USER MOD reduce.3.24.130724 H: found=0, std=0, add=1027, rem=0, adj=25 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 61 TYR OH : rot -46:sc= 0.15 USER MOD Set 1.2: A 104 SER OG : rot 168:sc= 1.21 USER MOD Set 2.1: A 12 GLN : amide:sc= 0.138 X(o=0.37,f=0.099) USER MOD Set 2.2: A 15 SER OG : rot -28:sc= 0.236 USER MOD Single : A 21 ASN : amide:sc= -3.65! C(o=-3.7!,f=-17!) USER MOD Single : A 26 SER OG : rot -74:sc= -1.36 USER MOD Single : A 28 HIS : no HD1:sc= -0.0319 X(o=-0.032,f=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 CYS SG : rot -110:sc= 1.17 USER MOD Single : A 35 HIS : no HD1:sc= -0.377 X(o=-0.38,f=-0.24) USER MOD Single : A 36 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 161:sc= 1.43 USER MOD Single : A 44 THR OG1 : rot 97:sc= -0.252 USER MOD Single : A 46 CYS SG : rot 82:sc= -2.21 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot -83:sc= 0.946 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 TYR OH : rot -141:sc= 0.00518 USER MOD Single : A 77 GLN : amide:sc= -1.19 X(o=-1.2,f=-0.85) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.0787 USER MOD Single : A 84 ASN : amide:sc= 1.63 K(o=1.6,f=-0.12) USER MOD Single : A 85 LYS NZ :NH3+ -159:sc= 1.1 (180deg=0.754) USER MOD Single : A 88 GLN : amide:sc= -1.42 K(o=-1.4,f=-3.4!) USER MOD Single : A 91 HIS : no HE2:sc= -0.174 K(o=-0.17,f=-1.1) USER MOD Single : A 93 ASN :FLIP amide:sc= -0.045 F(o=-2.6!,f=-0.045) USER MOD Single : A 95 GLN : amide:sc= -0.0171 X(o=-0.017,f=-0.12) USER MOD Single : A 105 ASN : amide:sc=-0.00234 X(o=-0.0023,f=-0.28) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=-0.095) USER MOD Single : A 109 THR OG1 : rot 180:sc= -0.017 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) 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 -108:sc= -10.4! (180deg=-11.7!) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 125 MET CE :methyl 152:sc= -3.05! (180deg=-3.09!) USER MOD Single : A 126 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 129 THR OG1 : rot -105:sc= -0.112 USER MOD Single : A 134 ASN : amide:sc= -0.0731 X(o=-0.073,f=-0.55) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 144:sc= 1.28 (180deg=0.804) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ -140:sc= -0.206 (180deg=-1.59) USER MOD ----------------------------------------------------------------- ATOM 127 N GLN A 12 12.854 13.694 3.871 1.00 0.00 N ATOM 128 CA GLN A 12 13.443 12.461 4.366 1.00 0.00 C ATOM 129 C GLN A 12 12.453 11.304 4.220 1.00 0.00 C ATOM 130 O GLN A 12 11.290 11.426 4.599 1.00 0.00 O ATOM 131 CB GLN A 12 13.897 12.614 5.819 1.00 0.00 C ATOM 132 CG GLN A 12 14.210 11.253 6.442 1.00 0.00 C ATOM 133 CD GLN A 12 15.669 11.182 6.900 1.00 0.00 C ATOM 134 OE1 GLN A 12 15.977 10.809 8.020 1.00 0.00 O ATOM 135 NE2 GLN A 12 16.545 11.559 5.974 1.00 0.00 N ATOM 0 HA GLN A 12 14.325 12.237 3.766 1.00 0.00 H new ATOM 0 HB2 GLN A 12 14.781 13.250 5.862 1.00 0.00 H new ATOM 0 HB3 GLN A 12 13.118 13.112 6.397 1.00 0.00 H new ATOM 0 HG2 GLN A 12 13.550 11.077 7.291 1.00 0.00 H new ATOM 0 HG3 GLN A 12 14.014 10.463 5.717 1.00 0.00 H new ATOM 0 HE21 GLN A 12 16.219 11.860 5.056 1.00 0.00 H new ATOM 0 HE22 GLN A 12 17.544 11.547 6.182 1.00 0.00 H new ATOM 144 N PRO A 13 12.965 10.177 3.654 1.00 0.00 N ATOM 145 CA PRO A 13 12.139 8.999 3.453 1.00 0.00 C ATOM 146 C PRO A 13 11.897 8.267 4.775 1.00 0.00 C ATOM 147 O PRO A 13 12.795 7.609 5.297 1.00 0.00 O ATOM 148 CB PRO A 13 12.895 8.158 2.438 1.00 0.00 C ATOM 149 CG PRO A 13 14.327 8.667 2.458 1.00 0.00 C ATOM 150 CD PRO A 13 14.339 9.997 3.193 1.00 0.00 C ATOM 0 HA PRO A 13 11.142 9.242 3.086 1.00 0.00 H new ATOM 0 HB2 PRO A 13 12.853 7.100 2.698 1.00 0.00 H new ATOM 0 HB3 PRO A 13 12.458 8.259 1.444 1.00 0.00 H new ATOM 0 HG2 PRO A 13 14.980 7.950 2.956 1.00 0.00 H new ATOM 0 HG3 PRO A 13 14.703 8.789 1.442 1.00 0.00 H new ATOM 0 HD2 PRO A 13 15.038 9.981 4.029 1.00 0.00 H new ATOM 0 HD3 PRO A 13 14.646 10.810 2.535 1.00 0.00 H new ATOM 158 N VAL A 14 10.679 8.407 5.277 1.00 0.00 N ATOM 159 CA VAL A 14 10.307 7.768 6.528 1.00 0.00 C ATOM 160 C VAL A 14 11.564 7.531 7.368 1.00 0.00 C ATOM 161 O VAL A 14 12.196 6.481 7.264 1.00 0.00 O ATOM 162 CB VAL A 14 9.526 6.483 6.246 1.00 0.00 C ATOM 163 CG1 VAL A 14 8.071 6.793 5.888 1.00 0.00 C ATOM 164 CG2 VAL A 14 10.199 5.662 5.145 1.00 0.00 C ATOM 0 H VAL A 14 9.937 8.954 4.840 1.00 0.00 H new ATOM 0 HA VAL A 14 9.647 8.414 7.106 1.00 0.00 H new ATOM 0 HB VAL A 14 9.526 5.884 7.157 1.00 0.00 H new ATOM 0 HG11 VAL A 14 7.538 5.862 5.692 1.00 0.00 H new ATOM 0 HG12 VAL A 14 7.596 7.316 6.718 1.00 0.00 H new ATOM 0 HG13 VAL A 14 8.041 7.422 4.998 1.00 0.00 H new ATOM 0 HG21 VAL A 14 9.623 4.754 4.965 1.00 0.00 H new ATOM 0 HG22 VAL A 14 10.245 6.251 4.229 1.00 0.00 H new ATOM 0 HG23 VAL A 14 11.209 5.395 5.456 1.00 0.00 H new ATOM 174 N SER A 15 11.889 8.525 8.182 1.00 0.00 N ATOM 175 CA SER A 15 13.059 8.439 9.039 1.00 0.00 C ATOM 176 C SER A 15 13.013 7.147 9.858 1.00 0.00 C ATOM 177 O SER A 15 14.050 6.546 10.134 1.00 0.00 O ATOM 178 CB SER A 15 13.153 9.652 9.967 1.00 0.00 C ATOM 179 OG SER A 15 14.094 10.613 9.495 1.00 0.00 O ATOM 0 H SER A 15 11.362 9.394 8.266 1.00 0.00 H new ATOM 0 HA SER A 15 13.947 8.430 8.406 1.00 0.00 H new ATOM 0 HB2 SER A 15 12.172 10.118 10.055 1.00 0.00 H new ATOM 0 HB3 SER A 15 13.440 9.323 10.966 1.00 0.00 H new ATOM 0 HG SER A 15 14.784 10.162 8.966 1.00 0.00 H new ATOM 185 N LEU A 16 11.800 6.759 10.223 1.00 0.00 N ATOM 186 CA LEU A 16 11.606 5.549 11.005 1.00 0.00 C ATOM 187 C LEU A 16 10.445 4.746 10.414 1.00 0.00 C ATOM 188 O LEU A 16 9.774 5.206 9.491 1.00 0.00 O ATOM 189 CB LEU A 16 11.426 5.891 12.486 1.00 0.00 C ATOM 190 CG LEU A 16 11.381 7.382 12.829 1.00 0.00 C ATOM 191 CD1 LEU A 16 10.086 8.022 12.324 1.00 0.00 C ATOM 192 CD2 LEU A 16 11.584 7.605 14.329 1.00 0.00 C ATOM 0 H LEU A 16 10.942 7.260 9.992 1.00 0.00 H new ATOM 0 HA LEU A 16 12.492 4.916 10.953 1.00 0.00 H new ATOM 0 HB2 LEU A 16 10.502 5.430 12.835 1.00 0.00 H new ATOM 0 HB3 LEU A 16 12.242 5.434 13.046 1.00 0.00 H new ATOM 0 HG LEU A 16 12.206 7.876 12.315 1.00 0.00 H new ATOM 0 HD11 LEU A 16 10.079 9.081 12.581 1.00 0.00 H new ATOM 0 HD12 LEU A 16 10.023 7.911 11.242 1.00 0.00 H new ATOM 0 HD13 LEU A 16 9.232 7.531 12.790 1.00 0.00 H new ATOM 0 HD21 LEU A 16 11.548 8.672 14.546 1.00 0.00 H new ATOM 0 HD22 LEU A 16 10.796 7.095 14.883 1.00 0.00 H new ATOM 0 HD23 LEU A 16 12.553 7.207 14.628 1.00 0.00 H new ATOM 204 N PRO A 17 10.239 3.529 10.985 1.00 0.00 N ATOM 205 CA PRO A 17 9.171 2.658 10.525 1.00 0.00 C ATOM 206 C PRO A 17 7.809 3.156 11.012 1.00 0.00 C ATOM 207 O PRO A 17 6.774 2.788 10.456 1.00 0.00 O ATOM 208 CB PRO A 17 9.527 1.281 11.062 1.00 0.00 C ATOM 209 CG PRO A 17 10.524 1.518 12.185 1.00 0.00 C ATOM 210 CD PRO A 17 11.014 2.952 12.080 1.00 0.00 C ATOM 0 HA PRO A 17 9.084 2.637 9.439 1.00 0.00 H new ATOM 0 HB2 PRO A 17 8.641 0.764 11.429 1.00 0.00 H new ATOM 0 HB3 PRO A 17 9.960 0.657 10.280 1.00 0.00 H new ATOM 0 HG2 PRO A 17 10.055 1.345 13.154 1.00 0.00 H new ATOM 0 HG3 PRO A 17 11.360 0.823 12.106 1.00 0.00 H new ATOM 0 HD2 PRO A 17 10.850 3.496 13.010 1.00 0.00 H new ATOM 0 HD3 PRO A 17 12.083 2.991 11.872 1.00 0.00 H new ATOM 218 N GLU A 18 7.852 3.985 12.044 1.00 0.00 N ATOM 219 CA GLU A 18 6.634 4.537 12.612 1.00 0.00 C ATOM 220 C GLU A 18 5.892 5.372 11.567 1.00 0.00 C ATOM 221 O GLU A 18 4.690 5.201 11.370 1.00 0.00 O ATOM 222 CB GLU A 18 6.938 5.366 13.861 1.00 0.00 C ATOM 223 CG GLU A 18 7.784 4.569 14.856 1.00 0.00 C ATOM 224 CD GLU A 18 7.428 4.937 16.298 1.00 0.00 C ATOM 225 OE1 GLU A 18 7.316 6.154 16.562 1.00 0.00 O ATOM 226 OE2 GLU A 18 7.275 3.994 17.103 1.00 0.00 O ATOM 0 H GLU A 18 8.712 4.288 12.502 1.00 0.00 H new ATOM 0 HA GLU A 18 5.990 3.711 12.913 1.00 0.00 H new ATOM 0 HB2 GLU A 18 7.465 6.277 13.578 1.00 0.00 H new ATOM 0 HB3 GLU A 18 6.005 5.672 14.335 1.00 0.00 H new ATOM 0 HG2 GLU A 18 7.626 3.502 14.700 1.00 0.00 H new ATOM 0 HG3 GLU A 18 8.841 4.764 14.678 1.00 0.00 H new ATOM 233 N GLU A 19 6.639 6.258 10.924 1.00 0.00 N ATOM 234 CA GLU A 19 6.067 7.120 9.904 1.00 0.00 C ATOM 235 C GLU A 19 5.269 6.291 8.896 1.00 0.00 C ATOM 236 O GLU A 19 4.181 6.690 8.483 1.00 0.00 O ATOM 237 CB GLU A 19 7.154 7.937 9.204 1.00 0.00 C ATOM 238 CG GLU A 19 7.934 8.787 10.209 1.00 0.00 C ATOM 239 CD GLU A 19 7.258 10.143 10.422 1.00 0.00 C ATOM 240 OE1 GLU A 19 6.277 10.408 9.695 1.00 0.00 O ATOM 241 OE2 GLU A 19 7.738 10.884 11.307 1.00 0.00 O ATOM 0 H GLU A 19 7.636 6.397 11.090 1.00 0.00 H new ATOM 0 HA GLU A 19 5.387 7.821 10.388 1.00 0.00 H new ATOM 0 HB2 GLU A 19 7.837 7.268 8.681 1.00 0.00 H new ATOM 0 HB3 GLU A 19 6.701 8.582 8.451 1.00 0.00 H new ATOM 0 HG2 GLU A 19 8.005 8.259 11.160 1.00 0.00 H new ATOM 0 HG3 GLU A 19 8.953 8.937 9.851 1.00 0.00 H new ATOM 248 N LEU A 20 5.840 5.154 8.528 1.00 0.00 N ATOM 249 CA LEU A 20 5.196 4.266 7.576 1.00 0.00 C ATOM 250 C LEU A 20 3.930 3.681 8.206 1.00 0.00 C ATOM 251 O LEU A 20 2.994 3.312 7.499 1.00 0.00 O ATOM 252 CB LEU A 20 6.182 3.207 7.079 1.00 0.00 C ATOM 253 CG LEU A 20 5.924 2.658 5.674 1.00 0.00 C ATOM 254 CD1 LEU A 20 5.570 3.784 4.701 1.00 0.00 C ATOM 255 CD2 LEU A 20 7.113 1.829 5.183 1.00 0.00 C ATOM 0 H LEU A 20 6.743 4.827 8.872 1.00 0.00 H new ATOM 0 HA LEU A 20 4.885 4.819 6.690 1.00 0.00 H new ATOM 0 HB2 LEU A 20 7.185 3.633 7.103 1.00 0.00 H new ATOM 0 HB3 LEU A 20 6.173 2.373 7.781 1.00 0.00 H new ATOM 0 HG LEU A 20 5.063 1.991 5.721 1.00 0.00 H new ATOM 0 HD11 LEU A 20 5.392 3.366 3.710 1.00 0.00 H new ATOM 0 HD12 LEU A 20 4.671 4.294 5.047 1.00 0.00 H new ATOM 0 HD13 LEU A 20 6.395 4.495 4.652 1.00 0.00 H new ATOM 0 HD21 LEU A 20 6.904 1.450 4.182 1.00 0.00 H new ATOM 0 HD22 LEU A 20 8.006 2.454 5.156 1.00 0.00 H new ATOM 0 HD23 LEU A 20 7.277 0.991 5.861 1.00 0.00 H new ATOM 267 N ASN A 21 3.944 3.613 9.529 1.00 0.00 N ATOM 268 CA ASN A 21 2.809 3.079 10.263 1.00 0.00 C ATOM 269 C ASN A 21 1.708 4.139 10.333 1.00 0.00 C ATOM 270 O ASN A 21 0.526 3.807 10.412 1.00 0.00 O ATOM 271 CB ASN A 21 3.203 2.711 11.695 1.00 0.00 C ATOM 272 CG ASN A 21 3.298 1.194 11.865 1.00 0.00 C ATOM 273 OD1 ASN A 21 2.746 0.421 11.098 1.00 0.00 O ATOM 274 ND2 ASN A 21 4.027 0.811 12.910 1.00 0.00 N ATOM 0 H ASN A 21 4.723 3.919 10.112 1.00 0.00 H new ATOM 0 HA ASN A 21 2.462 2.186 9.744 1.00 0.00 H new ATOM 0 HB2 ASN A 21 4.161 3.169 11.941 1.00 0.00 H new ATOM 0 HB3 ASN A 21 2.469 3.113 12.393 1.00 0.00 H new ATOM 0 HD21 ASN A 21 4.151 -0.182 13.109 1.00 0.00 H new ATOM 0 HD22 ASN A 21 4.462 1.510 13.512 1.00 0.00 H new ATOM 281 N ARG A 22 2.135 5.393 10.301 1.00 0.00 N ATOM 282 CA ARG A 22 1.199 6.503 10.360 1.00 0.00 C ATOM 283 C ARG A 22 0.257 6.467 9.155 1.00 0.00 C ATOM 284 O ARG A 22 -0.950 6.659 9.301 1.00 0.00 O ATOM 285 CB ARG A 22 1.937 7.844 10.382 1.00 0.00 C ATOM 286 CG ARG A 22 2.969 7.883 11.510 1.00 0.00 C ATOM 287 CD ARG A 22 3.606 9.270 11.623 1.00 0.00 C ATOM 288 NE ARG A 22 2.912 10.062 12.663 1.00 0.00 N ATOM 289 CZ ARG A 22 3.195 9.996 13.971 1.00 0.00 C ATOM 290 NH1 ARG A 22 4.158 9.173 14.407 1.00 0.00 N ATOM 291 NH2 ARG A 22 2.513 10.751 14.843 1.00 0.00 N ATOM 0 H ARG A 22 3.116 5.665 10.235 1.00 0.00 H new ATOM 0 HA ARG A 22 0.622 6.403 11.279 1.00 0.00 H new ATOM 0 HB2 ARG A 22 2.433 8.006 9.425 1.00 0.00 H new ATOM 0 HB3 ARG A 22 1.221 8.655 10.511 1.00 0.00 H new ATOM 0 HG2 ARG A 22 2.491 7.620 12.454 1.00 0.00 H new ATOM 0 HG3 ARG A 22 3.743 7.138 11.326 1.00 0.00 H new ATOM 0 HD2 ARG A 22 4.663 9.175 11.872 1.00 0.00 H new ATOM 0 HD3 ARG A 22 3.549 9.785 10.664 1.00 0.00 H new ATOM 0 HE ARG A 22 2.172 10.698 12.365 1.00 0.00 H new ATOM 0 HH11 ARG A 22 4.676 8.597 13.743 1.00 0.00 H new ATOM 0 HH12 ARG A 22 4.374 9.123 15.403 1.00 0.00 H new ATOM 0 HH21 ARG A 22 1.778 11.376 14.511 1.00 0.00 H new ATOM 0 HH22 ARG A 22 2.728 10.701 15.839 1.00 0.00 H new ATOM 305 N VAL A 23 0.842 6.221 7.993 1.00 0.00 N ATOM 306 CA VAL A 23 0.069 6.158 6.764 1.00 0.00 C ATOM 307 C VAL A 23 -0.179 4.693 6.398 1.00 0.00 C ATOM 308 O VAL A 23 -0.315 4.358 5.222 1.00 0.00 O ATOM 309 CB VAL A 23 0.781 6.938 5.657 1.00 0.00 C ATOM 310 CG1 VAL A 23 0.780 8.439 5.957 1.00 0.00 C ATOM 311 CG2 VAL A 23 2.206 6.421 5.451 1.00 0.00 C ATOM 0 H VAL A 23 1.843 6.063 7.876 1.00 0.00 H new ATOM 0 HA VAL A 23 -0.904 6.629 6.900 1.00 0.00 H new ATOM 0 HB VAL A 23 0.231 6.781 4.729 1.00 0.00 H new ATOM 0 HG11 VAL A 23 1.292 8.971 5.155 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -0.248 8.795 6.030 1.00 0.00 H new ATOM 0 HG13 VAL A 23 1.295 8.622 6.900 1.00 0.00 H new ATOM 0 HG21 VAL A 23 2.689 6.993 4.659 1.00 0.00 H new ATOM 0 HG22 VAL A 23 2.771 6.533 6.376 1.00 0.00 H new ATOM 0 HG23 VAL A 23 2.174 5.368 5.171 1.00 0.00 H new ATOM 321 N ARG A 24 -0.231 3.860 7.427 1.00 0.00 N ATOM 322 CA ARG A 24 -0.461 2.439 7.228 1.00 0.00 C ATOM 323 C ARG A 24 -1.960 2.137 7.243 1.00 0.00 C ATOM 324 O ARG A 24 -2.530 1.857 8.297 1.00 0.00 O ATOM 325 CB ARG A 24 0.230 1.612 8.314 1.00 0.00 C ATOM 326 CG ARG A 24 -0.078 0.123 8.149 1.00 0.00 C ATOM 327 CD ARG A 24 0.088 -0.622 9.475 1.00 0.00 C ATOM 328 NE ARG A 24 -1.062 -0.337 10.362 1.00 0.00 N ATOM 329 CZ ARG A 24 -2.264 -0.918 10.245 1.00 0.00 C ATOM 330 NH1 ARG A 24 -2.481 -1.819 9.278 1.00 0.00 N ATOM 331 NH2 ARG A 24 -3.248 -0.598 11.096 1.00 0.00 N ATOM 0 H ARG A 24 -0.118 4.142 8.401 1.00 0.00 H new ATOM 0 HA ARG A 24 -0.042 2.168 6.259 1.00 0.00 H new ATOM 0 HB2 ARG A 24 1.307 1.771 8.267 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -0.100 1.948 9.297 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -1.097 -0.003 7.782 1.00 0.00 H new ATOM 0 HG3 ARG A 24 0.586 -0.308 7.400 1.00 0.00 H new ATOM 0 HD2 ARG A 24 0.161 -1.694 9.293 1.00 0.00 H new ATOM 0 HD3 ARG A 24 1.016 -0.317 9.959 1.00 0.00 H new ATOM 0 HE ARG A 24 -0.931 0.345 11.110 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -1.731 -2.063 8.631 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -3.396 -2.261 9.189 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -3.082 0.088 11.833 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -4.163 -1.040 11.007 1.00 0.00 H new ATOM 345 N LEU A 25 -2.557 2.203 6.062 1.00 0.00 N ATOM 346 CA LEU A 25 -3.979 1.940 5.926 1.00 0.00 C ATOM 347 C LEU A 25 -4.345 0.702 6.748 1.00 0.00 C ATOM 348 O LEU A 25 -3.494 -0.144 7.015 1.00 0.00 O ATOM 349 CB LEU A 25 -4.366 1.834 4.449 1.00 0.00 C ATOM 350 CG LEU A 25 -4.814 3.133 3.778 1.00 0.00 C ATOM 351 CD1 LEU A 25 -5.376 2.863 2.381 1.00 0.00 C ATOM 352 CD2 LEU A 25 -5.810 3.890 4.660 1.00 0.00 C ATOM 0 H LEU A 25 -2.081 2.435 5.190 1.00 0.00 H new ATOM 0 HA LEU A 25 -4.560 2.772 6.325 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -3.512 1.439 3.898 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -5.170 1.104 4.356 1.00 0.00 H new ATOM 0 HG LEU A 25 -3.940 3.773 3.655 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -5.687 3.803 1.926 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.608 2.398 1.763 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -6.234 2.195 2.457 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -6.113 