USER MOD reduce.3.24.130724 H: found=0, std=0, add=1027, rem=0, adj=30 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 114 MET CE :methyl -168:sc= -2.1 (180deg=-1.85) USER MOD Set 1.2: A 117 LYS NZ :NH3+ -130:sc= -0.0485 (180deg=0.0893) USER MOD Set 2.1: A 105 ASN : amide:sc= -0.956 K(o=-0.55,f=-2.2) USER MOD Set 2.2: A 106 GLN :FLIP amide:sc= 0.401 F(o=-1.3,f=-0.55) USER MOD Set 3.1: A 88 GLN : amide:sc= 1.05 K(o=1.9,f=-1.4) USER MOD Set 3.2: A 95 GLN : amide:sc= 0.849 K(o=1.9,f=-2.3) USER MOD Set 4.1: A 34 CYS SG : rot -1:sc= 1.67 USER MOD Set 4.2: A 83 THR OG1 : rot 127:sc= 0.407 USER MOD Set 5.1: A 35 HIS : no HE2:sc= 0.2 K(o=0.41,f=-0.53) USER MOD Set 5.2: A 81 THR OG1 : rot 158:sc= 0.213 USER MOD Set 6.1: A 12 GLN :FLIP amide:sc= 0.00334 F(o=-0.67,f=0.11) USER MOD Set 6.2: A 15 SER OG : rot 124:sc= 0.103 USER MOD Single : A 21 ASN : amide:sc= -8.36! C(o=-8.4!,f=-23!) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HD1:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 MET CE :methyl -135:sc= -1.74 (180deg=-6.36!) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 85:sc= 1.05 USER MOD Single : A 44 THR OG1 : rot 83:sc= -0.0524 USER MOD Single : A 46 CYS SG : rot 180:sc= -4.73! USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.15 USER MOD Single : A 72 THR OG1 : rot 110:sc= 0.437 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 TYR OH : rot -165:sc= -0.18 USER MOD Single : A 77 GLN : amide:sc= -0.659 X(o=-0.66,f=-0.56) USER MOD Single : A 84 ASN : amide:sc= -0.14 K(o=-0.14,f=-1.9) USER MOD Single : A 85 LYS NZ :NH3+ 156:sc= -0.0174 (180deg=-0.239) USER MOD Single : A 91 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 93 ASN : amide:sc= -1.45 X(o=-1.5,f=-0.98!) USER MOD Single : A 104 SER OG : rot 131:sc= 0.429 USER MOD Single : A 109 THR OG1 : rot 159:sc= 0.127 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 MET CE :methyl -163:sc= -9.72! (180deg=-9.86!) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 125 MET CE :methyl 156:sc= -2.46! (180deg=-2.48!) USER MOD Single : A 126 GLN : amide:sc=-0.00445 X(o=-0.0044,f=0) USER MOD Single : A 129 THR OG1 : rot 180:sc= -0.22 USER MOD Single : A 134 ASN : amide:sc= -0.0666 X(o=-0.067,f=0) USER MOD Single : A 135 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.064) USER MOD Single : A 136 LYS NZ :NH3+ -124:sc= 0.955 (180deg=0.324) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ -142:sc= -0.236 (180deg=-1.37) USER MOD ----------------------------------------------------------------- ATOM 127 N GLN A 12 13.090 14.241 3.510 1.00 0.00 N ATOM 128 CA GLN A 12 13.719 12.941 3.669 1.00 0.00 C ATOM 129 C GLN A 12 12.656 11.843 3.738 1.00 0.00 C ATOM 130 O GLN A 12 11.567 12.060 4.268 1.00 0.00 O ATOM 131 CB GLN A 12 14.617 12.914 4.907 1.00 0.00 C ATOM 132 CG GLN A 12 14.416 11.622 5.702 1.00 0.00 C ATOM 133 CD GLN A 12 15.294 11.607 6.955 1.00 0.00 C ATOM 134 OE1 GLN A 12 14.655 11.233 8.060 1.00 0.00 O flip ATOM 135 NE2 GLN A 12 16.475 11.915 6.921 1.00 0.00 N flip ATOM 0 HA GLN A 12 14.350 12.755 2.800 1.00 0.00 H new ATOM 0 HB2 GLN A 12 15.661 13.001 4.605 1.00 0.00 H new ATOM 0 HB3 GLN A 12 14.395 13.773 5.540 1.00 0.00 H new ATOM 0 HG2 GLN A 12 13.368 11.525 5.987 1.00 0.00 H new ATOM 0 HG3 GLN A 12 14.657 10.764 5.075 1.00 0.00 H new ATOM 0 HE21 GLN A 12 16.904 12.193 6.039 1.00 0.00 H new ATOM 0 HE22 GLN A 12 17.032 11.894 7.775 1.00 0.00 H new ATOM 144 N PRO A 13 13.019 10.656 3.181 1.00 0.00 N ATOM 145 CA PRO A 13 12.109 9.523 3.175 1.00 0.00 C ATOM 146 C PRO A 13 12.019 8.884 4.562 1.00 0.00 C ATOM 147 O PRO A 13 12.966 8.955 5.345 1.00 0.00 O ATOM 148 CB PRO A 13 12.664 8.579 2.121 1.00 0.00 C ATOM 149 CG PRO A 13 14.110 8.996 1.907 1.00 0.00 C ATOM 150 CD PRO A 13 14.300 10.363 2.545 1.00 0.00 C ATOM 0 HA PRO A 13 11.084 9.808 2.936 1.00 0.00 H new ATOM 0 HB2 PRO A 13 12.602 7.543 2.453 1.00 0.00 H new ATOM 0 HB3 PRO A 13 12.095 8.651 1.194 1.00 0.00 H new ATOM 0 HG2 PRO A 13 14.787 8.268 2.354 1.00 0.00 H new ATOM 0 HG3 PRO A 13 14.342 9.036 0.843 1.00 0.00 H new ATOM 0 HD2 PRO A 13 15.110 10.351 3.274 1.00 0.00 H new ATOM 0 HD3 PRO A 13 14.553 11.116 1.799 1.00 0.00 H new ATOM 158 N VAL A 14 10.873 8.274 4.825 1.00 0.00 N ATOM 159 CA VAL A 14 10.647 7.623 6.104 1.00 0.00 C ATOM 160 C VAL A 14 11.953 6.988 6.585 1.00 0.00 C ATOM 161 O VAL A 14 12.662 6.352 5.807 1.00 0.00 O ATOM 162 CB VAL A 14 9.502 6.616 5.983 1.00 0.00 C ATOM 163 CG1 VAL A 14 8.149 7.328 5.928 1.00 0.00 C ATOM 164 CG2 VAL A 14 9.695 5.709 4.766 1.00 0.00 C ATOM 0 H VAL A 14 10.090 8.217 4.173 1.00 0.00 H new ATOM 0 HA VAL A 14 10.343 8.352 6.856 1.00 0.00 H new ATOM 0 HB VAL A 14 9.513 5.988 6.873 1.00 0.00 H new ATOM 0 HG11 VAL A 14 7.352 6.589 5.842 1.00 0.00 H new ATOM 0 HG12 VAL A 14 8.007 7.910 6.838 1.00 0.00 H new ATOM 0 HG13 VAL A 14 8.122 7.992 5.064 1.00 0.00 H new ATOM 0 HG21 VAL A 14 8.867 5.003 4.704 1.00 0.00 H new ATOM 0 HG22 VAL A 14 9.723 6.316 3.861 1.00 0.00 H new ATOM 0 HG23 VAL A 14 10.632 5.161 4.865 1.00 0.00 H new ATOM 174 N SER A 15 12.232 7.183 7.866 1.00 0.00 N ATOM 175 CA SER A 15 13.440 6.638 8.460 1.00 0.00 C ATOM 176 C SER A 15 13.078 5.594 9.519 1.00 0.00 C ATOM 177 O SER A 15 13.959 4.978 10.115 1.00 0.00 O ATOM 178 CB SER A 15 14.298 7.744 9.078 1.00 0.00 C ATOM 179 OG SER A 15 15.363 8.137 8.217 1.00 0.00 O ATOM 0 H SER A 15 11.642 7.711 8.509 1.00 0.00 H new ATOM 0 HA SER A 15 14.022 6.161 7.672 1.00 0.00 H new ATOM 0 HB2 SER A 15 13.672 8.609 9.298 1.00 0.00 H new ATOM 0 HB3 SER A 15 14.708 7.398 10.027 1.00 0.00 H new ATOM 0 HG SER A 15 15.307 9.100 8.046 1.00 0.00 H new ATOM 185 N LEU A 16 11.779 5.428 9.720 1.00 0.00 N ATOM 186 CA LEU A 16 11.289 4.470 10.696 1.00 0.00 C ATOM 187 C LEU A 16 9.956 3.894 10.214 1.00 0.00 C ATOM 188 O LEU A 16 9.317 4.457 9.326 1.00 0.00 O ATOM 189 CB LEU A 16 11.216 5.109 12.084 1.00 0.00 C ATOM 190 CG LEU A 16 10.152 6.192 12.270 1.00 0.00 C ATOM 191 CD1 LEU A 16 10.454 7.053 13.498 1.00 0.00 C ATOM 192 CD2 LEU A 16 10.000 7.034 11.002 1.00 0.00 C ATOM 0 H LEU A 16 11.051 5.941 9.223 1.00 0.00 H new ATOM 0 HA LEU A 16 11.983 3.634 10.791 1.00 0.00 H new ATOM 0 HB2 LEU A 16 11.036 4.321 12.815 1.00 0.00 H new ATOM 0 HB3 LEU A 16 12.190 5.541 12.315 1.00 0.00 H new ATOM 0 HG LEU A 16 9.194 5.703 12.448 1.00 0.00 H new ATOM 0 HD11 LEU A 16 9.682 7.815 13.607 1.00 0.00 H new ATOM 0 HD12 LEU A 16 10.471 6.424 14.388 1.00 0.00 H new ATOM 0 HD13 LEU A 16 11.424 7.534 13.375 1.00 0.00 H new ATOM 0 HD21 LEU A 16 9.237 7.797 11.161 1.00 0.00 H new ATOM 0 HD22 LEU A 16 10.950 7.514 10.768 1.00 0.00 H new ATOM 0 HD23 LEU A 16 9.704 6.392 10.172 1.00 0.00 H new ATOM 204 N PRO A 17 9.566 2.749 10.836 1.00 0.00 N ATOM 205 CA PRO A 17 8.321 2.091 10.480 1.00 0.00 C ATOM 206 C PRO A 17 7.118 2.849 11.046 1.00 0.00 C ATOM 207 O PRO A 17 5.972 2.498 10.768 1.00 0.00 O ATOM 208 CB PRO A 17 8.448 0.681 11.035 1.00 0.00 C ATOM 209 CG PRO A 17 9.553 0.742 12.077 1.00 0.00 C ATOM 210 CD PRO A 17 10.297 2.054 11.892 1.00 0.00 C ATOM 0 HA PRO A 17 8.151 2.068 9.404 1.00 0.00 H new ATOM 0 HB2 PRO A 17 7.509 0.350 11.480 1.00 0.00 H new ATOM 0 HB3 PRO A 17 8.694 -0.029 10.245 1.00 0.00 H new ATOM 0 HG2 PRO A 17 9.134 0.679 13.081 1.00 0.00 H new ATOM 0 HG3 PRO A 17 10.233 -0.102 11.962 1.00 0.00 H new ATOM 0 HD2 PRO A 17 10.309 2.636 12.814 1.00 0.00 H new ATOM 0 HD3 PRO A 17 11.336 1.884 11.609 1.00 0.00 H new ATOM 218 N GLU A 18 7.420 3.875 11.828 1.00 0.00 N ATOM 219 CA GLU A 18 6.378 4.685 12.435 1.00 0.00 C ATOM 220 C GLU A 18 5.719 5.578 11.381 1.00 0.00 C ATOM 221 O GLU A 18 4.519 5.470 11.134 1.00 0.00 O ATOM 222 CB GLU A 18 6.936 5.520 13.589 1.00 0.00 C ATOM 223 CG GLU A 18 7.743 4.651 14.555 1.00 0.00 C ATOM 224 CD GLU A 18 7.536 5.102 16.003 1.00 0.00 C ATOM 225 OE1 GLU A 18 8.153 6.124 16.372 1.00 0.00 O ATOM 226 OE2 GLU A 18 6.765 4.414 16.707 1.00 0.00 O ATOM 0 H GLU A 18 8.372 4.164 12.055 1.00 0.00 H new ATOM 0 HA GLU A 18 5.619 4.019 12.845 1.00 0.00 H new ATOM 0 HB2 GLU A 18 7.569 6.315 13.194 1.00 0.00 H new ATOM 0 HB3 GLU A 18 6.117 6.000 14.124 1.00 0.00 H new ATOM 0 HG2 GLU A 18 7.443 3.608 14.449 1.00 0.00 H new ATOM 0 HG3 GLU A 18 8.802 4.706 14.301 1.00 0.00 H new ATOM 233 N GLU A 19 6.532 6.439 10.789 1.00 0.00 N ATOM 234 CA GLU A 19 6.043 7.350 9.767 1.00 0.00 C ATOM 235 C GLU A 19 5.226 6.586 8.723 1.00 0.00 C ATOM 236 O GLU A 19 4.200 7.075 8.253 1.00 0.00 O ATOM 237 CB GLU A 19 7.197 8.110 9.112 1.00 0.00 C ATOM 238 CG GLU A 19 7.595 9.329 9.947 1.00 0.00 C ATOM 239 CD GLU A 19 6.560 10.447 9.812 1.00 0.00 C ATOM 240 OE1 GLU A 19 6.327 10.869 8.659 1.00 0.00 O ATOM 241 OE2 GLU A 19 6.025 10.855 10.866 1.00 0.00 O ATOM 0 H GLU A 19 7.527 6.526 10.997 1.00 0.00 H new ATOM 0 HA GLU A 19 5.393 8.084 10.243 1.00 0.00 H new ATOM 0 HB2 GLU A 19 8.055 7.447 8.997 1.00 0.00 H new ATOM 0 HB3 GLU A 19 6.905 8.430 8.112 1.00 0.00 H new ATOM 0 HG2 GLU A 19 7.691 9.042 10.994 1.00 0.00 H new ATOM 0 HG3 GLU A 19 8.571 9.692 9.625 1.00 0.00 H new ATOM 248 N LEU A 20 5.712 5.399 8.390 1.00 0.00 N ATOM 249 CA LEU A 20 5.040 4.563 7.410 1.00 0.00 C ATOM 250 C LEU A 20 3.755 4.001 8.020 1.00 0.00 C ATOM 251 O LEU A 20 2.826 3.642 7.299 1.00 0.00 O ATOM 252 CB LEU A 20 5.991 3.488 6.880 1.00 0.00 C ATOM 253 CG LEU A 20 5.779 3.061 5.427 1.00 0.00 C ATOM 254 CD1 LEU A 20 5.563 4.277 4.524 1.00 0.00 C ATOM 255 CD2 LEU A 20 6.932 2.182 4.939 1.00 0.00 C ATOM 0 H LEU A 20 6.563 4.996 8.782 1.00 0.00 H new ATOM 0 HA LEU A 20 4.749 5.154 6.542 1.00 0.00 H new ATOM 0 HB2 LEU A 20 7.013 3.852 6.985 1.00 0.00 H new ATOM 0 HB3 LEU A 20 5.900 2.606 7.514 1.00 0.00 H new ATOM 0 HG LEU A 20 4.872 2.458 5.378 1.00 0.00 H new ATOM 0 HD11 LEU A 20 5.415 3.945 3.496 1.00 0.00 H new ATOM 0 HD12 LEU A 20 4.683 4.827 4.858 1.00 0.00 H new ATOM 0 HD13 LEU A 20 6.437 4.926 4.573 1.00 0.00 H new ATOM 0 HD21 LEU A 20 6.756 1.893 3.903 1.00 0.00 H new ATOM 0 HD22 LEU A 20 7.867 2.738 5.006 1.00 0.00 H new ATOM 0 HD23 LEU A 20 6.996 1.288 5.559 1.00 0.00 H new ATOM 267 N ASN A 21 3.743 3.943 9.344 1.00 0.00 N ATOM 268 CA ASN A 21 2.587 3.431 10.060 1.00 0.00 C ATOM 269 C ASN A 21 1.538 4.538 10.184 1.00 0.00 C ATOM 270 O ASN A 21 0.371 4.263 10.459 1.00 0.00 O ATOM 271 CB ASN A 21 2.969 2.982 11.472 1.00 0.00 C ATOM 272 CG ASN A 21 3.454 1.531 11.473 1.00 0.00 C ATOM 273 OD1 ASN A 21 3.210 0.766 10.554 1.00 0.00 O ATOM 274 ND2 ASN A 21 4.153 1.195 12.553 1.00 0.00 N ATOM 0 H ASN A 21 4.515 4.242 9.939 1.00 0.00 H new ATOM 0 HA ASN A 21 2.195 2.579 9.504 1.00 0.00 H new ATOM 0 HB2 ASN A 21 3.752 3.631 11.865 1.00 0.00 H new ATOM 0 HB3 ASN A 21 2.109 3.082 12.135 1.00 0.00 H new ATOM 0 HD21 ASN A 21 4.521 0.248 12.648 1.00 0.00 H new ATOM 0 HD22 ASN A 21 4.321 1.884 13.286 1.00 0.00 H new ATOM 281 N ARG A 22 1.991 5.765 9.974 1.00 0.00 N ATOM 282 CA ARG A 22 1.105 6.914 10.059 1.00 0.00 C ATOM 283 C ARG A 22 0.193 6.972 8.832 1.00 0.00 C ATOM 284 O ARG A 22 -0.991 7.286 8.949 1.00 0.00 O ATOM 285 CB ARG A 22 1.902 8.217 10.155 1.00 0.00 C ATOM 286 CG ARG A 22 2.918 8.155 11.297 1.00 0.00 C ATOM 287 CD ARG A 22 3.586 9.515 11.511 1.00 0.00 C ATOM 288 NE ARG A 22 2.853 10.282 12.542 1.00 0.00 N ATOM 289 CZ ARG A 22 3.039 10.135 13.861 1.00 0.00 C ATOM 290 NH1 ARG A 22 3.934 9.249 14.317 1.00 0.00 N ATOM 291 NH2 ARG A 22 2.329 10.874 14.724 1.00 0.00 N ATOM 0 H ARG A 22 2.959 5.989 9.745 1.00 0.00 H new ATOM 0 HA ARG A 22 0.502 6.802 10.960 1.00 0.00 H new ATOM 0 HB2 ARG A 22 2.419 8.402 9.213 1.00 0.00 H new ATOM 0 HB3 ARG A 22 1.221 9.053 10.314 1.00 0.00 H new ATOM 0 HG2 ARG A 22 2.420 7.842 12.215 1.00 0.00 H new ATOM 0 HG3 ARG A 22 3.676 7.404 11.074 1.00 0.00 H new ATOM 0 HD2 ARG A 22 4.623 9.376 11.818 1.00 0.00 H new ATOM 0 HD3 ARG A 22 3.603 10.073 10.575 1.00 0.00 H new ATOM 0 HE ARG A 22 2.163 10.965 12.229 1.00 0.00 H new ATOM 0 HH11 ARG A 22 4.474 8.686 13.660 1.00 0.00 H new ATOM 0 HH12 ARG A 22 4.075 9.137 15.321 1.00 0.00 H new ATOM 0 HH21 ARG A 22 1.647 11.548 14.377 1.00 0.00 H new ATOM 0 HH22 ARG A 22 2.470 10.762 15.728 1.00 0.00 H new ATOM 305 N VAL A 23 0.777 6.664 7.684 1.00 0.00 N ATOM 306 CA VAL A 23 0.031 6.677 6.437 1.00 0.00 C ATOM 307 C VAL A 23 -0.284 5.239 6.021 1.00 0.00 C ATOM 308 O VAL A 23 -0.587 4.978 4.858 1.00 0.00 O ATOM 309 CB VAL A 23 0.808 7.452 5.370 1.00 0.00 C ATOM 310 CG1 VAL A 23 0.812 8.951 5.675 1.00 0.00 C ATOM 311 CG2 VAL A 23 2.235 6.916 5.235 1.00 0.00 C ATOM 0 H VAL A 23 1.759 6.404 7.591 1.00 0.00 H new ATOM 0 HA VAL A 23 -0.920 7.194 6.566 1.00 0.00 H new ATOM 0 HB VAL A 23 0.303 7.306 4.415 1.00 0.00 H new ATOM 0 HG11 VAL A 23 1.371 9.478 4.902 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -0.213 9.320 5.698 1.00 0.00 H new ATOM 0 HG13 VAL A 23 1.281 9.124 6.643 1.00 0.00 H new ATOM 0 HG21 VAL A 23 2.766 7.483 4.471 1.00 0.00 H new ATOM 0 HG22 VAL A 23 2.754 7.018 6.188 1.00 0.00 H new ATOM 0 HG23 VAL A 23 2.203 5.864 4.950 1.00 0.00 H new ATOM 321 N ARG A 24 -0.200 4.344 6.994 1.00 0.00 N ATOM 322 CA ARG A 24 -0.473 2.939 6.743 1.00 0.00 C ATOM 323 C ARG A 24 -1.982 2.685 6.728 1.00 0.00 C ATOM 324 O ARG A 24 -2.702 3.150 7.611 1.00 0.00 O ATOM 325 CB ARG A 24 0.176 2.053 7.809 1.00 0.00 C ATOM 326 CG ARG A 24 -0.158 0.579 7.574 1.00 0.00 C ATOM 327 CD ARG A 24 -1.106 0.052 8.654 1.00 0.00 C ATOM 328 NE ARG A 24 -0.687 0.553 9.983 1.00 0.00 N ATOM 329 CZ ARG A 24 0.439 0.180 10.605 1.00 0.00 C ATOM 330 NH1 ARG A 24 1.266 -0.699 10.024 1.00 0.00 N ATOM 331 NH2 ARG A 24 0.738 0.686 11.810 1.00 0.00 N ATOM 0 H ARG A 24 0.053 4.564 7.957 1.00 0.00 H new ATOM 0 HA ARG A 24 -0.050 2.688 5.771 1.00 0.00 H new ATOM 0 HB2 ARG A 24 1.257 2.192 7.793 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -0.170 2.355 8.798 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -0.616 0.458 6.592 1.00 0.00 H new ATOM 0 HG3 ARG A 24 0.759 -0.010 7.572 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -2.126 0.371 8.441 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -1.105 -1.038 8.650 1.00 0.00 H new ATOM 0 HE ARG A 24 -1.294 1.224 10.454 1.00 0.00 H new ATOM 0 HH11 ARG A 24 1.038 -1.085 9.108 1.00 0.00 H new ATOM 0 HH12 ARG A 24 2.123 -0.983 10.498 1.00 0.00 H new ATOM 0 HH21 ARG A 24 0.108 1.355 12.253 1.00 0.00 H new ATOM 0 HH22 ARG A 24 1.595 0.402 12.284 1.00 0.00 H new ATOM 345 N LEU A 25 -2.416 1.948 5.716 1.00 0.00 N ATOM 346 CA LEU A 25 -3.826 1.627 5.575 1.00 0.00 C ATOM 347 C LEU A 25 -4.138 0.359 6.372 1.00 0.00 C ATOM 348 O LEU A 25 -3.245 -0.442 6.646 1.00 0.00 O ATOM 349 CB LEU A 25 -4.208 1.534 4.096 1.00 0.00 C ATOM 350 CG LEU A 25 -4.846 2.785 3.489 1.00 0.00 C ATOM 351 CD1 LEU A 25 -5.303 2.525 2.052 1.00 0.00 C ATOM 352 CD2 LEU A 25 -5.987 3.301 4.368 1.00 0.00 C ATOM 0 H LEU A 25 -1.816 1.564 4.986 1.00 0.00 H new ATOM 0 HA LEU A 25 -4.442 2.424 5.990 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -3.312 1.293 3.524 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.899 0.701 3.971 1.00 0.00 H new ATOM 0 HG LEU A 25 -4.090 3.569 3.450 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -5.753 3.430 1.644 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.445 2.240 1.443 