0.00 C ATOM 2049 CD2 LEU A 130 11.006 12.173 6.834 1.00 0.00 C ATOM 0 H LEU A 130 9.661 12.268 4.877 1.00 0.00 H new ATOM 0 HA LEU A 130 7.480 11.874 6.442 1.00 0.00 H new ATOM 0 HB2 LEU A 130 9.406 14.175 6.373 1.00 0.00 H new ATOM 0 HB3 LEU A 130 8.202 13.968 7.629 1.00 0.00 H new ATOM 0 HG LEU A 130 10.141 13.074 8.554 1.00 0.00 H new ATOM 0 HD11 LEU A 130 9.771 10.650 8.745 1.00 0.00 H new ATOM 0 HD12 LEU A 130 8.253 11.571 8.864 1.00 0.00 H new ATOM 0 HD13 LEU A 130 8.659 10.716 7.357 1.00 0.00 H new ATOM 0 HD21 LEU A 130 11.673 11.529 7.407 1.00 0.00 H new ATOM 0 HD22 LEU A 130 10.685 11.652 5.932 1.00 0.00 H new ATOM 0 HD23 LEU A 130 11.532 13.087 6.558 1.00 0.00 H new ATOM 2061 N ASP A 131 6.988 14.415 4.448 1.00 0.00 N ATOM 2062 CA ASP A 131 5.964 15.294 3.909 1.00 0.00 C ATOM 2063 C ASP A 131 4.765 14.457 3.457 1.00 0.00 C ATOM 2064 O ASP A 131 3.658 14.630 3.963 1.00 0.00 O ATOM 2065 CB ASP A 131 6.485 16.067 2.695 1.00 0.00 C ATOM 2066 CG ASP A 131 6.031 17.526 2.614 1.00 0.00 C ATOM 2067 OD1 ASP A 131 5.527 18.021 3.644 1.00 0.00 O ATOM 2068 OD2 ASP A 131 6.199 18.112 1.523 1.00 0.00 O ATOM 0 H ASP A 131 7.898 14.492 3.994 1.00 0.00 H new ATOM 0 HA ASP A 131 5.679 15.998 4.691 1.00 0.00 H new ATOM 0 HB2 ASP A 131 7.575 16.041 2.707 1.00 0.00 H new ATOM 0 HB3 ASP A 131 6.164 15.552 1.790 1.00 0.00 H new ATOM 2073 N GLU A 132 5.028 13.569 2.510 1.00 0.00 N ATOM 2074 CA GLU A 132 3.984 12.705 1.985 1.00 0.00 C ATOM 2075 C GLU A 132 3.237 12.019 3.130 1.00 0.00 C ATOM 2076 O GLU A 132 2.008 11.966 3.130 1.00 0.00 O ATOM 2077 CB GLU A 132 4.563 11.675 1.013 1.00 0.00 C ATOM 2078 CG GLU A 132 4.352 12.112 -0.439 1.00 0.00 C ATOM 2079 CD GLU A 132 3.916 10.931 -1.309 1.00 0.00 C ATOM 2080 OE1 GLU A 132 4.801 10.110 -1.636 1.00 0.00 O ATOM 2081 OE2 GLU A 132 2.709 10.875 -1.626 1.00 0.00 O ATOM 0 H GLU A 132 5.948 13.429 2.093 1.00 0.00 H new ATOM 0 HA GLU A 132 3.274 13.320 1.432 1.00 0.00 H new ATOM 0 HB2 GLU A 132 5.628 11.545 1.206 1.00 0.00 H new ATOM 0 HB3 GLU A 132 4.089 10.707 1.178 1.00 0.00 H new ATOM 0 HG2 GLU A 132 3.597 12.897 -0.480 1.00 0.00 H new ATOM 0 HG3 GLU A 132 5.275 12.537 -0.833 1.00 0.00 H new ATOM 2088 N ILE A 133 4.010 11.511 4.078 1.00 0.00 N ATOM 2089 CA ILE A 133 3.437 10.830 5.226 1.00 0.00 C ATOM 2090 C ILE A 133 2.479 11.779 5.950 1.00 0.00 C ATOM 2091 O ILE A 133 1.309 11.454 6.149 1.00 0.00 O ATOM 2092 CB ILE A 133 4.542 10.269 6.124 1.00 0.00 C ATOM 2093 CG1 ILE A 133 5.447 9.312 5.345 1.00 0.00 C ATOM 2094 CG2 ILE A 133 3.952 9.611 7.373 1.00 0.00 C ATOM 2095 CD1 ILE A 133 5.209 7.862 5.773 1.00 0.00 C ATOM 0 H ILE A 133 5.029 11.557 4.075 1.00 0.00 H new ATOM 0 HA ILE A 133 2.852 9.968 4.905 1.00 0.00 H new ATOM 0 HB ILE A 133 5.164 11.099 6.461 1.00 0.00 H new ATOM 0 HG12 ILE A 133 5.258 9.415 4.277 1.00 0.00 H new ATOM 0 HG13 ILE A 133 6.491 9.577 5.511 1.00 0.00 H new ATOM 0 HG21 ILE A 133 4.758 9.221 7.994 1.00 0.00 H new ATOM 0 HG22 ILE A 133 3.383 10.349 7.939 1.00 0.00 H new ATOM 0 HG23 ILE A 133 3.294 8.794 7.077 1.00 0.00 H new ATOM 0 HD11 ILE A 133 5.865 7.202 5.204 1.00 0.00 H new ATOM 0 HD12 ILE A 133 5.423 7.757 6.837 1.00 0.00 H new ATOM 0 HD13 ILE A 133 4.170 7.592 