4.810 4.160 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -6.687 3.267 4.836 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -5.340 4.133 5.613 1.00 0.00 H new ATOM 364 N SER A 26 -5.613 0.637 7.126 1.00 0.00 N ATOM 365 CA SER A 26 -6.103 -0.483 7.912 1.00 0.00 C ATOM 366 C SER A 26 -7.265 -1.164 7.187 1.00 0.00 C ATOM 367 O SER A 26 -8.203 -0.499 6.748 1.00 0.00 O ATOM 368 CB SER A 26 -6.541 -0.028 9.306 1.00 0.00 C ATOM 369 OG SER A 26 -6.973 1.330 9.313 1.00 0.00 O ATOM 0 H SER A 26 -6.316 1.342 6.903 1.00 0.00 H new ATOM 0 HA SER A 26 -5.289 -1.198 8.031 1.00 0.00 H new ATOM 0 HB2 SER A 26 -7.350 -0.668 9.659 1.00 0.00 H new ATOM 0 HB3 SER A 26 -5.712 -0.148 10.004 1.00 0.00 H new ATOM 0 HG SER A 26 -6.195 1.921 9.242 1.00 0.00 H new ATOM 375 N ARG A 27 -7.166 -2.481 7.082 1.00 0.00 N ATOM 376 CA ARG A 27 -8.197 -3.259 6.417 1.00 0.00 C ATOM 377 C ARG A 27 -9.580 -2.687 6.733 1.00 0.00 C ATOM 378 O ARG A 27 -10.417 -2.547 5.843 1.00 0.00 O ATOM 379 CB ARG A 27 -8.147 -4.725 6.852 1.00 0.00 C ATOM 380 CG ARG A 27 -7.955 -5.648 5.647 1.00 0.00 C ATOM 381 CD ARG A 27 -8.456 -7.061 5.953 1.00 0.00 C ATOM 382 NE ARG A 27 -8.374 -7.323 7.407 1.00 0.00 N ATOM 383 CZ ARG A 27 -9.083 -8.267 8.042 1.00 0.00 C ATOM 384 NH1 ARG A 27 -9.929 -9.045 7.354 1.00 0.00 N ATOM 385 NH2 ARG A 27 -8.944 -8.433 9.364 1.00 0.00 N ATOM 0 H ARG A 27 -6.387 -3.029 7.447 1.00 0.00 H new ATOM 0 HA ARG A 27 -8.014 -3.204 5.344 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -7.331 -4.870 7.560 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -9.069 -4.986 7.371 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -8.492 -5.246 4.788 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -6.900 -5.683 5.376 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -9.485 -7.172 5.613 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -7.859 -7.793 5.409 1.00 0.00 H new ATOM 0 HE ARG A 27 -7.738 -6.749 7.961 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -10.034 -8.919 6.347 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -10.469 -9.763 7.837 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -8.299 -7.841 9.887 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -9.483 -9.151 9.847 1.00 0.00 H new ATOM 399 N HIS A 28 -9.778 -2.371 8.005 1.00 0.00 N ATOM 400 CA HIS A 28 -11.046 -1.817 8.450 1.00 0.00 C ATOM 401 C HIS A 28 -11.358 -0.548 7.655 1.00 0.00 C ATOM 402 O HIS A 28 -12.359 -0.488 6.942 1.00 0.00 O ATOM 403 CB HIS A 28 -11.035 -1.583 9.962 1.00 0.00 C ATOM 404 CG HIS A 28 -11.142 -2.847 10.780 1.00 0.00 C ATOM 405 ND1 HIS A 28 -10.368 -3.081 11.903 1.00 0.00 N ATOM 406 CD2 HIS A 28 -11.941 -3.942 10.628 1.00 0.00 C ATOM 407 CE1 HIS A 28 -10.694 -4.267 12.396 1.00 0.00 C ATOM 408 NE2 HIS A 28 -11.668 -4.799 11.604 1.00 0.00 N ATOM 0 H HIS A 28 -9.082 -2.488 8.741 1.00 0.00 H new ATOM 0 HA HIS A 28 -11.847 -2.530 8.257 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -10.115 -1.064 10.232 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -11.862 -0.922 10.223 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -12.672 -4.087 9.846 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -10.264 -4.731 13.271 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -12.114 -5.706 11.739 1.00 0.00 H new ATOM 416 N LYS A 29 -10.484 0.436 7.805 1.00 0.00 N ATOM 417 CA LYS A 29 -10.654 1.701 7.110 1.00 0.00 C ATOM 418 C LYS A 29 -10.997 1.430 5.643 1.00 0.00 C ATOM 419 O LYS A 29 -11.956 1.988 5.113 1.00 0.00 O ATOM 420 CB LYS A 29 -9.421 2.587 7.300 1.00 0.00 C ATOM 421 CG LYS A 29 -9.624 3.569 8.456 1.00 0.00 C ATOM 422 CD LYS A 29 -8.544 4.652 8.451 1.00 0.00 C ATOM 423 CE LYS A 29 -7.486 4.376 9.520 1.00 0.00 C ATOM 424 NZ LYS A 29 -7.636 5.316 10.653 1.00 0.00 N ATOM 0 H LYS A 29 -9.656 0.383 8.398 1.00 0.00 H new ATOM 0 HA LYS A 29 -11.488 2.260 7.535 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -8.548 1.964 7.496 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -9.220 3.138 6.381 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -10.608 4.031 8.377 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -9.600 3.031 9.404 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -8.072 4.695 7.470 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -9.000 5.626 8.628 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -7.580 3.350 9.876 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -6.490 4.474 9.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -6.910 5.115 11.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -7.524 6.292 10.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -8.580 5.203 11.075 1.00 0.00 H new ATOM 438 N LEU A 30 -10.193 0.574 5.030 1.00 0.00 N ATOM 439 CA LEU A 30 -10.399 0.222 3.635 1.00 0.00 C ATOM 440 C LEU A 30 -11.813 -0.333 3.457 1.00 0.00 C ATOM 441 O LEU A 30 -12.582 0.167 2.637 1.00 0.00 O ATOM 442 CB LEU A 30 -9.300 -0.727 3.154 1.00 0.00 C ATOM 443 CG LEU A 30 -7.891 -0.138 3.075 1.00 0.00 C ATOM 444 CD1 LEU A 30 -6.831 -1.239 3.136 1.00 0.00 C ATOM 445 CD2 LEU A 30 -7.733 0.742 1.833 1.00 0.00 C ATOM 0 H LEU A 30 -9.398 0.114 5.473 1.00 0.00 H new ATOM 0 HA LEU A 30 -10.322 1.107 3.003 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.275 -1.589 3.821 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -9.574 -1.096 2.166 1.00 0.00 H new ATOM 0 HG LEU A 30 -7.740 0.502 3.944 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -5.839 -0.792 3.078 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -6.928 -1.786 4.074 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -6.970 -1.924 2.300 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -6.722 1.148 1.801 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -7.913 0.145 0.939 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -8.452 1.560 1.873 1.00 0.00 H new ATOM 457 N GLU A 31 -12.114 -1.360 4.239 1.00 0.00 N ATOM 458 CA GLU A 31 -13.423 -1.989 4.178 1.00 0.00 C ATOM 459 C GLU A 31 -14.523 -0.926 4.193 1.00 0.00 C ATOM 460 O GLU A 31 -15.636 -1.173 3.731 1.00 0.00 O ATOM 461 CB GLU A 31 -13.606 -2.985 5.324 1.00 0.00 C ATOM 462 CG GLU A 31 -14.687 -4.015 4.989 1.00 0.00 C ATOM 463 CD GLU A 31 -15.888 -3.873 5.925 1.00 0.00 C ATOM 464 OE1 GLU A 31 -15.800 -4.418 7.047 1.00 0.00 O ATOM 465 OE2 GLU A 31 -16.868 -3.224 5.498 1.00 0.00 O ATOM 0 H GLU A 31 -11.474 -1.772 4.918 1.00 0.00 H new ATOM 0 HA GLU A 31 -13.495 -2.545 3.243 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -12.663 -3.494 5.522 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -13.877 -2.451 6.235 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -15.009 -3.886 3.956 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -14.274 -5.020 5.071 1.00 0.00 H new ATOM 472 N ARG A 32 -14.175 0.234 4.730 1.00 0.00 N ATOM 473 CA ARG A 32 -15.119 1.335 4.811 1.00 0.00 C ATOM 474 C ARG A 32 -14.977 2.248 3.592 1.00 0.00 C ATOM 475 O ARG A 32 -15.965 2.567 2.933 1.00 0.00 O ATOM 476 CB ARG A 32 -14.899 2.156 6.083 1.00 0.00 C ATOM 477 CG ARG A 32 -14.410 1.270 7.231 1.00 0.00 C ATOM 478 CD ARG A 32 -15.141 1.606 8.532 1.00 0.00 C ATOM 479 NE ARG A 32 -14.539 0.858 9.658 1.00 0.00 N ATOM 480 CZ ARG A 32 -15.143 0.662 10.838 1.00 0.00 C ATOM 481 NH1 ARG A 32 -16.369 1.158 11.054 1.00 0.00 N ATOM 482 NH2 ARG A 32 -14.521 -0.031 11.802 1.00 0.00 N ATOM 0 H ARG A 32 -13.252 0.435 5.114 1.00 0.00 H new ATOM 0 HA ARG A 32 -16.122 0.910 4.835 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -14.170 2.943 5.890 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -15.829 2.647 6.369 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -14.570 0.222 6.980 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -13.337 1.404 7.367 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -15.084 2.677 8.725 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -16.198 1.354 8.441 1.00 0.00 H new ATOM 0 HE ARG A 32 -13.606 0.467 9.528 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -16.843 1.685 10.320 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -16.829 1.009 11.952 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -13.588 -0.409 11.637 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -14.981 -0.180 12.700 1.00 0.00 H new ATOM 496 N TRP A 33 -13.740 2.641 3.328 1.00 0.00 N ATOM 497 CA TRP A 33 -13.456 3.511 2.199 1.00 0.00 C ATOM 498 C TRP A 33 -13.702 2.715 0.916 1.00 0.00 C ATOM 499 O TRP A 33 -13.698 3.278 -0.178 1.00 0.00 O ATOM 500 CB TRP A 33 -12.038 4.078 2.287 1.00 0.00 C ATOM 501 CG TRP A 33 -11.696 4.691 3.647 1.00 0.00 C ATOM 502 CD1 TRP A 33 -12.487 4.803 4.724 1.00 0.00 C ATOM 503 CD2 TRP A 33 -10.435 5.276 4.034 1.00 0.00 C ATOM 504 NE1 TRP A 33 -11.830 5.414 5.772 1.00 0.00 N ATOM 505 CE2 TRP A 33 -10.542 5.711 5.340 1.00 0.00 C ATOM 506 CE3 TRP A 33 -9.242 5.431 3.306 1.00 0.00 C ATOM 507 CZ2 TRP A 33 -9.494 6.330 6.030 1.00 0.00 C ATOM 508 CZ3 TRP A 33 -8.204 6.052 4.010 1.00 0.00 C ATOM 509 CH2 TRP A 33 -8.296 6.496 5.324 1.00 0.00 C ATOM 0 H TRP A 33 -12.923 2.373 3.876 1.00 0.00 H new ATOM 0 HA TRP A 33 -14.117 4.378 2.204 1.00 0.00 H new ATOM 0 HB2 TRP A 33 -11.325 3.282 2.069 1.00 0.00 H new ATOM 0 HB3 TRP A 33 -11.913 4.838 1.516 1.00 0.00 H new ATOM 0 HD1 TRP A 33 -13.510 4.458 4.766 1.00 0.00 H new ATOM 0 HE1 TRP A 33 -12.218 5.612 6.694 1.00 0.00 H new ATOM 0 HE3 TRP A 33 -9.135 5.097 2.284 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 -9.603 6.662 7.052 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 -7.265 6.196 3.496 1.00 0.00 H new ATOM 0 HH2 TRP A 33 -7.448 6.967 5.798 1.00 0.00 H new ATOM 520 N CYS A 34 -13.911 1.419 1.092 1.00 0.00 N ATOM 521 CA CYS A 34 -14.158 0.540 -0.039 1.00 0.00 C ATOM 522 C CYS A 34 -15.394 1.050 -0.782 1.00 0.00 C ATOM 523 O CYS A 34 -15.635 0.672 -1.927 1.00 0.00 O ATOM 524 CB CYS A 34 -14.318 -0.917 0.401 1.00 0.00 C ATOM 525 SG CYS A 34 -16.055 -1.240 0.878 1.00 0.00 S ATOM 0 H CYS A 34 -13.914 0.956 2.001 1.00 0.00 H new ATOM 0 HA CYS A 34 -13.299 0.556 -0.710 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -14.025 -1.584 -0.409 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -13.656 -1.126 1.242 1.00 0.00 H new ATOM 0 HG CYS A 34 -16.127 -1.412 2.165 1.00 0.00 H new ATOM 531 N HIS A 35 -16.146 1.902 -0.100 1.00 0.00 N ATOM 532 CA HIS A 35 -17.351 2.468 -0.681 1.00 0.00 C ATOM 533 C HIS A 35 -17.130 3.953 -0.976 1.00 0.00 C ATOM 534 O HIS A 35 -17.849 4.544 -1.780 1.00 0.00 O ATOM 535 CB HIS A 35 -18.560 2.216 0.222 1.00 0.00 C ATOM 536 CG HIS A 35 -19.407 1.039 -0.200 1.00 0.00 C ATOM 537 ND1 HIS A 35 -20.383 0.489 0.613 1.00 0.00 N ATOM 538 CD2 HIS A 35 -19.413 0.314 -1.355 1.00 0.00 C ATOM 539 CE1 HIS A 35 -20.945 -0.522 -0.035 1.00 0.00 C ATOM 540 NE2 HIS A 35 -20.342 -0.629 -1.254 1.00 0.00 N ATOM 0 H HIS A 35 -15.944 2.214 0.850 1.00 0.00 H new ATOM 0 HA HIS A 35 -17.569 1.974 -1.628 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -18.211 2.052 1.242 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -19.182 3.111 0.238 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -18.771 0.479 -2.207 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -21.741 -1.151 0.337 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -20.568 -1.320 -1.970 1.00 0.00 H new ATOM 548 N MET A 36 -16.132 4.514 -0.308 1.00 0.00 N ATOM 549 CA MET A 36 -15.808 5.919 -0.488 1.00 0.00 C ATOM 550 C MET A 36 -15.586 6.246 -1.966 1.00 0.00 C ATOM 551 O MET A 36 -15.235 5.368 -2.754 1.00 0.00 O ATOM 552 CB MET A 36 -14.543 6.256 0.305 1.00 0.00 C ATOM 553 CG MET A 36 -14.889 6.673 1.736 1.00 0.00 C ATOM 554 SD MET A 36 -15.896 8.146 1.716 1.00 0.00 S ATOM 555 CE MET A 36 -16.093 8.411 3.470 1.00 0.00 C ATOM 0 H MET A 36 -15.538 4.021 0.358 1.00 0.00 H new ATOM 0 HA MET A 36 -16.645 6.515 -0.125 1.00 0.00 H new ATOM 0 HB2 MET A 36 -13.880 5.391 0.324 1.00 0.00 H new ATOM 0 HB3 MET A 36 -14.002 7.061 -0.192 1.00 0.00 H new ATOM 0 HG2 MET A 36 -15.421 5.866 2.240 1.00 0.00 H new ATOM 0 HG3 MET A 36 -13.975 6.855 2.302 1.00 0.00 H new ATOM 0 HE1 MET A 36 -16.702 9.299 3.638 1.00 0.00 H new ATOM 0 HE2 MET A 36 -16.583 7.546 3.916 1.00 0.00 H new ATOM 0 HE3 MET A 36 -15.114 8.550 3.929 1.00 0.00 H new ATOM 565 N PRO A 37 -15.806 7.544 -2.307 1.00 0.00 N ATOM 566 CA PRO A 37 -15.634 7.997 -3.677 1.00 0.00 C ATOM 567 C PRO A 37 -14.150 8.119 -4.032 1.00 0.00 C ATOM 568 O PRO A 37 -13.692 7.528 -5.008 1.00 0.00 O ATOM 569 CB PRO A 37 -16.372 9.324 -3.748 1.00 0.00 C ATOM 570 CG PRO A 37 -16.533 9.788 -2.309 1.00 0.00 C ATOM 571 CD PRO A 37 -16.222 8.610 -1.401 1.00 0.00 C ATOM 0 HA PRO A 37 -16.035 7.293 -4.406 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -15.811 10.053 -4.333 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -17.342 9.206 -4.231 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -15.861 10.620 -2.099 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -17.548 10.147 -2.135 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -15.433 8.856 -0.690 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -17.096 8.317 -0.819 1.00 0.00 H new ATOM 579 N PHE A 38 -13.442 8.889 -3.220 1.00 0.00 N ATOM 580 CA PHE A 38 -12.020 9.096 -3.436 1.00 0.00 C ATOM 581 C PHE A 38 -11.203 7.937 -2.860 1.00 0.00 C ATOM 582 O PHE A 38 -9.984 8.035 -2.733 1.00 0.00 O ATOM 583 CB PHE A 38 -11.639 10.385 -2.705 1.00 0.00 C ATOM 584 CG PHE A 38 -12.093 10.430 -1.245 1.00 0.00 C ATOM 585 CD1 PHE A 38 -11.554 9.570 -0.338 1.00 0.00 C ATOM 586 CD2 PHE A 38 -13.036 11.328 -0.853 1.00 0.00 C ATOM 587 CE1 PHE A 38 -11.976 9.612 1.017 1.00 0.00 C ATOM 588 CE2 PHE A 38 -13.457 11.370 0.503 1.00 0.00 C ATOM 589 CZ PHE A 38 -12.918 10.510 1.409 1.00 0.00 C ATOM 0 H PHE A 38 -13.826 9.377 -2.411 1.00 0.00 H new ATOM 0 HA PHE A 38 -11.811 9.157 -4.504 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -10.556 10.505 -2.742 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -12.072 11.233 -3.236 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -10.806 8.856 -0.649 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -13.465 12.009 -1.573 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -11.548 8.930 1.737 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -14.205 12.084 0.815 1.00 0.00 H new ATOM 0 HZ PHE A 38 -13.239 10.541 2.440 1.00 0.00 H new ATOM 599 N PHE A 39 -11.909 6.866 -2.527 1.00 0.00 N ATOM 600 CA PHE A 39 -11.265 5.690 -1.968 1.00 0.00 C ATOM 601 C PHE A 39 -9.882 5.476 -2.586 1.00 0.00 C ATOM 602 O PHE A 39 -8.865 5.722 -1.941 1.00 0.00 O ATOM 603 CB PHE A 39 -12.153 4.491 -2.305 1.00 0.00 C ATOM 604 CG PHE A 39 -11.524 3.137 -1.972 1.00 0.00 C ATOM 605 CD1 PHE A 39 -11.169 2.848 -0.691 1.00 0.00 C ATOM 606 CD2 PHE A 39 -11.318 2.222 -2.957 1.00 0.00 C ATOM 607 CE1 PHE A 39 -10.585 1.592 -0.382 1.00 0.00 C ATOM 608 CE2 PHE A 39 -10.734 0.965 -2.648 1.00 0.00 C ATOM 609 CZ PHE A 39 -10.379 0.676 -1.367 1.00 0.00 C ATOM 0 H PHE A 39 -12.920 6.788 -2.634 1.00 0.00 H new ATOM 0 HA PHE A 39 -11.137 5.812 -0.892 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -13.094 4.586 -1.764 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -12.393 4.517 -3.368 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -11.332 3.575 0.091 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -11.599 2.451 -3.974 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -10.304 1.363 0.635 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -10.572 0.238 -3.430 1.00 0.00 H new ATOM 0 HZ PHE A 39 -9.934 -0.280 -1.132 1.00 0.00 H new ATOM 619 N ALA A 40 -9.890 5.019 -3.830 1.00 0.00 N ATOM 620 CA ALA A 40 -8.649 4.768 -4.543 1.00 0.00 C ATOM 621 C ALA A 40 -7.735 5.988 -4.412 1.00 0.00 C ATOM 622 O ALA A 40 -6.544 5.849 -4.141 1.00 0.00 O ATOM 623 CB ALA A 40 -8.959 4.426 -6.002 1.00 0.00 C ATOM 0 H ALA A 40 -10.736 4.816 -4.362 1.00 0.00 H new ATOM 0 HA ALA A 40 -8.124 3.915 -4.112 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -8.028 4.238 -6.537 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -9.587 3.536 -6.042 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -9.483 5.261 -6.468 1.00 0.00 H new ATOM 629 N LYS A 41 -8.329 7.156 -4.610 1.00 0.00 N ATOM 630 CA LYS A 41 -7.583 8.400 -4.517 1.00 0.00 C ATOM 631 C LYS A 41 -6.845 8.448 -3.178 1.00 0.00 C ATOM 632 O LYS A 41 -5.638 8.684 -3.138 1.00 0.00 O ATOM 633 CB LYS A 41 -8.506 9.597 -4.754 1.00 0.00 C ATOM 634 CG LYS A 41 -7.708 10.825 -5.197 1.00 0.00 C ATOM 635 CD LYS A 41 -7.229 11.633 -3.989 1.00 0.00 C ATOM 636 CE LYS A 41 -7.976 12.965 -3.890 1.00 0.00 C ATOM 637 NZ LYS A 41 -7.149 13.971 -3.187 1.00 0.00 N ATOM 0 H LYS A 41 -9.318 7.267 -4.834 1.00 0.00 H new ATOM 0 HA LYS A 41 -6.827 8.450 -5.300 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -9.246 9.346 -5.514 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -9.054 9.825 -3.840 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -6.850 10.511 -5.792 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -8.327 11.454 -5.837 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -7.383 11.057 -3.077 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -6.158 11.818 -4.072 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -8.226 13.324 -4.888 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -8.917 12.823 -3.