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -6.037 1.719 2.044 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -6.423 4.191 3.913 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -6.752 2.530 4.462 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -5.601 3.551 5.356 1.00 0.00 H new ATOM 364 N SER A 26 -5.408 0.216 6.721 1.00 0.00 N ATOM 365 CA SER A 26 -5.849 -0.941 7.481 1.00 0.00 C ATOM 366 C SER A 26 -7.115 -1.528 6.853 1.00 0.00 C ATOM 367 O SER A 26 -8.010 -0.789 6.447 1.00 0.00 O ATOM 368 CB SER A 26 -6.104 -0.575 8.945 1.00 0.00 C ATOM 369 OG SER A 26 -6.551 -1.693 9.705 1.00 0.00 O ATOM 0 H SER A 26 -6.146 0.882 6.491 1.00 0.00 H new ATOM 0 HA SER A 26 -5.057 -1.689 7.455 1.00 0.00 H new ATOM 0 HB2 SER A 26 -5.188 -0.181 9.385 1.00 0.00 H new ATOM 0 HB3 SER A 26 -6.849 0.219 8.996 1.00 0.00 H new ATOM 0 HG SER A 26 -6.701 -1.418 10.634 1.00 0.00 H new ATOM 375 N ARG A 27 -7.149 -2.851 6.794 1.00 0.00 N ATOM 376 CA ARG A 27 -8.290 -3.546 6.223 1.00 0.00 C ATOM 377 C ARG A 27 -9.589 -2.830 6.598 1.00 0.00 C ATOM 378 O ARG A 27 -10.455 -2.621 5.750 1.00 0.00 O ATOM 379 CB ARG A 27 -8.354 -4.994 6.711 1.00 0.00 C ATOM 380 CG ARG A 27 -8.834 -5.927 5.597 1.00 0.00 C ATOM 381 CD ARG A 27 -8.229 -7.324 5.753 1.00 0.00 C ATOM 382 NE ARG A 27 -8.568 -7.877 7.083 1.00 0.00 N ATOM 383 CZ ARG A 27 -9.695 -8.553 7.350 1.00 0.00 C ATOM 384 NH1 ARG A 27 -10.596 -8.762 6.381 1.00 0.00 N ATOM 385 NH2 ARG A 27 -9.919 -9.018 8.586 1.00 0.00 N ATOM 0 H ARG A 27 -6.404 -3.460 7.132 1.00 0.00 H new ATOM 0 HA ARG A 27 -8.170 -3.545 5.140 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -7.369 -5.309 7.055 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -9.028 -5.064 7.565 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -9.922 -5.994 5.617 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -8.558 -5.513 4.627 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -8.606 -7.982 4.970 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -7.146 -7.276 5.635 1.00 0.00 H new ATOM 0 HE ARG A 27 -7.903 -7.735 7.844 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -10.425 -8.407 5.440 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -11.453 -9.276 6.584 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -9.233 -8.858 9.323 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -10.776 -9.532 8.790 1.00 0.00 H new ATOM 399 N HIS A 28 -9.685 -2.475 7.871 1.00 0.00 N ATOM 400 CA HIS A 28 -10.864 -1.787 8.370 1.00 0.00 C ATOM 401 C HIS A 28 -11.107 -0.521 7.545 1.00 0.00 C ATOM 402 O HIS A 28 -12.118 -0.410 6.855 1.00 0.00 O ATOM 403 CB HIS A 28 -10.735 -1.503 9.867 1.00 0.00 C ATOM 404 CG HIS A 28 -11.217 -2.630 10.750 1.00 0.00 C ATOM 405 ND1 HIS A 28 -12.554 -2.964 10.876 1.00 0.00 N ATOM 406 CD2 HIS A 28 -10.526 -3.496 11.546 1.00 0.00 C ATOM 407 CE1 HIS A 28 -12.652 -3.986 11.714 1.00 0.00 C ATOM 408 NE2 HIS A 28 -11.395 -4.314 12.128 1.00 0.00 N ATOM 0 H HIS A 28 -8.965 -2.651 8.572 1.00 0.00 H new ATOM 0 HA HIS A 28 -11.739 -2.427 8.255 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -9.690 -1.295 10.098 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -11.299 -0.602 10.105 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -9.454 -3.513 11.680 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -13.567 -4.474 12.016 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -11.161 -5.064 12.778 1.00 0.00 H new ATOM 416 N LYS A 29 -10.161 0.402 7.645 1.00 0.00 N ATOM 417 CA LYS A 29 -10.260 1.655 6.917 1.00 0.00 C ATOM 418 C LYS A 29 -10.625 1.367 5.460 1.00 0.00 C ATOM 419 O LYS A 29 -11.475 2.044 4.884 1.00 0.00 O ATOM 420 CB LYS A 29 -8.975 2.471 7.079 1.00 0.00 C ATOM 421 CG LYS A 29 -8.976 3.239 8.403 1.00 0.00 C ATOM 422 CD LYS A 29 -7.746 4.141 8.515 1.00 0.00 C ATOM 423 CE LYS A 29 -6.469 3.310 8.664 1.00 0.00 C ATOM 424 NZ LYS A 29 -5.748 3.686 9.901 1.00 0.00 N ATOM 0 H LYS A 29 -9.323 0.307 8.219 1.00 0.00 H new ATOM 0 HA LYS A 29 -11.058 2.273 7.329 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -8.111 1.807 7.040 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -8.877 3.171 6.249 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -9.881 3.842 8.477 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -8.992 2.536 9.235 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -7.672 4.773 7.630 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -7.854 4.805 9.373 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -6.719 2.249 8.690 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -5.824 3.465 7.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -4.884 3.113 9.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -5.493 4.693 9.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -6.360 3.516 10.725 1.00 0.00 H new ATOM 438 N LEU A 30 -9.965 0.360 4.906 1.00 0.00 N ATOM 439 CA LEU A 30 -10.210 -0.026 3.527 1.00 0.00 C ATOM 440 C LEU A 30 -11.662 -0.485 3.381 1.00 0.00 C ATOM 441 O LEU A 30 -12.358 -0.071 2.455 1.00 0.00 O ATOM 442 CB LEU A 30 -9.187 -1.069 3.073 1.00 0.00 C ATOM 443 CG LEU A 30 -7.760 -0.559 2.859 1.00 0.00 C ATOM 444 CD1 LEU A 30 -6.778 -1.723 2.718 1.00 0.00 C ATOM 445 CD2 LEU A 30 -7.692 0.396 1.666 1.00 0.00 C ATOM 0 H LEU A 30 -9.261 -0.200 5.387 1.00 0.00 H new ATOM 0 HA LEU A 30 -10.077 0.828 2.863 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.159 -1.868 3.814 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -9.538 -1.511 2.140 1.00 0.00 H new ATOM 0 HG LEU A 30 -7.464 0.008 3.742 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -5.771 -1.333 2.567 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -6.800 -2.330 3.623 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -7.062 -2.337 1.863 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -6.667 0.744 1.536 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -8.016 -0.124 0.765 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -8.345 1.250 1.846 1.00 0.00 H new ATOM 457 N GLU A 31 -12.077 -1.336 4.308 1.00 0.00 N ATOM 458 CA GLU A 31 -13.433 -1.856 4.294 1.00 0.00 C ATOM 459 C GLU A 31 -14.443 -0.709 4.378 1.00 0.00 C ATOM 460 O GLU A 31 -15.588 -0.852 3.952 1.00 0.00 O ATOM 461 CB GLU A 31 -13.648 -2.858 5.430 1.00 0.00 C ATOM 462 CG GLU A 31 -14.714 -3.890 5.057 1.00 0.00 C ATOM 463 CD GLU A 31 -16.018 -3.629 5.814 1.00 0.00 C ATOM 464 OE1 GLU A 31 -16.835 -2.845 5.284 1.00 0.00 O ATOM 465 OE2 GLU A 31 -16.169 -4.220 6.905 1.00 0.00 O ATOM 0 H GLU A 31 -11.497 -1.678 5.074 1.00 0.00 H new ATOM 0 HA GLU A 31 -13.588 -2.384 3.353 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -12.710 -3.365 5.655 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -13.950 -2.329 6.334 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -14.899 -3.855 3.983 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -14.351 -4.892 5.285 1.00 0.00 H new ATOM 472 N ARG A 32 -13.981 0.404 4.929 1.00 0.00 N ATOM 473 CA ARG A 32 -14.829 1.575 5.074 1.00 0.00 C ATOM 474 C ARG A 32 -14.688 2.487 3.854 1.00 0.00 C ATOM 475 O ARG A 32 -15.685 2.889 3.256 1.00 0.00 O ATOM 476 CB ARG A 32 -14.470 2.363 6.335 1.00 0.00 C ATOM 477 CG ARG A 32 -14.012 1.426 7.455 1.00 0.00 C ATOM 478 CD ARG A 32 -14.683 1.789 8.782 1.00 0.00 C ATOM 479 NE ARG A 32 -14.534 0.676 9.745 1.00 0.00 N ATOM 480 CZ ARG A 32 -15.310 0.507 10.825 1.00 0.00 C ATOM 481 NH1 ARG A 32 -16.294 1.379 11.085 1.00 0.00 N ATOM 482 NH2 ARG A 32 -15.102 -0.533 11.644 1.00 0.00 N ATOM 0 H ARG A 32 -13.030 0.520 5.280 1.00 0.00 H new ATOM 0 HA ARG A 32 -15.859 1.229 5.157 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -13.679 3.078 6.108 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -15.334 2.938 6.667 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -14.251 0.395 7.192 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -12.929 1.485 7.563 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -14.235 2.696 9.189 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -15.740 2.001 8.619 1.00 0.00 H new ATOM 0 HE ARG A 32 -13.794 -0.006 9.577 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -16.452 2.170 10.461 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -16.885 1.251 11.907 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -14.353 -1.196 11.446 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -15.693 -0.661 12.466 1.00 0.00 H new ATOM 496 N TRP A 33 -13.441 2.787 3.520 1.00 0.00 N ATOM 497 CA TRP A 33 -13.156 3.644 2.382 1.00 0.00 C ATOM 498 C TRP A 33 -13.563 2.893 1.112 1.00 0.00 C ATOM 499 O TRP A 33 -13.726 3.499 0.054 1.00 0.00 O ATOM 500 CB TRP A 33 -11.689 4.078 2.375 1.00 0.00 C ATOM 501 CG TRP A 33 -11.200 4.637 3.713 1.00 0.00 C ATOM 502 CD1 TRP A 33 -11.898 4.794 4.846 1.00 0.00 C ATOM 503 CD2 TRP A 33 -9.870 5.110 4.012 1.00 0.00 C ATOM 504 NE1 TRP A 33 -11.118 5.331 5.850 1.00 0.00 N ATOM 505 CE2 TRP A 33 -9.845 5.529 5.327 1.00 0.00 C ATOM 506 CE3 TRP A 33 -8.725 5.181 3.199 1.00 0.00 C ATOM 507 CZ2 TRP A 33 -8.701 6.049 5.944 1.00 0.00 C ATOM 508 CZ3 TRP A 33 -7.590 5.702 3.831 1.00 0.00 C ATOM 509 CH2 TRP A 33 -7.549 6.129 5.153 1.00 0.00 C ATOM 0 H TRP A 33 -12.617 2.451 4.018 1.00 0.00 H new ATOM 0 HA TRP A 33 -13.732 4.568 2.441 1.00 0.00 H new ATOM 0 HB2 TRP A 33 -11.069 3.224 2.101 1.00 0.00 H new ATOM 0 HB3 TRP A 33 -11.548 4.835 1.603 1.00 0.00 H new ATOM 0 HD1 TRP A 33 -12.940 4.533 4.959 1.00 0.00 H new ATOM 0 HE1 TRP A 33 -11.420 5.544 6.801 1.00 0.00 H new ATOM 0 HE3 TRP A 33 -8.722 4.859 2.168 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 -8.707 6.371 6.975 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 -6.682 5.778 3.251 1.00 0.00 H new ATOM 0 HH2 TRP A 33 -6.632 6.521 5.568 1.00 0.00 H new ATOM 520 N CYS A 34 -13.715 1.585 1.259 1.00 0.00 N ATOM 521 CA CYS A 34 -14.100 0.746 0.136 1.00 0.00 C ATOM 522 C CYS A 34 -15.526 1.118 -0.275 1.00 0.00 C ATOM 523 O CYS A 34 -15.971 0.771 -1.368 1.00 0.00 O ATOM 524 CB CYS A 34 -13.973 -0.741 0.473 1.00 0.00 C ATOM 525 SG CYS A 34 -15.021 -1.729 -0.655 1.00 0.00 S ATOM 0 H CYS A 34 -13.579 1.086 2.138 1.00 0.00 H new ATOM 0 HA CYS A 34 -13.425 0.921 -0.701 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -12.933 -1.055 0.385 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -14.272 -0.915 1.507 1.00 0.00 H new ATOM 0 HG CYS A 34 -15.648 -0.935 -1.472 1.00 0.00 H new ATOM 531 N HIS A 35 -16.203 1.820 0.622 1.00 0.00 N ATOM 532 CA HIS A 35 -17.569 2.243 0.366 1.00 0.00 C ATOM 533 C HIS A 35 -17.601 3.752 0.116 1.00 0.00 C ATOM 534 O HIS A 35 -18.673 4.346 0.021 1.00 0.00 O ATOM 535 CB HIS A 35 -18.494 1.811 1.505 1.00 0.00 C ATOM 536 CG HIS A 35 -19.215 0.508 1.251 1.00 0.00 C ATOM 537 ND1 HIS A 35 -20.355 0.422 0.471 1.00 0.00 N ATOM 538 CD2 HIS A 35 -18.945 -0.758 1.679 1.00 0.00 C ATOM 539 CE1 HIS A 35 -20.746 -0.843 0.440 1.00 0.00 C ATOM 540 NE2 HIS A 35 -19.871 -1.573 1.190 1.00 0.00 N ATOM 0 H HIS A 35 -15.831 2.106 1.527 1.00 0.00 H new ATOM 0 HA HIS A 35 -17.943 1.753 -0.533 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -17.908 1.718 2.419 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -19.232 2.595 1.677 1.00 0.00 H new ATOM 0 HD1 HIS A 35 -20.816 1.201 0.000 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -18.118 -1.048 2.309 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -21.606 -1.229 -0.087 1.00 0.00 H new ATOM 548 N MET A 36 -16.412 4.328 0.018 1.00 0.00 N ATOM 549 CA MET A 36 -16.290 5.756 -0.219 1.00 0.00 C ATOM 550 C MET A 36 -15.814 6.037 -1.645 1.00 0.00 C ATOM 551 O MET A 36 -15.245 5.163 -2.297 1.00 0.00 O ATOM 552 CB MET A 36 -15.297 6.356 0.779 1.00 0.00 C ATOM 553 CG MET A 36 -15.655 5.963 2.213 1.00 0.00 C ATOM 554 SD MET A 36 -17.195 6.728 2.690 1.00 0.00 S ATOM 555 CE MET A 36 -16.575 8.153 3.569 1.00 0.00 C ATOM 0 H MET A 36 -15.525 3.832 0.098 1.00 0.00 H new ATOM 0 HA MET A 36 -17.271 6.212 -0.088 1.00 0.00 H new ATOM 0 HB2 MET A 36 -14.289 6.013 0.545 1.00 0.00 H new ATOM 0 HB3 MET A 36 -15.294 7.442 0.686 1.00 0.00 H new ATOM 0 HG2 MET A 36 -15.738 4.879 2.292 1.00 0.00 H new ATOM 0 HG3 MET A 36 -14.860 6.272 2.892 1.00 0.00 H new ATOM 0 HE1 MET A 36 -17.128 8.275 4.500 1.00 0.00 H new ATOM 0 HE2 MET A 36 -15.517 8.012 3.791 1.00 0.00 H new ATOM 0 HE3 MET A 36 -16.700 9.043 2.953 1.00 0.00 H new ATOM 565 N PRO A 37 -16.070 7.293 -2.100 1.00 0.00 N ATOM 566 CA PRO A 37 -15.674 7.700 -3.438 1.00 0.00 C ATOM 567 C PRO A 37 -14.166 7.944 -3.513 1.00 0.00 C ATOM 568 O PRO A 37 -13.504 7.483 -4.442 1.00 0.00 O ATOM 569 CB PRO A 37 -16.493 8.947 -3.728 1.00 0.00 C ATOM 570 CG PRO A 37 -16.968 9.458 -2.377 1.00 0.00 C ATOM 571 CD PRO A 37 -16.742 8.355 -1.356 1.00 0.00 C ATOM 0 HA PRO A 37 -15.866 6.931 -4.186 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -15.892 9.698 -4.240 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -17.338 8.717 -4.377 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -16.420 10.357 -2.095 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -18.023 9.728 -2.420 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -16.130 8.704 -0.525 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -17.685 8.007 -0.934 1.00 0.00 H new ATOM 579 N PHE A 38 -13.666 8.668 -2.522 1.00 0.00 N ATOM 580 CA PHE A 38 -12.248 8.979 -2.464 1.00 0.00 C ATOM 581 C PHE A 38 -11.453 7.808 -1.880 1.00 0.00 C ATOM 582 O PHE A 38 -10.619 7.999 -0.997 1.00 0.00 O ATOM 583 CB PHE A 38 -12.093 10.192 -1.545 1.00 0.00 C ATOM 584 CG PHE A 38 -12.870 10.082 -0.232 1.00 0.00 C ATOM 585 CD1 PHE A 38 -12.313 9.452 0.837 1.00 0.00 C ATOM 586 CD2 PHE A 38 -14.118 10.614 -0.133 1.00 0.00 C ATOM 587 CE1 PHE A 38 -13.034 9.349 2.056 1.00 0.00 C ATOM 588 CE2 PHE A 38 -14.839 10.511 1.086 1.00 0.00 C ATOM 589 CZ PHE A 38 -14.282 9.881 2.155 1.00 0.00 C ATOM 0 H PHE A 38 -14.218 9.048 -1.753 1.00 0.00 H new ATOM 0 HA PHE A 38 -11.870 9.177 -3.467 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -11.036 10.331 -1.319 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -12.425 11.083 -2.078 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -11.322 9.030 0.759 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -14.560 11.115 -0.981 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -12.592 8.848 2.904 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -15.830 10.933 1.164 1.00 0.00 H new ATOM 0 HZ PHE A 38 -14.830 9.803 3.082 1.00 0.00 H new ATOM 599 N PHE A 39 -11.741 6.623 -2.399 1.00 0.00 N ATOM 600 CA PHE A 39 -11.063 5.422 -1.940 1.00 0.00 C ATOM 601 C PHE A 39 -9.711 5.255 -2.636 1.00 0.00 C ATOM 602 O PHE A 39 -8.664 5.434 -2.016 1.00 0.00 O ATOM 603 CB PHE A 39 -11.960 4.237 -2.304 1.00 0.00 C ATOM 604 CG PHE A 39 -11.371 2.874 -1.934 1.00 0.00 C ATOM 605 CD1 PHE A 39 -11.171 2.552 -0.628 1.00 0.00 C ATOM 606 CD2 PHE A 39 -11.047 1.985 -2.911 1.00 0.00 C ATOM 607 CE1 PHE A 39 -10.624 1.288 -0.284 1.00 0.00 C ATOM 608 CE2 PHE A 39 -10.501 0.720 -2.567 1.00 0.00 C ATOM 609 CZ PHE A 39 -10.301 0.398 -1.261 1.00 0.00 C ATOM 0 H PHE A 39 -12.434 6.469 -3.132 1.00 0.00 H new ATOM 0 HA PHE A 39 -10.883 5.483 -0.867 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -12.921 4.354 -1.803 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -12.155 4.258 -3.376 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -11.428 3.258 0.148 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -11.205 2.241 -3.948 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -10.464 1.033 0.753 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -10.245 0.014 -3.343 1.00 0.00 H new ATOM 0 HZ PHE A 39 -9.886 -0.564 -0.999 1.00 0.00 H new ATOM 619 N ALA A 40 -9.778 4.916 -3.915 1.00 0.00 N ATOM 620 CA ALA A 40 -8.571 4.723 -4.702 1.00 0.00 C ATOM 621 C ALA A 40 -7.675 5.955 -4.563 1.00 0.00 C ATOM 622 O ALA A 40 -6.464 5.829 -4.390 1.00 0.00 O ATOM 623 CB ALA A 40 -8.951 4.440 -6.157 1.00 0.00 C ATOM 0 H ALA A 40 -10.649 4.770 -4.426 1.00 0.00 H new ATOM 0 HA ALA A 40 -8.008 3.863 -4.338 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -8.046 4.295 -6.748 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -9.563 3.540 -6.205 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -9.514 5.283 -6.557 1.00 0.00 H new ATOM 629 N LYS A 41 -8.304 7.118 -4.644 1.00 0.00 N ATOM 630 CA LYS A 41 -7.579 8.372 -4.529 1.00 0.00 C ATOM 631 C LYS A 41 -6.797 8.385 -3.214 1.00 0.00 C ATOM 632 O LYS A 41 -5.606 8.692 -3.200 1.00 0.00 O ATOM 633 CB LYS A 41 -8.531 9.559 -4.690 1.00 0.00 C ATOM 634 CG LYS A 41 -7.762 10.835 -5.036 1.00 0.00 C ATOM 635 CD LYS A 41 -7.528 11.690 -3.788 1.00 0.00 C ATOM 636 CE LYS A 41 -7.771 13.171 -4.085 1.00 0.00 C ATOM 637 NZ LYS A 41 -7.228 14.013 -2.996 1.00 0.00 N ATOM 0 H LYS A 41 -9.309 7.218 -4.788 1.00 0.00 H new ATOM 0 HA LYS A 41 -6.851 8.466 -5.335 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -9.257 9.344 -5.474 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -9.092 9.707 -3.768 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -6.805 10.576 -5.488 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -8.319 11.410 -5.776 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -8.192 11.362 -2.988 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -6.507 11.549 -3.433 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -7.300 13.441 -5.030 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -8.839 13.355 -4.