5.583 1.00 0.00 H new ATOM 2107 N ASN A 134 3.011 12.933 6.325 1.00 0.00 N ATOM 2108 CA ASN A 134 2.219 13.931 7.023 1.00 0.00 C ATOM 2109 C ASN A 134 0.985 14.273 6.185 1.00 0.00 C ATOM 2110 O ASN A 134 -0.145 14.074 6.628 1.00 0.00 O ATOM 2111 CB ASN A 134 3.018 15.218 7.236 1.00 0.00 C ATOM 2112 CG ASN A 134 2.428 16.046 8.379 1.00 0.00 C ATOM 2113 OD1 ASN A 134 1.876 17.117 8.184 1.00 0.00 O ATOM 2114 ND2 ASN A 134 2.575 15.493 9.580 1.00 0.00 N ATOM 0 H ASN A 134 3.981 13.199 6.158 1.00 0.00 H new ATOM 0 HA ASN A 134 1.935 13.519 7.991 1.00 0.00 H new ATOM 0 HB2 ASN A 134 4.057 14.973 7.458 1.00 0.00 H new ATOM 0 HB3 ASN A 134 3.018 15.806 6.318 1.00 0.00 H new ATOM 0 HD21 ASN A 134 2.215 15.968 10.408 1.00 0.00 H new ATOM 0 HD22 ASN A 134 3.047 14.594 9.673 1.00 0.00 H new ATOM 2121 N LYS A 135 1.244 14.782 4.989 1.00 0.00 N ATOM 2122 CA LYS A 135 0.169 15.154 4.086 1.00 0.00 C ATOM 2123 C LYS A 135 -0.809 13.985 3.955 1.00 0.00 C ATOM 2124 O LYS A 135 -2.008 14.145 4.179 1.00 0.00 O ATOM 2125 CB LYS A 135 0.735 15.634 2.748 1.00 0.00 C ATOM 2126 CG LYS A 135 1.446 16.980 2.905 1.00 0.00 C ATOM 2127 CD LYS A 135 2.428 17.219 1.757 1.00 0.00 C ATOM 2128 CE LYS A 135 1.692 17.651 0.487 1.00 0.00 C ATOM 2129 NZ LYS A 135 2.191 16.894 -0.684 1.00 0.00 N ATOM 0 H LYS A 135 2.183 14.945 4.625 1.00 0.00 H new ATOM 0 HA LYS A 135 -0.392 15.997 4.490 1.00 0.00 H new ATOM 0 HB2 LYS A 135 1.433 14.893 2.358 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -0.071 15.727 2.020 1.00 0.00 H new ATOM 0 HG2 LYS A 135 0.710 17.783 2.931 1.00 0.00 H new ATOM 0 HG3 LYS A 135 1.979 17.005 3.855 1.00 0.00 H new ATOM 0 HD2 LYS A 135 3.148 17.986 2.043 1.00 0.00 H new ATOM 0 HD3 LYS A 135 2.994 16.308 1.562 1.00 0.00 H new ATOM 0 HE2 LYS A 135 0.621 17.485 0.606 1.00 0.00 H new ATOM 0 HE3 LYS A 135 1.833 18.719 0.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 1.681 17.199 -1.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 3.208 17.073 -0.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 2.034 15.877 -0.532 1.00 0.00 H new ATOM 2143 N LYS A 136 -0.261 12.834 3.592 1.00 0.00 N ATOM 2144 CA LYS A 136 -1.070 11.638 3.429 1.00 0.00 C ATOM 2145 C LYS A 136 -1.879 11.397 4.705 1.00 0.00 C ATOM 2146 O LYS A 136 -3.105 11.304 4.658 1.00 0.00 O ATOM 2147 CB LYS A 136 -0.194 10.451 3.023 1.00 0.00 C ATOM 2148 CG LYS A 136 -1.001 9.151 3.018 1.00 0.00 C ATOM 2149 CD LYS A 136 -2.253 9.285 2.149 1.00 0.00 C ATOM 2150 CE LYS A 136 -1.891 9.285 0.663 1.00 0.00 C ATOM 2151 NZ LYS A 136 -2.751 8.336 -0.080 1.00 0.00 N ATOM 0 H LYS A 136 0.734 12.705 3.406 1.00 0.00 H new ATOM 0 HA LYS A 136 -1.786 11.769 2.617 1.00 0.00 H new ATOM 0 HB2 LYS A 136 0.226 10.626 2.033 1.00 0.00 H new ATOM 0 HB3 LYS A 136 0.645 10.360 3.713 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -0.381 8.336 2.645 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -1.288 8.893 4.037 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -2.937 8.463 2.360 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -2.777 10.207 2.399 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -2.009 10.288 0.254 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -0.844 9.011 0.