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -7.670 14.869 -3.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -6.932 13.633 -2.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -6.263 14.119 -3.711 1.00 0.00 H new ATOM 651 N THR A 42 -7.600 8.220 -2.113 1.00 0.00 N ATOM 652 CA THR A 42 -7.033 8.235 -0.776 1.00 0.00 C ATOM 653 C THR A 42 -6.056 7.071 -0.598 1.00 0.00 C ATOM 654 O THR A 42 -4.844 7.274 -0.556 1.00 0.00 O ATOM 655 CB THR A 42 -8.187 8.217 0.228 1.00 0.00 C ATOM 656 OG1 THR A 42 -8.711 9.541 0.178 1.00 0.00 O ATOM 657 CG2 THR A 42 -7.706 8.061 1.672 1.00 0.00 C ATOM 0 H THR A 42 -8.600 8.024 -2.150 1.00 0.00 H new ATOM 0 HA THR A 42 -6.448 9.139 -0.605 1.00 0.00 H new ATOM 0 HB THR A 42 -8.868 7.402 -0.017 1.00 0.00 H new ATOM 0 HG1 THR A 42 -9.619 9.547 0.545 1.00 0.00 H new ATOM 0 HG21 THR A 42 -8.565 8.054 2.343 1.00 0.00 H new ATOM 0 HG22 THR A 42 -7.159 7.124 1.774 1.00 0.00 H new ATOM 0 HG23 THR A 42 -7.051 8.893 1.929 1.00 0.00 H new ATOM 665 N VAL A 43 -6.620 5.876 -0.500 1.00 0.00 N ATOM 666 CA VAL A 43 -5.814 4.679 -0.328 1.00 0.00 C ATOM 667 C VAL A 43 -4.525 4.817 -1.140 1.00 0.00 C ATOM 668 O VAL A 43 -3.476 4.319 -0.735 1.00 0.00 O ATOM 669 CB VAL A 43 -6.629 3.441 -0.707 1.00 0.00 C ATOM 670 CG1 VAL A 43 -7.973 3.424 0.025 1.00 0.00 C ATOM 671 CG2 VAL A 43 -6.829 3.358 -2.222 1.00 0.00 C ATOM 0 H VAL A 43 -7.626 5.711 -0.536 1.00 0.00 H new ATOM 0 HA VAL A 43 -5.529 4.557 0.717 1.00 0.00 H new ATOM 0 HB VAL A 43 -6.066 2.561 -0.395 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -8.533 2.534 -0.262 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -7.801 3.413 1.101 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -8.544 4.313 -0.242 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -7.411 2.469 -2.464 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -7.360 4.245 -2.568 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -5.858 3.301 -2.715 1.00 0.00 H new ATOM 681 N THR A 44 -4.645 5.496 -2.271 1.00 0.00 N ATOM 682 CA THR A 44 -3.502 5.706 -3.143 1.00 0.00 C ATOM 683 C THR A 44 -2.493 6.647 -2.482 1.00 0.00 C ATOM 684 O THR A 44 -2.728 7.851 -2.392 1.00 0.00 O ATOM 685 CB THR A 44 -4.021 6.219 -4.488 1.00 0.00 C ATOM 686 OG1 THR A 44 -4.548 5.058 -5.123 1.00 0.00 O ATOM 687 CG2 THR A 44 -2.893 6.672 -5.417 1.00 0.00 C ATOM 0 H THR A 44 -5.517 5.908 -2.604 1.00 0.00 H new ATOM 0 HA THR A 44 -2.963 4.775 -3.320 1.00 0.00 H new ATOM 0 HB THR A 44 -4.707 7.049 -4.319 1.00 0.00 H new ATOM 0 HG1 THR A 44 -5.517 5.018 -4.980 1.00 0.00 H new ATOM 0 HG21 THR A 44 -3.316 7.026 -6.357 1.00 0.00 H new ATOM 0 HG22 THR A 44 -2.334 7.479 -4.944 1.00 0.00 H new ATOM 0 HG23 THR A 44 -2.225 5.834 -5.613 1.00 0.00 H new ATOM 695 N GLY A 45 -1.390 6.063 -2.037 1.00 0.00 N ATOM 696 CA GLY A 45 -0.344 6.834 -1.388 1.00 0.00 C ATOM 697 C GLY A 45 -0.128 6.362 0.051 1.00 0.00 C ATOM 698 O GLY A 45 0.632 6.972 0.802 1.00 0.00 O ATOM 0 H GLY A 45 -1.198 5.064 -2.113 1.00 0.00 H new ATOM 0 HA2 GLY A 45 0.585 6.738 -1.949 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -0.611 7.891 -1.392 1.00 0.00 H new ATOM 702 N CYS A 46 -0.810 5.278 0.393 1.00 0.00 N ATOM 703 CA CYS A 46 -0.701 4.716 1.729 1.00 0.00 C ATOM 704 C CYS A 46 0.005 3.363 1.625 1.00 0.00 C ATOM 705 O CYS A 46 0.211 2.849 0.527 1.00 0.00 O ATOM 706 CB CYS A 46 -2.069 4.595 2.404 1.00 0.00 C ATOM 707 SG CYS A 46 -2.999 6.160 2.218 1.00 0.00 S ATOM 0 H CYS A 46 -1.440 4.774 -0.232 1.00 0.00 H new ATOM 0 HA CYS A 46 -0.114 5.383 2.360 1.00 0.00 H new ATOM 0 HB2 CYS A 46 -2.631 3.773 1.960 1.00 0.00 H new ATOM 0 HB3 CYS A 46 -1.943 4.361 3.461 1.00 0.00 H new ATOM 0 HG CYS A 46 -3.566 6.192 1.049 1.00 0.00 H new ATOM 713 N PHE A 47 0.357 2.825 2.784 1.00 0.00 N ATOM 714 CA PHE A 47 1.037 1.542 2.837 1.00 0.00 C ATOM 715 C PHE A 47 0.209 0.515 3.612 1.00 0.00 C ATOM 716 O PHE A 47 -0.422 0.850 4.614 1.00 0.00 O ATOM 717 CB PHE A 47 2.362 1.767 3.568 1.00 0.00 C ATOM 718 CG PHE A 47 3.437 2.441 2.713 1.00 0.00 C ATOM 719 CD1 PHE A 47 3.320 3.755 2.383 1.00 0.00 C ATOM 720 CD2 PHE A 47 4.511 1.725 2.283 1.00 0.00 C ATOM 721 CE1 PHE A 47 4.318 4.380 1.590 1.00 0.00 C ATOM 722 CE2 PHE A 47 5.509 2.350 1.490 1.00 0.00 C ATOM 723 CZ PHE A 47 5.392 3.664 1.160 1.00 0.00 C ATOM 0 H PHE A 47 0.184 3.254 3.693 1.00 0.00 H new ATOM 0 HA PHE A 47 1.189 1.160 1.828 1.00 0.00 H new ATOM 0 HB2 PHE A 47 2.179 2.378 4.452 1.00 0.00 H new ATOM 0 HB3 PHE A 47 2.740 0.806 3.918 1.00 0.00 H new ATOM 0 HD1 PHE A 47 2.467 4.323 2.724 1.00 0.00 H new ATOM 0 HD2 PHE A 47 4.604 0.681 2.545 1.00 0.00 H new ATOM 0 HE1 PHE A 47 4.225 5.424 1.328 1.00 0.00 H new ATOM 0 HE2 PHE A 47 6.362 1.782 1.149 1.00 0.00 H new ATOM 0 HZ PHE A 47 6.151 4.139 0.557 1.00 0.00 H new ATOM 733 N VAL A 48 0.238 -0.715 3.120 1.00 0.00 N ATOM 734 CA VAL A 48 -0.502 -1.793 3.754 1.00 0.00 C ATOM 735 C VAL A 48 0.397 -3.026 3.864 1.00 0.00 C ATOM 736 O VAL A 48 1.247 -3.258 3.006 1.00 0.00 O ATOM 737 CB VAL A 48 -1.796 -2.063 2.983 1.00 0.00 C ATOM 738 CG1 VAL A 48 -2.643 -0.793 2.872 1.00 0.00 C ATOM 739 CG2 VAL A 48 -1.499 -2.646 1.601 1.00 0.00 C ATOM 0 H VAL A 48 0.763 -0.989 2.289 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.795 -1.513 4.766 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.371 -2.802 3.542 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.557 -1.012 2.320 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -2.899 -0.438 3.870 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.078 -0.023 2.347 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.436 -2.829 1.074 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -0.894 -1.941 1.031 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.956 -3.585 1.711 1.00 0.00 H new ATOM 749 N ARG A 49 0.177 -3.785 4.928 1.00 0.00 N ATOM 750 CA ARG A 49 0.957 -4.989 5.162 1.00 0.00 C ATOM 751 C ARG A 49 0.324 -6.180 4.439 1.00 0.00 C ATOM 752 O ARG A 49 -0.788 -6.591 4.769 1.00 0.00 O ATOM 753 CB ARG A 49 1.053 -5.301 6.656 1.00 0.00 C ATOM 754 CG ARG A 49 2.264 -6.188 6.954 1.00 0.00 C ATOM 755 CD ARG A 49 3.304 -5.434 7.787 1.00 0.00 C ATOM 756 NE ARG A 49 4.263 -6.390 8.383 1.00 0.00 N ATOM 757 CZ ARG A 49 5.343 -6.866 7.748 1.00 0.00 C ATOM 758 NH1 ARG A 49 5.606 -6.478 6.492 1.00 0.00 N ATOM 759 NH2 ARG A 49 6.158 -7.730 8.367 1.00 0.00 N ATOM 0 H ARG A 49 -0.530 -3.590 5.637 1.00 0.00 H new ATOM 0 HA ARG A 49 1.960 -4.815 4.774 1.00 0.00 H new ATOM 0 HB2 ARG A 49 1.130 -4.372 7.221 1.00 0.00 H new ATOM 0 HB3 ARG A 49 0.142 -5.800 6.986 1.00 0.00 H new ATOM 0 HG2 ARG A 49 1.942 -7.081 7.489 1.00 0.00 H new ATOM 0 HG3 ARG A 49 2.714 -6.522 6.019 1.00 0.00 H new ATOM 0 HD2 ARG A 49 3.834 -4.717 7.160 1.00 0.00 H new ATOM 0 HD3 ARG A 49 2.809 -4.864 8.574 1.00 0.00 H new ATOM 0 HE ARG A 49 4.091 -6.707 9.337 1.00 0.00 H new ATOM 0 HH11 ARG A 49 4.984 -5.821 6.020 1.00 0.00 H new ATOM 0 HH12 ARG A 49 6.428 -6.840 6.008 1.00 0.00 H new ATOM 0 HH21 ARG A 49 5.957 -8.026 9.322 1.00 0.00 H new ATOM 0 HH22 ARG A 49 6.980 -8.092 7.883 1.00 0.00 H new ATOM 773 N ILE A 50 1.058 -6.699 3.466 1.00 0.00 N ATOM 774 CA ILE A 50 0.582 -7.835 2.694 1.00 0.00 C ATOM 775 C ILE A 50 1.258 -9.110 3.202 1.00 0.00 C ATOM 776 O ILE A 50 2.414 -9.080 3.620 1.00 0.00 O ATOM 777 CB ILE A 50 0.783 -7.587 1.198 1.00 0.00 C ATOM 778 CG1 ILE A 50 -0.171 -8.447 0.367 1.00 0.00 C ATOM 779 CG2 ILE A 50 2.244 -7.801 0.797 1.00 0.00 C ATOM 780 CD1 ILE A 50 -1.614 -7.958 0.508 1.00 0.00 C ATOM 0 H ILE A 50 1.979 -6.354 3.194 1.00 0.00 H new ATOM 0 HA ILE A 50 -0.491 -7.966 2.831 1.00 0.00 H new ATOM 0 HB ILE A 50 0.542 -6.545 0.990 1.00 0.00 H new ATOM 0 HG12 ILE A 50 0.126 -8.417 -0.681 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.102 -9.486 0.688 1.00 0.00 H new ATOM 0 HG21 ILE A 50 2.359 -7.618 -0.271 1.00 0.00 H new ATOM 0 HG22 ILE A 50 2.879 -7.111 1.353 1.00 0.00 H new ATOM 0 HG23 ILE A 50 2.537 -8.826 1.023 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -2.271 -8.586 -0.093 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.916 -8.012 1.554 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.684 -6.926 0.163 1.00 0.00 H new ATOM 792 N GLY A 51 0.506 -10.200 3.150 1.00 0.00 N ATOM 793 CA GLY A 51 1.018 -11.484 3.599 1.00 0.00 C ATOM 794 C GLY A 51 1.210 -12.441 2.421 1.00 0.00 C ATOM 795 O GLY A 51 0.238 -12.941 1.857 1.00 0.00 O ATOM 0 H GLY A 51 -0.453 -10.220 2.804 1.00 0.00 H new ATOM 0 HA2 GLY A 51 1.968 -11.341 4.114 1.00 0.00 H new ATOM 0 HA3 GLY A 51 0.328 -11.923 4.320 1.00 0.00 H new ATOM 799 N ILE A 52 2.471 -12.666 2.083 1.00 0.00 N ATOM 800 CA ILE A 52 2.804 -13.554 0.982 1.00 0.00 C ATOM 801 C ILE A 52 2.159 -14.921 1.222 1.00 0.00 C ATOM 802 O ILE A 52 0.968 -15.101 0.973 1.00 0.00 O ATOM 803 CB ILE A 52 4.319 -13.616 0.782 1.00 0.00 C ATOM 804 CG1 ILE A 52 5.049 -13.644 2.127 1.00 0.00 C ATOM 805 CG2 ILE A 52 4.803 -12.469 -0.108 1.00 0.00 C ATOM 806 CD1 ILE A 52 5.587 -12.258 2.489 1.00 0.00 C ATOM 0 H ILE A 52 3.275 -12.249 2.552 1.00 0.00 H new ATOM 0 HA ILE A 52 2.398 -13.169 0.047 1.00 0.00 H new ATOM 0 HB ILE A 52 4.557 -14.546 0.266 1.00 0.00 H new ATOM 0 HG12 ILE A 52 4.369 -13.989 2.906 1.00 0.00 H new ATOM 0 HG13 ILE A 52 5.872 -14.357 2.083 1.00 0.00 H new ATOM 0 HG21 ILE A 52 5.884 -12.537 -0.234 1.00 0.00 H new ATOM 0 HG22 ILE A 52 4.319 -12.536 -1.083 1.00 0.00 H new ATOM 0 HG23 ILE A 52 4.551 -11.516 0.358 1.00 0.00 H new ATOM 0 HD11 ILE A 52 6.101 -12.307 3.449 1.00 0.00 H new ATOM 0 HD12 ILE A 52 6.285 -11.926 1.720 1.00 0.00 H new ATOM 0 HD13 ILE A 52 4.759 -11.552 2.556 1.00 0.00 H new ATOM 917 N VAL A 60 4.851 -14.492 7.539 1.00 0.00 N ATOM 918 CA VAL A 60 5.642 -13.655 6.653 1.00 0.00 C ATOM 919 C VAL A 60 4.765 -12.527 6.107 1.00 0.00 C ATOM 920 O VAL A 60 3.582 -12.730 5.837 1.00 0.00 O ATOM 921 CB VAL A 60 6.274 -14.508 5.552 1.00 0.00 C ATOM 922 CG1 VAL A 60 5.201 -15.235 4.738 1.00 0.00 C ATOM 923 CG2 VAL A 60 7.168 -13.659 4.645 1.00 0.00 C ATOM 0 HA VAL A 60 6.465 -13.192 7.198 1.00 0.00 H new ATOM 0 HB VAL A 60 6.900 -15.261 6.030 1.00 0.00 H new ATOM 0 HG11 VAL A 60 5.677 -15.834 3.962 1.00 0.00 H new ATOM 0 HG12 VAL A 60 4.624 -15.885 5.395 1.00 0.00 H new ATOM 0 HG13 VAL A 60 4.537 -14.504 4.276 1.00 0.00 H new ATOM 0 HG21 VAL A 60 7.605 -14.290 3.871 1.00 0.00 H new ATOM 0 HG22 VAL A 60 6.573 -12.873 4.180 1.00 0.00 H new ATOM 0 HG23 VAL A 60 7.964 -13.208 5.238 1.00 0.00 H new ATOM 933 N TYR A 61 5.378 -11.362 5.959 1.00 0.00 N ATOM 934 CA TYR A 61 4.668 -10.201 5.449 1.00 0.00 C ATOM 935 C TYR A 61 5.607 -9.288 4.658 1.00 0.00 C ATOM 936 O TYR A 61 6.780 -9.150 5.000 1.00 0.00 O ATOM 937 CB TYR A 61 4.158 -9.446 6.678 1.00 0.00 C ATOM 938 CG TYR A 61 2.882 -10.034 7.284 1.00 0.00 C ATOM 939 CD1 TYR A 61 1.669 -9.851 6.650 1.00 0.00 C ATOM 940 CD2 TYR A 61 2.943 -10.747 8.464 1.00 0.00 C ATOM 941 CE1 TYR A 61 0.468 -10.404 7.221 1.00 0.00 C ATOM 942 CE2 TYR A 61 1.742 -11.300 9.034 1.00 0.00 C ATOM 943 CZ TYR A 61 0.564 -11.101 8.384 1.00 0.00 C ATOM 944 OH TYR A 61 -0.570 -11.624 8.923 1.00 0.00 O ATOM 0 H TYR A 61 6.359 -11.197 6.183 1.00 0.00 H new ATOM 0 HA TYR A 61 3.862 -10.506 4.781 1.00 0.00 H new ATOM 0 HB2 TYR A 61 4.939 -9.440 7.438 1.00 0.00 H new ATOM 0 HB3 TYR A 61 3.972 -8.408 6.403 1.00 0.00 H new ATOM 0 HD1 TYR A 61 1.621 -9.293 5.726 1.00 0.00 H new ATOM 0 HD2 TYR A 61 3.892 -10.890 8.960 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -0.487 -10.268 6.736 1.00 0.00 H new ATOM 0 HE2 TYR A 61 1.776 -11.860 9.957 1.00 0.00 H new ATOM 0 HH TYR A 61 -1.280 -10.949 8.910 1.00 0.00 H new ATOM 954 N ARG A 62 5.054 -8.687 3.614 1.00 0.00 N ATOM 955 CA ARG A 62 5.827 -7.791 2.771 1.00 0.00 C ATOM 956 C ARG A 62 5.167 -6.412 2.716 1.00 0.00 C ATOM 957 O ARG A 62 3.942 -6.308 2.668 1.00 0.00 O ATOM 958 CB ARG A 62 5.955 -8.344 1.350 1.00 0.00 C ATOM 959 CG ARG A 62 6.628 -9.718 1.354 1.00 0.00 C ATOM 960 CD ARG A 62 8.035 -9.641 0.758 1.00 0.00 C ATOM 961 NE ARG A 62 8.400 -10.941 0.151 1.00 0.00 N ATOM 962 CZ ARG A 62 8.934 -11.964 0.833 1.00 0.00 C ATOM 963 NH1 ARG A 62 9.170 -11.844 2.146 1.00 0.00 N ATOM 964 NH2 ARG A 62 9.233 -13.106 0.200 1.00 0.00 N ATOM 0 H ARG A 62 4.080 -8.803 3.333 1.00 0.00 H new ATOM 0 HA ARG A 62 6.823 -7.704 3.206 1.00 0.00 H new ATOM 0 HB2 ARG A 62 4.967 -8.420 0.896 1.00 0.00 H new ATOM 0 HB3 ARG A 62 6.535 -7.653 0.738 1.00 0.00 H new ATOM 0 HG2 ARG A 62 6.682 -10.098 2.374 1.00 0.00 H new ATOM 0 HG3 ARG A 62 6.025 -10.424 0.783 1.00 0.00 H new ATOM 0 HD2 ARG A 62 8.077 -8.854 0.005 1.00 0.00 H new ATOM 0 HD3 ARG A 62 8.754 -9.378 1.534 1.00 0.00 H new ATOM 0 HE ARG A 62 8.235 -11.066 -0.848 1.00 0.00 H new ATOM 0 HH11 ARG A 62 8.943 -10.974 2.627 1.00 0.00 H new ATOM 0 HH12 ARG A 62 9.576 -12.623 2.664 1.00 0.00 H new ATOM 0 HH21 ARG A 62 9.054 -13.197 -0.800 1.00 0.00 H new ATOM 0 HH22 ARG A 62 9.639 -13.885 0.718 1.00 0.00 H new ATOM 978 N VAL A 63 6.008 -5.388 2.726 1.00 0.00 N ATOM 979 CA VAL A 63 5.521 -4.020 2.678 1.00 0.00 C ATOM 980 C VAL A 63 5.262 -3.626 1.223 1.00 0.00 C ATOM 981 O