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -7.401 15.015 -3.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -7.696 13.767 -2.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -6.205 13.850 -2.908 1.00 0.00 H new ATOM 651 N THR A 42 -7.498 8.046 -2.142 1.00 0.00 N ATOM 652 CA THR A 42 -6.884 8.015 -0.826 1.00 0.00 C ATOM 653 C THR A 42 -5.883 6.862 -0.731 1.00 0.00 C ATOM 654 O THR A 42 -4.673 7.086 -0.706 1.00 0.00 O ATOM 655 CB THR A 42 -8.002 7.936 0.215 1.00 0.00 C ATOM 656 OG1 THR A 42 -8.745 9.136 0.020 1.00 0.00 O ATOM 657 CG2 THR A 42 -7.477 8.052 1.648 1.00 0.00 C ATOM 0 H THR A 42 -8.485 7.790 -2.158 1.00 0.00 H new ATOM 0 HA THR A 42 -6.307 8.921 -0.637 1.00 0.00 H new ATOM 0 HB THR A 42 -8.539 6.994 0.100 1.00 0.00 H new ATOM 0 HG1 THR A 42 -9.405 9.000 -0.691 1.00 0.00 H new ATOM 0 HG21 THR A 42 -8.311 7.990 2.347 1.00 0.00 H new ATOM 0 HG22 THR A 42 -6.777 7.241 1.846 1.00 0.00 H new ATOM 0 HG23 THR A 42 -6.969 9.008 1.773 1.00 0.00 H new ATOM 665 N VAL A 43 -6.424 5.654 -0.682 1.00 0.00 N ATOM 666 CA VAL A 43 -5.593 4.465 -0.591 1.00 0.00 C ATOM 667 C VAL A 43 -4.317 4.676 -1.408 1.00 0.00 C ATOM 668 O VAL A 43 -3.236 4.257 -0.998 1.00 0.00 O ATOM 669 CB VAL A 43 -6.389 3.235 -1.032 1.00 0.00 C ATOM 670 CG1 VAL A 43 -7.752 3.187 -0.338 1.00 0.00 C ATOM 671 CG2 VAL A 43 -6.546 3.200 -2.553 1.00 0.00 C ATOM 0 H VAL A 43 -7.427 5.472 -0.704 1.00 0.00 H new ATOM 0 HA VAL A 43 -5.292 4.288 0.442 1.00 0.00 H new ATOM 0 HB VAL A 43 -5.830 2.349 -0.733 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -8.298 2.303 -0.669 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -7.609 3.142 0.742 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -8.321 4.081 -0.592 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -7.115 2.316 -2.840 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -7.073 4.095 -2.885 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -5.562 3.165 -3.020 1.00 0.00 H new ATOM 681 N THR A 44 -4.485 5.326 -2.550 1.00 0.00 N ATOM 682 CA THR A 44 -3.360 5.598 -3.429 1.00 0.00 C ATOM 683 C THR A 44 -2.360 6.530 -2.743 1.00 0.00 C ATOM 684 O THR A 44 -2.641 7.712 -2.547 1.00 0.00 O ATOM 685 CB THR A 44 -3.910 6.158 -4.742 1.00 0.00 C ATOM 686 OG1 THR A 44 -4.464 5.022 -5.399 1.00 0.00 O ATOM 687 CG2 THR A 44 -2.803 6.632 -5.686 1.00 0.00 C ATOM 0 H THR A 44 -5.383 5.672 -2.887 1.00 0.00 H new ATOM 0 HA THR A 44 -2.806 4.687 -3.654 1.00 0.00 H new ATOM 0 HB THR A 44 -4.584 6.987 -4.528 1.00 0.00 H new ATOM 0 HG1 THR A 44 -5.365 4.851 -5.053 1.00 0.00 H new ATOM 0 HG21 THR A 44 -3.248 7.020 -6.602 1.00 0.00 H new ATOM 0 HG22 THR A 44 -2.224 7.419 -5.202 1.00 0.00 H new ATOM 0 HG23 THR A 44 -2.147 5.795 -5.927 1.00 0.00 H new ATOM 695 N GLY A 45 -1.213 5.964 -2.396 1.00 0.00 N ATOM 696 CA GLY A 45 -0.170 6.729 -1.735 1.00 0.00 C ATOM 697 C GLY A 45 0.094 6.195 -0.326 1.00 0.00 C ATOM 698 O GLY A 45 1.143 6.463 0.258 1.00 0.00 O ATOM 0 H GLY A 45 -0.983 4.984 -2.561 1.00 0.00 H new ATOM 0 HA2 GLY A 45 0.747 6.683 -2.323 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -0.462 7.778 -1.681 1.00 0.00 H new ATOM 702 N CYS A 46 -0.877 5.448 0.180 1.00 0.00 N ATOM 703 CA CYS A 46 -0.763 4.874 1.510 1.00 0.00 C ATOM 704 C CYS A 46 0.098 3.613 1.417 1.00 0.00 C ATOM 705 O CYS A 46 0.513 3.220 0.327 1.00 0.00 O ATOM 706 CB CYS A 46 -2.136 4.584 2.120 1.00 0.00 C ATOM 707 SG CYS A 46 -2.994 6.153 2.506 1.00 0.00 S ATOM 0 H CYS A 46 -1.746 5.227 -0.307 1.00 0.00 H new ATOM 0 HA CYS A 46 -0.285 5.590 2.178 1.00 0.00 H new ATOM 0 HB2 CYS A 46 -2.734 3.994 1.425 1.00 0.00 H new ATOM 0 HB3 CYS A 46 -2.022 3.990 3.027 1.00 0.00 H new ATOM 0 HG CYS A 46 -4.159 5.895 3.021 1.00 0.00 H new ATOM 713 N PHE A 47 0.341 3.014 2.573 1.00 0.00 N ATOM 714 CA PHE A 47 1.146 1.805 2.635 1.00 0.00 C ATOM 715 C PHE A 47 0.425 0.707 3.420 1.00 0.00 C ATOM 716 O PHE A 47 -0.048 0.941 4.531 1.00 0.00 O ATOM 717 CB PHE A 47 2.442 2.168 3.362 1.00 0.00 C ATOM 718 CG PHE A 47 3.481 2.858 2.475 1.00 0.00 C ATOM 719 CD1 PHE A 47 3.343 4.175 2.165 1.00 0.00 C ATOM 720 CD2 PHE A 47 4.542 2.154 1.997 1.00 0.00 C ATOM 721 CE1 PHE A 47 4.307 4.815 1.341 1.00 0.00 C ATOM 722 CE2 PHE A 47 5.505 2.794 1.173 1.00 0.00 C ATOM 723 CZ PHE A 47 5.368 4.111 0.863 1.00 0.00 C ATOM 0 H PHE A 47 -0.005 3.343 3.474 1.00 0.00 H new ATOM 0 HA PHE A 47 1.335 1.431 1.629 1.00 0.00 H new ATOM 0 HB2 PHE A 47 2.205 2.821 4.202 1.00 0.00 H new ATOM 0 HB3 PHE A 47 2.880 1.261 3.778 1.00 0.00 H new ATOM 0 HD1 PHE A 47 2.501 4.734 2.545 1.00 0.00 H new ATOM 0 HD2 PHE A 47 4.652 1.108 2.244 1.00 0.00 H new ATOM 0 HE1 PHE A 47 4.197 5.861 1.094 1.00 0.00 H new ATOM 0 HE2 PHE A 47 6.347 2.235 0.792 1.00 0.00 H new ATOM 0 HZ PHE A 47 6.102 4.598 0.237 1.00 0.00 H new ATOM 733 N VAL A 48 0.364 -0.468 2.811 1.00 0.00 N ATOM 734 CA VAL A 48 -0.291 -1.603 3.439 1.00 0.00 C ATOM 735 C VAL A 48 0.702 -2.762 3.548 1.00 0.00 C ATOM 736 O VAL A 48 1.624 -2.873 2.742 1.00 0.00 O ATOM 737 CB VAL A 48 -1.557 -1.972 2.663 1.00 0.00 C ATOM 738 CG1 VAL A 48 -2.551 -0.809 2.653 1.00 0.00 C ATOM 739 CG2 VAL A 48 -1.218 -2.416 1.239 1.00 0.00 C ATOM 0 H VAL A 48 0.757 -0.659 1.889 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.608 -1.349 4.451 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.029 -2.813 3.172 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.442 -1.097 2.095 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -2.829 -0.559 3.677 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.091 0.059 2.180 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.136 -2.672 0.710 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -0.712 -1.605 0.716 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.565 -3.288 1.276 1.00 0.00 H new ATOM 749 N ARG A 49 0.479 -3.597 4.552 1.00 0.00 N ATOM 750 CA ARG A 49 1.342 -4.744 4.778 1.00 0.00 C ATOM 751 C ARG A 49 0.688 -6.016 4.233 1.00 0.00 C ATOM 752 O ARG A 49 -0.411 -6.380 4.648 1.00 0.00 O ATOM 753 CB ARG A 49 1.635 -4.928 6.268 1.00 0.00 C ATOM 754 CG ARG A 49 3.006 -5.574 6.482 1.00 0.00 C ATOM 755 CD ARG A 49 3.525 -5.303 7.895 1.00 0.00 C ATOM 756 NE ARG A 49 3.218 -6.451 8.776 1.00 0.00 N ATOM 757 CZ ARG A 49 2.041 -6.632 9.392 1.00 0.00 C ATOM 758 NH1 ARG A 49 1.055 -5.741 9.226 1.00 0.00 N ATOM 759 NH2 ARG A 49 1.851 -7.704 10.173 1.00 0.00 N ATOM 0 H ARG A 49 -0.287 -3.502 5.219 1.00 0.00 H new ATOM 0 HA ARG A 49 2.281 -4.561 4.255 1.00 0.00 H new ATOM 0 HB2 ARG A 49 1.602 -3.961 6.771 1.00 0.00 H new ATOM 0 HB3 ARG A 49 0.862 -5.549 6.720 1.00 0.00 H new ATOM 0 HG2 ARG A 49 2.935 -6.649 6.317 1.00 0.00 H new ATOM 0 HG3 ARG A 49 3.714 -5.185 5.750 1.00 0.00 H new ATOM 0 HD2 ARG A 49 4.601 -5.131 7.869 1.00 0.00 H new ATOM 0 HD3 ARG A 49 3.067 -4.397 8.292 1.00 0.00 H new ATOM 0 HE ARG A 49 3.947 -7.148 8.924 1.00 0.00 H new ATOM 0 HH11 ARG A 49 1.200 -4.925 8.631 1.00 0.00 H new ATOM 0 HH12 ARG A 49 0.159 -5.878 9.694 1.00 0.00 H new ATOM 0 HH21 ARG A 49 2.602 -8.383 10.299 1.00 0.00 H new ATOM 0 HH22 ARG A 49 0.955 -7.841 10.642 1.00 0.00 H new ATOM 773 N ILE A 50 1.392 -6.656 3.311 1.00 0.00 N ATOM 774 CA ILE A 50 0.894 -7.879 2.705 1.00 0.00 C ATOM 775 C ILE A 50 1.550 -9.084 3.384 1.00 0.00 C ATOM 776 O ILE A 50 2.636 -8.966 3.950 1.00 0.00 O ATOM 777 CB ILE A 50 1.093 -7.845 1.188 1.00 0.00 C ATOM 778 CG1 ILE A 50 0.069 -8.736 0.481 1.00 0.00 C ATOM 779 CG2 ILE A 50 2.530 -8.214 0.815 1.00 0.00 C ATOM 780 CD1 ILE A 50 -1.321 -8.098 0.502 1.00 0.00 C ATOM 0 H ILE A 50 2.303 -6.351 2.969 1.00 0.00 H new ATOM 0 HA ILE A 50 -0.181 -7.971 2.861 1.00 0.00 H new ATOM 0 HB ILE A 50 0.924 -6.825 0.844 1.00 0.00 H new ATOM 0 HG12 ILE A 50 0.380 -8.905 -0.550 1.00 0.00 H new ATOM 0 HG13 ILE A 50 0.033 -9.711 0.967 1.00 0.00 H new ATOM 0 HG21 ILE A 50 2.644 -8.182 -0.269 1.00 0.00 H new ATOM 0 HG22 ILE A 50 3.219 -7.504 1.274 1.00 0.00 H new ATOM 0 HG23 ILE A 50 2.752 -9.219 1.174 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -2.029 -8.752 -0.007 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.639 -7.952 1.534 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.287 -7.134 -0.006 1.00 0.00 H new ATOM 792 N GLY A 51 0.863 -10.214 3.305 1.00 0.00 N ATOM 793 CA GLY A 51 1.365 -11.438 3.905 1.00 0.00 C ATOM 794 C GLY A 51 1.582 -12.520 2.844 1.00 0.00 C ATOM 795 O GLY A 51 0.792 -13.457 2.738 1.00 0.00 O ATOM 0 H GLY A 51 -0.037 -10.308 2.835 1.00 0.00 H new ATOM 0 HA2 GLY A 51 2.304 -11.236 4.421 1.00 0.00 H new ATOM 0 HA3 GLY A 51 0.660 -11.795 4.655 1.00 0.00 H new ATOM 799 N ILE A 52 2.656 -12.353 2.087 1.00 0.00 N ATOM 800 CA ILE A 52 2.986 -13.304 1.038 1.00 0.00 C ATOM 801 C ILE A 52 2.615 -14.715 1.499 1.00 0.00 C ATOM 802 O ILE A 52 2.053 -15.494 0.732 1.00 0.00 O ATOM 803 CB ILE A 52 4.452 -13.157 0.625 1.00 0.00 C ATOM 804 CG1 ILE A 52 5.384 -13.407 1.813 1.00 0.00 C ATOM 805 CG2 ILE A 52 4.705 -11.796 -0.026 1.00 0.00 C ATOM 806 CD1 ILE A 52 5.397 -12.207 2.761 1.00 0.00 C ATOM 0 H ILE A 52 3.309 -11.574 2.178 1.00 0.00 H new ATOM 0 HA ILE A 52 2.403 -13.099 0.140 1.00 0.00 H new ATOM 0 HB ILE A 52 4.674 -13.917 -0.124 1.00 0.00 H new ATOM 0 HG12 ILE A 52 5.061 -14.298 2.352 1.00 0.00 H new ATOM 0 HG13 ILE A 52 6.394 -13.601 1.453 1.00 0.00 H new ATOM 0 HG21 ILE A 52 5.754 -11.718 -0.310 1.00 0.00 H new ATOM 0 HG22 ILE A 52 4.081 -11.696 -0.914 1.00 0.00 H new ATOM 0 HG23 ILE A 52 4.460 -11.003 0.681 1.00 0.00 H new ATOM 0 HD11 ILE A 52 6.067 -12.411 3.596 1.00 0.00 H new ATOM 0 HD12 ILE A 52 5.744 -11.324 2.225 1.00 0.00 H new ATOM 0 HD13 ILE A 52 4.390 -12.030 3.138 1.00 0.00 H new ATOM 917 N VAL A 60 5.774 -14.358 7.516 1.00 0.00 N ATOM 918 CA VAL A 60 6.406 -13.597 6.452 1.00 0.00 C ATOM 919 C VAL A 60 5.465 -12.478 6.002 1.00 0.00 C ATOM 920 O VAL A 60 4.308 -12.731 5.670 1.00 0.00 O ATOM 921 CB VAL A 60 6.813 -14.531 5.311 1.00 0.00 C ATOM 922 CG1 VAL A 60 7.681 -13.798 4.285 1.00 0.00 C ATOM 923 CG2 VAL A 60 7.528 -15.773 5.847 1.00 0.00 C ATOM 0 HA VAL A 60 7.321 -13.127 6.811 1.00 0.00 H new ATOM 0 HB VAL A 60 5.904 -14.860 4.807 1.00 0.00 H new ATOM 0 HG11 VAL A 60 7.956 -14.485 3.485 1.00 0.00 H new ATOM 0 HG12 VAL A 60 7.122 -12.960 3.868 1.00 0.00 H new ATOM 0 HG13 VAL A 60 8.583 -13.426 4.771 1.00 0.00 H new ATOM 0 HG21 VAL A 60 7.806 -16.420 5.015 1.00 0.00 H new ATOM 0 HG22 VAL A 60 8.425 -15.471 6.388 1.00 0.00 H new ATOM 0 HG23 VAL A 60 6.863 -16.314 6.520 1.00 0.00 H new ATOM 933 N TYR A 61 5.997 -11.264 6.005 1.00 0.00 N ATOM 934 CA TYR A 61 5.218 -10.105 5.601 1.00 0.00 C ATOM 935 C TYR A 61 6.069 -9.132 4.782 1.00 0.00 C ATOM 936 O TYR A 61 7.291 -9.104 4.918 1.00 0.00 O ATOM 937 CB TYR A 61 4.783 -9.417 6.897 1.00 0.00 C ATOM 938 CG TYR A 61 3.528 -10.022 7.530 1.00 0.00 C ATOM 939 CD1 TYR A 61 2.282 -9.713 7.024 1.00 0.00 C ATOM 940 CD2 TYR A 61 3.643 -10.876 8.608 1.00 0.00 C ATOM 941 CE1 TYR A 61 1.101 -10.281 7.621 1.00 0.00 C ATOM 942 CE2 TYR A 61 2.462 -11.445 9.205 1.00 0.00 C ATOM 943 CZ TYR A 61 1.249 -11.119 8.682 1.00 0.00 C ATOM 944 OH TYR A 61 0.134 -11.657 9.245 1.00 0.00 O ATOM 0 H TYR A 61 6.957 -11.058 6.281 1.00 0.00 H new ATOM 0 HA TYR A 61 4.372 -10.407 4.984 1.00 0.00 H new ATOM 0 HB2 TYR A 61 5.601 -9.468 7.616 1.00 0.00 H new ATOM 0 HB3 TYR A 61 4.602 -8.362 6.693 1.00 0.00 H new ATOM 0 HD1 TYR A 61 2.192 -9.045 6.180 1.00 0.00 H new ATOM 0 HD2 TYR A 61 4.618 -11.118 9.004 1.00 0.00 H new ATOM 0 HE1 TYR A 61 0.120 -10.047 7.235 1.00 0.00 H new ATOM 0 HE2 TYR A 61 2.538 -12.115 10.049 1.00 0.00 H new ATOM 0 HH TYR A 61 0.392 -12.237 9.992 1.00 0.00 H new ATOM 954 N ARG A 62 5.388 -8.357 3.950 1.00 0.00 N ATOM 955 CA ARG A 62 6.066 -7.385 3.109 1.00 0.00 C ATOM 956 C ARG A 62 5.320 -6.049 3.136 1.00 0.00 C ATOM 957 O ARG A 62 4.114 -6.012 3.371 1.00 0.00 O ATOM 958 CB ARG A 62 6.163 -7.879 1.665 1.00 0.00 C ATOM 959 CG ARG A 62 6.618 -9.339 1.614 1.00 0.00 C ATOM 960 CD ARG A 62 8.092 -9.440 1.218 1.00 0.00 C ATOM 961 NE ARG A 62 8.210 -9.689 -0.237 1.00 0.00 N ATOM 962 CZ ARG A 62 8.215 -10.908 -0.792 1.00 0.00 C ATOM 963 NH1 ARG A 62 8.109 -11.997 -0.019 1.00 0.00 N ATOM 964 NH2 ARG A 62 8.326 -11.038 -2.121 1.00 0.00 N ATOM 0 H ARG A 62 4.374 -8.383 3.840 1.00 0.00 H new ATOM 0 HA ARG A 62 7.074 -7.250 3.503 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.193 -7.779 1.177 1.00 0.00 H new ATOM 0 HB3 ARG A 62 6.865 -7.256 1.110 1.00 0.00 H new ATOM 0 HG2 ARG A 62 6.467 -9.805 2.588 1.00 0.00 H new ATOM 0 HG3 ARG A 62 6.007 -9.889 0.899 1.00 0.00 H new ATOM 0 HD2 ARG A 62 8.612 -8.519 1.481 1.00 0.00 H new ATOM 0 HD3 ARG A 62 8.572 -10.246 1.773 1.00 0.00 H new ATOM 0 HE ARG A 62 8.293 -8.882 -0.855 1.00 0.00 H new ATOM 0 HH11 ARG A 62 8.024 -11.898 0.993 1.00 0.00 H new ATOM 0 HH12 ARG A 62 8.113 -12.925 -0.442 1.00 0.00 H new ATOM 0 HH21 ARG A 62 8.407 -10.209 -2.710 1.00 0.00 H new ATOM 0 HH22 ARG A 62 8.330 -11.966 -2.544 1.00 0.00 H new ATOM 978 N VAL A 63 6.070 -4.985 2.890 1.00 0.00 N ATOM 979 CA VAL A 63 5.495 -3.650 2.883 1.00 0.00 C ATOM 980 C VAL A 63 