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -2.587 8.446 -1.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -2.521 7.363 0.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -3.750 8.532 0.133 1.00 0.00 H new ATOM 2165 N GLU A 137 -1.161 11.303 5.814 1.00 0.00 N ATOM 2166 CA GLU A 137 -1.798 11.075 7.100 1.00 0.00 C ATOM 2167 C GLU A 137 -3.089 11.890 7.206 1.00 0.00 C ATOM 2168 O GLU A 137 -4.175 11.325 7.329 1.00 0.00 O ATOM 2169 CB GLU A 137 -0.845 11.406 8.250 1.00 0.00 C ATOM 2170 CG GLU A 137 -1.342 10.803 9.566 1.00 0.00 C ATOM 2171 CD GLU A 137 -0.719 11.518 10.767 1.00 0.00 C ATOM 2172 OE1 GLU A 137 -0.439 12.728 10.624 1.00 0.00 O ATOM 2173 OE2 GLU A 137 -0.538 10.839 11.800 1.00 0.00 O ATOM 0 H GLU A 137 -0.145 11.381 5.849 1.00 0.00 H new ATOM 0 HA GLU A 137 -2.052 10.018 7.175 1.00 0.00 H new ATOM 0 HB2 GLU A 137 0.150 11.023 8.024 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -0.755 12.487 8.353 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -2.428 10.878 9.617 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -1.094 9.742 9.601 1.00 0.00 H new ATOM 2180 N LEU A 138 -2.927 13.204 7.153 1.00 0.00 N ATOM 2181 CA LEU A 138 -4.066 14.101 7.241 1.00 0.00 C ATOM 2182 C LEU A 138 -5.197 13.573 6.356 1.00 0.00 C ATOM 2183 O LEU A 138 -6.324 13.404 6.817 1.00 0.00 O ATOM 2184 CB LEU A 138 -3.646 15.535 6.911 1.00 0.00 C ATOM 2185 CG LEU A 138 -3.184 16.388 8.094 1.00 0.00 C ATOM 2186 CD1 LEU A 138 -4.232 16.391 9.209 1.00 0.00 C ATOM 2187 CD2 LEU A 138 -1.813 15.933 8.597 1.00 0.00 C ATOM 0 H LEU A 138 -2.025 13.668 7.050 1.00 0.00 H new ATOM 0 HA LEU A 138 -4.448 14.132 8.262 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -2.839 15.497 6.179 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -4.487 16.038 6.433 1.00 0.00 H new ATOM 0 HG LEU A 138 -3.075 17.417 7.751 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -3.879 17.004 10.038 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -5.168 16.800 8.828 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -4.396 15.371 9.557 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -1.509 16.556 9.438 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -1.870 14.893 8.918 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -1.082 16.025 7.794 1.00 0.00 H new ATOM 2199 N SER A 139 -4.855 13.325 5.100 1.00 0.00 N ATOM 2200 CA SER A 139 -5.827 12.819 4.146 1.00 0.00 C ATOM 2201 C SER A 139 -6.637 11.684 4.776 1.00 0.00 C ATOM 2202 O SER A 139 -7.861 11.649 4.656 1.00 0.00 O ATOM 2203 CB SER A 139 -5.142 12.336 2.866 1.00 0.00 C ATOM 2204 OG SER A 139 -5.665 12.977 1.706 1.00 0.00 O ATOM 0 H SER A 139 -3.918 13.465 4.721 1.00 0.00 H new ATOM 0 HA SER A 139 -6.501 13.633 3.880 1.00 0.00 H new ATOM 0 HB2 SER A 139 -4.071 12.527 2.934 1.00 0.00 H new ATOM 0 HB3 SER A 139 -5.268 11.257 2.772 1.00 0.00 H new ATOM 0 HG SER A 139 -5.201 12.643 0.910 1.00 0.00 H new ATOM 2210 N ILE A 140 -5.921 10.784 5.434 1.00 0.00 N ATOM 2211 CA ILE A 140 -6.558 9.651 6.083 1.00 0.00 C ATOM 2212 C ILE A 140 -7.496 10.158 7.181 1.00 0.00 C ATOM 2213 O ILE A 140 -8.684 9.839 7.183 1.00 0.00 O ATOM 2214 CB ILE A 140 -5.506 8.659 6.583 1.00 