VAL A 63 5.999 -4.031 0.326 1.00 0.00 O ATOM 982 CB VAL A 63 6.509 -3.088 3.383 1.00 0.00 C ATOM 983 CG1 VAL A 63 6.083 -1.626 3.237 1.00 0.00 C ATOM 984 CG2 VAL A 63 6.666 -3.469 4.857 1.00 0.00 C ATOM 0 H VAL A 63 7.023 -5.478 2.767 1.00 0.00 H new ATOM 0 HA VAL A 63 4.575 -3.933 3.212 1.00 0.00 H new ATOM 0 HB VAL A 63 7.480 -3.204 2.902 1.00 0.00 H new ATOM 0 HG11 VAL A 63 6.802 -0.985 3.747 1.00 0.00 H new ATOM 0 HG12 VAL A 63 6.046 -1.361 2.180 1.00 0.00 H new ATOM 0 HG13 VAL A 63 5.096 -1.489 3.680 1.00 0.00 H new ATOM 0 HG21 VAL A 63 7.373 -2.791 5.335 1.00 0.00 H new ATOM 0 HG22 VAL A 63 5.700 -3.396 5.356 1.00 0.00 H new ATOM 0 HG23 VAL A 63 7.037 -4.491 4.931 1.00 0.00 H new ATOM 994 N ALA A 64 4.212 -2.840 1.034 1.00 0.00 N ATOM 995 CA ALA A 64 3.846 -2.386 -0.297 1.00 0.00 C ATOM 996 C ALA A 64 3.181 -1.012 -0.198 1.00 0.00 C ATOM 997 O ALA A 64 2.616 -0.665 0.838 1.00 0.00 O ATOM 998 CB ALA A 64 2.940 -3.426 -0.960 1.00 0.00 C ATOM 0 H ALA A 64 3.603 -2.506 1.781 1.00 0.00 H new ATOM 0 HA ALA A 64 4.732 -2.279 -0.923 1.00 0.00 H new ATOM 0 HB1 ALA A 64 2.665 -3.086 -1.958 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.470 -4.376 -1.033 1.00 0.00 H new ATOM 0 HB3 ALA A 64 2.039 -3.558 -0.361 1.00 0.00 H new ATOM 1004 N GLU A 65 3.271 -0.266 -1.290 1.00 0.00 N ATOM 1005 CA GLU A 65 2.685 1.062 -1.339 1.00 0.00 C ATOM 1006 C GLU A 65 1.565 1.110 -2.380 1.00 0.00 C ATOM 1007 O GLU A 65 1.778 0.769 -3.542 1.00 0.00 O ATOM 1008 CB GLU A 65 3.750 2.121 -1.631 1.00 0.00 C ATOM 1009 CG GLU A 65 3.116 3.501 -1.815 1.00 0.00 C ATOM 1010 CD GLU A 65 4.168 4.540 -2.208 1.00 0.00 C ATOM 1011 OE1 GLU A 65 4.795 4.339 -3.270 1.00 0.00 O ATOM 1012 OE2 GLU A 65 4.322 5.512 -1.437 1.00 0.00 O ATOM 0 H GLU A 65 3.741 -0.557 -2.147 1.00 0.00 H new ATOM 0 HA GLU A 65 2.256 1.285 -0.362 1.00 0.00 H new ATOM 0 HB2 GLU A 65 4.469 2.154 -0.813 1.00 0.00 H new ATOM 0 HB3 GLU A 65 4.302 1.848 -2.530 1.00 0.00 H new ATOM 0 HG2 GLU A 65 2.344 3.451 -2.583 1.00 0.00 H new ATOM 0 HG3 GLU A 65 2.626 3.806 -0.890 1.00 0.00 H new ATOM 1019 N ILE A 66 0.395 1.536 -1.925 1.00 0.00 N ATOM 1020 CA ILE A 66 -0.759 1.633 -2.802 1.00 0.00 C ATOM 1021 C ILE A 66 -0.475 2.661 -3.900 1.00 0.00 C ATOM 1022 O ILE A 66 -0.309 3.846 -3.617 1.00 0.00 O ATOM 1023 CB ILE A 66 -2.023 1.929 -1.994 1.00 0.00 C ATOM 1024 CG1 ILE A 66 -2.084 1.064 -0.734 1.00 0.00 C ATOM 1025 CG2 ILE A 66 -3.276 1.772 -2.858 1.00 0.00 C ATOM 1026 CD1 ILE A 66 -3.487 1.081 -0.124 1.00 0.00 C ATOM 0 H ILE A 66 0.222 1.818 -0.960 1.00 0.00 H new ATOM 0 HA ILE A 66 -0.942 0.680 -3.297 1.00 0.00 H new ATOM 0 HB ILE A 66 -1.984 2.969 -1.669 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -1.802 0.040 -0.978 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -1.362 1.428 -0.003 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -4.161 1.988 -2.259 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -3.228 2.465 -3.698 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -3.333 0.750 -3.234 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -3.502 0.458 0.770 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -3.756 2.103 0.141 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -4.203 0.694 -0.848 1.00 0.00 H new ATOM 1038 N THR A 67 -0.428 2.169 -5.129 1.00 0.00 N ATOM 1039 CA THR A 67 -0.167 3.030 -6.270 1.00 0.00 C ATOM 1040 C THR A 67 -1.456 3.278 -7.056 1.00 0.00 C ATOM 1041 O THR A 67 -1.442 3.968 -8.075 1.00 0.00 O ATOM 1042 CB THR A 67 0.940 2.385 -7.106 1.00 0.00 C ATOM 1043 OG1 THR A 67 0.271 1.362 -7.839 1.00 0.00 O ATOM 1044 CG2 THR A 67 1.955 1.625 -6.248 1.00 0.00 C ATOM 0 H THR A 67 -0.566 1.185 -5.360 1.00 0.00 H new ATOM 0 HA THR A 67 0.178 4.014 -5.952 1.00 0.00 H new ATOM 0 HB THR A 67 1.455 3.155 -7.681 1.00 0.00 H new ATOM 0 HG1 THR A 67 0.916 0.894 -8.410 1.00 0.00 H new ATOM 0 HG21 THR A 67 2.719 1.187 -6.890 1.00 0.00 H new ATOM 0 HG22 THR A 67 2.424 2.313 -5.544 1.00 0.00 H new ATOM 0 HG23 THR A 67 1.446 0.834 -5.698 1.00 0.00 H new ATOM 1052 N GLY A 68 -2.538 2.703 -6.553 1.00 0.00 N ATOM 1053 CA GLY A 68 -3.832 2.853 -7.196 1.00 0.00 C ATOM 1054 C GLY A 68 -4.760 1.691 -6.838 1.00 0.00 C ATOM 1055 O GLY A 68 -4.410 0.840 -6.022 1.00 0.00 O ATOM 0 H GLY A 68 -2.545 2.132 -5.708 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -4.287 3.795 -6.889 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -3.702 2.899 -8.277 1.00 0.00 H new ATOM 1059 N VAL A 69 -5.927 1.691 -7.467 1.00 0.00 N ATOM 1060 CA VAL A 69 -6.908 0.647 -7.226 1.00 0.00 C ATOM 1061 C VAL A 69 -7.400 0.096 -8.565 1.00 0.00 C ATOM 1062 O VAL A 69 -7.895 0.846 -9.405 1.00 0.00 O ATOM 1063 CB VAL A 69 -8.040 1.185 -6.349 1.00 0.00 C ATOM 1064 CG1 VAL A 69 -9.190 0.180 -6.260 1.00 0.00 C ATOM 1065 CG2 VAL A 69 -7.526 1.555 -4.956 1.00 0.00 C ATOM 0 H VAL A 69 -6.215 2.398 -8.143 1.00 0.00 H new ATOM 0 HA VAL A 69 -6.457 -0.181 -6.680 1.00 0.00 H new ATOM 0 HB VAL A 69 -8.423 2.092 -6.816 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -9.981 0.587 -5.631 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -9.583 -0.012 -7.258 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -8.826 -0.752 -5.827 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -8.351 1.935 -4.353 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -7.103 0.671 -4.478 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -6.757 2.323 -5.044 1.00 0.00 H new ATOM 1075 N VAL A 70 -7.246 -1.211 -8.724 1.00 0.00 N ATOM 1076 CA VAL A 70 -7.668 -1.871 -9.947 1.00 0.00 C ATOM 1077 C VAL A 70 -9.036 -2.520 -9.725 1.00 0.00 C ATOM 1078 O VAL A 70 -9.521 -2.583 -8.597 1.00 0.00 O ATOM 1079 CB VAL A 70 -6.600 -2.868 -10.400 1.00 0.00 C ATOM 1080 CG1 VAL A 70 -5.316 -2.146 -10.815 1.00 0.00 C ATOM 1081 CG2 VAL A 70 -6.318 -3.903 -9.308 1.00 0.00 C ATOM 0 H VAL A 70 -6.835 -1.830 -8.025 1.00 0.00 H new ATOM 0 HA VAL A 70 -7.779 -1.146 -10.753 1.00 0.00 H new ATOM 0 HB VAL A 70 -6.984 -3.397 -11.272 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -4.573 -2.878 -11.133 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -5.531 -1.466 -11.639 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -4.928 -1.579 -9.969 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -5.555 -4.600 -9.655 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -5.965 -3.397 -8.409 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -7.233 -4.450 -9.080 1.00 0.00 H new ATOM 1091 N GLU A 71 -9.619 -2.987 -10.820 1.00 0.00 N ATOM 1092 CA GLU A 71 -10.921 -3.629 -10.759 1.00 0.00 C ATOM 1093 C GLU A 71 -10.820 -5.080 -11.234 1.00 0.00 C ATOM 1094 O GLU A 71 -10.029 -5.392 -12.123 1.00 0.00 O ATOM 1095 CB GLU A 71 -11.953 -2.853 -11.579 1.00 0.00 C ATOM 1096 CG GLU A 71 -12.676 -1.818 -10.715 1.00 0.00 C ATOM 1097 CD GLU A 71 -14.186 -1.862 -10.955 1.00 0.00 C ATOM 1098 OE1 GLU A 71 -14.730 -2.988 -10.949 1.00 0.00 O ATOM 1099 OE2 GLU A 71 -14.763 -0.769 -11.138 1.00 0.00 O ATOM 0 H GLU A 71 -9.213 -2.933 -11.754 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.256 -3.630 -9.722 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -11.459 -2.354 -12.413 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -12.678 -3.546 -12.006 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -12.466 -2.007 -9.662 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -12.297 -0.821 -10.942 1.00 0.00 H new ATOM 1106 N THR A 72 -11.632 -5.928 -10.620 1.00 0.00 N ATOM 1107 CA THR A 72 -11.644 -7.338 -10.969 1.00 0.00 C ATOM 1108 C THR A 72 -13.041 -7.762 -11.425 1.00 0.00 C ATOM 1109 O THR A 72 -13.983 -6.972 -11.371 1.00 0.00 O ATOM 1110 CB THR A 72 -11.133 -8.128 -9.763 1.00 0.00 C ATOM 1111 OG1 THR A 72 -12.047 -7.801 -8.720 1.00 0.00 O ATOM 1112 CG2 THR A 72 -9.786 -7.612 -9.253 1.00 0.00 C ATOM 0 H THR A 72 -12.286 -5.665 -9.883 1.00 0.00 H new ATOM 0 HA THR A 72 -10.985 -7.542 -11.813 1.00 0.00 H new ATOM 0 HB THR A 72 -11.041 -9.180 -10.032 1.00 0.00 H new ATOM 0 HG1 THR A 72 -11.787 -6.949 -8.312 1.00 0.00 H new ATOM 0 HG21 THR A 72 -9.469 -8.207 -8.397 1.00 0.00 H new ATOM 0 HG22 THR A 72 -9.042 -7.692 -10.046 1.00 0.00 H new ATOM 0 HG23 THR A 72 -9.886 -6.569 -8.953 1.00 0.00 H new ATOM 1120 N ALA A 73 -13.132 -9.009 -11.865 1.00 0.00 N ATOM 1121 CA ALA A 73 -14.399 -9.548 -12.330 1.00 0.00 C ATOM 1122 C ALA A 73 -15.012 -10.419 -11.232 1.00 0.00 C ATOM 1123 O ALA A 73 -16.233 -10.532 -11.134 1.00 0.00 O ATOM 1124 CB ALA A 73 -14.177 -10.321 -13.632 1.00 0.00 C ATOM 0 H ALA A 73 -12.349 -9.661 -11.909 1.00 0.00 H new ATOM 0 HA ALA A 73 -15.103 -8.744 -12.544 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -15.127 -10.726 -13.981 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.768 -9.651 -14.388 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.478 -11.138 -13.455 1.00 0.00 H new ATOM 1130 N LYS A 74 -14.137 -11.012 -10.433 1.00 0.00 N ATOM 1131 CA LYS A 74 -14.577 -11.869 -9.346 1.00 0.00 C ATOM 1132 C LYS A 74 -14.694 -11.041 -8.065 1.00 0.00 C ATOM 1133 O LYS A 74 -13.928 -10.101 -7.856 1.00 0.00 O ATOM 1134 CB LYS A 74 -13.653 -13.081 -9.211 1.00 0.00 C ATOM 1135 CG LYS A 74 -13.804 -14.021 -10.409 1.00 0.00 C ATOM 1136 CD LYS A 74 -14.040 -15.461 -9.949 1.00 0.00 C ATOM 1137 CE LYS A 74 -14.505 -16.339 -11.112 1.00 0.00 C ATOM 1138 NZ LYS A 74 -15.885 -16.822 -10.878 1.00 0.00 N ATOM 0 H LYS A 74 -13.125 -10.916 -10.517 1.00 0.00 H new ATOM 0 HA LYS A 74 -15.567 -12.273 -9.557 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -12.618 -12.747 -9.134 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -13.884 -13.618 -8.291 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -14.637 -13.693 -11.031 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -12.907 -13.975 -11.027 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -13.121 -15.867 -9.527 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -14.788 -15.475 -9.156 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -14.465 -15.772 -12.042 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -13.831 -17.188 -11.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -16.185 -17.416 -11.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -15.913 -17.381 -10.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -16.527 -16.009 -10.791 1.00 0.00 H new ATOM 1152 N VAL A 75 -15.660 -11.419 -7.240 1.00 0.00 N ATOM 1153 CA VAL A 75 -15.888 -10.722 -5.985 1.00 0.00 C ATOM 1154 C VAL A 75 -15.604 -11.673 -4.821 1.00 0.00 C ATOM 1155 O VAL A 75 -15.785 -12.883 -4.945 1.00 0.00 O ATOM 1156 CB VAL A 75 -17.306 -10.148 -5.956 1.00 0.00 C ATOM 1157 CG1 VAL A 75 -17.715 -9.770 -4.531 1.00 0.00 C ATOM 1158 CG2 VAL A 75 -17.432 -8.949 -6.898 1.00 0.00 C ATOM 0 H VAL A 75 -16.294 -12.199 -7.416 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.207 -9.876 -5.888 1.00 0.00 H new ATOM 0 HB VAL A 75 -17.988 -10.923 -6.307 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -18.727 -9.365 -4.538 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.683 -10.656 -3.896 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -17.026 -9.020 -4.142 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -18.450 -8.560 -6.858 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -16.734 -8.170 -6.591 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -17.203 -9.261 -7.917 1.00 0.00 H new ATOM 1168 N TYR A 76 -15.164 -11.089 -3.716 1.00 0.00 N ATOM 1169 CA TYR A 76 -14.853 -11.869 -2.530 1.00 0.00 C ATOM 1170 C TYR A 76 -15.314 -11.147 -1.263 1.00 0.00 C ATOM 1171 O TYR A 76 -15.539 -9.938 -1.279 1.00 0.00 O ATOM 1172 CB TYR A 76 -13.329 -12.002 -2.501 1.00 0.00 C ATOM 1173 CG TYR A 76 -12.586 -10.665 -2.550 1.00 0.00 C ATOM 1174 CD1 TYR A 76 -12.498 -9.883 -1.417 1.00 0.00 C ATOM 1175 CD2 TYR A 76 -12.005 -10.242 -3.728 1.00 0.00 C ATOM 1176 CE1 TYR A 76 -11.799 -8.625 -1.463 1.00 0.00 C ATOM 1177 CE2 TYR A 76 -11.306 -8.984 -3.774 1.00 0.00 C ATOM 1178 CZ TYR A 76 -11.237 -8.237 -2.639 1.00 0.00 C ATOM 1179 OH TYR A 76 -10.577 -7.049 -2.683 1.00 0.00 O ATOM 0 H TYR A 76 -15.015 -10.085 -3.617 1.00 0.00 H new ATOM 0 HA TYR A 76 -15.357 -12.835 -2.563 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -13.038 -12.534 -1.595 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -13.012 -12.613 -3.346 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -12.953 -10.214 -0.495 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -12.075 -10.854 -4.615 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -11.723 -8.003 -0.583 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -10.847 -8.641 -4.689 1.00 0.00 H new ATOM 0 HH TYR A 76 -10.769 -6.599 -3.532 1.00 0.00 H new ATOM 1189 N GLN A 77 -15.442 -11.919 -0.193 1.00 0.00 N ATOM 1190 CA GLN A 77 -15.873 -11.369 1.080 1.00 0.00 C ATOM 1191 C GLN A 77 -14.735 -10.576 1.727 1.00 0.00 C ATOM 1192 O GLN A 77 -13.563 -10.881 1.517 1.00 0.00 O ATOM 1193 CB GLN A 77 -16.372 -12.473 2.014 1.00 0.00 C ATOM 1194 CG GLN A 77 -16.840 -11.891 3.350 1.00 0.00 C ATOM 1195 CD GLN A 77 -17.336 -12.996 4.285 1.00 0.00 C ATOM 1196 OE1 GLN A 77 -17.365 -14.167 3.944 1.00 0.00 O ATOM 1197 NE2 GLN A 77 -17.723 -12.560 5.480 1.00 0.00 N ATOM 0 H GLN A 77 -15.254 -12.922 -0.183 1.00 0.00 H new ATOM 0 HA GLN A 77 -16.706 -10.690 0.897 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -17.193 -13.012 1.540 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -15.575 -13.196 2.187 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -16.020 -11.351 3.823 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -17.639 -11.170 3.177 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -17.673 -11.565 5.701 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -18.070 -13.220 6.176 1.00 0.00 H new ATOM 1206 N LEU A 78 -15.122 -9.573 2.502 1.00 0.00 N ATOM 1207 CA LEU A 78 -14.150 -8.734 3.181 1.00 0.00 C ATOM 1208 C LEU A 78 -14.746 -8.233 4.499 1.00 0.00 C ATOM 1209 O LEU A 78 -15.210 -7.097 4.582 1.00 0.00 O ATOM 1210 CB LEU A 78 -13.672 -7.612 2.257 1.00 0.00 C ATOM 1211 CG LEU A 78 -12.850 -6.503 2.918 1.00 0.00 C ATOM 1212 CD1 LEU A 78 -11.425 -6.977 3.211 1.00 0.00 C ATOM 1213 CD2 LEU A 78 -12.867 -5.229 2.071 1.00 0.00 C ATOM 0 H LEU A 78 -16.096 -9.323 2.674 1.00 0.00 H new ATOM 0 HA LEU A 78 -13.260 -9.310 3.432 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -13.074 -8.054 1.460 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -14.545 -7.159 1.787 1.00 0.00 H new ATOM 0 HG LEU A 78 -13.312 -6.260 3.875 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -10.862 -6.170 3.680 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -11.458 -7.835 3.883 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -10.938 -7.264 2.279 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -12.276 -4.457 2.563 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -12.444 -5.439 1.089 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -13.894 -4.882 1.957 1.00 0.00 H new ATOM 1225 N GLY A 79 -14.714 -9.106 5.495 1.00 0.00 N ATOM 1226 CA GLY A 79 -15.245 -8.766 6.804 1.00 0.00 C ATOM 1227 C GLY A 79 -16.771 -8.660 6.766 1.00 0.00 C ATOM 1228 O GLY A 79 -17.372 -7.997 7.610 1.00 0.00 O ATOM 0 H GLY A 