5.408 -3.145 1.441 1.00 0.00 C ATOM 981 O VAL A 63 6.420 -3.063 0.747 1.00 0.00 O ATOM 982 CB VAL A 63 6.306 -2.726 3.793 1.00 0.00 C ATOM 983 CG1 VAL A 63 5.777 -1.291 3.729 1.00 0.00 C ATOM 984 CG2 VAL A 63 6.316 -3.243 5.232 1.00 0.00 C ATOM 0 H VAL A 63 7.070 -5.020 2.694 1.00 0.00 H new ATOM 0 HA VAL A 63 4.481 -3.668 3.283 1.00 0.00 H new ATOM 0 HB VAL A 63 7.335 -2.720 3.433 1.00 0.00 H new ATOM 0 HG11 VAL A 63 6.371 -0.655 4.385 1.00 0.00 H new ATOM 0 HG12 VAL A 63 5.847 -0.923 2.705 1.00 0.00 H new ATOM 0 HG13 VAL A 63 4.736 -1.272 4.051 1.00 0.00 H new ATOM 0 HG21 VAL A 63 6.900 -2.567 5.857 1.00 0.00 H new ATOM 0 HG22 VAL A 63 5.294 -3.293 5.608 1.00 0.00 H new ATOM 0 HG23 VAL A 63 6.762 -4.237 5.258 1.00 0.00 H new ATOM 994 N ALA A 64 4.190 -2.820 1.034 1.00 0.00 N ATOM 995 CA ALA A 64 3.958 -2.325 -0.312 1.00 0.00 C ATOM 996 C ALA A 64 3.211 -0.992 -0.239 1.00 0.00 C ATOM 997 O ALA A 64 2.595 -0.676 0.778 1.00 0.00 O ATOM 998 CB ALA A 64 3.195 -3.378 -1.119 1.00 0.00 C ATOM 0 H ALA A 64 3.353 -2.890 1.613 1.00 0.00 H new ATOM 0 HA ALA A 64 4.904 -2.145 -0.823 1.00 0.00 H new ATOM 0 HB1 ALA A 64 3.021 -3.007 -2.129 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.781 -4.296 -1.166 1.00 0.00 H new ATOM 0 HB3 ALA A 64 2.239 -3.583 -0.638 1.00 0.00 H new ATOM 1004 N GLU A 65 3.289 -0.246 -1.331 1.00 0.00 N ATOM 1005 CA GLU A 65 2.627 1.046 -1.404 1.00 0.00 C ATOM 1006 C GLU A 65 1.554 1.032 -2.494 1.00 0.00 C ATOM 1007 O GLU A 65 1.838 0.702 -3.645 1.00 0.00 O ATOM 1008 CB GLU A 65 3.639 2.167 -1.645 1.00 0.00 C ATOM 1009 CG GLU A 65 2.935 3.516 -1.808 1.00 0.00 C ATOM 1010 CD GLU A 65 3.869 4.549 -2.441 1.00 0.00 C ATOM 1011 OE1 GLU A 65 4.372 4.257 -3.547 1.00 0.00 O ATOM 1012 OE2 GLU A 65 4.059 5.608 -1.805 1.00 0.00 O ATOM 0 H GLU A 65 3.800 -0.511 -2.173 1.00 0.00 H new ATOM 0 HA GLU A 65 2.142 1.239 -0.447 1.00 0.00 H new ATOM 0 HB2 GLU A 65 4.338 2.216 -0.810 1.00 0.00 H new ATOM 0 HB3 GLU A 65 4.224 1.948 -2.538 1.00 0.00 H new ATOM 0 HG2 GLU A 65 2.047 3.394 -2.429 1.00 0.00 H new ATOM 0 HG3 GLU A 65 2.597 3.874 -0.835 1.00 0.00 H new ATOM 1019 N ILE A 66 0.344 1.395 -2.094 1.00 0.00 N ATOM 1020 CA ILE A 66 -0.772 1.428 -3.023 1.00 0.00 C ATOM 1021 C ILE A 66 -0.491 2.462 -4.115 1.00 0.00 C ATOM 1022 O ILE A 66 -0.256 3.633 -3.820 1.00 0.00 O ATOM 1023 CB ILE A 66 -2.085 1.666 -2.274 1.00 0.00 C ATOM 1024 CG1 ILE A 66 -2.311 0.593 -1.208 1.00 0.00 C ATOM 1025 CG2 ILE A 66 -3.262 1.763 -3.248 1.00 0.00 C ATOM 1026 CD1 ILE A 66 -3.300 1.075 -0.145 1.00 0.00 C ATOM 0 H ILE A 66 0.112 1.669 -1.139 1.00 0.00 H new ATOM 0 HA ILE A 66 -0.884 0.464 -3.518 1.00 0.00 H new ATOM 0 HB ILE A 66 -2.014 2.623 -1.757 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -2.689 -0.316 -1.676 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -1.362 0.338 -0.737 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -4.183 1.932 -2.690 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -3.097 2.592 -3.936 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -3.345 0.834 -3.812 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -3.443 0.293 0.601 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -2.907 1.970 0.338 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -4.256 1.306 -0.615 1.00 0.00 H new ATOM 1038 N THR A 67 -0.525 1.992 -5.353 1.00 0.00 N ATOM 1039 CA THR A 67 -0.276 2.861 -6.491 1.00 0.00 C ATOM 1040 C THR A 67 -1.588 3.196 -7.203 1.00 0.00 C ATOM 1041 O THR A 67 -1.628 4.083 -8.054 1.00 0.00 O ATOM 1042 CB THR A 67 0.749 2.175 -7.396 1.00 0.00 C ATOM 1043 OG1 THR A 67 -0.011 1.200 -8.104 1.00 0.00 O ATOM 1044 CG2 THR A 67 1.768 1.351 -6.606 1.00 0.00 C ATOM 0 H THR A 67 -0.721 1.020 -5.593 1.00 0.00 H new ATOM 0 HA THR A 67 0.139 3.818 -6.174 1.00 0.00 H new ATOM 0 HB THR A 67 1.271 2.926 -7.989 1.00 0.00 H new ATOM 0 HG1 THR A 67 0.576 0.709 -8.716 1.00 0.00 H new ATOM 0 HG21 THR A 67 2.472 0.885 -7.295 1.00 0.00 H new ATOM 0 HG22 THR A 67 2.309 2.002 -5.920 1.00 0.00 H new ATOM 0 HG23 THR A 67 1.250 0.577 -6.039 1.00 0.00 H new ATOM 1052 N GLY A 68 -2.630 2.467 -6.829 1.00 0.00 N ATOM 1053 CA GLY A 68 -3.940 2.675 -7.422 1.00 0.00 C ATOM 1054 C GLY A 68 -4.913 1.571 -7.002 1.00 0.00 C ATOM 1055 O GLY A 68 -4.610 0.777 -6.113 1.00 0.00 O ATOM 0 H GLY A 68 -2.593 1.732 -6.123 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -4.332 3.645 -7.117 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -3.853 2.694 -8.508 1.00 0.00 H new ATOM 1059 N VAL A 69 -6.061 1.557 -7.663 1.00 0.00 N ATOM 1060 CA VAL A 69 -7.081 0.564 -7.370 1.00 0.00 C ATOM 1061 C VAL A 69 -7.635 0.005 -8.682 1.00 0.00 C ATOM 1062 O VAL A 69 -8.124 0.758 -9.523 1.00 0.00 O ATOM 1063 CB VAL A 69 -8.162 1.172 -6.474 1.00 0.00 C ATOM 1064 CG1 VAL A 69 -9.346 0.216 -6.318 1.00 0.00 C ATOM 1065 CG2 VAL A 69 -7.589 1.563 -5.111 1.00 0.00 C ATOM 0 H VAL A 69 -6.308 2.217 -8.400 1.00 0.00 H new ATOM 0 HA VAL A 69 -6.652 -0.272 -6.817 1.00 0.00 H new ATOM 0 HB VAL A 69 -8.526 2.079 -6.956 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -10.100 0.672 -5.677 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -9.779 0.010 -7.297 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -9.004 -0.717 -5.869 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -8.378 1.992 -4.494 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -7.185 0.678 -4.619 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -6.795 2.297 -5.247 1.00 0.00 H new ATOM 1075 N VAL A 70 -7.540 -1.309 -8.816 1.00 0.00 N ATOM 1076 CA VAL A 70 -8.025 -1.977 -10.011 1.00 0.00 C ATOM 1077 C VAL A 70 -9.413 -2.561 -9.736 1.00 0.00 C ATOM 1078 O VAL A 70 -9.946 -2.412 -8.638 1.00 0.00 O ATOM 1079 CB VAL A 70 -7.014 -3.030 -10.470 1.00 0.00 C ATOM 1080 CG1 VAL A 70 -5.714 -2.373 -10.938 1.00 0.00 C ATOM 1081 CG2 VAL A 70 -6.746 -4.051 -9.364 1.00 0.00 C ATOM 0 H VAL A 70 -7.134 -1.930 -8.116 1.00 0.00 H new ATOM 0 HA VAL A 70 -8.128 -1.266 -10.831 1.00 0.00 H new ATOM 0 HB VAL A 70 -7.445 -3.562 -11.318 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -5.012 -3.143 -11.259 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -5.924 -1.703 -11.772 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -5.278 -1.804 -10.117 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -6.024 -4.788 -9.716 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -6.346 -3.541 -8.488 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -7.677 -4.553 -9.099 1.00 0.00 H new ATOM 1091 N GLU A 71 -9.957 -3.213 -10.753 1.00 0.00 N ATOM 1092 CA GLU A 71 -11.272 -3.820 -10.634 1.00 0.00 C ATOM 1093 C GLU A 71 -11.257 -5.236 -11.213 1.00 0.00 C ATOM 1094 O GLU A 71 -10.992 -5.423 -12.399 1.00 0.00 O ATOM 1095 CB GLU A 71 -12.337 -2.959 -11.317 1.00 0.00 C ATOM 1096 CG GLU A 71 -12.468 -3.322 -12.798 1.00 0.00 C ATOM 1097 CD GLU A 71 -13.416 -2.359 -13.516 1.00 0.00 C ATOM 1098 OE1 GLU A 71 -14.641 -2.582 -13.407 1.00 0.00 O ATOM 1099 OE2 GLU A 71 -12.894 -1.423 -14.159 1.00 0.00 O ATOM 0 H GLU A 71 -9.512 -3.334 -11.663 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.527 -3.884 -9.576 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -13.296 -3.098 -10.819 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -12.076 -1.905 -11.219 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -11.487 -3.293 -13.272 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -12.838 -4.343 -12.895 1.00 0.00 H new ATOM 1106 N THR A 72 -11.546 -6.198 -10.348 1.00 0.00 N ATOM 1107 CA THR A 72 -11.569 -7.591 -10.759 1.00 0.00 C ATOM 1108 C THR A 72 -12.964 -7.979 -11.252 1.00 0.00 C ATOM 1109 O THR A 72 -13.857 -7.136 -11.325 1.00 0.00 O ATOM 1110 CB THR A 72 -11.084 -8.439 -9.582 1.00 0.00 C ATOM 1111 OG1 THR A 72 -12.117 -8.307 -8.609 1.00 0.00 O ATOM 1112 CG2 THR A 72 -9.851 -7.843 -8.899 1.00 0.00 C ATOM 0 H THR A 72 -11.766 -6.040 -9.365 1.00 0.00 H new ATOM 0 HA THR A 72 -10.900 -7.765 -11.602 1.00 0.00 H new ATOM 0 HB THR A 72 -10.855 -9.446 -9.931 1.00 0.00 H new ATOM 0 HG1 THR A 72 -12.595 -9.158 -8.522 1.00 0.00 H new ATOM 0 HG21 THR A 72 -9.548 -8.484 -8.071 1.00 0.00 H new ATOM 0 HG22 THR A 72 -9.036 -7.771 -9.619 1.00 0.00 H new ATOM 0 HG23 THR A 72 -10.090 -6.849 -8.520 1.00 0.00 H new ATOM 1120 N ALA A 73 -13.109 -9.255 -11.578 1.00 0.00 N ATOM 1121 CA ALA A 73 -14.380 -9.764 -12.063 1.00 0.00 C ATOM 1122 C ALA A 73 -15.044 -10.596 -10.963 1.00 0.00 C ATOM 1123 O ALA A 73 -16.269 -10.690 -10.906 1.00 0.00 O ATOM 1124 CB ALA A 73 -14.154 -10.568 -13.345 1.00 0.00 C ATOM 0 H ALA A 73 -12.367 -9.952 -11.516 1.00 0.00 H new ATOM 0 HA ALA A 73 -15.053 -8.943 -12.308 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -15.108 -10.950 -13.708 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.708 -9.925 -14.104 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.485 -11.403 -13.138 1.00 0.00 H new ATOM 1130 N LYS A 74 -14.206 -11.177 -10.117 1.00 0.00 N ATOM 1131 CA LYS A 74 -14.696 -11.997 -9.023 1.00 0.00 C ATOM 1132 C LYS A 74 -14.825 -11.136 -7.764 1.00 0.00 C ATOM 1133 O LYS A 74 -14.085 -10.169 -7.591 1.00 0.00 O ATOM 1134 CB LYS A 74 -13.807 -13.228 -8.837 1.00 0.00 C ATOM 1135 CG LYS A 74 -14.432 -14.210 -7.844 1.00 0.00 C ATOM 1136 CD LYS A 74 -14.316 -15.650 -8.349 1.00 0.00 C ATOM 1137 CE LYS A 74 -13.058 -16.324 -7.798 1.00 0.00 C ATOM 1138 NZ LYS A 74 -13.068 -17.772 -8.106 1.00 0.00 N ATOM 0 H LYS A 74 -13.190 -11.096 -10.167 1.00 0.00 H new ATOM 0 HA LYS A 74 -15.690 -12.381 -9.250 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -13.658 -13.722 -9.797 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -12.824 -12.921 -8.480 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -13.937 -14.119 -6.877 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -15.481 -13.958 -7.690 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -15.198 -16.217 -8.049 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -14.289 -15.656 -9.439 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -12.171 -15.860 -8.230 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -13.002 -16.176 -6.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -12.207 -18.214 -7.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -13.904 -18.213 -7.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -13.099 -17.907 -9.137 1.00 0.00 H new ATOM 1152 N VAL A 75 -15.770 -11.519 -6.919 1.00 0.00 N ATOM 1153 CA VAL A 75 -16.006 -10.794 -5.682 1.00 0.00 C ATOM 1154 C VAL A 75 -15.736 -11.720 -4.494 1.00 0.00 C ATOM 1155 O VAL A 75 -15.918 -12.932 -4.593 1.00 0.00 O ATOM 1156 CB VAL A 75 -17.421 -10.213 -5.677 1.00 0.00 C ATOM 1157 CG1 VAL A 75 -17.829 -9.773 -4.269 1.00 0.00 C ATOM 1158 CG2 VAL A 75 -17.542 -9.056 -6.670 1.00 0.00 C ATOM 0 H VAL A 75 -16.382 -12.322 -7.066 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.322 -9.949 -5.598 1.00 0.00 H new ATOM 0 HB VAL A 75 -18.107 -10.999 -5.994 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -18.839 -9.364 -4.294 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.802 -10.631 -3.597 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -17.137 -9.010 -3.911 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -18.558 -8.661 -6.647 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -16.840 -8.268 -6.398 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -17.315 -9.413 -7.674 1.00 0.00 H new ATOM 1168 N TYR A 76 -15.306 -11.113 -3.397 1.00 0.00 N ATOM 1169 CA TYR A 76 -15.009 -11.868 -2.192 1.00 0.00 C ATOM 1170 C TYR A 76 -15.440 -11.098 -0.942 1.00 0.00 C ATOM 1171 O TYR A 76 -15.595 -9.878 -0.983 1.00 0.00 O ATOM 1172 CB TYR A 76 -13.489 -12.044 -2.168 1.00 0.00 C ATOM 1173 CG TYR A 76 -12.709 -10.731 -2.260 1.00 0.00 C ATOM 1174 CD1 TYR A 76 -12.439 -10.007 -1.116 1.00 0.00 C ATOM 1175 CD2 TYR A 76 -12.276 -10.270 -3.487 1.00 0.00 C ATOM 1176 CE1 TYR A 76 -11.705 -8.771 -1.203 1.00 0.00 C ATOM 1177 CE2 TYR A 76 -11.541 -9.034 -3.573 1.00 0.00 C ATOM 1178 CZ TYR A 76 -11.292 -8.346 -2.427 1.00 0.00 C ATOM 1179 OH TYR A 76 -10.599 -7.179 -2.509 1.00 0.00 O ATOM 0 H TYR A 76 -15.156 -10.107 -3.318 1.00 0.00 H new ATOM 0 HA TYR A 76 -15.540 -12.820 -2.195 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -13.208 -12.558 -1.249 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -13.195 -12.688 -2.997 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -12.778 -10.367 -0.156 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -12.488 -10.836 -4.382 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -11.487 -8.195 -0.316 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -11.196 -8.662 -4.526 1.00 0.00 H new ATOM 0 HH TYR A 76 -10.576 -6.877 -3.441 1.00 0.00 H new ATOM 1189 N GLN A 77 -15.623 -11.842 0.139 1.00 0.00 N ATOM 1190 CA GLN A 77 -16.033 -11.244 1.398 1.00 0.00 C ATOM 1191 C GLN A 77 -14.876 -10.454 2.013 1.00 0.00 C ATOM 1192 O GLN A 77 -13.712 -10.806 1.829 1.00 0.00 O ATOM 1193 CB GLN A 77 -16.547 -12.309 2.369 1.00 0.00 C ATOM 1194 CG GLN A 77 -17.206 -11.665 3.591 1.00 0.00 C ATOM 1195 CD GLN A 77 -17.490 -12.708 4.673 1.00 0.00 C ATOM 1196 OE1 GLN A 77 -17.532 -13.902 4.426 1.00 0.00 O ATOM 1197 NE2 GLN A 77 -17.684 -12.193 5.884 1.00 0.00 N ATOM 0 H GLN A 77 -15.495 -12.853 0.169 1.00 0.00 H new ATOM 0 HA GLN A 77 -16.853 -10.554 1.200 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -17.265 -12.953 1.861 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -15.721 -12.944 2.689 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -16.556 -10.887 3.992 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -18.136 -11.181 3.294 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -17.635 -11.184 6.023 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -17.882 -12.807 6.674 1.00 0.00 H new ATOM 1206 N LEU A 78 -15.237 -9.401 2.731 1.00 0.00 N ATOM 1207 CA LEU A 78 -14.243 -8.558 3.375 1.00 0.00 C ATOM 1208 C LEU A 78 -14.852 -7.924 4.627 1.00 0.00 C ATOM 1209 O LEU A 78 -15.399 -6.824 4.567 1.00 0.00 O ATOM 1210 CB LEU A 78 -13.681 -7.539 2.381 1.00 0.00 C ATOM 1211 CG LEU A 78 -12.933 -6.351 2.990 1.00 0.00 C ATOM 1212 CD1 LEU A 78 -11.557 -6.776 3.506 1.00 0.00 C ATOM 1213 CD2 LEU A 78 -12.840 -5.194 1.994 1.00 0.00 C ATOM 0 H LEU A 78 -16.204 -9.112 2.881 1.00 0.00 H new ATOM 0 HA LEU A 78 -13.391 -9.154 3.702 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -13.006 -8.058 1.701 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -14.505 -7.155 1.780 1.00 0.00 H new ATOM 0 HG LEU A 78 -13.501 -5.992 3.848 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -11.046 -5.913 3.934 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -11.676 -7.543 4.271 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -10.966 -7.175 2.681 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -12.304 -4.362 2.451 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -12.306 -5.523 1.103 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -13.843 -4.871 1.717 1.00 0.00 H new ATOM 1225 N GLY A 79 -14.737 -8.646 5.732 1.00 0.00 N ATOM 1226 CA GLY A 79 -15.269 -8.168 6.997 1.00 0.00 C ATOM 1227 C GLY A 79 -16.797 -8.094 6.956 1.00 0.00 C ATOM 1228 O GLY A 79 -17.408 -7.368 7.738 1.00 0.00 