0.00 C ATOM 2215 CG1 ILE A 140 -4.877 7.893 5.418 1.00 0.00 C ATOM 2216 CG2 ILE A 140 -6.095 7.719 7.636 1.00 0.00 C ATOM 2217 CD1 ILE A 140 -3.610 8.592 4.921 1.00 0.00 C ATOM 0 H ILE A 140 -4.906 10.817 5.532 1.00 0.00 H new ATOM 0 HA ILE A 140 -7.170 9.099 5.370 1.00 0.00 H new ATOM 0 HB ILE A 140 -4.708 9.223 7.066 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -4.636 6.878 5.734 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -5.595 7.811 4.602 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -5.326 7.024 7.974 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -6.456 8.302 8.483 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -6.924 7.160 7.202 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -3.183 8.026 4.093 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -3.858 9.598 4.583 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -2.884 8.650 5.732 1.00 0.00 H new ATOM 2229 N LYS A 141 -6.927 10.940 8.086 1.00 0.00 N ATOM 2230 CA LYS A 141 -7.697 11.494 9.186 1.00 0.00 C ATOM 2231 C LYS A 141 -9.025 12.035 8.652 1.00 0.00 C ATOM 2232 O LYS A 141 -10.093 11.624 9.105 1.00 0.00 O ATOM 2233 CB LYS A 141 -6.872 12.534 9.948 1.00 0.00 C ATOM 2234 CG LYS A 141 -5.966 11.864 10.983 1.00 0.00 C ATOM 2235 CD LYS A 141 -4.530 11.755 10.467 1.00 0.00 C ATOM 2236 CE LYS A 141 -3.573 12.577 11.331 1.00 0.00 C ATOM 2237 NZ LYS A 141 -3.151 11.802 12.519 1.00 0.00 N ATOM 0 H LYS A 141 -5.942 11.203 8.080 1.00 0.00 H new ATOM 0 HA LYS A 141 -7.937 10.717 9.912 1.00 0.00 H new ATOM 0 HB2 LYS A 141 -6.266 13.108 9.247 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -7.538 13.239 10.445 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -5.980 12.438 11.910 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -6.348 10.870 11.217 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -4.219 10.710 10.466 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -4.483 12.102 9.435 1.00 0.00 H new ATOM 0 HE2 LYS A 141 -2.699 12.861 10.746 1.00 0.00 H new ATOM 0 HE3 LYS A 141 -4.060 13.500 11.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 -2.556 12.398 13.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 -3.991 11.494 13.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 -2.609 10.968 12.215 1.00 0.00 H new ATOM 2251 N GLU A 142 -8.915 12.946 7.697 1.00 0.00 N ATOM 2252 CA GLU A 142 -10.095 13.546 7.097 1.00 0.00 C ATOM 2253 C GLU A 142 -11.112 12.465 6.729 1.00 0.00 C ATOM 2254 O GLU A 142 -12.240 12.476 7.219 1.00 0.00 O ATOM 2255 CB GLU A 142 -9.720 14.386 5.874 1.00 0.00 C ATOM 2256 CG GLU A 142 -9.135 15.736 6.294 1.00 0.00 C ATOM 2257 CD GLU A 142 -9.319 16.780 5.190 1.00 0.00 C ATOM 2258 OE1 GLU A 142 -10.422 16.798 4.604 1.00 0.00 O ATOM 2259 OE2 GLU A 142 -8.351 17.536 4.958 1.00 0.00 O ATOM 0 H GLU A 142 -8.028 13.283 7.324 1.00 0.00 H new ATOM 0 HA GLU A 142 -10.552 14.212 7.829 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -8.995 13.845 5.265 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -10.602 14.545 5.253 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -9.620 16.078 7.208 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -8.075 15.623 6.519 1.00 0.00 H new