79 -14.329 -10.048 5.422 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -14.947 -9.524 7.529 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -14.819 -7.820 7.139 1.00 0.00 H new ATOM 1232 N GLY A 80 -17.354 -9.323 5.778 1.00 0.00 N ATOM 1233 CA GLY A 80 -18.798 -9.312 5.618 1.00 0.00 C ATOM 1234 C GLY A 80 -19.196 -8.700 4.273 1.00 0.00 C ATOM 1235 O GLY A 80 -20.095 -9.202 3.601 1.00 0.00 O ATOM 0 H GLY A 80 -16.852 -9.872 5.080 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -19.183 -10.329 5.687 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -19.253 -8.744 6.429 1.00 0.00 H new ATOM 1239 N THR A 81 -18.508 -7.624 3.922 1.00 0.00 N ATOM 1240 CA THR A 81 -18.778 -6.939 2.669 1.00 0.00 C ATOM 1241 C THR A 81 -18.015 -7.603 1.522 1.00 0.00 C ATOM 1242 O THR A 81 -16.882 -8.048 1.701 1.00 0.00 O ATOM 1243 CB THR A 81 -18.430 -5.460 2.855 1.00 0.00 C ATOM 1244 OG1 THR A 81 -18.987 -4.826 1.707 1.00 0.00 O ATOM 1245 CG2 THR A 81 -16.928 -5.193 2.736 1.00 0.00 C ATOM 0 H THR A 81 -17.764 -7.209 4.483 1.00 0.00 H new ATOM 0 HA THR A 81 -19.832 -7.009 2.399 1.00 0.00 H new ATOM 0 HB THR A 81 -18.782 -5.124 3.830 1.00 0.00 H new ATOM 0 HG1 THR A 81 -18.809 -3.863 1.747 1.00 0.00 H new ATOM 0 HG21 THR A 81 -16.735 -4.129 2.876 1.00 0.00 H new ATOM 0 HG22 THR A 81 -16.396 -5.762 3.499 1.00 0.00 H new ATOM 0 HG23 THR A 81 -16.581 -5.498 1.749 1.00 0.00 H new ATOM 1253 N ARG A 82 -18.666 -7.650 0.369 1.00 0.00 N ATOM 1254 CA ARG A 82 -18.063 -8.253 -0.807 1.00 0.00 C ATOM 1255 C ARG A 82 -17.592 -7.168 -1.778 1.00 0.00 C ATOM 1256 O ARG A 82 -18.406 -6.438 -2.341 1.00 0.00 O ATOM 1257 CB ARG A 82 -19.054 -9.173 -1.524 1.00 0.00 C ATOM 1258 CG ARG A 82 -18.831 -10.633 -1.128 1.00 0.00 C ATOM 1259 CD ARG A 82 -19.263 -11.578 -2.251 1.00 0.00 C ATOM 1260 NE ARG A 82 -18.280 -12.675 -2.397 1.00 0.00 N ATOM 1261 CZ ARG A 82 -18.435 -13.718 -3.224 1.00 0.00 C ATOM 1262 NH1 ARG A 82 -19.535 -13.813 -3.983 1.00 0.00 N ATOM 1263 NH2 ARG A 82 -17.491 -14.666 -3.291 1.00 0.00 N ATOM 0 H ARG A 82 -19.605 -7.280 0.224 1.00 0.00 H new ATOM 0 HA ARG A 82 -17.210 -8.844 -0.475 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -20.074 -8.877 -1.278 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -18.942 -9.064 -2.603 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -17.778 -10.794 -0.897 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -19.394 -10.858 -0.222 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -20.249 -11.989 -2.032 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -19.348 -11.028 -3.188 1.00 0.00 H new ATOM 0 HE ARG A 82 -17.431 -12.635 -1.833 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -20.254 -13.092 -3.931 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -19.653 -14.607 -4.613 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -16.654 -14.594 -2.712 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -17.609 -15.460 -3.921 1.00 0.00 H new ATOM 1277 N THR A 83 -16.279 -7.096 -1.943 1.00 0.00 N ATOM 1278 CA THR A 83 -15.690 -6.112 -2.835 1.00 0.00 C ATOM 1279 C THR A 83 -15.060 -6.801 -4.047 1.00 0.00 C ATOM 1280 O THR A 83 -14.920 -8.022 -4.068 1.00 0.00 O ATOM 1281 CB THR A 83 -14.696 -5.276 -2.027 1.00 0.00 C ATOM 1282 OG1 THR A 83 -14.404 -4.168 -2.874 1.00 0.00 O ATOM 1283 CG2 THR A 83 -13.347 -5.977 -1.852 1.00 0.00 C ATOM 0 H THR A 83 -15.607 -7.703 -1.474 1.00 0.00 H new ATOM 0 HA THR A 83 -16.448 -5.441 -3.239 1.00 0.00 H new ATOM 0 HB THR A 83 -15.120 -5.055 -1.047 1.00 0.00 H new ATOM 0 HG1 THR A 83 -13.767 -3.573 -2.426 1.00 0.00 H new ATOM 0 HG21 THR A 83 -12.679 -5.341 -1.272 1.00 0.00 H new ATOM 0 HG22 THR A 83 -13.493 -6.922 -1.329 1.00 0.00 H new ATOM 0 HG23 THR A 83 -12.907 -6.168 -2.831 1.00 0.00 H new ATOM 1291 N ASN A 84 -14.698 -5.987 -5.028 1.00 0.00 N ATOM 1292 CA ASN A 84 -14.087 -6.503 -6.241 1.00 0.00 C ATOM 1293 C ASN A 84 -12.975 -5.553 -6.690 1.00 0.00 C ATOM 1294 O ASN A 84 -12.543 -5.597 -7.841 1.00 0.00 O ATOM 1295 CB ASN A 84 -15.110 -6.603 -7.374 1.00 0.00 C ATOM 1296 CG ASN A 84 -15.324 -5.242 -8.041 1.00 0.00 C ATOM 1297 OD1 ASN A 84 -15.807 -4.297 -7.440 1.00 0.00 O ATOM 1298 ND2 ASN A 84 -14.938 -5.196 -9.313 1.00 0.00 N ATOM 0 H ASN A 84 -14.816 -4.974 -5.007 1.00 0.00 H new ATOM 0 HA ASN A 84 -13.692 -7.495 -6.024 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -14.768 -7.325 -8.115 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -16.057 -6.973 -6.982 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -15.039 -4.332 -9.846 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -14.541 -6.025 -9.756 1.00 0.00 H new ATOM 1305 N LYS A 85 -12.543 -4.716 -5.758 1.00 0.00 N ATOM 1306 CA LYS A 85 -11.490 -3.757 -6.044 1.00 0.00 C ATOM 1307 C LYS A 85 -10.149 -4.321 -5.569 1.00 0.00 C ATOM 1308 O LYS A 85 -9.949 -4.530 -4.373 1.00 0.00 O ATOM 1309 CB LYS A 85 -11.830 -2.392 -5.443 1.00 0.00 C ATOM 1310 CG LYS A 85 -13.112 -1.825 -6.058 1.00 0.00 C ATOM 1311 CD LYS A 85 -13.169 -0.304 -5.904 1.00 0.00 C ATOM 1312 CE LYS A 85 -13.719 0.087 -4.531 1.00 0.00 C ATOM 1313 NZ LYS A 85 -15.153 -0.266 -4.427 1.00 0.00 N ATOM 0 H LYS A 85 -12.903 -4.682 -4.804 1.00 0.00 H new ATOM 0 HA LYS A 85 -11.405 -3.594 -7.118 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -11.951 -2.486 -4.364 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -11.005 -1.700 -5.612 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -13.160 -2.089 -7.114 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -13.980 -2.275 -5.577 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -12.172 0.116 -6.033 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -13.798 0.121 -6.686 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -13.156 -0.422 -3.749 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -13.590 1.158 -4.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -15.596 0.299 -3.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -15.626 -0.069 -5.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -15.246 -1.277 -4.201 1.00 0.00 H new ATOM 1327 N GLY A 86 -9.266 -4.551 -6.529 1.00 0.00 N ATOM 1328 CA GLY A 86 -7.951 -5.087 -6.224 1.00 0.00 C ATOM 1329 C GLY A 86 -6.990 -3.974 -5.799 1.00 0.00 C ATOM 1330 O GLY A 86 -6.798 -3.003 -6.529 1.00 0.00 O ATOM 0 H GLY A 86 -9.436 -4.376 -7.519 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -8.032 -5.827 -5.427 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -7.553 -5.602 -7.098 1.00 0.00 H new ATOM 1334 N LEU A 87 -6.413 -4.152 -4.620 1.00 0.00 N ATOM 1335 CA LEU A 87 -5.477 -3.175 -4.089 1.00 0.00 C ATOM 1336 C LEU A 87 -4.177 -3.232 -4.894 1.00 0.00 C ATOM 1337 O LEU A 87 -3.471 -4.239 -4.869 1.00 0.00 O ATOM 1338 CB LEU A 87 -5.280 -3.383 -2.586 1.00 0.00 C ATOM 1339 CG LEU A 87 -6.076 -2.451 -1.670 1.00 0.00 C ATOM 1340 CD1 LEU A 87 -5.627 -2.599 -0.215 1.00 0.00 C ATOM 1341 CD2 LEU A 87 -5.989 -1.002 -2.153 1.00 0.00 C ATOM 0 H LEU A 87 -6.575 -4.958 -4.017 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.876 -2.166 -4.197 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -5.546 -4.412 -2.344 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -4.220 -3.265 -2.359 1.00 0.00 H new ATOM 0 HG LEU A 87 -7.126 -2.742 -1.714 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -6.208 -1.926 0.415 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -5.783 -3.627 0.111 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.569 -2.349 -0.134 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -6.563 -0.361 -1.485 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.947 -0.682 -2.157 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.395 -0.930 -3.162 1.00 0.00 H new ATOM 1353 N GLN A 88 -3.900 -2.138 -5.588 1.00 0.00 N ATOM 1354 CA GLN A 88 -2.697 -2.050 -6.398 1.00 0.00 C ATOM 1355 C GLN A 88 -1.477 -1.796 -5.511 1.00 0.00 C ATOM 1356 O GLN A 88 -1.190 -0.654 -5.155 1.00 0.00 O ATOM 1357 CB GLN A 88 -2.834 -0.963 -7.467 1.00 0.00 C ATOM 1358 CG GLN A 88 -2.265 -1.437 -8.806 1.00 0.00 C ATOM 1359 CD GLN A 88 -2.668 -0.490 -9.938 1.00 0.00 C ATOM 1360 OE1 GLN A 88 -3.523 0.367 -9.790 1.00 0.00 O ATOM 1361 NE2 GLN A 88 -2.006 -0.692 -11.074 1.00 0.00 N ATOM 0 H GLN A 88 -4.488 -1.305 -5.606 1.00 0.00 H new ATOM 0 HA GLN A 88 -2.557 -3.002 -6.910 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -3.884 -0.697 -7.588 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -2.312 -0.062 -7.144 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -1.178 -1.494 -8.744 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -2.625 -2.443 -9.023 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -1.302 -1.428 -11.130 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -2.203 -0.111 -11.889 1.00 0.00 H new ATOM 1370 N LEU A 89 -0.791 -2.880 -5.179 1.00 0.00 N ATOM 1371 CA LEU A 89 0.392 -2.789 -4.340 1.00 0.00 C ATOM 1372 C LEU A 89 1.642 -2.946 -5.209 1.00 0.00 C ATOM 1373 O LEU A 89 1.646 -3.724 -6.162 1.00 0.00 O ATOM 1374 CB LEU A 89 0.312 -3.795 -3.190 1.00 0.00 C ATOM 1375 CG LEU A 89 -1.022 -3.855 -2.443 1.00 0.00 C ATOM 1376 CD1 LEU A 89 -0.888 -4.657 -1.147 1.00 0.00 C ATOM 1377 CD2 LEU A 89 -1.574 -2.450 -2.193 1.00 0.00 C ATOM 0 H LEU A 89 -1.032 -3.826 -5.476 1.00 0.00 H new ATOM 0 HA LEU A 89 0.451 -1.807 -3.870 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.529 -4.787 -3.586 1.00 0.00 H new ATOM 0 HB3 LEU A 89 1.098 -3.559 -2.472 1.00 0.00 H new ATOM 0 HG LEU A 89 -1.743 -4.377 -3.072 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.850 -4.685 -0.635 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.571 -5.674 -1.379 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -0.147 -4.185 -0.502 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -2.523 -2.521 -1.661 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -0.863 -1.881 -1.594 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -1.730 -1.945 -3.146 1.00 0.00 H new ATOM 1389 N ARG A 90 2.672 -2.195 -4.849 1.00 0.00 N ATOM 1390 CA ARG A 90 3.925 -2.241 -5.584 1.00 0.00 C ATOM 1391 C ARG A 90 5.083 -2.566 -4.639 1.00 0.00 C ATOM 1392 O ARG A 90 5.379 -1.796 -3.726 1.00 0.00 O ATOM 1393 CB ARG A 90 4.203 -0.908 -6.282 1.00 0.00 C ATOM 1394 CG ARG A 90 5.656 -0.830 -6.754 1.00 0.00 C ATOM 1395 CD ARG A 90 5.754 -0.140 -8.116 1.00 0.00 C ATOM 1396 NE ARG A 90 5.746 1.329 -7.941 1.00 0.00 N ATOM 1397 CZ ARG A 90 5.578 2.204 -8.942 1.00 0.00 C ATOM 1398 NH1 ARG A 90 5.403 1.763 -10.195 1.00 0.00 N ATOM 1399 NH2 ARG A 90 5.586 3.520 -8.690 1.00 0.00 N ATOM 0 H ARG A 90 2.665 -1.551 -4.058 1.00 0.00 H new ATOM 0 HA ARG A 90 3.838 -3.022 -6.339 1.00 0.00 H new ATOM 0 HB2 ARG A 90 3.533 -0.793 -7.134 1.00 0.00 H new ATOM 0 HB3 ARG A 90 3.994 -0.085 -5.599 1.00 0.00 H new ATOM 0 HG2 ARG A 90 6.251 -0.284 -6.022 1.00 0.00 H new ATOM 0 HG3 ARG A 90 6.075 -1.834 -6.820 1.00 0.00 H new ATOM 0 HD2 ARG A 90 6.667 -0.449 -8.624 1.00 0.00 H new ATOM 0 HD3 ARG A 90 4.919 -0.444 -8.748 1.00 0.00 H new ATOM 0 HE ARG A 90 5.877 1.699 -6.999 1.00 0.00 H new ATOM 0 HH11 ARG A 90 5.398 0.761 -10.387 1.00 0.00 H new ATOM 0 HH12 ARG A 90 5.275 2.429 -10.957 1.00 0.00 H new ATOM 0 HH21 ARG A 90 5.720 3.856 -7.736 1.00 0.00 H new ATOM 0 HH22 ARG A 90 5.458 4.186 -9.452 1.00 0.00 H new ATOM 1413 N HIS A 91 5.707 -3.708 -4.890 1.00 0.00 N ATOM 1414 CA HIS A 91 6.826 -4.144 -4.072 1.00 0.00 C ATOM 1415 C HIS A 91 8.139 -3.858 -4.805 1.00 0.00 C ATOM 1416 O HIS A 91 8.619 -4.690 -5.573 1.00 0.00 O ATOM 1417 CB HIS A 91 6.673 -5.615 -3.682 1.00 0.00 C ATOM 1418 CG HIS A 91 7.764 -6.126 -2.771 1.00 0.00 C ATOM 1419 ND1 HIS A 91 7.762 -5.910 -1.404 1.00 0.00 N ATOM 1420 CD2 HIS A 91 8.891 -6.844 -3.046 1.00 0.00 C ATOM 1421 CE1 HIS A 91 8.843 -6.477 -0.890 1.00 0.00 C ATOM 1422 NE2 HIS A 91 9.542 -7.055 -1.908 1.00 0.00 N ATOM 0 H HIS A 91 5.459 -4.344 -5.648 1.00 0.00 H new ATOM 0 HA HIS A 91 6.841 -3.581 -3.139 1.00 0.00 H new ATOM 0 HB2 HIS A 91 5.710 -5.752 -3.190 1.00 0.00 H new ATOM 0 HB3 HIS A 91 6.657 -6.221 -4.588 1.00 0.00 H new ATOM 0 HD1 HIS A 91 7.049 -5.401 -0.881 1.00 0.00 H new ATOM 0 HD2 HIS A 91 9.201 -7.183 -4.023 1.00 0.00 H new ATOM 0 HE1 HIS A 91 9.122 -6.481 0.153 1.00 0.00 H new ATOM 1430 N GLY A 92 8.682 -2.679 -4.541 1.00 0.00 N ATOM 1431 CA GLY A 92 9.929 -2.273 -5.166 1.00 0.00 C ATOM 1432 C GLY A 92 9.710 -1.891 -6.631 1.00 0.00 C ATOM 1433 O GLY A 92 8.820 -1.101 -6.944 1.00 0.00 O ATOM 0 H GLY A 92 8.281 -1.992 -3.903 1.00 0.00 H new ATOM 0 HA2 GLY A 92 10.352 -1.426 -4.625 1.00 0.00 H new ATOM 0 HA3 GLY A 92 10.653 -3.085 -5.103 1.00 0.00 H new ATOM 1437 N ASN A 93 10.537 -2.468 -7.490 1.00 0.00 N ATOM 1438 CA ASN A 93 10.444 -2.198 -8.915 1.00 0.00 C ATOM 1439 C ASN A 93 9.455 -3.176 -9.552 1.00 0.00 C ATOM 1440 O ASN A 93 9.379 -3.279 -10.775 1.00 0.00 O ATOM 1441 CB ASN A 93 11.800 -2.384 -9.600 1.00 0.00 C ATOM 1442 CG ASN A 93 12.117 -1.200 -10.516 1.00 0.00 C ATOM 1443 OD1 ASN A 93 13.193 -0.507 -10.152 1.00 0.00 O flip ATOM 1444 ND2 ASN A 93 11.432 -0.934 -11.489 1.00 0.00 N flip ATOM 0 H ASN A 93 11.275 -3.121 -7.227 1.00 0.00 H new ATOM 0 HA ASN A 93 10.113 -1.167 -9.042 1.00 0.00 H new ATOM 0 HB2 ASN A 93 12.581 -2.485 -8.847 1.00 0.00 H new ATOM 0 HB3 ASN A 93 11.795 -3.307 -10.180 1.00 0.00 H new ATOM 0 HD21 ASN A 93 10.619 -1.508 -11.712 1.00 0.00 H new ATOM 0 HD22 ASN A 93 11.672 -0.138 -12.080 1.00 0.00 H new ATOM 1451 N ASP A 94 8.722 -3.870 -8.693 1.00 0.00 N ATOM 1452 CA ASP A 94 7.740 -4.836 -9.157 1.00 0.00 C ATOM 1453 C ASP A 94 6.358 -4.444 -8.632 1.00 0.00 C ATOM 1454 O ASP A 94 6.216 -4.062 -7.472 1.00 0.00 O ATOM 1455 CB ASP A 94 8.062 -6.239 -8.640 1.00 0.00 C ATOM 1456 CG ASP A 94 8.709 -7.173 -9.664 1.00 0.00 C ATOM 1457 OD1 ASP A 94 8.005 -7.526 -10.635 1.00 0.00 O ATOM 1458 OD2 ASP A 94 9.893 -7.514 -9.453 1.00 0.00 O ATOM 0 H ASP A 94 8.788 -3.783 -7.679 1.00 0.00 H new ATOM 0 HA ASP A 94 7.759 -4.840 -10.247 1.00 0.00 H new ATOM 0 HB2 ASP A 94 8.727 -6.150 -7.781 1.00 0.00 H new ATOM 0 HB3 ASP A 94 7.140 -6.699 -8.283 1.00 0.00 H new ATOM 1463 N GLN A 95 5.374 -4.551 -9.513 1.00 0.00 N ATOM 1464 CA GLN A 95 4.007 -4.213 -9.153 1.00 0.00 C ATOM 1465 C GLN A 95 3.210 -5.481 -8.842 1.00 0.00 C ATOM 1466 O GLN A 95 3.545 -6.562 -9.324 1.00 0.00 O ATOM 1467 CB GLN A 95 3.334 -3.400 -10.261 1.00 0.00 C ATOM 1468 CG GLN A 95 2.799 -4.315 -11.364 1.00 0.00 C ATOM 1469 CD GLN A 95 3.044 -3.708 -12.747 1.00 0.00 C ATOM 1470 OE1 GLN A 95 4.156 -3.363 -13.113 1.00 0.00 O ATOM 1471 NE2 GLN A 95 1.948 -3.597 -13.491 1.00 0.00 N ATOM 0 H GLN A 95 5.496 -4.867 -10.475 1.00 0.00 H new ATOM 0 HA GLN A 95 4.031 -3.594 -8.256 1.00 0.00 H new ATOM 0 HB2 GLN A 95 2.516 -2.814 -9.841 1.00 0.00 H new ATOM 0 HB3 GLN A 95 4.048 -2.694 -10.684 1.00 0.00 H new ATOM 0 HG2 GLN A 95 3.283 -5.289 -11.300 1.00 0.00 H new ATOM 0 HG3 GLN A 95 1.731 -4.479 -11.219 1.00 0.00 H new ATOM 0 HE21 GLN A 95 1.048 -3.906 -13.123 1.00 0.00 H new ATOM 0 HE22 GLN A 95 2.007 -3.203 -14.430 1.00 0.00 H new ATOM 1480 N ARG A 96 2.171 -5.307 -8.038 1.00 0.00 N ATOM 1481 CA ARG A 96 1.324 -6.424 -7.657 1.00 0.00 C ATOM 1482 C ARG A 96 -0.112 -5.948 -7.430 1.00 0.00 C