O ATOM 0 H GLY A 79 -14.283 -9.558 5.778 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -14.955 -8.832 7.802 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -14.859 -7.183 7.219 1.00 0.00 H new ATOM 1232 N GLY A 80 -17.370 -8.855 6.035 1.00 0.00 N ATOM 1233 CA GLY A 80 -18.815 -8.885 5.882 1.00 0.00 C ATOM 1234 C GLY A 80 -19.231 -8.363 4.505 1.00 0.00 C ATOM 1235 O GLY A 80 -20.122 -8.923 3.868 1.00 0.00 O ATOM 0 H GLY A 80 -16.860 -9.455 5.387 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -19.177 -9.905 6.013 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -19.279 -8.279 6.660 1.00 0.00 H new ATOM 1239 N THR A 81 -18.566 -7.296 4.086 1.00 0.00 N ATOM 1240 CA THR A 81 -18.856 -6.692 2.797 1.00 0.00 C ATOM 1241 C THR A 81 -18.089 -7.413 1.686 1.00 0.00 C ATOM 1242 O THR A 81 -16.964 -7.864 1.896 1.00 0.00 O ATOM 1243 CB THR A 81 -18.531 -5.200 2.890 1.00 0.00 C ATOM 1244 OG1 THR A 81 -19.053 -4.655 1.681 1.00 0.00 O ATOM 1245 CG2 THR A 81 -17.029 -4.922 2.806 1.00 0.00 C ATOM 0 H THR A 81 -17.827 -6.834 4.617 1.00 0.00 H new ATOM 0 HA THR A 81 -19.910 -6.794 2.540 1.00 0.00 H new ATOM 0 HB THR A 81 -18.922 -4.801 3.826 1.00 0.00 H new ATOM 0 HG1 THR A 81 -19.218 -3.696 1.799 1.00 0.00 H new ATOM 0 HG21 THR A 81 -16.853 -3.849 2.877 1.00 0.00 H new ATOM 0 HG22 THR A 81 -16.519 -5.428 3.626 1.00 0.00 H new ATOM 0 HG23 THR A 81 -16.643 -5.291 1.856 1.00 0.00 H new ATOM 1253 N ARG A 82 -18.729 -7.498 0.529 1.00 0.00 N ATOM 1254 CA ARG A 82 -18.121 -8.156 -0.615 1.00 0.00 C ATOM 1255 C ARG A 82 -17.582 -7.117 -1.600 1.00 0.00 C ATOM 1256 O ARG A 82 -18.353 -6.382 -2.216 1.00 0.00 O ATOM 1257 CB ARG A 82 -19.130 -9.055 -1.333 1.00 0.00 C ATOM 1258 CG ARG A 82 -18.901 -10.526 -0.981 1.00 0.00 C ATOM 1259 CD ARG A 82 -19.445 -11.444 -2.078 1.00 0.00 C ATOM 1260 NE ARG A 82 -20.566 -12.254 -1.550 1.00 0.00 N ATOM 1261 CZ ARG A 82 -20.411 -13.390 -0.858 1.00 0.00 C ATOM 1262 NH1 ARG A 82 -19.181 -13.859 -0.606 1.00 0.00 N ATOM 1263 NH2 ARG A 82 -21.486 -14.059 -0.419 1.00 0.00 N ATOM 0 H ARG A 82 -19.662 -7.122 0.359 1.00 0.00 H new ATOM 0 HA ARG A 82 -17.301 -8.772 -0.247 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -20.143 -8.764 -1.056 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -19.043 -8.917 -2.411 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -17.835 -10.709 -0.844 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -19.388 -10.757 -0.034 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -19.783 -10.849 -2.927 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -18.653 -12.098 -2.442 1.00 0.00 H new ATOM 0 HE ARG A 82 -21.516 -11.926 -1.724 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -18.363 -13.351 -0.941 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -19.063 -14.724 -0.079 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -22.422 -13.703 -0.612 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -21.368 -14.924 0.108 1.00 0.00 H new ATOM 1277 N THR A 83 -16.263 -7.090 -1.720 1.00 0.00 N ATOM 1278 CA THR A 83 -15.612 -6.153 -2.620 1.00 0.00 C ATOM 1279 C THR A 83 -14.939 -6.901 -3.772 1.00 0.00 C ATOM 1280 O THR A 83 -14.820 -8.125 -3.738 1.00 0.00 O ATOM 1281 CB THR A 83 -14.641 -5.304 -1.797 1.00 0.00 C ATOM 1282 OG1 THR A 83 -14.232 -4.276 -2.695 1.00 0.00 O ATOM 1283 CG2 THR A 83 -13.345 -6.049 -1.469 1.00 0.00 C ATOM 0 H THR A 83 -15.627 -7.702 -1.209 1.00 0.00 H new ATOM 0 HA THR A 83 -16.336 -5.485 -3.087 1.00 0.00 H new ATOM 0 HB THR A 83 -15.125 -4.993 -0.871 1.00 0.00 H new ATOM 0 HG1 THR A 83 -14.384 -3.401 -2.281 1.00 0.00 H new ATOM 0 HG21 THR A 83 -12.691 -5.402 -0.884 1.00 0.00 H new ATOM 0 HG22 THR A 83 -13.576 -6.946 -0.894 1.00 0.00 H new ATOM 0 HG23 THR A 83 -12.843 -6.331 -2.395 1.00 0.00 H new ATOM 1291 N ASN A 84 -14.516 -6.134 -4.767 1.00 0.00 N ATOM 1292 CA ASN A 84 -13.858 -6.709 -5.928 1.00 0.00 C ATOM 1293 C ASN A 84 -12.800 -5.733 -6.444 1.00 0.00 C ATOM 1294 O ASN A 84 -12.540 -5.671 -7.645 1.00 0.00 O ATOM 1295 CB ASN A 84 -14.858 -6.964 -7.057 1.00 0.00 C ATOM 1296 CG ASN A 84 -15.319 -5.649 -7.689 1.00 0.00 C ATOM 1297 OD1 ASN A 84 -15.677 -4.698 -7.014 1.00 0.00 O ATOM 1298 ND2 ASN A 84 -15.289 -5.648 -9.019 1.00 0.00 N ATOM 0 H ASN A 84 -14.616 -5.119 -4.793 1.00 0.00 H new ATOM 0 HA ASN A 84 -13.406 -7.654 -5.627 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -14.400 -7.596 -7.818 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -15.720 -7.507 -6.669 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -15.577 -4.817 -9.535 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -14.978 -6.479 -9.523 1.00 0.00 H new ATOM 1305 N LYS A 85 -12.218 -4.993 -5.512 1.00 0.00 N ATOM 1306 CA LYS A 85 -11.193 -4.022 -5.858 1.00 0.00 C ATOM 1307 C LYS A 85 -9.816 -4.600 -5.525 1.00 0.00 C ATOM 1308 O LYS A 85 -9.559 -4.982 -4.384 1.00 0.00 O ATOM 1309 CB LYS A 85 -11.477 -2.680 -5.181 1.00 0.00 C ATOM 1310 CG LYS A 85 -12.797 -2.084 -5.677 1.00 0.00 C ATOM 1311 CD LYS A 85 -12.923 -0.615 -5.268 1.00 0.00 C ATOM 1312 CE LYS A 85 -13.135 0.278 -6.492 1.00 0.00 C ATOM 1313 NZ LYS A 85 -14.391 -0.083 -7.186 1.00 0.00 N ATOM 0 H LYS A 85 -12.437 -5.046 -4.517 1.00 0.00 H new ATOM 0 HA LYS A 85 -11.204 -3.821 -6.929 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -11.518 -2.815 -4.100 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -10.661 -1.986 -5.384 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -12.854 -2.169 -6.762 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -13.633 -2.652 -5.269 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -13.758 -0.496 -4.578 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -12.024 -0.303 -4.737 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -13.170 1.323 -6.185 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -12.292 0.174 -7.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -14.733 0.734 -7.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -14.215 -0.880 -7.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -15.109 -0.357 -6.485 1.00 0.00 H new ATOM 1327 N GLY A 86 -8.967 -4.645 -6.541 1.00 0.00 N ATOM 1328 CA GLY A 86 -7.623 -5.170 -6.370 1.00 0.00 C ATOM 1329 C GLY A 86 -6.639 -4.052 -6.018 1.00 0.00 C ATOM 1330 O GLY A 86 -6.257 -3.263 -6.880 1.00 0.00 O ATOM 0 H GLY A 86 -9.184 -4.327 -7.485 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -7.620 -5.923 -5.582 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -7.303 -5.666 -7.286 1.00 0.00 H new ATOM 1334 N LEU A 87 -6.258 -4.021 -4.750 1.00 0.00 N ATOM 1335 CA LEU A 87 -5.326 -3.013 -4.273 1.00 0.00 C ATOM 1336 C LEU A 87 -4.017 -3.124 -5.057 1.00 0.00 C ATOM 1337 O LEU A 87 -3.321 -4.134 -4.970 1.00 0.00 O ATOM 1338 CB LEU A 87 -5.147 -3.123 -2.757 1.00 0.00 C ATOM 1339 CG LEU A 87 -5.942 -2.125 -1.913 1.00 0.00 C ATOM 1340 CD1 LEU A 87 -5.506 -2.177 -0.448 1.00 0.00 C ATOM 1341 CD2 LEU A 87 -5.840 -0.713 -2.493 1.00 0.00 C ATOM 0 H LEU A 87 -6.578 -4.678 -4.038 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.721 -2.013 -4.452 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -5.426 -4.131 -2.450 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -4.089 -3.001 -2.526 1.00 0.00 H new ATOM 0 HG LEU A 87 -6.993 -2.410 -1.946 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -6.086 -1.458 0.130 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -5.674 -3.179 -0.054 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.447 -1.931 -0.375 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -6.414 -0.023 -1.874 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.796 -0.402 -2.511 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.238 -0.707 -3.508 1.00 0.00 H new ATOM 1353 N GLN A 88 -3.721 -2.071 -5.804 1.00 0.00 N ATOM 1354 CA GLN A 88 -2.508 -2.037 -6.603 1.00 0.00 C ATOM 1355 C GLN A 88 -1.298 -1.732 -5.718 1.00 0.00 C ATOM 1356 O GLN A 88 -1.014 -0.571 -5.426 1.00 0.00 O ATOM 1357 CB GLN A 88 -2.627 -1.018 -7.738 1.00 0.00 C ATOM 1358 CG GLN A 88 -2.300 -1.660 -9.088 1.00 0.00 C ATOM 1359 CD GLN A 88 -2.615 -0.705 -10.241 1.00 0.00 C ATOM 1360 OE1 GLN A 88 -3.394 0.226 -10.114 1.00 0.00 O ATOM 1361 NE2 GLN A 88 -1.969 -0.987 -11.369 1.00 0.00 N ATOM 0 H GLN A 88 -4.301 -1.234 -5.873 1.00 0.00 H new ATOM 0 HA GLN A 88 -2.366 -3.019 -7.054 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -3.637 -0.610 -7.761 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -1.950 -0.183 -7.555 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -1.246 -1.936 -9.117 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -2.874 -2.579 -9.206 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -1.331 -1.782 -11.406 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -2.112 -0.408 -12.197 1.00 0.00 H new ATOM 1370 N LEU A 89 -0.617 -2.795 -5.315 1.00 0.00 N ATOM 1371 CA LEU A 89 0.556 -2.656 -4.468 1.00 0.00 C ATOM 1372 C LEU A 89 1.815 -2.715 -5.335 1.00 0.00 C ATOM 1373 O LEU A 89 1.776 -3.212 -6.460 1.00 0.00 O ATOM 1374 CB LEU A 89 0.533 -3.695 -3.346 1.00 0.00 C ATOM 1375 CG LEU A 89 -0.794 -3.846 -2.599 1.00 0.00 C ATOM 1376 CD1 LEU A 89 -0.616 -4.678 -1.327 1.00 0.00 C ATOM 1377 CD2 LEU A 89 -1.417 -2.480 -2.306 1.00 0.00 C ATOM 0 H LEU A 89 -0.855 -3.756 -5.559 1.00 0.00 H new ATOM 0 HA LEU A 89 0.555 -1.685 -3.972 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.801 -4.663 -3.769 1.00 0.00 H new ATOM 0 HB3 LEU A 89 1.307 -3.437 -2.623 1.00 0.00 H new ATOM 0 HG LEU A 89 -1.488 -4.386 -3.243 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.574 -4.770 -0.815 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.248 -5.670 -1.590 1.00 0.00 H new ATOM 0 HD13 LEU A 89 0.101 -4.188 -0.669 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -2.359 -2.616 -1.775 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -0.735 -1.893 -1.691 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -1.602 -1.956 -3.244 1.00 0.00 H new ATOM 1389 N ARG A 90 2.902 -2.201 -4.780 1.00 0.00 N ATOM 1390 CA ARG A 90 4.171 -2.189 -5.488 1.00 0.00 C ATOM 1391 C ARG A 90 5.317 -2.525 -4.531 1.00 0.00 C ATOM 1392 O ARG A 90 5.474 -1.880 -3.496 1.00 0.00 O ATOM 1393 CB ARG A 90 4.432 -0.824 -6.127 1.00 0.00 C ATOM 1394 CG ARG A 90 5.501 -0.924 -7.217 1.00 0.00 C ATOM 1395 CD ARG A 90 6.286 0.383 -7.337 1.00 0.00 C ATOM 1396 NE ARG A 90 5.660 1.258 -8.354 1.00 0.00 N ATOM 1397 CZ ARG A 90 5.786 1.082 -9.676 1.00 0.00 C ATOM 1398 NH1 ARG A 90 6.515 0.063 -10.150 1.00 0.00 N ATOM 1399 NH2 ARG A 90 5.182 1.925 -10.525 1.00 0.00 N ATOM 0 H ARG A 90 2.931 -1.789 -3.847 1.00 0.00 H new ATOM 0 HA ARG A 90 4.119 -2.942 -6.275 1.00 0.00 H new ATOM 0 HB2 ARG A 90 3.507 -0.436 -6.554 1.00 0.00 H new ATOM 0 HB3 ARG A 90 4.752 -0.116 -5.363 1.00 0.00 H new ATOM 0 HG2 ARG A 90 6.183 -1.742 -6.988 1.00 0.00 H new ATOM 0 HG3 ARG A 90 5.031 -1.159 -8.172 1.00 0.00 H new ATOM 0 HD2 ARG A 90 6.311 0.892 -6.373 1.00 0.00 H new ATOM 0 HD3 ARG A 90 7.319 0.172 -7.613 1.00 0.00 H new ATOM 0 HE ARG A 90 5.098 2.044 -8.028 1.00 0.00 H new ATOM 0 HH11 ARG A 90 6.974 -0.579 -9.504 1.00 0.00 H new ATOM 0 HH12 ARG A 90 6.611 -0.071 -11.157 1.00 0.00 H new ATOM 0 HH21 ARG A 90 4.626 2.701 -10.165 1.00 0.00 H new ATOM 0 HH22 ARG A 90 5.278 1.791 -11.532 1.00 0.00 H new ATOM 1413 N HIS A 91 6.087 -3.533 -4.912 1.00 0.00 N ATOM 1414 CA HIS A 91 7.213 -3.962 -4.100 1.00 0.00 C ATOM 1415 C HIS A 91 8.521 -3.537 -4.772 1.00 0.00 C ATOM 1416 O HIS A 91 9.079 -4.280 -5.578 1.00 0.00 O ATOM 1417 CB HIS A 91 7.147 -5.467 -3.831 1.00 0.00 C ATOM 1418 CG HIS A 91 8.313 -5.999 -3.032 1.00 0.00 C ATOM 1419 ND1 HIS A 91 8.432 -5.814 -1.665 1.00 0.00 N ATOM 1420 CD2 HIS A 91 9.408 -6.713 -3.421 1.00 0.00 C ATOM 1421 CE1 HIS A 91 9.552 -6.394 -1.261 1.00 0.00 C ATOM 1422 NE2 HIS A 91 10.156 -6.950 -2.350 1.00 0.00 N ATOM 0 H HIS A 91 5.954 -4.065 -5.772 1.00 0.00 H new ATOM 0 HA HIS A 91 7.170 -3.475 -3.126 1.00 0.00 H new ATOM 0 HB2 HIS A 91 6.223 -5.690 -3.299 1.00 0.00 H new ATOM 0 HB3 HIS A 91 7.102 -5.995 -4.784 1.00 0.00 H new ATOM 0 HD2 HIS A 91 9.629 -7.031 -4.429 1.00 0.00 H new ATOM 0 HE1 HIS A 91 9.922 -6.422 -0.247 1.00 0.00 H new ATOM 0 HE2 HIS A 91 11.037 -7.463 -2.343 1.00 0.00 H new ATOM 1430 N GLY A 92 8.972 -2.344 -4.414 1.00 0.00 N ATOM 1431 CA GLY A 92 10.203 -1.811 -4.972 1.00 0.00 C ATOM 1432 C GLY A 92 10.010 -1.399 -6.433 1.00 0.00 C ATOM 1433 O GLY A 92 9.313 -0.427 -6.720 1.00 0.00 O ATOM 0 H GLY A 92 8.507 -1.731 -3.744 1.00 0.00 H new ATOM 0 HA2 GLY A 92 10.528 -0.950 -4.388 1.00 0.00 H new ATOM 0 HA3 GLY A 92 10.992 -2.560 -4.903 1.00 0.00 H new ATOM 1437 N ASN A 93 10.640 -2.159 -7.317 1.00 0.00 N ATOM 1438 CA ASN A 93 10.547 -1.885 -8.740 1.00 0.00 C ATOM 1439 C ASN A 93 9.641 -2.929 -9.397 1.00 0.00 C ATOM 1440 O ASN A 93 9.720 -3.153 -10.604 1.00 0.00 O ATOM 1441 CB ASN A 93 11.921 -1.965 -9.408 1.00 0.00 C ATOM 1442 CG ASN A 93 12.459 -3.397 -9.386 1.00 0.00 C ATOM 1443 OD1 ASN A 93 11.944 -4.291 -10.036 1.00 0.00 O ATOM 1444 ND2 ASN A 93 13.521 -3.563 -8.603 1.00 0.00 N ATOM 0 H ASN A 93 11.217 -2.964 -7.075 1.00 0.00 H new ATOM 0 HA ASN A 93 10.144 -0.880 -8.864 1.00 0.00 H new ATOM 0 HB2 ASN A 93 11.849 -1.615 -10.438 1.00 0.00 H new ATOM 0 HB3 ASN A 93 12.618 -1.303 -8.894 1.00 0.00 H new ATOM 0 HD21 ASN A 93 13.954 -4.483 -8.520 1.00 0.00 H new ATOM 0 HD22 ASN A 93 13.902 -2.771 -8.086 1.00 0.00 H new ATOM 1451 N ASP A 94 8.800 -3.539 -8.574 1.00 0.00 N ATOM 1452 CA ASP A 94 7.881 -4.553 -9.061 1.00 0.00 C ATOM 1453 C ASP A 94 6.471 -4.243 -8.552 1.00 0.00 C ATOM 1454 O ASP A 94 6.276 -4.005 -7.361 1.00 0.00 O ATOM 1455 CB ASP A 94 8.272 -5.941 -8.551 1.00 0.00 C ATOM 1456 CG ASP A 94 8.795 -6.899 -9.624 1.00 0.00 C ATOM 1457 OD1 ASP A 94 7.948 -7.594 -10.226 1.00 0.00 O ATOM 1458 OD2 ASP A 94 10.030 -6.915 -9.817 1.00 0.00 O ATOM 0 H ASP A 94 8.736 -3.350 -7.574 1.00 0.00 H new ATOM 0 HA ASP A 94 7.917 -4.546 -10.150 1.00 0.00 H new ATOM 0 HB2 ASP A 94 9.037 -5.827 -7.782 1.00 0.00 H new ATOM 0 HB3 ASP A 94 7.404 -6.394 -8.072 1.00 0.00 H new ATOM 1463 N GLN A 95 5.525 -4.256 -9.479 1.00 0.00 N ATOM 1464 CA GLN A 95 4.140 -3.979 -9.140 1.00 0.00 C ATOM 1465 C GLN A 95 3.380 -5.286 -8.903 1.00 0.00 C ATOM 1466 O GLN A 95 3.801 -6.345 -9.366 1.00 0.00 O ATOM 1467 CB GLN A 95 3.465 -3.142 -10.228 1.00 0.00 C ATOM 1468 CG GLN A 95 2.105 -2.625 -9.757 1.00 0.00 C ATOM 1469 CD GLN A 95 1.418 -1.809 -10.855 1.00 0.00 C ATOM 1470 OE1 GLN A 95 0.427 -2.215 -11.438 1.00 0.00 O ATOM 1471 NE2 GLN A 95 2.000 -0.639 -11.103 1.00 0.00 N ATOM 0 H GLN A 95 5.691 -4.454 -10.466 1.00 0.00 H new ATOM 0 HA GLN A 95 4.122 -3.398 -8.218 1.00 0.00 H new ATOM 0 HB2 GLN A 95 4.105 -2.301 -10.495 1.00 0.00 H new ATOM 0 HB3 GLN A 95 3.338 -3.744 -11.128 1.00 0.00 H new ATOM 0 HG2 GLN A 95 1.471 -3.465 -9.473 1.00 0.00 H new ATOM 0 HG3 GLN A 95 2.235 -2.008 -8.868 1.00 0.00 H new ATOM 0 HE21 GLN A 95 2.828 -0.360 -10.577 1.00 0.00 H new ATOM 0 HE22 GLN A 95 1.618 -0.021 -11.819 1.00 0.00 H new ATOM 1480 N ARG A 96 2.274 -5.168 -8.183 1.00 0.00 N ATOM 1481 CA ARG A 96 1.452 -6.327 -7.880 1.00 0.00 C ATOM 1482 C ARG A 96 -0.003 -5.905 -7.667 1.00 0.00 C ATOM 1483 O ARG A 96 -0.331 -4.724 -7.770 1.00 0.00 O ATOM 1484 CB ARG A 96 1.955 -7.047 -6.627 1.00 0.00 C ATOM 1485 CG ARG A 96 2.956 -8.146 -6.991 1.00 0.00 C ATOM 1486 CD ARG A 96 3.714 -8.629 -5.753 1.00 0.00 C ATOM 1487 NE ARG A 96 3.908 -10.095 -5.818 1.00 0.00 N ATOM 1488 CZ ARG A 96 4.717 -10.783 -5.000 1.00 0.00 C ATOM 1489 NH1 ARG A 96 5.411 -10.142 -4.050 1.00 0.00 N ATOM 1490 NH2 ARG A 96 4.831 -12.111 -5.133 1.00 0.00 N ATOM 0 H ARG A 96 1.928 -4.288 -7.801 1.00 0.00 H new ATOM 0 HA ARG A 96 1.516 -7.009 -8.728 1.00 0.00 H new ATOM 0 HB2 ARG A 96 2.426 -6.329 -5.955 1.00 0.00 H new ATOM 0 HB3 ARG A 96 1.112 -7.481 -6.090 1.00 0.00 H new ATOM 0 HG2 ARG A 96 2.431 -8.984 -7.450 1.00 0.00 H new ATOM 0 HG3 ARG A 96 3.663 -7.769 -7.730 1.00 0.00 H new ATOM 0 HD2 ARG A 96 4.680 -8.128 -5.690 1.00 0.00 H new ATOM 0 HD3 ARG A 96 3.160 -8.367 -4.852 1.00 0.00 H new ATOM 0 HE ARG A 96 3.394 -10.614 -6.530 1.00 0.00 H new ATOM 0 HH11 ARG A 96 5.324 -9.131 -3.949 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.027 -10.665 -3.427 1.00 0.00 H new ATOM 0 HH21 ARG A 96 4.302 -12.598 -5.857 1.00 0.00 H new ATOM 0 HH22 ARG A 96 5.446 -12.635 -4.511 1.00 0.00 H new ATOM 1504 N VAL A 97 -0.836 -6.892 -7.374 1.00 0.00 N ATOM 1505 CA VAL A 97 -2.248 -6.638 -7.145 1.00 0.00 C ATOM 1506 C VAL A 97 -2.793 -7.666 -6.152 1.00 0.00 C ATOM 1507 O VAL A 97 -2.980 -8.831 -6.499 1.00 0.00 O ATOM 1508 CB VAL A 97 -3.001 -6.636 -8.477 1.00 0.00 C ATOM 1509 CG1 VAL A 97 -4.501 -6.843 -8.259 1.00 0.00 C ATOM 1510 CG2 VAL A 97 -2.734 -5.347 -9.256 1.00 0.00 C ATOM 0 H VAL A 97 -0.560 -7.870 -7.290 1.00 0.00 H new ATOM 0 HA VAL A 97 -2.392 -5.652 -6.703 1.00 0.00 H new ATOM 0 HB VAL A 97 -2.630 -7.470 -9.072 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -5.013 -6.837 -9.221 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -4.668 -7.800 -7.765 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -4.892 -6.039 -7.635 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -3.281 -5.372 -10.198 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -3.064 -4.491 -8.667 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -1.667 -5.259 -9.458 1.00 0.00 H new ATOM 1520 N PHE A 98 -3.032 -7.197 -4.936 1.00 0.00 N ATOM 1521 CA PHE A 98 -3.552 -8.061 -3.890 1.00 0.00 C ATOM 1522 C PHE A 98 -4.993 -7.687 -3.535 1.00 0.00 C ATOM 1523 O PHE A 98 -5.614 -6.876 -4.221 1.00 0.00 O ATOM 1524 CB PHE A 98 -2.667 -7.856 -2.659 1.00 0.00 C ATOM 1525 CG PHE A 98 -1.218 -8.308 -2.853 1.00 0.00 C ATOM 1526 CD1 PHE A 98 -0.313 -7.466 -3.420 1.00 0.00 C ATOM 1527 CD2 PHE A 98 -0.835 -9.552 -2.457 1.00 0.00 C ATOM 1528 CE1 PHE A 98 1.032 -7.886 -3.599 1.00 0.00 C ATOM 1529 CE2 PHE A 98 0.510 -9.971 -2.636 1.00 0.00 C ATOM 1530 CZ PHE A 98 1.415 -9.129 -3.204 1.00 0.00 C ATOM 0 H PHE A 98 -2.875 -6.230 -4.652 1.00 0.00 H new ATOM 0 HA PHE A 98 -3.546 -9.097 -4.227 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -2.675 -6.800 -2.390 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -3.098 -8.401 -1.819 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -0.617 -6.478 -3.734 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -1.554 -10.221 -2.007 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.751 -7.217 -4.049 1.00 0.00 H new ATOM 0 HE2 PHE A 98 0.814 -10.958 -2.321 1.00 0.00 H new ATOM 0 HZ PHE A 98 2.438 -9.448 -3.341 1.00 0.00 H new ATOM 1540 N ARG A 99 -5.482 -8.295 -2.465 1.00 0.00 N ATOM 1541 CA ARG A 99 -6.838 -8.037 -2.011 1.00 0.00 C ATOM 1542 C ARG A 99 -6.821 -7.454 -0.596 1.00 0.00 C ATOM 1543 O ARG A 99 -5.813 -7.540 0.103 1.00 0.00 O ATOM 1544 CB ARG A 99 -7.675 -9.317 -2.018 1.00 0.00 C ATOM 1545 CG ARG A 99 -7.676 -9.964 -3.404 1.00 0.00 C ATOM 1546 CD ARG A 99 -8.536 -9.161 -4.383 1.00 0.00 C ATOM 1547 NE ARG A 99 -7.809 -8.971 -5.657 1.00 0.00 N ATOM 1548 CZ ARG A 99 -7.552 -9.954 -6.530 1.00 0.00 C ATOM 1549 NH1 ARG A 99 -7.963 -11.203 -6.272 1.00 0.00 N ATOM 1550 NH2 ARG A 99 -6.885 -9.689 -7.662 1.00 0.00 N ATOM 0 H ARG A 99 -4.963 -8.966 -1.899 1.00 0.00 H new ATOM 0 HA ARG A 99 -7.287 -7.320 -2.698 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -7.278 -10.019 -1.285 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -8.698 -9.088 -1.719 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -6.655 -10.029 -3.780 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -8.055 -10.984 -3.333 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -9.476 -9.682 -4.565 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -8.787 -8.193 -3.950 1.00 0.00 H new ATOM 0 HE ARG A 99 -7.483 -8.032 -5.885 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -8.471 -11.405 -5.411 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -7.768 -11.952 -6.937 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -6.573 -8.738 -7.859 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -6.690 -10.438 -8.326 1.00 0.00 H new ATOM 1564 N LEU A 100 -7.950 -6.874 -0.216 1.00 0.00 N ATOM 1565 CA LEU A 100 -8.079 -6.277 1.102 1.00 0.00 C ATOM 1566 C LEU A 100 -7.968 -7.371 2.166 1.00 0.00 C ATOM 1567 O LEU A 100 -7.407 -7.146 3.237 1.00 0.00 O ATOM 1568 CB LEU A 100 -9.366 -5.456 1.196 1.00 0.00 C ATOM 1569 CG LEU A 100 -9.336 -4.081 0.526 1.00 0.00 C ATOM 1570 CD1 LEU A 100 -9.157 -4.212 -0.987 1.00 0.00 C ATOM 1571 CD2 LEU A 100 -10.579 -3.267 0.888 1.00 0.00 C ATOM 0 H LEU A 100 -8.784 -6.805 -0.799 1.00 0.00 H new ATOM 0 HA LEU A 100 -7.266 -5.573 1.282 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -10.176 -6.036 0.754 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -9.610 -5.319 2.250 1.00 0.00 H new ATOM 0 HG LEU A 100 -8.472 -3.535 0.906 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.139 -3.220 -1.438 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -8.219 -4.724 -1.199 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -9.986 -4.785 -1.403 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -10.532 -2.294 0.399 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -11.471 -3.798 0.556 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -10.621 -3.128 1.968 1.00 0.00 H new ATOM 1583 N GLU A 101 -8.512 -8.533 1.833 1.00 0.00 N ATOM 1584 CA GLU A 101 -8.482 -9.662 2.746 1.00 0.00 C ATOM 1585 C GLU A 101 -7.043 -9.962 3.172 1.00 0.00 C ATOM 1586 O GLU A 101 -6.791 -10.297 4.328 1.00 0.00 O ATOM 1587 CB GLU A 101 -9.135 -10.894 2.116 1.00 0.00 C ATOM 1588 CG GLU A 101 -8.542 -11.183 0.735 1.00 0.00 C ATOM 1589 CD GLU A 101 -8.982 -12.557 0.226 1.00 0.00 C ATOM 1590 OE1 GLU A 101 -8.697 -13.544 0.938 1.00 0.00 O ATOM 1591 OE2 GLU A 101 -9.594 -12.590 -0.864 1.00 0.00 O ATOM 0 H GLU A 101 -8.976 -8.716 0.943 1.00 0.00 H new ATOM 0 HA GLU A 101 -9.057 -9.401 3.635 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -8.992 -11.758 2.765 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -10.210 -10.736 2.028 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -8.857 -10.413 0.031 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -7.454 -11.142 0.787 1.00 0.00 H new ATOM 1598 N PHE A 102 -6.137 -9.831 2.214 1.00 0.00 N ATOM 1599 CA PHE A 102 -4.730 -10.083 2.476 1.00 0.00 C ATOM 1600 C PHE A 102 -4.072 -8.876 3.146 1.00 0.00 C ATOM 1601 O PHE A 102 -3.124 -9.028 3.916 1.00 0.00 O ATOM 1602 CB PHE A 102 -4.060 -10.328 1.122 1.00 0.00 C ATOM 1603 CG PHE A 102 -4.721 -11.429 0.291 1.00 0.00 C ATOM 1604 CD1 PHE A 102 -5.424 -12.417 0.907 1.00 0.00 C ATOM 1605 CD2 PHE A 102 -4.605 -11.420 -1.064 1.00 0.00 C ATOM 1606 CE1 PHE A 102 -6.038 -13.439 0.135 1.00 0.00 C ATOM 1607 CE2 PHE A 102 -5.219 -12.442 -1.836 1.00 0.00 C ATOM 1608 CZ PHE A 102 -5.922 -13.430 -1.220 1.00 0.00 C ATOM 0 H PHE A 102 -6.350 -9.554 1.256 1.00 0.00 H new ATOM 0 HA PHE A 102 -4.623 -10.938 3.144 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -4.070 -9.400 0.550 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -3.015 -10.590 1.287 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -5.515 -12.424 1.983 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -4.046 -10.636 -1.553 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -6.597 -14.223 0.624 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -5.128 -12.435 -2.912 1.00 0.00 H new ATOM 0 HZ PHE A 102 -6.388 -14.208 -1.807 1.00 0.00 H new ATOM 1618 N VAL A 103 -4.600 -7.702 2.830 1.00 0.00 N ATOM 1619 CA VAL A 103 -4.075 -6.469 3.392 1.00 0.00 C ATOM 1620 C VAL A 103 -4.091 -6.563 4.919 1.00 0.00 C ATOM 1621 O VAL A 103 -5.142 -6.423 5.543 1.00 0.00 O ATOM 1622 CB VAL A 103 -4.866 -5.273 2.858 1.00 0.00 C ATOM 1623 CG1 VAL A 103 -4.669 -4.044 3.749 1.00 0.00 C ATOM 1624 CG2 VAL A 103 -4.485 -4.967 1.409 1.00 0.00 C ATOM 0 H VAL A 103 -5.386 -7.579 2.192 1.00 0.00 H new ATOM 0 HA VAL A 103 -3.039 -6.320 3.086 1.00 0.00 H new ATOM 0 HB VAL A 103 -5.924 -5.535 2.878 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.242 -3.208 3.348 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -5.013 -4.268 4.759 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -3.612 -3.780 3.776 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -5.062 -4.113 1.054 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -3.421 -4.735 1.354 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -4.700 -5.835 0.785 1.00 0.00 H new ATOM 1634 N SER A 104 -2.913 -6.799 5.478 1.00 0.00 N ATOM 1635 CA SER A 104 -2.778 -6.913 6.920 1.00 0.00 C ATOM 1636 C SER A 104 -3.352 -5.669 7.599 1.00 0.00 C ATOM 1637 O SER A 104 -4.027 -4.863 6.959 1.00 0.00 O ATOM 1638 CB SER A 104 -1.315 -7.110 7.322 1.00 0.00 C ATOM 1639 OG SER A 104 -1.185 -7.934 8.477 1.00 0.00 O ATOM 0 H SER A 104 -2.043 -6.914 4.958 1.00 0.00 H new ATOM 0 HA SER A 104 -3.338 -7.789 7.248 1.00 0.00 H new ATOM 0 HB2 SER A 104 -0.769 -7.559 6.493 1.00 0.00 H new ATOM 0 HB3 SER A 104 -0.858 -6.139 7.516 1.00 0.00 H new ATOM 0 HG SER A 104 -0.522 -8.635 8.306 1.00 0.00 H new ATOM 1645 N ASN A 105 -3.065 -5.551 8.887 1.00 0.00 N ATOM 1646 CA ASN A 105 -3.545 -4.418 9.660 1.00 0.00 C ATOM 1647 C ASN A 105 -2.502 -4.049 10.718 1.00 0.00 C ATOM 1648 O ASN A 105 -2.186 -2.875 10.900 1.00 0.00 O ATOM 1649 CB ASN A 105 -4.850 -4.757 10.382 1.00 0.00 C ATOM 1650 CG ASN A 105 -4.726 -6.076 11.148 1.00 0.00 C ATOM 1651 OD1 ASN A 105 -4.311 -6.121 12.295 1.00 0.00 O ATOM 1652 ND2 ASN A 105 -5.109 -7.143 10.454 1.00 0.00 N ATOM 0 H ASN A 105 -2.506 -6.221 9.415 1.00 0.00 H new ATOM 0 HA ASN A 105 -3.718 -3.590 8.972 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -5.107 -3.954 11.073 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -5.662 -4.827 9.659 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -5.065 -8.070 10.878 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -5.447 -7.035 9.498 1.00 0.00 H new ATOM 1659 N GLN A 106 -1.996 -5.075 11.387 1.00 0.00 N ATOM 1660 CA GLN A 106 -0.995 -4.873 12.421 1.00 0.00 C ATOM 1661 C GLN A 106 0.021 -3.818 11.978 1.00 0.00 C ATOM 1662 O GLN A 106 0.114 -3.500 10.794 1.00 0.00 O ATOM 1663 CB GLN A 106 -0.299 -6.189 12.774 1.00 0.00 C ATOM 1664 CG GLN A 106 -1.049 -6.923 13.888 1.00 0.00 C ATOM 1665 CD GLN A 106 -1.469 -8.323 13.436 1.00 0.00 C ATOM 1666 OE1 GLN A 106 -0.667 -9.294 13.865 1.00 0.00 O flip ATOM 1667 NE2 GLN A 106 -2.456 -8.510 12.744 1.00 0.00 N flip ATOM 0 H GLN A 106 -2.260 -6.048 11.233 1.00 0.00 H new ATOM 0 HA GLN A 106 -1.496 -4.512 13.319 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -0.242 -6.823 11.889 1.00 0.00 H new ATOM 0 HB3 GLN A 106 0.725 -5.990 13.090 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -0.414 -6.997 14.771 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -1.930 -6.350 14.176 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -3.029 -7.720 12.449 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -2.708 -9.457 12.461 1.00 0.00 H new ATOM 1676 N GLU A 107 0.755 -3.305 12.954 1.00 0.00 N ATOM 1677 CA GLU A 107 1.761 -2.292 12.680 1.00 0.00 C ATOM 1678 C GLU A 107 2.877 -2.873 11.810 1.00 0.00 C ATOM 1679 O GLU A 107 2.932 -4.082 11.591 1.00 0.00 O ATOM 1680 CB GLU A 107 2.323 -1.712 13.979 1.00 0.00 C ATOM 1681 CG GLU A 107 1.233 -1.596 15.046 1.00 0.00 C ATOM 1682 CD GLU A 107 1.500 -0.412 15.977 1.00 0.00 C ATOM 1683 OE1 GLU A 107 2.215 0.510 15.531 1.00 0.00 O ATOM 1684 OE2 GLU A 107 0.982 -0.456 17.114 1.00 0.00 O ATOM 0 H GLU A 107 0.674 -3.571 13.935 1.00 0.00 H new ATOM 0 HA GLU A 107 1.288 -1.477 12.132 1.00 0.00 H new ATOM 0 HB2 GLU A 107 3.129 -2.347 14.346 1.00 0.00 H new ATOM 0 HB3 GLU A 107 2.754 -0.729 13.786 1.00 0.00 H new ATOM 0 HG2 GLU A 107 0.262 -1.474 14.567 1.00 0.00 H new ATOM 0 HG3 GLU A 107 1.189 -2.517 15.627 1.00 0.00 H new ATOM 1691 N PHE A 108 3.739 -1.985 11.337 1.00 0.00 N ATOM 1692 CA PHE A 108 4.851 -2.395 10.497 1.00 0.00 C ATOM 1693 C PHE A 108 6.041 -2.850 11.344 1.00 0.00 C ATOM 1694 O PHE A 108 6.694 -2.034 11.993 1.00 0.00 O ATOM 1695 CB PHE A 108 5.264 -1.173 9.674 1.00 0.00 C ATOM 1696 CG PHE A 108 4.501 -1.024 8.356 1.00 0.00 C ATOM 1697 CD1 PHE A 108 4.221 -2.122 7.604 1.00 0.00 C ATOM 1698 CD2 PHE A 108 4.102 0.207 7.936 1.00 0.00 C ATOM 1699 CE1 PHE A 108 3.514 -1.983 6.380 1.00 0.00 C ATOM 1700 CE2 PHE A 108 3.395 0.346 6.713 1.00 0.00 C ATOM 1701 CZ PHE A 108 3.115 -0.752 5.961 1.00 0.00 C ATOM 0 H PHE A 108 3.690 -0.983 11.520 1.00 0.00 H new ATOM 0 HA PHE A 108 4.550 -3.230 9.864 1.00 0.00 H new ATOM 0 HB2 PHE A 108 5.112 -0.276 10.274 1.00 0.00 H new ATOM 0 HB3 PHE A 108 6.331 -1.236 9.459 1.00 0.00 H new ATOM 0 HD1 PHE A 108 4.536 -3.100 7.938 1.00 0.00 H new ATOM 0 HD2 PHE A 108 4.323 1.079 8.534 1.00 0.00 H new ATOM 0 HE1 PHE A 108 3.293 -2.855 5.782 1.00 0.00 H new ATOM 0 HE2 PHE A 108 3.079 1.324 6.380 1.00 0.00 H new ATOM 0 HZ PHE A 108 2.576 -0.647 5.031 1.00 0.00 H new ATOM 1711 N THR A 109 6.286 -4.152 11.311 1.00 0.00 N ATOM 1712 CA THR A 109 7.386 -4.725 12.068 1.00 0.00 C ATOM 1713 C THR A 109 8.721 -4.163 11.577 1.00 0.00 C ATOM 1714 O THR A 109 8.966 -4.096 10.374 1.00 0.00 O ATOM 1715 CB THR A 109 7.291 -6.249 11.959 1.00 0.00 C ATOM 1716 OG1 THR A 109 6.912 -6.477 10.605 1.00 0.00 O ATOM 1717 CG2 THR A 109 6.130 -6.822 12.774 1.00 0.00 C ATOM 0 H THR A 109 5.742 -4.826 10.772 1.00 0.00 H new ATOM 0 HA THR A 109 7.324 -4.455 13.122 1.00 0.00 H new ATOM 0 HB THR A 109 8.226 -6.697 12.296 1.00 0.00 H new ATOM 0 HG1 THR A 109 7.144 -7.394 10.350 1.00 0.00 H new ATOM 0 HG21 THR A 109 6.107 -7.906 12.662 1.00 0.00 H new ATOM 0 HG22 THR A 109 6.264 -6.568 13.826 1.00 0.00 H new ATOM 0 HG23 THR A 109 5.191 -6.401 12.415 1.00 0.00 H new ATOM 1725 N GLU A 110 9.550 -3.774 12.535 1.00 0.00 N ATOM 1726 CA GLU A 110 10.855 -3.219 12.215 1.00 0.00 C ATOM 1727 C GLU A 110 11.489 -3.989 11.054 1.00 0.00 C ATOM 1728 O GLU A 110 12.165 -3.402 10.211 1.00 0.00 O ATOM 1729 CB GLU A 110 11.769 -3.227 13.442 1.00 0.00 C ATOM 1730 CG GLU A 110 13.176 -2.746 13.080 1.00 0.00 C ATOM 1731 CD GLU A 110 14.086 -2.739 14.310 1.00 0.00 C ATOM 1732 OE1 GLU A 110 14.377 -3.849 14.807 1.00 0.00 O ATOM 1733 OE2 GLU A 110 14.471 -1.625 14.725 1.00 0.00 O ATOM 0 H GLU A 110 9.344 -3.832 13.532 1.00 0.00 H new ATOM 0 HA GLU A 110 10.722 -2.182 11.908 1.00 0.00 H new ATOM 0 HB2 GLU A 110 11.349 -2.585 14.217 1.00 0.00 H new ATOM 0 HB3 GLU A 110 11.820 -4.234 13.855 1.00 0.00 H new ATOM 0 HG2 GLU A 110 13.600 -3.394 12.313 1.00 0.00 H new ATOM 0 HG3 GLU A 110 13.124 -1.743 12.656 1.00 0.00 H new ATOM 1740 N SER A 111 11.247 -5.292 11.048 1.00 0.00 N ATOM 1741 CA SER A 111 11.786 -6.148 10.005 1.00 0.00 C ATOM 1742 C SER A 111 11.108 -5.835 8.669 1.00 0.00 C ATOM 1743 O SER A 111 11.737 -5.293 7.762 1.00 0.00 O ATOM 1744 CB SER A 111 11.607 -7.626 10.358 1.00 0.00 C ATOM 1745 OG SER A 111 11.921 -7.891 11.722 1.00 0.00 O ATOM 0 H SER A 111 10.685 -5.775 11.749 1.00 0.00 H new ATOM 0 HA SER A 111 12.854 -5.950 9.918 1.00 0.00 H new ATOM 0 HB2 SER A 111 10.578 -7.924 10.158 1.00 0.00 H new ATOM 0 HB3 SER A 111 12.245 -8.232 9.715 1.00 0.00 H new ATOM 0 HG SER A 111 11.793 -8.845 11.908 1.00 0.00 H new ATOM 1751 N GLU A 112 9.834 -6.190 8.591 1.00 0.00 N ATOM 1752 CA GLU A 112 9.064 -5.954 7.382 1.00 0.00 C ATOM 1753 C GLU A 112 9.449 -4.610 6.761 1.00 0.00 C ATOM 1754 O GLU A 112 9.945 -4.561 5.637 1.00 0.00 O ATOM 1755 CB GLU A 112 7.562 -6.015 7.668 1.00 0.00 C ATOM 1756 CG GLU A 112 7.054 -7.458 7.622 1.00 0.00 C ATOM 1757 CD GLU A 112 8.068 -8.417 8.249 1.00 0.00 C ATOM 1758 OE1 GLU A 112 8.957 -8.873 7.498 1.00 0.00 O ATOM 1759 OE2 GLU A 112 7.931 -8.672 9.465 1.00 0.00 O ATOM 0 H GLU A 112 9.316 -6.639 9.346 1.00 0.00 H new ATOM 0 HA GLU A 112 9.297 -6.743 6.667 1.00 0.00 H new ATOM 0 HB2 GLU A 112 7.357 -5.584 8.648 1.00 0.00 H new ATOM 0 HB3 GLU A 112 7.024 -5.413 6.936 1.00 0.00 H new ATOM 0 HG2 GLU A 112 6.104 -7.530 8.152 1.00 0.00 H new ATOM 0 HG3 GLU A 112 6.865 -7.748 6.588 1.00 0.00 H new ATOM 1766 N PHE A 113 9.207 -3.552 7.521 1.00 0.00 N ATOM 1767 CA PHE A 113 9.522 -2.211 7.060 1.00 0.00 C ATOM 1768 C PHE A 113 10.901 -2.169 6.398 1.00 0.00 C ATOM 1769 O PHE A 113 11.005 -2.064 5.177 1.00 0.00 O ATOM 1770 CB PHE A 113 9.534 -1.304 8.292 1.00 0.00 C ATOM 1771 CG PHE A 113 10.048 0.111 8.020 1.00 0.00 C ATOM 1772 CD1 PHE A 113 9.484 0.860 7.035 1.00 0.00 C ATOM 1773 CD2 PHE A 113 11.067 0.619 8.762 1.00 0.00 C ATOM 1774 CE1 PHE A 113 9.961 2.174 6.781 1.00 0.00 C ATOM 1775 CE2 PHE A 113 11.544 1.932 8.509 1.00 0.00 C ATOM 1776 CZ PHE A 113 10.981 2.682 7.524 1.00 0.00 C ATOM 0 H PHE A 113 8.796 -3.597 8.454 1.00 0.00 H new ATOM 0 HA PHE A 113 8.785 -1.888 6.325 1.00 0.00 H new ATOM 0 HB2 PHE A 113 8.523 -1.241 8.693 1.00 0.00 H new ATOM 0 HB3 PHE A 113 10.154 -1.763 9.062 1.00 0.00 H new ATOM 0 HD1 PHE A 113 8.674 0.456 6.446 1.00 0.00 H new ATOM 0 HD2 PHE A 113 11.514 0.024 9.544 1.00 0.00 H new ATOM 0 HE1 PHE A 113 9.514 2.769 5.998 1.00 0.00 H new ATOM 0 HE2 PHE A 113 12.354 2.335 9.099 1.00 0.00 H new ATOM 0 HZ PHE A 113 11.344 3.681 7.332 1.00 0.00 H new ATOM 1786 N MET A 114 11.926 -2.253 7.233 1.00 0.00 N ATOM 1787 CA MET A 114 13.294 -2.226 6.744 1.00 0.00 C ATOM 1788 C MET A 114 13.478 -3.197 5.576 1.00 0.00 C ATOM 1789 O MET A 114 14.063 -2.841 4.555 1.00 0.00 O ATOM 1790 CB MET A 114 14.249 -2.604 7.878 1.00 0.00 C ATOM 1791 CG MET A 114 14.162 -1.597 9.027 1.00 0.00 C ATOM 1792 SD MET A 114 15.487 -0.408 8.897 1.00 0.00 S ATOM 1793 CE MET A 114 14.769 0.955 9.799 1.00 0.00 C ATOM 0 H MET A 114 11.837 -2.340 8.245 1.00 0.00 H new ATOM 0 HA MET A 114 13.515 -1.218 6.392 1.00 0.00 H new ATOM 0 HB2 MET A 114 14.007 -3.601 8.245 1.00 0.00 H new ATOM 0 HB3 MET A 114 15.271 -2.643 7.500 1.00 0.00 H new ATOM 0 HG2 MET A 114 13.200 -1.086 9.002 1.00 0.00 H new ATOM 0 HG3 MET A 114 14.221 -2.117 9.983 1.00 0.00 H new ATOM 0 HE1 MET A 114 15.366 1.853 9.638 1.00 0.00 H new ATOM 0 HE2 MET A 114 13.752 1.128 9.448 1.00 0.00 H new ATOM 0 HE3 MET A 114 14.750 0.718 10.863 1.00 0.00 H new ATOM 1803 N LYS A 115 12.968 -4.405 5.767 1.00 0.00 N ATOM 1804 CA LYS A 115 13.069 -5.430 4.742 1.00 0.00 C ATOM 1805 C LYS A 115 12.597 -4.856 3.405 1.00 0.00 C ATOM 1806 O LYS A 115 13.229 -5.077 2.372 1.00 0.00 O ATOM 1807 CB LYS A 115 12.317 -6.692 5.170 1.00 0.00 C ATOM 1808 CG LYS A 115 13.094 -7.455 6.244 1.00 0.00 C ATOM 1809 CD LYS A 115 14.145 -8.371 5.615 1.00 0.00 C ATOM 1810 CE LYS A 115 14.845 -9.217 6.680 1.00 0.00 C ATOM 1811 NZ LYS A 115 14.013 -10.386 7.044 1.00 0.00 N ATOM 0 H LYS A 115 12.484 -4.697 6.616 1.00 0.00 H new ATOM 0 HA LYS A 115 14.107 -5.735 4.609 1.00 0.00 H new ATOM 0 HB2 LYS A 115 11.333 -6.421 5.552 1.00 0.00 H new ATOM 0 HB3 LYS A 115 12.158 -7.336 4.305 1.00 0.00 H new ATOM 0 HG2 LYS A 115 13.579 -6.749 6.918 1.00 0.00 H new ATOM 0 HG3 LYS A 115 12.404 -8.047 6.845 1.00 0.00 H new ATOM 0 HD2 LYS A 115 13.671 -9.023 4.881 1.00 0.00 H new ATOM 0 HD3 LYS A 115 14.882 -7.771 5.080 1.00 0.00 H new ATOM 0 HE2 LYS A 115 15.812 -9.554 6.307 1.00 0.00 H new ATOM 0 HE3 LYS A 115 15.038 -8.611 7.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 14.503 -10.949 7.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 13.100 -10.059 7.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 13.850 -10.972 6.201 1.00 0.00 H new ATOM 1825 N TRP A 116 11.490 -4.131 3.466 1.00 0.00 N ATOM 1826 CA TRP A 116 10.925 -3.524 2.273 1.00 0.00 C ATOM 1827 C TRP A 116 11.896 -2.446 1.786 1.00 0.00 C ATOM 1828 O TRP A 116 12.240 -2.403 0.606 1.00 0.00 O ATOM 1829 CB TRP A 116 9.520 -2.984 2.545 1.00 0.00 C ATOM 1830 CG TRP A 116 9.139 -1.778 1.683 1.00 0.00 C ATOM 1831 CD1 TRP A 116 8.659 -1.777 0.432 1.00 0.00 C ATOM 1832 CD2 TRP A 116 9.226 -0.388 2.062 1.00 0.00 C ATOM 1833 NE1 TRP A 116 8.431 -0.494 -0.021 1.00 0.00 N ATOM 1834 CE2 TRP A 116 8.787 0.378 1.002 1.00 0.00 C ATOM 1835 CE3 TRP A 116 9.661 0.202 3.262 1.00 0.00 C ATOM 1836 CZ2 TRP A 116 8.741 1.776 1.033 1.00 0.00 C ATOM 1837 CZ3 TRP A 116 9.609 1.601 3.278 1.00 0.00 C ATOM 1838 CH2 TRP A 116 9.170 2.386 2.218 1.00 0.00 C ATOM 0 H TRP A 116 10.969 -3.950 4.324 1.00 0.00 H new ATOM 0 HA TRP A 116 10.803 -4.266 1.484 1.00 0.00 H new ATOM 0 HB2 TRP A 116 8.796 -3.781 2.376 1.00 0.00 H new ATOM 0 HB3 TRP A 116 9.447 -2.704 3.596 1.00 0.00 H new ATOM 0 HD1 TRP A 116 8.474 -2.669 -0.149 1.00 0.00 H new ATOM 0 HE1 TRP A 116 8.068 -0.233 -0.938 1.00 0.00 H new ATOM 0 HE3 TRP A 116 10.008 -0.378 4.104 1.00 0.00 H new ATOM 0 HZ2 TRP A 116 8.394 2.353 0.189 1.00 0.00 H new ATOM 0 HZ3 TRP A 116 9.932 2.105 4.176 1.00 0.00 H new ATOM 0 HH2 TRP A 116 9.160 3.462 2.308 1.00 0.00 H new ATOM 1849 N LYS A 117 12.311 -1.604 2.720 1.00 0.00 N ATOM 1850 CA LYS A 117 13.236 -0.529 2.401 1.00 0.00 C ATOM 1851 C LYS A 117 14.348 -1.070 1.500 1.00 0.00 C ATOM 1852 O LYS A 117 14.696 -0.448 0.497 1.00 0.00 O ATOM 1853 CB LYS A 117 13.750 0.134 3.681 1.00 0.00 C ATOM 1854 CG LYS A 117 13.210 1.559 3.815 1.00 0.00 C ATOM 1855 CD LYS A 117 13.235 2.020 5.274 1.00 0.00 C ATOM 1856 CE LYS A 117 14.626 2.519 5.668 1.00 0.00 C ATOM 1857 NZ LYS A 117 14.754 2.589 7.141 1.00 0.00 N ATOM 0 H LYS A 117 12.024 -1.644 3.698 1.00 0.00 H new ATOM 0 HA LYS A 117 12.728 0.258 1.844 1.00 0.00 H new ATOM 0 HB2 LYS A 117 13.449 -0.456 4.547 1.00 0.00 H new ATOM 0 HB3 LYS A 117 14.840 0.154 3.672 1.00 0.00 H new ATOM 0 HG2 LYS A 117 13.807 2.237 3.205 1.00 0.00 H new ATOM 0 HG3 LYS A 117 12.190 1.603 3.434 1.00 0.00 H new ATOM 0 HD2 LYS A 117 12.505 2.816 5.420 1.00 0.00 H new ATOM 0 HD3 LYS A 117 12.943 1.196 5.925 1.00 0.00 H new ATOM 0 HE2 LYS A 117 15.386 1.852 5.262 1.00 0.00 H new ATOM 0 HE3 LYS A 117 14.802 3.504 5.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 15.125 3.522 7.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 13.821 2.446 7.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 15.406 1.848 7.468 1.00 0.00 H new ATOM 1871 N GLU A 118 14.874 -2.222 1.889 1.00 0.00 N ATOM 1872 CA GLU A 118 15.939 -2.853 1.129 1.00 0.00 C ATOM 1873 C GLU A 118 15.622 -2.806 -0.368 1.00 0.00 C ATOM 1874 O GLU A 118 16.438 -2.344 -1.164 1.00 0.00 O ATOM 1875 CB GLU A 118 16.168 -4.292 1.596 1.00 0.00 C ATOM 1876 CG GLU A 118 16.684 -4.325 3.036 1.00 0.00 C ATOM 1877 CD GLU A 118 18.190 -4.593 3.072 1.00 0.00 C ATOM 1878 OE1 GLU A 118 18.577 -5.711 2.668 1.00 0.00 O ATOM 1879 OE2 GLU A 118 18.920 -3.675 3.503 1.00 0.00 O ATOM 0 H GLU A 118 14.582 -2.735 2.721 1.00 0.00 H new ATOM 0 HA GLU A 118 16.861 -2.299 1.303 1.00 0.00 H new ATOM 0 HB2 GLU A 118 15.236 -4.853 1.527 1.00 0.00 H new ATOM 0 HB3 GLU A 118 16.885 -4.782 0.938 1.00 0.00 H new ATOM 0 HG2 GLU A 118 16.468 -3.375 3.525 1.00 0.00 H new ATOM 0 HG3 GLU A 118 16.160 -5.099 3.596 1.00 0.00 H new ATOM 1886 N ALA A 119 14.437 -3.292 -0.705 1.00 0.00 N ATOM 1887 CA ALA A 119 14.002 -3.311 -2.091 1.00 0.00 C ATOM 1888 C ALA A 119 14.164 -1.913 -2.691 1.00 0.00 C ATOM 1889 O ALA A 119 14.652 -1.767 -3.811 1.00 0.00 O ATOM 1890 CB ALA A 119 12.560 -3.815 -2.168 1.00 0.00 C ATOM 0 H ALA A 119 13.764 -3.676 -0.042 1.00 0.00 H new ATOM 0 HA ALA A 119 14.617 -3.995 -2.676 1.00 0.00 H new ATOM 0 HB1 ALA A 119 12.234 -3.829 -3.208 1.00 0.00 H new ATOM 0 HB2 ALA A 119 12.504 -4.823 -1.757 1.00 0.00 H new ATOM 0 HB3 ALA A 119 11.912 -3.153 -1.594 1.00 0.00 H new ATOM 1896 N MET A 120 13.746 -0.920 -1.919 1.00 0.00 N ATOM 1897 CA MET A 120 13.838 0.461 -2.361 1.00 0.00 C ATOM 1898 C MET A 120 15.299 0.902 -2.479 1.00 0.00 C ATOM 1899 O MET A 120 15.669 1.584 -3.433 1.00 0.00 O ATOM 1900 CB MET A 120 13.110 1.365 -1.364 1.00 0.00 C ATOM 1901 CG MET A 120 11.668 0.901 -1.155 1.00 0.00 C ATOM 1902 SD MET A 120 10.620 1.569 -2.436 1.00 0.00 S ATOM 1903 CE MET A 120 10.972 3.308 -2.250 1.00 0.00 C ATOM 0 H MET A 120 13.343 -1.045 -0.990 1.00 0.00 H new ATOM 0 HA MET A 120 13.373 0.541 -3.344 1.00 0.00 H new ATOM 0 HB2 MET A 120 13.639 1.361 -0.411 1.00 0.00 H new ATOM 0 HB3 MET A 120 13.116 2.393 -1.728 1.00 0.00 H new ATOM 0 HG2 MET A 120 11.622 -0.188 -1.167 1.00 0.00 H new ATOM 0 HG3 MET A 120 11.312 1.224 -0.177 1.00 0.00 H new ATOM 0 HE1 MET A 120 10.198 3.891 -2.749 1.00 0.00 H new ATOM 0 HE2 MET A 120 10.993 3.564 -1.191 1.00 0.00 H new ATOM 0 HE3 MET A 120 11.941 3.533 -2.696 1.00 0.00 H new ATOM 1913 N PHE A 121 16.088 0.495 -1.496 1.00 0.00 N ATOM 1914 CA PHE A 121 17.499 0.840 -1.477 1.00 0.00 C ATOM 1915 C PHE A 121 18.256 0.111 -2.589 1.00 0.00 C ATOM 1916 O PHE A 121 19.178 0.667 -3.185 1.00 0.00 O ATOM 1917 CB PHE A 121 18.051 0.392 -0.123 1.00 0.00 C ATOM 1918 CG PHE A 121 17.924 1.445 0.980 1.00 0.00 C ATOM 1919 CD1 PHE A 121 16.695 1.818 1.426 1.00 0.00 C ATOM 1920 CD2 PHE A 121 19.041 2.008 1.515 1.00 0.00 C ATOM 1921 CE1 PHE A 121 16.577 2.796 2.449 1.00 0.00 C ATOM 1922 CE2 PHE A 121 18.923 2.986 2.538 1.00 0.00 C ATOM 1923 CZ PHE A 121 17.693 3.359 2.984 1.00 0.00 C ATOM 0 H PHE A 121 15.777 -0.071 -0.706 1.00 0.00 H new ATOM 0 HA PHE A 121 17.622 1.912 -1.632 1.00 0.00 H new ATOM 0 HB2 PHE A 121 17.528 -0.512 0.190 1.00 0.00 H new ATOM 0 HB3 PHE A 121 19.102 0.128 -0.240 1.00 0.00 H new ATOM 0 HD1 PHE A 121 15.808 1.370 1.002 1.00 0.00 H new ATOM 0 HD2 PHE A 121 20.017 1.711 1.162 1.00 0.00 H new ATOM 0 HE1 PHE A 121 15.600 3.093 2.802 1.00 0.00 H new ATOM 0 HE2 PHE A 121 19.810 3.434 2.962 1.00 0.00 H new ATOM 0 HZ PHE A 121 17.603 4.102 3.763 1.00 0.00 H new ATOM 1933 N SER A 122 17.838 -1.122 -2.836 1.00 0.00 N ATOM 1934 CA SER A 122 18.466 -1.932 -3.866 1.00 0.00 C ATOM 1935 C SER A 122 18.039 -1.440 -5.251 1.00 0.00 C ATOM 1936 O SER A 122 18.842 -1.426 -6.183 1.00 0.00 O ATOM 1937 CB SER A 122 18.111 -3.411 -3.696 1.00 0.00 C ATOM 1938 OG SER A 122 19.260 -4.249 -3.787 1.00 0.00 O ATOM 0 H SER A 122 17.073 -1.579 -2.341 1.00 0.00 H new ATOM 0 HA SER A 122 19.547 -1.832 -3.769 1.00 0.00 H new ATOM 0 HB2 SER A 122 17.629 -3.560 -2.730 1.00 0.00 H new ATOM 0 HB3 SER A 122 17.389 -3.701 -4.460 1.00 0.00 H new ATOM 0 HG SER A 122 18.992 -5.185 -3.672 1.00 0.00 H new ATOM 1944 N ALA A 123 16.776 -1.050 -5.342 1.00 0.00 N ATOM 1945 CA ALA A 123 16.234 -0.558 -6.597 1.00 0.00 C ATOM 1946 C ALA A 123 16.651 0.901 -6.792 1.00 0.00 C ATOM 1947 O ALA A 123 16.276 1.530 -7.780 1.00 0.00 O ATOM 1948 CB ALA A 123 14.714 -0.736 -6.601 1.00 0.00 C ATOM 0 H ALA A 123 16.113 -1.065 -4.567 1.00 0.00 H new ATOM 0 HA ALA A 123 16.632 -1.129 -7.436 1.00 0.00 H new ATOM 0 HB1 ALA A 123 14.307 -0.367 -7.542 1.00 0.00 H new ATOM 0 HB2 ALA A 123 14.471 -1.793 -6.490 1.00 0.00 H new ATOM 0 HB3 ALA A 123 14.280 -0.175 -5.773 1.00 0.00 H new ATOM 1954 N GLY A 124 17.420 1.396 -5.833 1.00 0.00 N ATOM 1955 CA GLY A 124 17.891 2.769 -5.887 1.00 0.00 C ATOM 1956 C GLY A 124 16.719 3.749 -5.977 1.00 0.00 C ATOM 1957 O GLY A 124 16.846 4.822 -6.564 1.00 0.00 O ATOM 0 H GLY A 124 17.728 0.871 -5.015 1.00 0.00 H new ATOM 0 HA2 GLY A 124 18.485 2.988 -5.000 1.00 0.00 H new ATOM 0 HA3 GLY A 124 18.545 2.899 -6.749 1.00 0.00 H new ATOM 1961 N MET A 125 15.604 3.343 -5.388 1.00 0.00 N ATOM 1962 CA MET A 125 14.410 4.171 -5.394 1.00 0.00 C ATOM 1963 C MET A 125 14.332 5.031 -4.131 1.00 0.00 C ATOM 1964 O MET A 125 15.200 4.947 -3.264 1.00 0.00 O ATOM 1965 CB MET A 125 13.170 3.279 -5.482 1.00 0.00 C ATOM 1966 CG MET A 125 12.772 3.035 -6.939 1.00 0.00 C ATOM 1967 SD MET A 125 11.088 3.562 -7.208 1.00 0.00 S ATOM 1968 CE MET A 125 10.233 2.018 -6.940 1.00 0.00 C ATOM 0 H MET A 125 15.502 2.451 -4.903 1.00 0.00 H new ATOM 0 HA MET A 125 14.454 4.833 -6.259 1.00 0.00 H new ATOM 0 HB2 MET A 125 13.368 2.326 -4.991 1.00 0.00 H new ATOM 0 HB3 MET A 125 12.342 3.747 -4.949 1.00 0.00 H new ATOM 0 HG2 MET A 125 13.443 3.579 -7.604 1.00 0.00 H new ATOM 0 HG3 MET A 125 12.874 1.977 -7.180 1.00 0.00 H new ATOM 0 HE1 MET A 125 9.202 2.219 -6.648 1.00 0.00 H new ATOM 0 HE2 MET A 125 10.242 1.433 -7.860 1.00 0.00 H new ATOM 0 HE3 MET A 125 10.732 1.458 -6.149 1.00 0.00 H new ATOM 1978 N GLN A 126 13.285 5.840 -4.068 1.00 0.00 N ATOM 1979 CA GLN A 126 13.082 6.714 -2.925 1.00 0.00 C ATOM 1980 C GLN A 126 11.789 6.345 -2.197 1.00 0.00 C ATOM 1981 O GLN A 126 10.843 5.856 -2.813 1.00 0.00 O ATOM 1982 CB GLN A 126 13.069 8.183 -3.355 1.00 0.00 C ATOM 1983 CG GLN A 126 14.413 8.587 -3.964 1.00 0.00 C ATOM 1984 CD GLN A 126 15.139 9.596 -3.071 1.00 0.00 C ATOM 1985 OE1 GLN A 126 14.781 10.759 -2.986 1.00 0.00 O ATOM 1986 NE2 GLN A 126 16.176 9.086 -2.413 1.00 0.00 N ATOM 0 H GLN A 126 12.568 5.909 -4.790 1.00 0.00 H new ATOM 0 HA GLN A 126 13.915 6.578 -2.235 1.00 0.00 H new ATOM 0 HB2 GLN A 126 12.273 8.346 -4.081 1.00 0.00 H new ATOM 0 HB3 GLN A 126 12.850 8.816 -2.495 1.00 0.00 H new ATOM 0 HG2 GLN A 126 15.035 7.702 -4.100 1.00 0.00 H new ATOM 0 HG3 GLN A 126 14.253 9.019 -4.952 1.00 0.00 H new ATOM 0 HE21 GLN A 126 16.421 8.103 -2.530 1.00 0.00 H new ATOM 0 HE22 GLN A 126 16.726 9.678 -1.791 1.00 0.00 H new ATOM 1995 N LEU A 127 11.789 6.593 -0.895 1.00 0.00 N ATOM 1996 CA LEU A 127 10.627 6.292 -0.076 1.00 0.00 C ATOM 1997 C LEU A 127 9.784 7.559 0.091 1.00 0.00 C ATOM 1998 O LEU A 127 10.067 8.582 -0.530 1.00 0.00 O ATOM 1999 CB LEU A 127 11.055 5.659 1.250 1.00 0.00 C ATOM 2000 CG LEU A 127 12.405 4.939 1.244 1.00 0.00 C ATOM 2001 CD1 LEU A 127 13.196 5.248 2.516 1.00 0.00 C ATOM 2002 CD2 LEU A 127 12.222 3.435 1.033 1.00 0.00 C ATOM 0 H LEU A 127 12.575 6.999 -0.387 1.00 0.00 H new ATOM 0 HA LEU A 127 9.996 5.551 -0.567 1.00 0.00 H new ATOM 0 HB2 LEU A 127 11.085 6.440 2.010 1.00 0.00 H new ATOM 0 HB3 LEU A 127 