ATOM 1483 O ARG A 96 -0.408 -4.764 -7.580 1.00 0.00 O ATOM 1484 CB ARG A 96 1.839 -7.096 -6.383 1.00 0.00 C ATOM 1485 CG ARG A 96 2.837 -8.208 -6.715 1.00 0.00 C ATOM 1486 CD ARG A 96 3.726 -8.523 -5.510 1.00 0.00 C ATOM 1487 NE ARG A 96 5.053 -8.992 -5.970 1.00 0.00 N ATOM 1488 CZ ARG A 96 5.988 -9.510 -5.161 1.00 0.00 C ATOM 1489 NH1 ARG A 96 5.748 -9.628 -3.848 1.00 0.00 N ATOM 1490 NH2 ARG A 96 7.164 -9.909 -5.666 1.00 0.00 N ATOM 0 H ARG A 96 1.897 -4.409 -7.640 1.00 0.00 H new ATOM 0 HA ARG A 96 1.345 -7.149 -8.471 1.00 0.00 H new ATOM 0 HB2 ARG A 96 2.316 -6.354 -5.743 1.00 0.00 H new ATOM 0 HB3 ARG A 96 1.001 -7.510 -5.822 1.00 0.00 H new ATOM 0 HG2 ARG A 96 2.299 -9.106 -7.019 1.00 0.00 H new ATOM 0 HG3 ARG A 96 3.456 -7.906 -7.560 1.00 0.00 H new ATOM 0 HD2 ARG A 96 3.840 -7.634 -4.889 1.00 0.00 H new ATOM 0 HD3 ARG A 96 3.256 -9.286 -4.890 1.00 0.00 H new ATOM 0 HE ARG A 96 5.269 -8.916 -6.964 1.00 0.00 H new ATOM 0 HH11 ARG A 96 4.854 -9.324 -3.464 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.460 -10.022 -3.233 1.00 0.00 H new ATOM 0 HH21 ARG A 96 7.347 -9.818 -6.665 1.00 0.00 H new ATOM 0 HH22 ARG A 96 7.876 -10.303 -5.051 1.00 0.00 H new ATOM 1504 N VAL A 97 -0.966 -6.896 -7.071 1.00 0.00 N ATOM 1505 CA VAL A 97 -2.364 -6.588 -6.821 1.00 0.00 C ATOM 1506 C VAL A 97 -2.960 -7.656 -5.903 1.00 0.00 C ATOM 1507 O VAL A 97 -3.229 -8.775 -6.338 1.00 0.00 O ATOM 1508 CB VAL A 97 -3.115 -6.452 -8.147 1.00 0.00 C ATOM 1509 CG1 VAL A 97 -4.620 -6.309 -7.913 1.00 0.00 C ATOM 1510 CG2 VAL A 97 -2.573 -5.280 -8.967 1.00 0.00 C ATOM 0 H VAL A 97 -0.717 -7.877 -6.947 1.00 0.00 H new ATOM 0 HA VAL A 97 -2.459 -5.630 -6.310 1.00 0.00 H new ATOM 0 HB VAL A 97 -2.951 -7.365 -8.720 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -5.130 -6.214 -8.872 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -4.992 -7.190 -7.390 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -4.812 -5.421 -7.311 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -3.124 -5.206 -9.904 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -2.692 -4.355 -8.402 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -1.516 -5.442 -9.179 1.00 0.00 H new ATOM 1520 N PHE A 98 -3.150 -7.273 -4.648 1.00 0.00 N ATOM 1521 CA PHE A 98 -3.710 -8.184 -3.665 1.00 0.00 C ATOM 1522 C PHE A 98 -5.144 -7.789 -3.305 1.00 0.00 C ATOM 1523 O PHE A 98 -5.634 -6.750 -3.745 1.00 0.00 O ATOM 1524 CB PHE A 98 -2.836 -8.083 -2.413 1.00 0.00 C ATOM 1525 CG PHE A 98 -1.392 -8.542 -2.624 1.00 0.00 C ATOM 1526 CD1 PHE A 98 -0.496 -7.714 -3.225 1.00 0.00 C ATOM 1527 CD2 PHE A 98 -1.004 -9.778 -2.210 1.00 0.00 C ATOM 1528 CE1 PHE A 98 0.844 -8.140 -3.420 1.00 0.00 C ATOM 1529 CE2 PHE A 98 0.336 -10.204 -2.405 1.00 0.00 C ATOM 1530 CZ PHE A 98 1.232 -9.376 -3.007 1.00 0.00 C ATOM 0 H PHE A 98 -2.926 -6.344 -4.290 1.00 0.00 H new ATOM 0 HA PHE A 98 -3.731 -9.197 -4.066 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -2.831 -7.049 -2.068 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -3.285 -8.681 -1.620 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -0.804 -6.732 -3.554 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -1.716 -10.436 -1.733 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.556 -7.482 -3.897 1.00 0.00 H new ATOM 0 HE2 PHE A 98 0.644 -11.185 -2.076 1.00 0.00 H new ATOM 0 HZ PHE A 98 2.251 -9.700 -3.157 1.00 0.00 H new ATOM 1540 N ARG A 99 -5.776 -8.638 -2.508 1.00 0.00 N ATOM 1541 CA ARG A 99 -7.143 -8.391 -2.084 1.00 0.00 C ATOM 1542 C ARG A 99 -7.162 -7.792 -0.676 1.00 0.00 C ATOM 1543 O ARG A 99 -6.235 -8.004 0.105 1.00 0.00 O ATOM 1544 CB ARG A 99 -7.965 -9.681 -2.093 1.00 0.00 C ATOM 1545 CG ARG A 99 -8.179 -10.184 -3.522 1.00 0.00 C ATOM 1546 CD ARG A 99 -7.979 -11.699 -3.606 1.00 0.00 C ATOM 1547 NE ARG A 99 -9.175 -12.397 -3.084 1.00 0.00 N ATOM 1548 CZ ARG A 99 -9.422 -13.702 -3.265 1.00 0.00 C ATOM 1549 NH1 ARG A 99 -8.557 -14.458 -3.954 1.00 0.00 N ATOM 1550 NH2 ARG A 99 -10.533 -14.251 -2.756 1.00 0.00 N ATOM 0 H ARG A 99 -5.366 -9.498 -2.145 1.00 0.00 H new ATOM 0 HA ARG A 99 -7.586 -7.687 -2.788 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -7.455 -10.446 -1.507 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -8.930 -9.505 -1.617 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -9.185 -9.927 -3.855 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -7.483 -9.684 -4.195 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -7.798 -11.993 -4.640 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -7.099 -11.990 -3.033 1.00 0.00 H new ATOM 0 HE ARG A 99 -9.854 -11.851 -2.553 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -7.711 -14.041 -4.341 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -8.745 -15.451 -4.092 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -11.191 -13.676 -2.230 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -10.720 -15.244 -2.894 1.00 0.00 H new ATOM 1564 N LEU A 100 -8.228 -7.057 -0.394 1.00 0.00 N ATOM 1565 CA LEU A 100 -8.379 -6.426 0.906 1.00 0.00 C ATOM 1566 C LEU A 100 -8.369 -7.502 1.994 1.00 0.00 C ATOM 1567 O LEU A 100 -8.115 -7.207 3.161 1.00 0.00 O ATOM 1568 CB LEU A 100 -9.626 -5.540 0.929 1.00 0.00 C ATOM 1569 CG LEU A 100 -9.425 -4.088 0.489 1.00 0.00 C ATOM 1570 CD1 LEU A 100 -9.466 -3.967 -1.036 1.00 0.00 C ATOM 1571 CD2 LEU A 100 -10.441 -3.165 1.165 1.00 0.00 C ATOM 0 H LEU A 100 -8.995 -6.885 -1.044 1.00 0.00 H new ATOM 0 HA LEU A 100 -7.539 -5.761 1.107 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -10.381 -5.993 0.286 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -10.029 -5.540 1.942 1.00 0.00 H new ATOM 0 HG LEU A 100 -8.434 -3.767 0.811 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.321 -2.925 -1.322 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -8.674 -4.577 -1.471 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -10.433 -4.313 -1.403 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -10.276 -2.139 0.835 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -11.450 -3.475 0.895 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -10.321 -3.222 2.247 1.00 0.00 H new ATOM 1583 N GLU A 101 -8.649 -8.727 1.573 1.00 0.00 N ATOM 1584 CA GLU A 101 -8.676 -9.848 2.497 1.00 0.00 C ATOM 1585 C GLU A 101 -7.252 -10.243 2.893 1.00 0.00 C ATOM 1586 O GLU A 101 -7.037 -10.819 3.958 1.00 0.00 O ATOM 1587 CB GLU A 101 -9.427 -11.037 1.895 1.00 0.00 C ATOM 1588 CG GLU A 101 -8.501 -11.885 1.022 1.00 0.00 C ATOM 1589 CD GLU A 101 -9.226 -13.127 0.498 1.00 0.00 C ATOM 1590 OE1 GLU A 101 -9.436 -14.049 1.316 1.00 0.00 O ATOM 1591 OE2 GLU A 101 -9.555 -13.126 -0.708 1.00 0.00 O ATOM 0 H GLU A 101 -8.859 -8.968 0.604 1.00 0.00 H new ATOM 0 HA GLU A 101 -9.211 -9.540 3.396 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -9.843 -11.651 2.694 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -10.266 -10.678 1.299 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -8.140 -11.290 0.183 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -7.627 -12.186 1.599 1.00 0.00 H new ATOM 1598 N PHE A 102 -6.315 -9.916 2.015 1.00 0.00 N ATOM 1599 CA PHE A 102 -4.918 -10.230 2.259 1.00 0.00 C ATOM 1600 C PHE A 102 -4.224 -9.092 3.010 1.00 0.00 C ATOM 1601 O PHE A 102 -3.135 -9.274 3.553 1.00 0.00 O ATOM 1602 CB PHE A 102 -4.252 -10.404 0.893 1.00 0.00 C ATOM 1603 CG PHE A 102 -4.806 -11.573 0.075 1.00 0.00 C ATOM 1604 CD1 PHE A 102 -5.509 -12.561 0.692 1.00 0.00 C ATOM 1605 CD2 PHE A 102 -4.595 -11.624 -1.267 1.00 0.00 C ATOM 1606 CE1 PHE A 102 -6.022 -13.646 -0.067 1.00 0.00 C ATOM 1607 CE2 PHE A 102 -5.109 -12.709 -2.026 1.00 0.00 C ATOM 1608 CZ PHE A 102 -5.812 -13.697 -1.410 1.00 0.00 C ATOM 0 H PHE A 102 -6.496 -9.436 1.133 1.00 0.00 H new ATOM 0 HA PHE A 102 -4.840 -11.132 2.866 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -4.373 -9.484 0.321 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -3.182 -10.550 1.038 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -5.677 -12.520 1.758 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -4.037 -10.840 -1.756 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -6.579 -14.431 0.422 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -4.942 -12.749 -3.092 1.00 0.00 H new ATOM 0 HZ PHE A 102 -6.203 -14.522 -1.987 1.00 0.00 H new ATOM 1618 N VAL A 103 -4.882 -7.942 3.017 1.00 0.00 N ATOM 1619 CA VAL A 103 -4.342 -6.774 3.692 1.00 0.00 C ATOM 1620 C VAL A 103 -4.345 -7.017 5.203 1.00 0.00 C ATOM 1621 O VAL A 103 -5.403 -7.200 5.803 1.00 0.00 O ATOM 1622 CB VAL A 103 -5.127 -5.525 3.286 1.00 0.00 C ATOM 1623 CG1 VAL A 103 -4.699 -4.314 4.116 1.00 0.00 C ATOM 1624 CG2 VAL A 103 -4.975 -5.245 1.789 1.00 0.00 C ATOM 0 H VAL A 103 -5.785 -7.794 2.566 1.00 0.00 H new ATOM 0 HA VAL A 103 -3.308 -6.603 3.392 1.00 0.00 H new ATOM 0 HB VAL A 103 -6.182 -5.712 3.487 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.272 -3.440 3.807 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -4.882 -4.513 5.172 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -3.637 -4.124 3.962 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -5.543 -4.352 1.526 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -3.922 -5.088 1.553 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.352 -6.095 1.220 1.00 0.00 H new ATOM 1634 N SER A 104 -3.150 -7.010 5.773 1.00 0.00 N ATOM 1635 CA SER A 104 -3.001 -7.227 7.202 1.00 0.00 C ATOM 1636 C SER A 104 -3.398 -5.963 7.968 1.00 0.00 C ATOM 1637 O SER A 104 -3.695 -4.934 7.362 1.00 0.00 O ATOM 1638 CB SER A 104 -1.568 -7.632 7.552 1.00 0.00 C ATOM 1639 OG SER A 104 -1.519 -8.871 8.255 1.00 0.00 O ATOM 0 H SER A 104 -2.275 -6.857 5.271 1.00 0.00 H new ATOM 0 HA SER A 104 -3.662 -8.043 7.494 1.00 0.00 H new ATOM 0 HB2 SER A 104 -0.980 -7.711 6.638 1.00 0.00 H new ATOM 0 HB3 SER A 104 -1.109 -6.852 8.160 1.00 0.00 H new ATOM 0 HG SER A 104 -0.594 -9.194 8.284 1.00 0.00 H new ATOM 1645 N ASN A 105 -3.389 -6.081 9.287 1.00 0.00 N ATOM 1646 CA ASN A 105 -3.744 -4.961 10.142 1.00 0.00 C ATOM 1647 C ASN A 105 -2.533 -4.569 10.990 1.00 0.00 C ATOM 1648 O ASN A 105 -2.294 -3.386 11.228 1.00 0.00 O ATOM 1649 CB ASN A 105 -4.886 -5.331 11.090 1.00 0.00 C ATOM 1650 CG ASN A 105 -5.352 -4.113 11.889 1.00 0.00 C ATOM 1651 OD1 ASN A 105 -5.551 -3.031 11.361 1.00 0.00 O ATOM 1652 ND2 ASN A 105 -5.516 -4.348 13.188 1.00 0.00 N ATOM 0 H ASN A 105 -3.141 -6.936 9.785 1.00 0.00 H new ATOM 0 HA ASN A 105 -4.060 -4.136 9.503 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -5.721 -5.736 10.518 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -4.557 -6.114 11.773 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -5.826 -3.599 13.807 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -5.332 -5.278 13.565 1.00 0.00 H new ATOM 1659 N GLN A 106 -1.801 -5.584 11.425 1.00 0.00 N ATOM 1660 CA GLN A 106 -0.621 -5.360 12.242 1.00 0.00 C ATOM 1661 C GLN A 106 0.143 -4.130 11.746 1.00 0.00 C ATOM 1662 O GLN A 106 -0.019 -3.716 10.599 1.00 0.00 O ATOM 1663 CB GLN A 106 0.280 -6.597 12.254 1.00 0.00 C ATOM 1664 CG GLN A 106 -0.240 -7.644 13.241 1.00 0.00 C ATOM 1665 CD GLN A 106 -0.518 -8.972 12.535 1.00 0.00 C ATOM 1666 OE1 GLN A 106 -1.502 -9.137 11.833 1.00 0.00 O ATOM 1667 NE2 GLN A 106 0.401 -9.907 12.760 1.00 0.00 N ATOM 0 H GLN A 106 -2.003 -6.564 11.227 1.00 0.00 H new ATOM 0 HA GLN A 106 -0.942 -5.175 13.267 1.00 0.00 H new ATOM 0 HB2 GLN A 106 0.327 -7.027 11.253 1.00 0.00 H new ATOM 0 HB3 GLN A 106 1.296 -6.309 12.525 1.00 0.00 H new ATOM 0 HG2 GLN A 106 0.492 -7.796 14.034 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -1.153 -7.281 13.714 1.00 0.00 H new ATOM 0 HE21 GLN A 106 1.201 -9.702 13.359 1.00 0.00 H new ATOM 0 HE22 GLN A 106 0.306 -10.829 12.334 1.00 0.00 H new ATOM 1676 N GLU A 107 0.958 -3.582 12.634 1.00 0.00 N ATOM 1677 CA GLU A 107 1.747 -2.408 12.301 1.00 0.00 C ATOM 1678 C GLU A 107 3.118 -2.825 11.763 1.00 0.00 C ATOM 1679 O GLU A 107 3.540 -3.965 11.947 1.00 0.00 O ATOM 1680 CB GLU A 107 1.891 -1.483 13.511 1.00 0.00 C ATOM 1681 CG GLU A 107 2.937 -2.020 14.491 1.00 0.00 C ATOM 1682 CD GLU A 107 3.044 -1.123 15.726 1.00 0.00 C ATOM 1683 OE1 GLU A 107 2.288 -1.386 16.685 1.00 0.00 O ATOM 1684 OE2 GLU A 107 3.879 -0.194 15.682 1.00 0.00 O ATOM 0 H GLU A 107 1.090 -3.929 13.584 1.00 0.00 H new ATOM 0 HA GLU A 107 1.226 -1.853 11.521 1.00 0.00 H new ATOM 0 HB2 GLU A 107 2.178 -0.485 13.178 1.00 0.00 H new ATOM 0 HB3 GLU A 107 0.930 -1.387 14.016 1.00 0.00 H new ATOM 0 HG2 GLU A 107 2.670 -3.032 14.795 1.00 0.00 H new ATOM 0 HG3 GLU A 107 3.906 -2.081 13.996 1.00 0.00 H new ATOM 1691 N PHE A 108 3.774 -1.878 11.109 1.00 0.00 N ATOM 1692 CA PHE A 108 5.088 -2.132 10.543 1.00 0.00 C ATOM 1693 C PHE A 108 6.157 -2.175 11.636 1.00 0.00 C ATOM 1694 O PHE A 108 6.021 -1.519 12.668 1.00 0.00 O ATOM 1695 CB PHE A 108 5.396 -0.976 9.590 1.00 0.00 C ATOM 1696 CG PHE A 108 4.507 -0.942 8.345 1.00 0.00 C ATOM 1697 CD1 PHE A 108 4.103 -2.105 7.766 1.00 0.00 C ATOM 1698 CD2 PHE A 108 4.121 0.250 7.816 1.00 0.00 C ATOM 1699 CE1 PHE A 108 3.279 -2.074 6.610 1.00 0.00 C ATOM 1700 CE2 PHE A 108 3.297 0.281 6.661 1.00 0.00 C ATOM 1701 CZ PHE A 108 2.893 -0.881 6.082 1.00 0.00 C ATOM 0 H PHE A 108 3.420 -0.933 10.958 1.00 0.00 H new ATOM 0 HA PHE A 108 5.092 -3.094 10.030 1.00 0.00 H new ATOM 0 HB2 PHE A 108 5.285 -0.035 10.129 1.00 0.00 H new ATOM 0 HB3 PHE A 108 6.438 -1.044 9.278 1.00 0.00 H new ATOM 0 HD1 PHE A 108 4.409 -3.052 8.186 1.00 0.00 H new ATOM 0 HD2 PHE A 108 4.442 1.173 8.275 1.00 0.00 H new ATOM 0 HE1 PHE A 108 2.959 -2.997 6.150 1.00 0.00 H new ATOM 0 HE2 PHE A 108 2.991 1.228 6.242 1.00 0.00 H new ATOM 0 HZ PHE A 108 2.266 -0.857 5.203 1.00 0.00 H new ATOM 1711 N THR A 109 7.197 -2.952 11.373 1.00 0.00 N ATOM 1712 CA THR A 109 8.289 -3.089 12.322 1.00 0.00 C ATOM 1713 C THR A 109 9.612 -2.677 11.674 1.00 0.00 C ATOM 1714 O THR A 109 9.724 -2.639 10.450 1.00 0.00 O ATOM 1715 CB THR A 109 8.288 -4.529 12.839 1.00 0.00 C ATOM 1716 OG1 THR A 109 9.187 -4.501 13.945 1.00 0.00 O ATOM 1717 CG2 THR A 109 8.937 -5.505 11.856 1.00 0.00 C ATOM 0 H THR A 109 7.307 -3.494 10.516 1.00 0.00 H new ATOM 0 HA THR A 109 8.159 -2.422 13.175 1.00 0.00 H new ATOM 0 HB THR A 109 7.263 -4.842 13.038 1.00 0.00 H new ATOM 0 HG1 THR A 109 9.245 -5.395 14.342 1.00 0.00 H new ATOM 0 HG21 THR A 109 8.910 -6.512 12.272 1.00 0.00 H new ATOM 0 HG22 THR A 109 8.392 -5.487 10.912 1.00 0.00 H new ATOM 0 HG23 THR A 109 9.972 -5.212 11.682 1.00 0.00 H new ATOM 1725 N GLU A 110 10.583 -2.377 12.526 1.00 0.00 N ATOM 1726 CA GLU A 110 11.894 -1.969 12.052 1.00 0.00 C ATOM 1727 C GLU A 110 12.476 -3.033 11.119 1.00 0.00 C ATOM 1728 O GLU A 110 13.201 -2.710 10.179 1.00 0.00 O ATOM 1729 CB GLU A 110 12.838 -1.691 13.223 1.00 0.00 C ATOM 1730 CG GLU A 110 14.280 -1.527 12.739 1.00 0.00 C ATOM 1731 CD GLU A 110 15.183 -1.023 13.866 1.00 0.00 C ATOM 1732 OE1 GLU A 110 15.222 0.212 14.052 1.00 0.00 O ATOM 1733 OE2 GLU A 110 15.814 -1.884 14.516 1.00 0.00 O ATOM 0 H GLU A 110 10.487 -2.409 13.541 1.00 0.00 H new ATOM 0 HA GLU A 110 11.783 -1.042 11.489 1.00 0.00 H new ATOM 0 HB2 GLU A 110 12.521 -0.788 13.744 1.00 0.00 H new ATOM 0 HB3 GLU A 110 12.783 -2.509 13.941 1.00 0.00 H new ATOM 0 HG2 GLU A 110 14.654 -2.482 12.368 1.00 0.00 H new ATOM 0 HG3 GLU A 110 14.310 -0.827 11.904 1.00 0.00 H new ATOM 1740 N SER A 111 12.138 -4.280 11.412 1.00 0.00 N ATOM 1741 CA SER A 111 12.618 -5.394 10.611 1.00 0.00 C ATOM 1742 C SER A 111 12.069 -5.289 9.187 1.00 0.00 C ATOM 1743 O SER A 111 12.793 -4.916 8.265 1.00 0.00 O ATOM 1744 CB SER A 111 12.221 -6.733 11.236 1.00 0.00 C ATOM 1745 OG SER A 111 13.359 -7.502 11.616 1.00 0.00 O ATOM 0 H SER A 111 11.537 -4.544 12.193 1.00 0.00 H new ATOM 0 HA SER A 111 13.707 -5.348 10.578 1.00 0.00 H new ATOM 0 HB2 SER A 111 11.596 -6.554 12.111 1.00 0.00 H new ATOM 0 HB3 SER A 111 11.620 -7.301 10.526 1.00 0.00 H new ATOM 0 HG SER A 111 13.064 -8.348 12.012 1.00 0.00 H new ATOM 1751 N GLU A 112 10.795 -5.624 9.052 1.00 0.00 N ATOM 1752 CA GLU A 112 10.140 -5.573 7.755 1.00 0.00 C ATOM 1753 C GLU A 112 10.435 -4.239 7.065 1.00 0.00 C ATOM 1754 O GLU A 112 10.671 -4.200 5.859 1.00 0.00 O ATOM 1755 CB GLU A 112 8.633 -5.798 7.893 1.00 0.00 C ATOM 1756 CG GLU A 112 7.994 -4.717 8.767 1.00 0.00 C ATOM 1757 CD GLU A 112 7.372 -3.614 7.909 1.00 0.00 C ATOM 1758 OE1 GLU A 112 6.271 -3.865 7.373 1.00 0.00 O ATOM 1759 OE2 GLU A 112 8.012 -2.545 7.808 1.00 0.00 O ATOM 0 H GLU A 112 10.198 -5.932 9.819 1.00 0.00 H new ATOM 0 HA GLU A 112 10.538 -6.377 7.136 1.00 0.00 H new ATOM 0 HB2 GLU A 112 8.169 -5.794 6.906 1.00 0.00 H new ATOM 0 HB3 GLU A 112 8.447 -6.780 8.329 1.00 0.00 H new ATOM 0 HG2 GLU A 112 7.229 -5.163 9.402 1.00 0.00 H new ATOM 0 HG3 GLU A 112 8.746 -4.287 9.428 1.00 0.00 H new ATOM 1766 N PHE A 113 10.410 -3.180 7.860 1.00 0.00 N ATOM 1767 CA PHE A 113 10.672 -1.848 7.341 1.00 0.00 C ATOM 1768 C PHE A 113 12.025 -1.793 6.629 1.00 0.00 C ATOM 1769 O PHE A 113 12.135 -1.232 5.540 1.00 0.00 O ATOM 1770 CB PHE A 113 10.700 -0.898 8.540 1.00 0.00 C ATOM 1771 CG PHE A 113 10.977 0.561 8.171 1.00 0.00 C ATOM 1772 CD1 PHE A 113 10.254 1.163 7.189 1.00 0.00 C ATOM 1773 CD2 PHE A 113 11.947 1.255 8.825 1.00 0.00 C ATOM 1774 CE1 PHE A 113 10.511 2.517 6.847 1.00 0.00 C ATOM 1775 CE2 PHE A 113 12.204 2.609 8.482 1.00 0.00 C ATOM 1776 CZ PHE A 113 11.481 3.212 7.501 1.00 0.00 C ATOM 0 H PHE A 113 10.212 -3.217 8.860 1.00 0.00 H new ATOM 0 HA PHE A 113 9.902 -1.571 6.621 1.00 0.00 H new ATOM 0 HB2 PHE A 113 9.743 -0.956 9.059 1.00 0.00 H new ATOM 0 HB3 PHE A 113 11.463 -1.236 9.241 1.00 0.00 H new ATOM 0 HD1 PHE A 113 9.485 0.611 6.669 1.00 0.00 H new ATOM 0 HD2 PHE A 113 12.521 0.777 9.605 1.00 0.00 H new ATOM 0 HE1 PHE A 113 9.936 2.995 6.068 1.00 0.00 H new ATOM 0 HE2 PHE A 113 12.974 3.160 9.001 1.00 0.00 H new ATOM 0 HZ PHE A 113 11.676 4.242 7.241 1.00 0.00 H new ATOM 1786 N MET A 114 13.021 -2.382 7.274 1.00 0.00 N ATOM 1787 CA MET A 114 14.363 -2.407 6.717 1.00 0.00 C ATOM 1788 C MET A 114 14.473 -3.448 5.601 1.00 0.00 C ATOM 1789 O MET A 114 15.203 -3.249 4.631 1.00 0.00 O ATOM 1790 CB MET A 114 15.369 -2.735 7.822 1.00 0.00 C ATOM 1791 CG MET A 114 15.507 -1.567 8.800 1.00 0.00 C ATOM 1792 SD MET A 114 16.502 -0.275 8.073 1.00 0.00 S ATOM 1793 CE MET A 114 16.030 1.100 9.109 1.00 0.00 C ATOM 0 H MET A 114 12.926 -2.846 8.177 1.00 0.00 H new ATOM 0 HA MET A 114 14.580 -1.425 6.296 1.00 0.00 H new ATOM 0 HB2 MET A 114 15.047 -3.628 8.359 1.00 0.00 H new ATOM 0 HB3 MET A 114 16.339 -2.961 7.380 1.00 0.00 H new ATOM 0 HG2 MET A 114 14.521 -1.178 9.056 1.00 0.00 H new ATOM 0 HG3 MET A 114 15.964 -1.911 9.728 1.00 0.00 H new ATOM 0 HE1 MET A 114 16.563 1.996 8.790 1.00 0.00 H new ATOM 0 HE2 MET A 114 14.956 1.267 9.024 1.00 0.00 H new ATOM 0 HE3 MET A 114 16.282 0.878 10.146 1.00 0.00 H new ATOM 1803 N LYS A 115 13.739 -4.537 5.776 1.00 0.00 N ATOM 1804 CA LYS A 115 13.745 -5.610 4.795 1.00 0.00 C ATOM 1805 C LYS A 115 13.140 -5.101 3.485 1.00 0.00 C ATOM 1806 O LYS A 115 13.688 -5.339 2.410 1.00 0.00 O ATOM 1807 CB LYS A 115 13.047 -6.851 5.355 1.00 0.00 C ATOM 1808 CG LYS A 115 13.959 -7.602 6.327 1.00 0.00 C ATOM 1809 CD LYS A 115 15.008 -8.420 5.572 1.00 0.00 C ATOM 1810 CE LYS A 115 14.464 -9.801 5.201 1.00 0.00 C ATOM 1811 NZ LYS A 115 15.109 -10.298 3.965 1.00 0.00 N ATOM 0 H LYS A 115 13.136 -4.700 6.582 1.00 0.00 H new ATOM 0 HA LYS A 115 14.767 -5.920 4.575 1.00 0.00 H new ATOM 0 HB2 LYS A 115 12.129 -6.557 5.865 1.00 0.00 H new ATOM 0 HB3 LYS A 115 12.760 -7.511 4.537 1.00 0.00 H new ATOM 0 HG2 LYS A 115 14.454 -6.892 6.990 1.00 0.00 H new ATOM 0 HG3 LYS A 115 13.362 -8.262 6.956 1.00 0.00 H new ATOM 0 HD2 LYS A 115 15.308 -7.889 4.669 1.00 0.00 H new ATOM 0 HD3 LYS A 115 15.901 -8.530 6.188 1.00 0.00 H new ATOM 0 HE2 LYS A 115 14.643 -10.500 6.018 1.00 0.00 H new ATOM 0 HE3 LYS A 115 13.385 -9.747 5.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 14.728 -11.236 3.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 14.917 -9.639 3.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 16.136 -10.369 4.114 1.00 0.00 H new ATOM 1825 N TRP A 116 12.016 -4.411 3.618 1.00 0.00 N ATOM 1826 CA TRP A 116 11.331 -3.867 2.458 1.00 0.00 C ATOM 1827 C TRP A 116 12.213 -2.771 1.858 1.00 0.00 C ATOM 1828 O TRP A 116 12.374 -2.696 0.641 1.00 0.00 O ATOM 1829 CB TRP A 116 9.932 -3.371 2.831 1.00 0.00 C ATOM 1830 CG TRP A 116 9.449 -2.185 1.995 1.00 0.00 C ATOM 1831 CD1 TRP A 116 8.943 -2.201 0.754 1.00 0.00 C ATOM 1832 CD2 TRP A 116 9.448 -0.797 2.391 1.00 0.00 C ATOM 1833 NE1 TRP A 116 8.617 -0.932 0.324 1.00 0.00 N ATOM 1834 CE2 TRP A 116 8.933 -0.050 1.351 1.00 0.00 C ATOM 1835 CE3 TRP A 116 9.867 -0.193 3.589 1.00 0.00 C ATOM 1836 CZ2 TRP A 116 8.790 1.341 1.403 1.00 0.00 C ATOM 1837 CZ3 TRP A 116 9.717 1.199 3.626 1.00 0.00 C ATOM 1838 CH2 TRP A 116 9.201 1.965 2.587 1.00 0.00 C ATOM 0 H TRP A 116 11.563 -4.217 4.511 1.00 0.00 H new ATOM 0 HA TRP A 116 11.176 -4.639 1.705 1.00 0.00 H new ATOM 0 HB2 TRP A 116 9.225 -4.193 2.720 1.00 0.00 H new ATOM 0 HB3 TRP A 116 9.927 -3.087 3.883 1.00 0.00 H new ATOM 0 HD1 TRP A 116 8.808 -3.096 0.165 1.00 0.00 H new ATOM 0 HE1 TRP A 116 8.217 -0.686 -0.582 1.00 0.00 H new ATOM 0 HE3 TRP A 116 10.273 -0.758 4.416 1.00 0.00 H new ATOM 0 HZ2 TRP A 116 8.385 1.903 0.575 1.00 0.00 H new ATOM 0 HZ3 TRP A 116 10.024 1.713 4.525 1.00 0.00 H new ATOM 0 HH2 TRP A 116 9.118 3.037 2.693 1.00 0.00 H new ATOM 1849 N LYS A 117 12.763 -1.949 2.740 1.00 0.00 N ATOM 1850 CA LYS A 117 13.625 -0.860 2.312 1.00 0.00 C ATOM 1851 C LYS A 117 14.666 -1.397 1.328 1.00 0.00 C ATOM 1852 O LYS A 117 14.920 -0.785 0.292 1.00 0.00 O ATOM 1853 CB LYS A 117 14.232 -0.150 3.524 1.00 0.00 C ATOM 1854 CG LYS A 117 13.576 1.214 3.745 1.00 0.00 C ATOM 1855 CD LYS A 117 13.809 1.709 5.174 1.00 0.00 C ATOM 1856 CE LYS A 117 15.239 2.223 5.351 1.00 0.00 C ATOM 1857 NZ LYS A 117 15.241 3.686 5.572 1.00 0.00 N ATOM 0 H LYS A 117 12.628 -2.015 3.749 1.00 0.00 H new ATOM 0 HA LYS A 117 13.048 -0.101 1.783 1.00 0.00 H new ATOM 0 HB2 LYS A 117 14.104 -0.767 4.413 1.00 0.00 H new ATOM 0 HB3 LYS A 117 15.304 -0.022 3.376 1.00 0.00 H new ATOM 0 HG2 LYS A 117 13.981 1.936 3.036 1.00 0.00 H new ATOM 0 HG3 LYS A 117 12.506 1.143 3.551 1.00 0.00 H new ATOM 0 HD2 LYS A 117 13.102 2.505 5.407 1.00 0.00 H new ATOM 0 HD3 LYS A 117 13.620 0.899 5.878 1.00 0.00 H new ATOM 0 HE2 LYS A 117 15.710 1.721 6.196 1.00 0.00 H new ATOM 0 HE3 LYS A 117 15.830 1.982 4.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 16.220 4.018 5.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 14.811 4.161 4.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 14.694 3.908 6.428 1.00 0.00 H new ATOM 1871 N GLU A 118 15.242 -2.535 1.688 1.00 0.00 N ATOM 1872 CA GLU A 118 16.251 -3.161 0.850 1.00 0.00 C ATOM 1873 C GLU A 118 15.809 -3.143 -0.615 1.00 0.00 C ATOM 1874 O GLU A 118 16.565 -2.724 -1.490 1.00 0.00 O ATOM 1875 CB GLU A 118 16.543 -4.588 1.317 1.00 0.00 C ATOM 1876 CG GLU A 118 17.274 -4.586 2.661 1.00 0.00 C ATOM 1877 CD GLU A 118 18.791 -4.590 2.461 1.00 0.00 C ATOM 1878 OE1 GLU A 118 19.324 -5.688 2.189 1.00 0.00 O ATOM 1879 OE2 GLU A 118 19.382 -3.496 2.583 1.00 0.00 O ATOM 0 H GLU A 118 15.029 -3.040 2.548 1.00 0.00 H new ATOM 0 HA GLU A 118 17.175 -2.589 0.938 1.00 0.00 H new ATOM 0 HB2 GLU A 118 15.609 -5.143 1.408 1.00 0.00 H new ATOM 0 HB3 GLU A 118 17.148 -5.102 0.570 1.00 0.00 H new ATOM 0 HG2 GLU A 118 16.982 -3.708 3.236 1.00 0.00 H new ATOM 0 HG3 GLU A 118 16.978 -5.460 3.241 1.00 0.00 H new ATOM 1886 N ALA A 119 14.586 -3.603 -0.837 1.00 0.00 N ATOM 1887 CA ALA A 119 14.035 -3.645 -2.181 1.00 0.00 C ATOM 1888 C ALA A 119 14.129 -2.253 -2.809 1.00 0.00 C ATOM 1889 O ALA A 119 14.576 -2.110 -3.946 1.00 0.00 O ATOM 1890 CB ALA A 119 12.597 -4.164 -2.127 1.00 0.00 C ATOM 0 H ALA A 119 13.961 -3.950 -0.109 1.00 0.00 H new ATOM 0 HA ALA A 119 14.605 -4.330 -2.809 1.00 0.00 H new ATOM 0 HB1 ALA A 119 12.183 -4.196 -3.135 1.00 0.00 H new ATOM 0 HB2 ALA A 119 12.588 -5.167 -1.699 1.00 0.00 H new ATOM 0 HB3 ALA A 119 11.994 -3.500 -1.508 1.00 0.00 H new ATOM 1896 N MET A 120 13.699 -1.262 -2.042 1.00 0.00 N ATOM 1897 CA MET A 120 13.728 0.114 -2.510 1.00 0.00 C ATOM 1898 C MET A 120 15.166 0.583 -2.742 1.00 0.00 C ATOM 1899 O MET A 120 15.446 1.279 -3.717 1.00 0.00 O ATOM 1900 CB MET A 120 13.056 1.019 -1.476 1.00 0.00 C ATOM 1901 CG MET A 120 11.641 0.532 -1.157 1.00 0.00 C ATOM 1902 SD MET A 120 10.471 1.278 -2.280 1.00 0.00 S ATOM 1903 CE MET A 120 10.831 3.004 -2.001 1.00 0.00 C ATOM 0 H MET A 120 13.329 -1.384 -1.100 1.00 0.00 H new ATOM 0 HA MET A 120 13.191 0.168 -3.457 1.00 0.00 H new ATOM 0 HB2 MET A 120 13.652 1.039 -0.563 1.00 0.00 H new ATOM 0 HB3 MET A 120 13.016 2.041 -1.853 1.00 0.00 H new ATOM 0 HG2 MET A 120 11.594 -0.554 -1.239 1.00 0.00 H new ATOM 0 HG3 MET A 120 11.383 0.786 -0.129 1.00 0.00 H new ATOM 0 HE1 MET A 120 10.013 3.461 -1.443 1.00 0.00 H new ATOM 0 HE2 MET A 120 11.755 3.095 -1.430 1.00 0.00 H new ATOM 0 HE3 MET A 120 10.945 3.511 -2.959 1.00 0.00 H new ATOM 1913 N PHE A 121 16.040 0.183 -1.830 1.00 0.00 N ATOM 1914 CA PHE A 121 17.442 0.554 -1.923 1.00 0.00 C ATOM 1915 C PHE A 121 18.120 -0.157 -3.096 1.00 0.00 C ATOM 1916 O PHE A 121 18.954 0.431 -3.784 1.00 0.00 O ATOM 1917 CB PHE A 121 18.109 0.112 -0.619 1.00 0.00 C ATOM 1918 CG PHE A 121 18.006 1.137 0.512 1.00 0.00 C ATOM 1919 CD1 PHE A 121 16.786 1.568 0.930 1.00 0.00 C ATOM 1920 CD2 PHE A 121 19.135 1.617 1.099 1.00 0.00 C ATOM 1921 CE1 PHE A 121 16.690 2.519 1.979 1.00 0.00 C ATOM 1922 CE2 PHE A 121 19.039 2.569 2.149 1.00 0.00 C ATOM 1923 CZ PHE A 121 17.819 3.000 2.567 1.00 0.00 C ATOM 0 H PHE A 121 15.804 -0.394 -1.023 1.00 0.00 H new ATOM 0 HA PHE A 121 17.533 1.628 -2.082 1.00 0.00 H new ATOM 0 HB2 PHE A 121 17.656 -0.823 -0.290 1.00 0.00 H new ATOM 0 HB3 PHE A 121 19.161 -0.095 -0.813 1.00 0.00 H new ATOM 0 HD1 PHE A 121 15.890 1.186 0.464 1.00 0.00 H new ATOM 0 HD2 PHE A 121 20.104 1.275 0.767 1.00 0.00 H new ATOM 0 HE1 PHE A 121 15.721 2.861 2.311 1.00 0.00 H new ATOM 0 HE2 PHE A 121 19.935 2.951 2.615 1.00 0.00 H new ATOM 0 HZ PHE A 121 17.746 3.724 3.365 1.00 0.00 H new ATOM 1933 N SER A 122 17.738 -1.411 -3.288 1.00 0.00 N ATOM 1934 CA SER A 122 18.299 -2.208 -4.365 1.00 0.00 C ATOM 1935 C SER A 122 17.783 -1.702 -5.714 1.00 0.00 C ATOM 1936 O SER A 122 18.517 -1.694 -6.700 1.00 0.00 O ATOM 1937 CB SER A 122 17.960 -3.689 -4.189 1.00 0.00 C ATOM 1938 OG SER A 122 18.983 -4.536 -4.705 1.00 0.00 O ATOM 0 H SER A 122 17.046 -1.895 -2.715 1.00 0.00 H new ATOM 0 HA SER A 122 19.384 -2.106 -4.336 1.00 0.00 H new ATOM 0 HB2 SER A 122 17.811 -3.904 -3.131 1.00 0.00 H new ATOM 0 HB3 SER A 122 17.019 -3.908 -4.694 1.00 0.00 H new ATOM 0 HG SER A 122 18.730 -5.473 -4.572 1.00 0.00 H new ATOM 1944 N ALA A 123 16.523 -1.291 -5.713 1.00 0.00 N ATOM 1945 CA ALA A 123 15.900 -0.785 -6.924 1.00 0.00 C ATOM 1946 C ALA A 123 16.244 0.697 -7.088 1.00 0.00 C ATOM 1947 O ALA A 123 15.812 1.336 -8.046 1.00 0.00 O ATOM 1948 CB ALA A 123 14.391 -1.029 -6.862 1.00 0.00 C ATOM 0 H ALA A 123 15.917 -1.298 -4.893 1.00 0.00 H new ATOM 0 HA ALA A 123 16.280 -1.311 -7.800 1.00 0.00 H new ATOM 0 HB1 ALA A 123 13.923 -0.649 -7.770 1.00 0.00 H new ATOM 0 HB2 ALA A 123 14.199 -2.098 -6.774 1.00 0.00 H new ATOM 0 HB3 ALA A 123 13.974 -0.513 -5.997 1.00 0.00 H new ATOM 1954 N GLY A 124 17.020 1.200 -6.139 1.00 0.00 N ATOM 1955 CA GLY A 124 17.427 2.595 -6.167 1.00 0.00 C ATOM 1956 C GLY A 124 16.210 3.522 -6.175 1.00 0.00 C ATOM 1957 O GLY A 124 16.253 4.604 -6.759 1.00 0.00 O ATOM 0 H GLY A 124 17.378 0.667 -5.346 1.00 0.00 H new ATOM 0 HA2 GLY A 124 18.049 2.813 -5.299 1.00 0.00 H new ATOM 0 HA3 GLY A 124 18.037 2.782 -7.051 1.00 0.00 H new ATOM 1961 N MET A 125 15.153 3.064 -5.521 1.00 0.00 N ATOM 1962 CA MET A 125 13.926 3.838 -5.447 1.00 0.00 C ATOM 1963 C MET A 125 13.944 4.780 -4.241 1.00 0.00 C ATOM 1964 O MET A 125 14.960 4.898 -3.557 1.00 0.00 O ATOM 1965 CB MET A 125 12.729 2.891 -5.336 1.00 0.00 C ATOM 1966 CG MET A 125 12.180 2.537 -6.719 1.00 0.00 C ATOM 1967 SD MET A 125 10.443 2.937 -6.808 1.00 0.00 S ATOM 1968 CE MET A 125 9.738 1.329 -6.486 1.00 0.00 C ATOM 0 H MET A 125 15.121 2.166 -5.037 1.00 0.00 H new ATOM 0 HA MET A 125 13.843 4.438 -6.353 1.00 0.00 H new ATOM 0 HB2 MET A 125 13.028 1.981 -4.816 1.00 0.00 H new ATOM 0 HB3 MET A 125 11.946 3.358 -4.738 1.00 0.00 H new ATOM 0 HG2 MET A 125 12.727 3.084 -7.487 1.00 0.00 H new ATOM 0 HG3 MET A 125 12.328 1.475 -6.917 1.00 0.00 H new ATOM 0 HE1 MET A 125 8.759 1.447 -6.022 1.00 0.00 H new ATOM 0 HE2 MET A 125 9.632 0.784 -7.424 1.00 0.00 H new ATOM 0 HE3 MET A 125 10.392 0.773 -5.815 1.00 0.00 H new ATOM 1978 N GLN A 126 12.810 5.427 -4.018 1.00 0.00 N ATOM 1979 CA GLN A 126 12.683 6.355 -2.907 1.00 0.00 C ATOM 1980 C GLN A 126 11.460 6.002 -2.058 1.00 0.00 C ATOM 1981 O GLN A 126 10.432 5.583 -2.587 1.00 0.00 O ATOM 1982 CB GLN A 126 12.606 7.799 -3.405 1.00 0.00 C ATOM 1983 CG GLN A 126 11.347 8.023 -4.245 1.00 0.00 C ATOM 1984 CD GLN A 126 11.494 9.261 -5.133 1.00 0.00 C ATOM 1985 OE1 GLN A 126 11.282 10.387 -4.712 1.00 0.00 O ATOM 1986 NE2 GLN A 126 11.866 8.992 -6.381 1.00 0.00 N ATOM 0 H GLN A 126 11.970 5.327 -4.588 1.00 0.00 H new ATOM 0 HA GLN A 126 13.572 6.268 -2.283 1.00 0.00 H new ATOM 0 HB2 GLN A 126 12.606 8.481 -2.555 1.00 0.00 H new ATOM 0 HB3 GLN A 126 13.490 8.030 -3.999 1.00 0.00 H new ATOM 0 HG2 GLN A 126 11.158 7.147 -4.865 1.00 0.00 H new ATOM 0 HG3 GLN A 126 10.484 8.141 -3.589 1.00 0.00 H new ATOM 0 HE21 GLN A 126 12.027 8.027 -6.668 1.00 0.00 H new ATOM 0 HE22 GLN A 126 11.990 9.751 -7.051 1.00 0.00 H new ATOM 1995 N LEU A 127 11.613 6.185 -0.754 1.00 0.00 N ATOM 1996 CA LEU A 127 10.534 5.891 0.174 1.00 0.00 C ATOM 1997 C LEU A 127 9.662 7.136 0.346 1.00 0.00 C ATOM 1998 O LEU A 127 9.897 8.157 -0.298 1.00 0.00 O ATOM 1999 CB LEU A 127 11.092 5.345 1.489 1.00 0.00 C ATOM 2000 CG LEU A 127 12.400 4.557 1.387 1.00 0.00 C ATOM 2001 CD1 LEU A 127 13.303 4.835 2.590 1.00 0.00 C ATOM 2002 CD2 LEU A 127 12.127 3.062 1.209 1.00 0.00 C ATOM 0 H LEU A 127 12.467 6.533 -0.319 1.00 0.00 H new ATOM 0 HA LEU A 127 9.893 5.105 -0.224 1.00 0.00 H new ATOM 0 HB2 LEU A 127 11.247 6.182 2.170 1.00 0.00 H new ATOM 0 HB3 