10.287 4.948 1.555 1.00 0.00 H new ATOM 0 HG LEU A 127 12.989 5.313 0.403 1.00 0.00 H new ATOM 0 HD11 LEU A 127 14.151 4.724 2.487 1.00 0.00 H new ATOM 0 HD12 LEU A 127 13.373 6.321 2.583 1.00 0.00 H new ATOM 0 HD13 LEU A 127 12.628 4.919 3.386 1.00 0.00 H new ATOM 0 HD21 LEU A 127 13.196 2.946 1.033 1.00 0.00 H new ATOM 0 HD22 LEU A 127 11.611 3.026 1.838 1.00 0.00 H new ATOM 0 HD23 LEU A 127 11.728 3.259 0.078 1.00 0.00 H new ATOM 2014 N PRO A 128 8.740 7.444 0.954 1.00 0.00 N ATOM 2015 CA PRO A 128 7.854 8.568 1.210 1.00 0.00 C ATOM 2016 C PRO A 128 8.530 9.604 2.111 1.00 0.00 C ATOM 2017 O PRO A 128 9.094 9.258 3.147 1.00 0.00 O ATOM 2018 CB PRO A 128 6.613 7.955 1.838 1.00 0.00 C ATOM 2019 CG PRO A 128 7.032 6.581 2.335 1.00 0.00 C ATOM 2020 CD PRO A 128 8.375 6.248 1.706 1.00 0.00 C ATOM 0 HA PRO A 128 7.597 9.116 0.304 1.00 0.00 H new ATOM 0 HB2 PRO A 128 6.245 8.572 2.658 1.00 0.00 H new ATOM 0 HB3 PRO A 128 5.805 7.877 1.111 1.00 0.00 H new ATOM 0 HG2 PRO A 128 7.108 6.575 3.422 1.00 0.00 H new ATOM 0 HG3 PRO A 128 6.287 5.833 2.063 1.00 0.00 H new ATOM 0 HD2 PRO A 128 9.121 6.015 2.466 1.00 0.00 H new ATOM 0 HD3 PRO A 128 8.302 5.378 1.054 1.00 0.00 H new ATOM 2028 N THR A 129 8.450 10.855 1.682 1.00 0.00 N ATOM 2029 CA THR A 129 9.047 11.944 2.436 1.00 0.00 C ATOM 2030 C THR A 129 8.181 12.290 3.649 1.00 0.00 C ATOM 2031 O THR A 129 6.956 12.333 3.550 1.00 0.00 O ATOM 2032 CB THR A 129 9.254 13.122 1.482 1.00 0.00 C ATOM 2033 OG1 THR A 129 8.169 13.022 0.565 1.00 0.00 O ATOM 2034 CG2 THR A 129 10.498 12.955 0.607 1.00 0.00 C ATOM 0 H THR A 129 7.981 11.139 0.822 1.00 0.00 H new ATOM 0 HA THR A 129 10.019 11.659 2.840 1.00 0.00 H new ATOM 0 HB THR A 129 9.336 14.044 2.057 1.00 0.00 H new ATOM 0 HG1 THR A 129 8.225 13.750 -0.089 1.00 0.00 H new ATOM 0 HG21 THR A 129 10.598 13.818 -0.051 1.00 0.00 H new ATOM 0 HG22 THR A 129 11.381 12.878 1.241 1.00 0.00 H new ATOM 0 HG23 THR A 129 10.402 12.050 0.007 1.00 0.00 H new ATOM 2042 N LEU A 130 8.852 12.528 4.767 1.00 0.00 N ATOM 2043 CA LEU A 130 8.159 12.868 5.997 1.00 0.00 C ATOM 2044 C LEU A 130 6.975 13.782 5.675 1.00 0.00 C ATOM 2045 O LEU A 130 5.895 13.627 6.242 1.00 0.00 O ATOM 2046 CB LEU A 130 9.135 13.463 7.015 1.00 0.00 C ATOM 2047 CG LEU A 130 10.078 12.470 7.699 1.00 0.00 C ATOM 2048 CD1 LEU A 130 9.358 11.158 8.014 1.00 0.00 C ATOM 2049 CD2 LEU A 130 11.339 12.245 6.862 1.00 0.00 C ATOM 0 H LEU A 130 9.868 12.492 4.846 1.00 0.00 H new ATOM 0 HA LEU A 130 7.752 11.971 6.465 1.00 0.00 H new ATOM 0 HB2 LEU A 130 9.738 14.219 6.512 1.00 0.00 H new ATOM 0 HB3 LEU A 130 8.558 13.976 7.785 1.00 0.00 H new ATOM 0 HG LEU A 130 10.395 12.900 8.649 1.00 0.00 H new ATOM 0 HD11 LEU A 130 10.051 10.470 8.499 1.00 0.00 H new ATOM 0 HD12 LEU A 130 8.517 11.355 8.678 1.00 0.00 H new ATOM 0 HD13 LEU A 130 8.993 10.712 7.089 1.00 0.00 H new ATOM 0 HD21 LEU A 130 11.992 11.536 7.371 1.00 0.00 H new ATOM 0 HD22 LEU A 130 11.062 11.847 5.886 1.00 0.00 H new ATOM 0 HD23 LEU A 130 11.863 13.192 6.732 1.00 0.00 H new ATOM 2061 N ASP A 131 7.218 14.714 4.766 1.00 0.00 N ATOM 2062 CA ASP A 131 6.185 15.652 4.361 1.00 0.00 C ATOM 2063 C ASP A 131 5.016 14.882 3.745 1.00 0.00 C ATOM 2064 O ASP A 131 3.873 15.035 4.174 1.00 0.00 O ATOM 2065 CB ASP A 131 6.712 16.632 3.310 1.00 0.00 C ATOM 2066 CG ASP A 131 5.921 17.936 3.188 1.00 0.00 C ATOM 2067 OD1 ASP A 131 5.250 18.288 4.182 1.00 0.00 O ATOM 2068 OD2 ASP A 131 6.005 18.550 2.103 1.00 0.00 O ATOM 0 H ASP A 131 8.116 14.840 4.298 1.00 0.00 H new ATOM 0 HA ASP A 131 5.868 16.206 5.244 1.00 0.00 H new ATOM 0 HB2 ASP A 131 7.748 16.874 3.548 1.00 0.00 H new ATOM 0 HB3 ASP A 131 6.715 16.134 2.340 1.00 0.00 H new ATOM 2073 N GLU A 132 5.341 14.071 2.750 1.00 0.00 N ATOM 2074 CA GLU A 132 4.332 13.277 2.071 1.00 0.00 C ATOM 2075 C GLU A 132 3.574 12.409 3.077 1.00 0.00 C ATOM 2076 O GLU A 132 2.374 12.183 2.928 1.00 0.00 O ATOM 2077 CB GLU A 132 4.958 12.419 0.969 1.00 0.00 C ATOM 2078 CG GLU A 132 4.791 13.078 -0.401 1.00 0.00 C ATOM 2079 CD GLU A 132 4.490 12.034 -1.478 1.00 0.00 C ATOM 2080 OE1 GLU A 132 3.345 11.532 -1.478 1.00 0.00 O ATOM 2081 OE2 GLU A 132 5.411 11.762 -2.278 1.00 0.00 O ATOM 0 H GLU A 132 6.290 13.946 2.397 1.00 0.00 H new ATOM 0 HA GLU A 132 3.622 13.956 1.598 1.00 0.00 H new ATOM 0 HB2 GLU A 132 6.017 12.269 1.178 1.00 0.00 H new ATOM 0 HB3 GLU A 132 4.492 11.434 0.962 1.00 0.00 H new ATOM 0 HG2 GLU A 132 3.983 13.808 -0.361 1.00 0.00 H new ATOM 0 HG3 GLU A 132 5.699 13.622 -0.660 1.00 0.00 H new ATOM 2088 N ILE A 133 4.305 11.946 4.080 1.00 0.00 N ATOM 2089 CA ILE A 133 3.717 11.108 5.111 1.00 0.00 C ATOM 2090 C ILE A 133 2.631 11.897 5.845 1.00 0.00 C ATOM 2091 O ILE A 133 1.469 11.495 5.859 1.00 0.00 O ATOM 2092 CB ILE A 133 4.803 10.551 6.033 1.00 0.00 C ATOM 2093 CG1 ILE A 133 5.787 9.674 5.256 1.00 0.00 C ATOM 2094 CG2 ILE A 133 4.186 9.807 7.220 1.00 0.00 C ATOM 2095 CD1 ILE A 133 5.429 8.193 5.395 1.00 0.00 C ATOM 0 H ILE A 133 5.300 12.135 4.201 1.00 0.00 H new ATOM 0 HA ILE A 133 3.234 10.238 4.666 1.00 0.00 H new ATOM 0 HB ILE A 133 5.370 11.390 6.437 1.00 0.00 H new ATOM 0 HG12 ILE A 133 5.779 9.957 4.203 1.00 0.00 H new ATOM 0 HG13 ILE A 133 6.799 9.843 5.623 1.00 0.00 H new ATOM 0 HG21 ILE A 133 4.980 9.421 7.860 1.00 0.00 H new ATOM 0 HG22 ILE A 133 3.559 10.491 7.792 1.00 0.00 H new ATOM 0 HG23 ILE A 133 3.579 8.978 6.855 1.00 0.00 H new ATOM 0 HD11 ILE A 133 6.144 7.592 4.833 1.00 0.00 H new ATOM 0 HD12 ILE A 133 5.462 7.908 6.447 1.00 0.00 H new ATOM 0 HD13 ILE A 133 4.426 8.023 5.004 1.00 0.00 H new ATOM 2107 N ASN A 134 3.049 13.006 6.439 1.00 0.00 N ATOM 2108 CA ASN A 134 2.127 13.854 7.173 1.00 0.00 C ATOM 2109 C ASN A 134 0.976 14.266 6.253 1.00 0.00 C ATOM 2110 O ASN A 134 -0.189 14.025 6.565 1.00 0.00 O ATOM 2111 CB ASN A 134 2.820 15.128 7.662 1.00 0.00 C ATOM 2112 CG ASN A 134 2.141 15.674 8.919 1.00 0.00 C ATOM 2113 OD1 ASN A 134 1.508 16.717 8.911 1.00 0.00 O ATOM 2114 ND2 ASN A 134 2.308 14.914 9.998 1.00 0.00 N ATOM 0 H ASN A 134 4.014 13.336 6.426 1.00 0.00 H new ATOM 0 HA ASN A 134 1.761 13.290 8.031 1.00 0.00 H new ATOM 0 HB2 ASN A 134 3.868 14.918 7.873 1.00 0.00 H new ATOM 0 HB3 ASN A 134 2.798 15.883 6.876 1.00 0.00 H new ATOM 0 HD21 ASN A 134 1.894 15.193 10.887 1.00 0.00 H new ATOM 0 HD22 ASN A 134 2.850 14.052 9.936 1.00 0.00 H new ATOM 2121 N LYS A 135 1.343 14.880 5.138 1.00 0.00 N ATOM 2122 CA LYS A 135 0.355 15.327 4.170 1.00 0.00 C ATOM 2123 C LYS A 135 -0.623 14.186 3.883 1.00 0.00 C ATOM 2124 O LYS A 135 -1.837 14.384 3.910 1.00 0.00 O ATOM 2125 CB LYS A 135 1.042 15.878 2.919 1.00 0.00 C ATOM 2126 CG LYS A 135 0.920 14.899 1.750 1.00 0.00 C ATOM 2127 CD LYS A 135 1.505 15.498 0.469 1.00 0.00 C ATOM 2128 CE LYS A 135 0.770 14.974 -0.766 1.00 0.00 C ATOM 2129 NZ LYS A 135 1.685 14.918 -1.928 1.00 0.00 N ATOM 0 H LYS A 135 2.310 15.079 4.883 1.00 0.00 H new ATOM 0 HA LYS A 135 -0.229 16.154 4.575 1.00 0.00 H new ATOM 0 HB2 LYS A 135 0.595 16.834 2.646 1.00 0.00 H new ATOM 0 HB3 LYS A 135 2.094 16.067 3.131 1.00 0.00 H new ATOM 0 HG2 LYS A 135 1.439 13.972 1.992 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -0.128 14.645 1.591 1.00 0.00 H new ATOM 0 HD2 LYS A 135 1.433 16.585 0.506 1.00 0.00 H new ATOM 0 HD3 LYS A 135 2.564 15.251 0.398 1.00 0.00 H new ATOM 0 HE2 LYS A 135 0.368 13.981 -0.564 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -0.078 15.620 -0.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 1.140 14.708 -2.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 2.165 15.834 -2.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 2.394 14.172 -1.776 1.00 0.00 H new ATOM 2143 N LYS A 136 -0.059 13.018 3.614 1.00 0.00 N ATOM 2144 CA LYS A 136 -0.866 11.846 3.321 1.00 0.00 C ATOM 2145 C LYS A 136 -1.686 11.476 4.559 1.00 0.00 C ATOM 2146 O LYS A 136 -2.882 11.205 4.457 1.00 0.00 O ATOM 2147 CB LYS A 136 0.012 10.707 2.801 1.00 0.00 C ATOM 2148 CG LYS A 136 -0.791 9.411 2.672 1.00 0.00 C ATOM 2149 CD LYS A 136 -2.117 9.657 1.949 1.00 0.00 C ATOM 2150 CE LYS A 136 -1.888 9.920 0.459 1.00 0.00 C ATOM 2151 NZ LYS A 136 -3.065 9.492 -0.330 1.00 0.00 N ATOM 0 H LYS A 136 0.948 12.858 3.593 1.00 0.00 H new ATOM 0 HA LYS A 136 -1.574 12.061 2.521 1.00 0.00 H new ATOM 0 HB2 LYS A 136 0.429 10.978 1.831 1.00 0.00 H new ATOM 0 HB3 LYS A 136 0.852 10.553 3.478 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -0.207 8.670 2.126 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -0.984 8.998 3.662 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -2.769 8.792 2.073 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -2.628 10.509 2.398 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -1.700 10.981 0.296 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -1.002 9.383 0.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -2.767 8.810 -1.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -3.761 9.044 0.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -3.496 10.320 -0.788 1.00 0.00 H new ATOM 2165 N GLU A 137 -1.011 11.476 5.699 1.00 0.00 N ATOM 2166 CA GLU A 137 -1.662 11.143 6.954 1.00 0.00 C ATOM 2167 C GLU A 137 -3.011 11.856 7.058 1.00 0.00 C ATOM 2168 O GLU A 137 -4.057 11.210 7.108 1.00 0.00 O ATOM 2169 CB GLU A 137 -0.765 11.489 8.145 1.00 0.00 C ATOM 2170 CG GLU A 137 -1.122 10.637 9.365 1.00 0.00 C ATOM 2171 CD GLU A 137 -0.267 11.025 10.573 1.00 0.00 C ATOM 2172 OE1 GLU A 137 0.318 12.129 10.524 1.00 0.00 O ATOM 2173 OE2 GLU A 137 -0.217 10.209 11.519 1.00 0.00 O ATOM 0 H GLU A 137 -0.019 11.701 5.780 1.00 0.00 H new ATOM 0 HA GLU A 137 -1.840 10.068 6.975 1.00 0.00 H new ATOM 0 HB2 GLU A 137 0.279 11.328 7.877 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -0.872 12.546 8.391 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -2.177 10.764 9.606 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -0.973 9.582 9.133 1.00 0.00 H new ATOM 2180 N LEU A 138 -2.944 13.179 7.087 1.00 0.00 N ATOM 2181 CA LEU A 138 -4.148 13.987 7.185 1.00 0.00 C ATOM 2182 C LEU A 138 -5.233 13.387 6.288 1.00 0.00 C ATOM 2183 O LEU A 138 -6.348 13.132 6.742 1.00 0.00 O ATOM 2184 CB LEU A 138 -3.836 15.452 6.876 1.00 0.00 C ATOM 2185 CG LEU A 138 -3.357 16.299 8.057 1.00 0.00 C ATOM 2186 CD1 LEU A 138 -4.376 16.274 9.198 1.00 0.00 C ATOM 2187 CD2 LEU A 138 -1.967 15.859 8.519 1.00 0.00 C ATOM 0 H LEU A 138 -2.075 13.711 7.044 1.00 0.00 H new ATOM 0 HA LEU A 138 -4.533 13.975 8.205 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -3.073 15.484 6.098 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -4.732 15.914 6.463 1.00 0.00 H new ATOM 0 HG LEU A 138 -3.272 17.333 7.724 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -4.011 16.884 10.025 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -5.327 16.673 8.845 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -4.516 15.248 9.538 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -1.650 16.477 9.359 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -2.000 14.815 8.829 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -1.258 15.971 7.698 1.00 0.00 H new ATOM 2199 N SER A 139 -4.870 13.180 5.031 1.00 0.00 N ATOM 2200 CA SER A 139 -5.799 12.615 4.067 1.00 0.00 C ATOM 2201 C SER A 139 -6.519 11.411 4.677 1.00 0.00 C ATOM 2202 O SER A 139 -7.731 11.268 4.530 1.00 0.00 O ATOM 2203 CB SER A 139 -5.077 12.206 2.781 1.00 0.00 C ATOM 2204 OG SER A 139 -5.742 12.692 1.618 1.00 0.00 O ATOM 0 H SER A 139 -3.945 13.393 4.658 1.00 0.00 H new ATOM 0 HA SER A 139 -6.534 13.379 3.812 1.00 0.00 H new ATOM 0 HB2 SER A 139 -4.056 12.588 2.801 1.00 0.00 H new ATOM 0 HB3 SER A 139 -5.010 11.119 2.733 1.00 0.00 H new ATOM 0 HG SER A 139 -5.250 12.412 0.818 1.00 0.00 H new ATOM 2210 N ILE A 140 -5.741 10.575 5.350 1.00 0.00 N ATOM 2211 CA ILE A 140 -6.289 9.388 5.983 1.00 0.00 C ATOM 2212 C ILE A 140 -7.244 9.808 7.104 1.00 0.00 C ATOM 2213 O ILE A 140 -8.418 9.442 7.093 1.00 0.00 O ATOM 2214 CB ILE A 140 -5.165 8.461 6.449 1.00 0.00 C ATOM 2215 CG1 ILE A 140 -4.526 7.736 5.262 1.00 0.00 C ATOM 2216 CG2 ILE A 140 -5.665 7.485 7.515 1.00 0.00 C ATOM 2217 CD1 ILE A 140 -3.324 8.515 4.726 1.00 0.00 C ATOM 0 H ILE A 140 -4.735 10.697 5.470 1.00 0.00 H new ATOM 0 HA ILE A 140 -6.872 8.809 5.266 1.00 0.00 H new ATOM 0 HB ILE A 140 -4.388 9.071 6.911 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -4.210 6.739 5.568 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -5.264 7.608 4.470 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -4.846 6.838 7.829 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -6.036 8.044 8.375 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -6.470 6.877 7.103 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -2.889 7.978 3.883 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -3.647 9.503 4.399 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -2.578 8.620 5.514 1.00 0.00 H new ATOM 2229 N LYS A 141 -6.703 10.569 8.044 1.00 0.00 N ATOM 2230 CA LYS A 141 -7.492 11.042 9.169 1.00 0.00 C ATOM 2231 C LYS A 141 -8.866 11.493 8.669 1.00 0.00 C ATOM 2232 O LYS A 141 -9.890 10.964 9.098 1.00 0.00 O ATOM 2233 CB LYS A 141 -6.732 12.124 9.938 1.00 0.00 C ATOM 2234 CG LYS A 141 -5.775 11.502 10.958 1.00 0.00 C ATOM 2235 CD LYS A 141 -4.348 11.448 10.408 1.00 0.00 C ATOM 2236 CE LYS A 141 -3.366 12.131 11.362 1.00 0.00 C ATOM 2237 NZ LYS A 141 -3.055 13.500 10.892 1.00 0.00 N ATOM 0 H LYS A 141 -5.728 10.870 8.050 1.00 0.00 H new ATOM 0 HA LYS A 141 -7.661 10.235 9.882 1.00 0.00 H new ATOM 0 HB2 LYS A 141 -6.171 12.746 9.240 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -7.440 12.777 10.449 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -5.792 12.084 11.880 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -6.110 10.496 11.210 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -4.052 10.410 10.257 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -4.312 11.935 9.433 1.00 0.00 H new ATOM 0 HE2 LYS A 141 -3.792 12.172 12.364 1.00 0.00 H new ATOM 0 HE3 LYS A 141 -2.449 11.546 11.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 -2.051 13.707 11.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 -3.252 13.570 9.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 -3.644 14.186 11.407 1.00 0.00 H new ATOM 2251 N GLU A 142 -8.843 12.465 7.770 1.00 0.00 N ATOM 2252 CA GLU A 142 -10.075 12.993 7.207 1.00 0.00 C ATOM 2253 C GLU A 142 -11.039 11.852 6.876 1.00 0.00 C ATOM 2254 O GLU A 142 -12.142 11.790 7.418 1.00 0.00 O ATOM 2255 CB GLU A 142 -9.790 13.847 5.970 1.00 0.00 C ATOM 2256 CG GLU A 142 -9.513 15.301 6.359 1.00 0.00 C ATOM 2257 CD GLU A 142 -10.693 16.202 5.987 1.00 0.00 C ATOM 2258 OE1 GLU A 142 -11.594 16.339 6.842 1.00 0.00 O ATOM 2259 OE2 GLU A 142 -10.666 16.734 4.856 1.00 0.00 O ATOM 0 H GLU A 142 -7.991 12.901 7.417 1.00 0.00 H new ATOM 0 HA GLU A 142 -10.546 13.636 7.951 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -8.933 13.441 5.433 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -10.641 13.804 5.290 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -9.325 15.365 7.431 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -8.611 15.650 5.856 1.00 0.00 H new