LEU A 127 10.338 4.701 1.941 1.00 0.00 H new ATOM 0 HG LEU A 127 12.934 4.895 0.499 1.00 0.00 H new ATOM 0 HD11 LEU A 127 14.226 4.263 2.492 1.00 0.00 H new ATOM 0 HD12 LEU A 127 13.538 5.899 2.630 1.00 0.00 H new ATOM 0 HD13 LEU A 127 12.789 4.542 3.506 1.00 0.00 H new ATOM 0 HD21 LEU A 127 13.073 2.525 1.139 1.00 0.00 H new ATOM 0 HD22 LEU A 127 11.562 2.691 2.064 1.00 0.00 H new ATOM 0 HD23 LEU A 127 11.552 2.903 0.297 1.00 0.00 H new ATOM 2014 N PRO A 128 8.646 7.007 1.241 1.00 0.00 N ATOM 2015 CA PRO A 128 7.738 8.110 1.506 1.00 0.00 C ATOM 2016 C PRO A 128 8.410 9.179 2.370 1.00 0.00 C ATOM 2017 O PRO A 128 9.032 8.862 3.383 1.00 0.00 O ATOM 2018 CB PRO A 128 6.533 7.473 2.179 1.00 0.00 C ATOM 2019 CG PRO A 128 7.004 6.120 2.685 1.00 0.00 C ATOM 2020 CD PRO A 128 8.337 5.813 2.022 1.00 0.00 C ATOM 0 HA PRO A 128 7.440 8.637 0.600 1.00 0.00 H new ATOM 0 HB2 PRO A 128 6.171 8.092 3.000 1.00 0.00 H new ATOM 0 HB3 PRO A 128 5.707 7.361 1.476 1.00 0.00 H new ATOM 0 HG2 PRO A 128 7.111 6.134 3.770 1.00 0.00 H new ATOM 0 HG3 PRO A 128 6.272 5.348 2.447 1.00 0.00 H new ATOM 0 HD2 PRO A 128 9.111 5.613 2.763 1.00 0.00 H new ATOM 0 HD3 PRO A 128 8.269 4.930 1.386 1.00 0.00 H new ATOM 2028 N THR A 129 8.261 10.422 1.938 1.00 0.00 N ATOM 2029 CA THR A 129 8.846 11.540 2.659 1.00 0.00 C ATOM 2030 C THR A 129 7.959 11.934 3.842 1.00 0.00 C ATOM 2031 O THR A 129 6.735 11.949 3.726 1.00 0.00 O ATOM 2032 CB THR A 129 9.073 12.679 1.663 1.00 0.00 C ATOM 2033 OG1 THR A 129 7.919 12.644 0.828 1.00 0.00 O ATOM 2034 CG2 THR A 129 10.234 12.398 0.707 1.00 0.00 C ATOM 0 H THR A 129 7.744 10.680 1.098 1.00 0.00 H new ATOM 0 HA THR A 129 9.810 11.271 3.091 1.00 0.00 H new ATOM 0 HB THR A 129 9.267 13.604 2.207 1.00 0.00 H new ATOM 0 HG1 THR A 129 8.156 12.258 -0.041 1.00 0.00 H new ATOM 0 HG21 THR A 129 10.352 13.237 0.022 1.00 0.00 H new ATOM 0 HG22 THR A 129 11.152 12.265 1.279 1.00 0.00 H new ATOM 0 HG23 THR A 129 10.026 11.492 0.138 1.00 0.00 H new ATOM 2042 N LEU A 130 8.612 12.244 4.952 1.00 0.00 N ATOM 2043 CA LEU A 130 7.898 12.638 6.155 1.00 0.00 C ATOM 2044 C LEU A 130 6.701 13.510 5.770 1.00 0.00 C ATOM 2045 O LEU A 130 5.610 13.349 6.315 1.00 0.00 O ATOM 2046 CB LEU A 130 8.850 13.305 7.149 1.00 0.00 C ATOM 2047 CG LEU A 130 9.772 12.365 7.929 1.00 0.00 C ATOM 2048 CD1 LEU A 130 9.025 11.104 8.368 1.00 0.00 C ATOM 2049 CD2 LEU A 130 11.028 12.035 7.121 1.00 0.00 C ATOM 0 H LEU A 130 9.628 12.230 5.044 1.00 0.00 H new ATOM 0 HA LEU A 130 7.502 11.761 6.667 1.00 0.00 H new ATOM 0 HB2 LEU A 130 9.468 14.020 6.606 1.00 0.00 H new ATOM 0 HB3 LEU A 130 8.256 13.875 7.864 1.00 0.00 H new ATOM 0 HG LEU A 130 10.097 12.878 8.834 1.00 0.00 H new ATOM 0 HD11 LEU A 130 9.703 10.453 8.920 1.00 0.00 H new ATOM 0 HD12 LEU A 130 8.187 11.382 9.008 1.00 0.00 H new ATOM 0 HD13 LEU A 130 8.652 10.578 7.489 1.00 0.00 H new ATOM 0 HD21 LEU A 130 11.666 11.366 7.698 1.00 0.00 H new ATOM 0 HD22 LEU A 130 10.743 11.550 6.187 1.00 0.00 H new ATOM 0 HD23 LEU A 130 11.571 12.954 6.901 1.00 0.00 H new ATOM 2061 N ASP A 131 6.946 14.415 4.833 1.00 0.00 N ATOM 2062 CA ASP A 131 5.902 15.312 4.369 1.00 0.00 C ATOM 2063 C ASP A 131 4.723 14.489 3.845 1.00 0.00 C ATOM 2064 O ASP A 131 3.605 14.612 4.343 1.00 0.00 O ATOM 2065 CB ASP A 131 6.404 16.198 3.227 1.00 0.00 C ATOM 2066 CG ASP A 131 6.269 17.702 3.468 1.00 0.00 C ATOM 2067 OD1 ASP A 131 7.186 18.259 4.110 1.00 0.00 O ATOM 2068 OD2 ASP A 131 5.252 18.262 3.004 1.00 0.00 O ATOM 0 H ASP A 131 7.852 14.546 4.383 1.00 0.00 H new ATOM 0 HA ASP A 131 5.601 15.940 5.207 1.00 0.00 H new ATOM 0 HB2 ASP A 131 7.453 15.968 3.043 1.00 0.00 H new ATOM 0 HB3 ASP A 131 5.857 15.940 2.320 1.00 0.00 H new ATOM 2073 N GLU A 132 5.013 13.668 2.846 1.00 0.00 N ATOM 2074 CA GLU A 132 3.992 12.825 2.250 1.00 0.00 C ATOM 2075 C GLU A 132 3.249 12.042 3.335 1.00 0.00 C ATOM 2076 O GLU A 132 2.020 11.988 3.335 1.00 0.00 O ATOM 2077 CB GLU A 132 4.598 11.880 1.210 1.00 0.00 C ATOM 2078 CG GLU A 132 4.198 12.294 -0.207 1.00 0.00 C ATOM 2079 CD GLU A 132 3.765 11.080 -1.032 1.00 0.00 C ATOM 2080 OE1 GLU A 132 4.655 10.259 -1.343 1.00 0.00 O ATOM 2081 OE2 GLU A 132 2.554 11.001 -1.332 1.00 0.00 O ATOM 0 H GLU A 132 5.941 13.569 2.435 1.00 0.00 H new ATOM 0 HA GLU A 132 3.275 13.466 1.736 1.00 0.00 H new ATOM 0 HB2 GLU A 132 5.684 11.883 1.300 1.00 0.00 H new ATOM 0 HB3 GLU A 132 4.265 10.860 1.402 1.00 0.00 H new ATOM 0 HG2 GLU A 132 3.383 13.017 -0.162 1.00 0.00 H new ATOM 0 HG3 GLU A 132 5.037 12.789 -0.695 1.00 0.00 H new ATOM 2088 N ILE A 133 4.027 11.454 4.232 1.00 0.00 N ATOM 2089 CA ILE A 133 3.458 10.677 5.320 1.00 0.00 C ATOM 2090 C ILE A 133 2.398 11.514 6.040 1.00 0.00 C ATOM 2091 O ILE A 133 1.276 11.055 6.247 1.00 0.00 O ATOM 2092 CB ILE A 133 4.563 10.159 6.243 1.00 0.00 C ATOM 2093 CG1 ILE A 133 5.593 9.342 5.460 1.00 0.00 C ATOM 2094 CG2 ILE A 133 3.974 9.368 7.413 1.00 0.00 C ATOM 2095 CD1 ILE A 133 5.327 7.842 5.603 1.00 0.00 C ATOM 0 H ILE A 133 5.046 11.500 4.228 1.00 0.00 H new ATOM 0 HA ILE A 133 2.956 9.791 4.933 1.00 0.00 H new ATOM 0 HB ILE A 133 5.086 11.017 6.665 1.00 0.00 H new ATOM 0 HG12 ILE A 133 5.560 9.622 4.407 1.00 0.00 H new ATOM 0 HG13 ILE A 133 6.596 9.573 5.820 1.00 0.00 H new ATOM 0 HG21 ILE A 133 4.780 9.011 8.054 1.00 0.00 H new ATOM 0 HG22 ILE A 133 3.310 10.012 7.990 1.00 0.00 H new ATOM 0 HG23 ILE A 133 3.411 8.517 7.030 1.00 0.00 H new ATOM 0 HD11 ILE A 133 6.073 7.285 5.037 1.00 0.00 H new ATOM 0 HD12 ILE A 133 5.385 7.561 6.655 1.00 0.00 H new ATOM 0 HD13 ILE A 133 4.333 7.611 5.220 1.00 0.00 H new ATOM 2107 N ASN A 134 2.792 12.726 6.401 1.00 0.00 N ATOM 2108 CA ASN A 134 1.890 13.631 7.093 1.00 0.00 C ATOM 2109 C ASN A 134 0.780 14.069 6.135 1.00 0.00 C ATOM 2110 O ASN A 134 -0.399 13.840 6.400 1.00 0.00 O ATOM 2111 CB ASN A 134 2.626 14.886 7.568 1.00 0.00 C ATOM 2112 CG ASN A 134 1.941 15.492 8.794 1.00 0.00 C ATOM 2113 OD1 ASN A 134 1.340 16.552 8.741 1.00 0.00 O ATOM 2114 ND2 ASN A 134 2.063 14.761 9.899 1.00 0.00 N ATOM 0 H ASN A 134 3.724 13.103 6.227 1.00 0.00 H new ATOM 0 HA ASN A 134 1.480 13.105 7.955 1.00 0.00 H new ATOM 0 HB2 ASN A 134 3.659 14.636 7.810 1.00 0.00 H new ATOM 0 HB3 ASN A 134 2.656 15.621 6.763 1.00 0.00 H new ATOM 0 HD21 ASN A 134 1.639 15.080 10.771 1.00 0.00 H new ATOM 0 HD22 ASN A 134 2.580 13.882 9.875 1.00 0.00 H new ATOM 2121 N LYS A 135 1.196 14.690 5.041 1.00 0.00 N ATOM 2122 CA LYS A 135 0.252 15.162 4.043 1.00 0.00 C ATOM 2123 C LYS A 135 -0.789 14.072 3.777 1.00 0.00 C ATOM 2124 O LYS A 135 -1.991 14.325 3.854 1.00 0.00 O ATOM 2125 CB LYS A 135 0.989 15.628 2.786 1.00 0.00 C ATOM 2126 CG LYS A 135 1.267 17.131 2.839 1.00 0.00 C ATOM 2127 CD LYS A 135 1.739 17.650 1.479 1.00 0.00 C ATOM 2128 CE LYS A 135 0.938 18.882 1.053 1.00 0.00 C ATOM 2129 NZ LYS A 135 0.049 18.554 -0.084 1.00 0.00 N ATOM 0 H LYS A 135 2.175 14.877 4.824 1.00 0.00 H new ATOM 0 HA LYS A 135 -0.286 16.035 4.411 1.00 0.00 H new ATOM 0 HB2 LYS A 135 1.929 15.084 2.688 1.00 0.00 H new ATOM 0 HB3 LYS A 135 0.393 15.396 1.903 1.00 0.00 H new ATOM 0 HG2 LYS A 135 0.364 17.661 3.141 1.00 0.00 H new ATOM 0 HG3 LYS A 135 2.025 17.338 3.594 1.00 0.00 H new ATOM 0 HD2 LYS A 135 2.799 17.901 1.529 1.00 0.00 H new ATOM 0 HD3 LYS A 135 1.632 16.866 0.730 1.00 0.00 H new ATOM 0 HE2 LYS A 135 0.346 19.246 1.892 1.00 0.00 H new ATOM 0 HE3 LYS A 135 1.618 19.686 0.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -0.487 19.401 -0.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 0.621 18.228 -0.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -0.612 17.802 0.198 1.00 0.00 H new ATOM 2143 N LYS A 136 -0.290 12.884 3.471 1.00 0.00 N ATOM 2144 CA LYS A 136 -1.162 11.755 3.193 1.00 0.00 C ATOM 2145 C LYS A 136 -2.057 11.497 4.407 1.00 0.00 C ATOM 2146 O LYS A 136 -3.281 11.568 4.307 1.00 0.00 O ATOM 2147 CB LYS A 136 -0.341 10.537 2.764 1.00 0.00 C ATOM 2148 CG LYS A 136 -1.202 9.272 2.751 1.00 0.00 C ATOM 2149 CD LYS A 136 -2.554 9.536 2.085 1.00 0.00 C ATOM 2150 CE LYS A 136 -2.409 9.619 0.564 1.00 0.00 C ATOM 2151 NZ LYS A 136 -3.734 9.774 -0.075 1.00 0.00 N ATOM 0 H LYS A 136 0.707 12.678 3.409 1.00 0.00 H new ATOM 0 HA LYS A 136 -1.820 11.979 2.353 1.00 0.00 H new ATOM 0 HB2 LYS A 136 0.077 10.707 1.772 1.00 0.00 H new ATOM 0 HB3 LYS A 136 0.499 10.402 3.445 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -0.679 8.477 2.219 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -1.357 8.923 3.772 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -3.253 8.741 2.344 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -2.975 10.467 2.465 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -1.770 10.462 0.299 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -1.921 8.719 0.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -3.649 10.398 -0.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -4.084 8.843 -0.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -4.401 10.190 0.606 1.00 0.00 H new ATOM 2165 N GLU A 137 -1.411 11.202 5.526 1.00 0.00 N ATOM 2166 CA GLU A 137 -2.133 10.933 6.758 1.00 0.00 C ATOM 2167 C GLU A 137 -3.313 11.896 6.903 1.00 0.00 C ATOM 2168 O GLU A 137 -4.458 11.466 7.038 1.00 0.00 O ATOM 2169 CB GLU A 137 -1.203 11.020 7.969 1.00 0.00 C ATOM 2170 CG GLU A 137 -1.827 10.340 9.189 1.00 0.00 C ATOM 2171 CD GLU A 137 -2.718 9.169 8.769 1.00 0.00 C ATOM 2172 OE1 GLU A 137 -2.189 8.274 8.076 1.00 0.00 O ATOM 2173 OE2 GLU A 137 -3.907 9.196 9.151 1.00 0.00 O ATOM 0 H GLU A 137 -0.396 11.143 5.605 1.00 0.00 H new ATOM 0 HA GLU A 137 -2.522 9.916 6.713 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -0.249 10.549 7.734 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -0.994 12.065 8.198 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -1.040 9.983 9.853 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -2.415 11.065 9.753 1.00 0.00 H new ATOM 2180 N LEU A 138 -2.994 13.181 6.869 1.00 0.00 N ATOM 2181 CA LEU A 138 -4.014 14.209 6.995 1.00 0.00 C ATOM 2182 C LEU A 138 -5.238 13.811 6.167 1.00 0.00 C ATOM 2183 O LEU A 138 -6.373 14.010 6.597 1.00 0.00 O ATOM 2184 CB LEU A 138 -3.441 15.579 6.626 1.00 0.00 C ATOM 2185 CG LEU A 138 -2.964 16.444 7.795 1.00 0.00 C ATOM 2186 CD1 LEU A 138 -4.037 16.537 8.882 1.00 0.00 C ATOM 2187 CD2 LEU A 138 -1.632 15.932 8.348 1.00 0.00 C ATOM 0 H LEU A 138 -2.044 13.534 6.756 1.00 0.00 H new ATOM 0 HA LEU A 138 -4.343 14.295 8.031 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -2.603 15.429 5.945 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -4.202 16.133 6.077 1.00 0.00 H new ATOM 0 HG LEU A 138 -2.792 17.455 7.424 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -3.673 17.157 9.701 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -4.940 16.982 8.464 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -4.264 15.539 9.256 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -1.315 16.564 9.178 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -1.753 14.907 8.699 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -0.877 15.960 7.562 1.00 0.00 H new ATOM 2199 N SER A 139 -4.965 13.257 4.995 1.00 0.00 N ATOM 2200 CA SER A 139 -6.030 12.830 4.104 1.00 0.00 C ATOM 2201 C SER A 139 -6.877 11.750 4.781 1.00 0.00 C ATOM 2202 O SER A 139 -8.105 11.784 4.710 1.00 0.00 O ATOM 2203 CB SER A 139 -5.465 12.309 2.781 1.00 0.00 C ATOM 2204 OG SER A 139 -6.348 12.555 1.690 1.00 0.00 O ATOM 0 H SER A 139 -4.022 13.094 4.642 1.00 0.00 H new ATOM 0 HA SER A 139 -6.659 13.693 3.885 1.00 0.00 H new ATOM 0 HB2 SER A 139 -4.504 12.785 2.584 1.00 0.00 H new ATOM 0 HB3 SER A 139 -5.279 11.238 2.863 1.00 0.00 H new ATOM 0 HG SER A 139 -5.951 12.209 0.863 1.00 0.00 H new ATOM 2210 N ILE A 140 -6.188 10.818 5.422 1.00 0.00 N ATOM 2211 CA ILE A 140 -6.862 9.730 6.111 1.00 0.00 C ATOM 2212 C ILE A 140 -7.781 10.307 7.189 1.00 0.00 C ATOM 2213 O ILE A 140 -8.955 9.948 7.267 1.00 0.00 O ATOM 2214 CB ILE A 140 -5.843 8.722 6.646 1.00 0.00 C ATOM 2215 CG1 ILE A 140 -5.260 7.877 5.512 1.00 0.00 C ATOM 2216 CG2 ILE A 140 -6.455 7.858 7.750 1.00 0.00 C ATOM 2217 CD1 ILE A 140 -3.863 8.365 5.126 1.00 0.00 C ATOM 0 H ILE A 140 -5.170 10.793 5.479 1.00 0.00 H new ATOM 0 HA ILE A 140 -7.493 9.173 5.418 1.00 0.00 H new ATOM 0 HB ILE A 140 -5.016 9.275 7.092 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -5.212 6.833 5.820 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -5.918 7.923 4.644 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -5.710 7.150 8.113 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -6.781 8.495 8.572 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -7.311 7.312 7.353 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -3.472 7.747 4.318 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -3.918 9.402 4.795 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -3.201 8.294 5.989 1.00 0.00 H new ATOM 2229 N LYS A 141 -7.212 11.192 7.995 1.00 0.00 N ATOM 2230 CA LYS A 141 -7.966 11.823 9.065 1.00 0.00 C ATOM 2231 C LYS A 141 -9.263 12.402 8.497 1.00 0.00 C ATOM 2232 O LYS A 141 -10.345 12.147 9.026 1.00 0.00 O ATOM 2233 CB LYS A 141 -7.101 12.852 9.796 1.00 0.00 C ATOM 2234 CG LYS A 141 -6.156 12.169 10.787 1.00 0.00 C ATOM 2235 CD LYS A 141 -4.718 12.171 10.264 1.00 0.00 C ATOM 2236 CE LYS A 141 -3.749 12.690 11.328 1.00 0.00 C ATOM 2237 NZ LYS A 141 -4.156 14.037 11.787 1.00 0.00 N ATOM 0 H LYS A 141 -6.238 11.487 7.928 1.00 0.00 H new ATOM 0 HA LYS A 141 -8.248 11.086 9.817 1.00 0.00 H new ATOM 0 HB2 LYS A 141 -6.522 13.426 9.072 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -7.740 13.559 10.325 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -6.198 12.682 11.748 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -6.483 11.143 10.959 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -4.433 11.161 9.969 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -4.652 12.794 9.372 1.00 0.00 H new ATOM 0 HE2 LYS A 141 -3.726 12.003 12.174 1.00 0.00 H new ATOM 0 HE3 LYS A 141 -2.739 12.728 10.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 -3.311 14.630 11.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 -4.780 14.471 11.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 -4.663 13.957 12.692 1.00 0.00 H new ATOM 2251 N GLU A 142 -9.113 13.171 7.429 1.00 0.00 N ATOM 2252 CA GLU A 142 -10.259 13.788 6.783 1.00 0.00 C ATOM 2253 C GLU A 142 -11.327 12.736 6.480 1.00 0.00 C ATOM 2254 O GLU A 142 -12.476 12.874 6.899 1.00 0.00 O ATOM 2255 CB GLU A 142 -9.839 14.527 5.511 1.00 0.00 C ATOM 2256 CG GLU A 142 -9.278 15.912 5.841 1.00 0.00 C ATOM 2257 CD GLU A 142 -9.762 16.954 4.830 1.00 0.00 C ATOM 2258 OE1 GLU A 142 -10.971 16.922 4.516 1.00 0.00 O ATOM 2259 OE2 GLU A 142 -8.910 17.758 4.393 1.00 0.00 O ATOM 0 H GLU A 142 -8.214 13.381 6.994 1.00 0.00 H new ATOM 0 HA GLU A 142 -10.685 14.523 7.466 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -9.088 13.944 4.979 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -10.696 14.627 4.845 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -9.586 16.203 6.845 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -8.189 15.877 5.840 1.00 0.00 H new