USER MOD reduce.3.24.130724 H: found=0, std=0, add=608, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 606 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 173 MET CE :methyl -155:sc= -1.66 (180deg=-2.31) USER MOD Set 1.2: A 176 HIS :FLIP no HE2:sc= -4.56! C(o=-7.6!,f=-6.2!) USER MOD Set 2.1: A 132 TYR OH : rot 150:sc= 0.0427 USER MOD Set 2.2: A 135 LYS NZ :NH3+ -168:sc= 0.345 (180deg=0.289) USER MOD Set 3.1: A 123 ASN : amide:sc= -0.233 K(o=-1.3,f=-2.8!) USER MOD Set 3.2: A 179 MET CE :methyl 156:sc= -1.06 (180deg=-2.88!) USER MOD Single : A 113 ASN : amide:sc= 0.403 X(o=0.4,f=-0.038) USER MOD Single : A 114 LYS NZ :NH3+ 147:sc=-0.00979 (180deg=-0.949) USER MOD Single : A 122 HIS : no HE2:sc= -1.15 K(o=-1.2,f=-4.7!) USER MOD Single : A 124 CYS SG : rot 180:sc= -1.27 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ -175:sc= 0.268 (180deg=0.259) USER MOD Single : A 140 THR OG1 : rot 110:sc= -0.524 USER MOD Single : A 144 MET CE :methyl -131:sc= -4.09 (180deg=-4.48!) USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 160 THR OG1 : rot 180:sc= 0 USER MOD Single : A 165 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 166 SER OG : rot 170:sc= -0.746 USER MOD Single : A 169 GLN : amide:sc= -0.0515 K(o=-0.051,f=-1.7!) USER MOD Single : A 172 ASN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 174 HIS : no HE2:sc= -1.9! C(o=-1.9!,f=-2.6!) USER MOD Single : A 181 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 182 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.1) USER MOD Single : A 186 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 110 N ASN A 113 -5.649 -7.399 10.491 1.00 0.00 N ATOM 111 CA ASN A 113 -4.990 -8.458 9.736 1.00 0.00 C ATOM 112 C ASN A 113 -6.013 -9.324 9.007 1.00 0.00 C ATOM 113 O ASN A 113 -5.872 -10.545 8.936 1.00 0.00 O ATOM 114 CB ASN A 113 -4.142 -9.326 10.668 1.00 0.00 C ATOM 115 CG ASN A 113 -3.301 -8.500 11.622 1.00 0.00 C ATOM 116 OD1 ASN A 113 -2.681 -7.514 11.225 1.00 0.00 O ATOM 117 ND2 ASN A 113 -3.277 -8.901 12.888 1.00 0.00 N ATOM 0 HA ASN A 113 -4.341 -7.991 8.995 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -4.795 -9.984 11.241 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -3.489 -9.964 10.072 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -2.729 -8.385 13.576 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -3.807 -9.725 13.172 1.00 0.00 H new ATOM 124 N LYS A 114 -7.043 -8.683 8.465 1.00 0.00 N ATOM 125 CA LYS A 114 -8.090 -9.392 7.739 1.00 0.00 C ATOM 126 C LYS A 114 -7.728 -9.534 6.264 1.00 0.00 C ATOM 127 O LYS A 114 -7.086 -8.657 5.685 1.00 0.00 O ATOM 128 CB LYS A 114 -9.424 -8.657 7.879 1.00 0.00 C ATOM 129 CG LYS A 114 -10.631 -9.517 7.543 1.00 0.00 C ATOM 130 CD LYS A 114 -11.839 -8.667 7.188 1.00 0.00 C ATOM 131 CE LYS A 114 -12.562 -8.178 8.434 1.00 0.00 C ATOM 132 NZ LYS A 114 -11.920 -6.962 9.006 1.00 0.00 N ATOM 0 H LYS A 114 -7.175 -7.673 8.515 1.00 0.00 H new ATOM 0 HA LYS A 114 -8.185 -10.389 8.170 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -9.522 -8.291 8.901 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -9.418 -7.783 7.227 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -10.389 -10.174 6.708 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -10.872 -10.156 8.393 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -11.521 -7.812 6.591 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -12.526 -9.248 6.572 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -13.601 -7.959 8.189 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -12.572 -8.970 9.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -12.647 -6.355 9.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -11.230 -7.243 9.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -11.434 -6.438 8.251 1.00 0.00 H new ATOM 146 N ILE A 115 -8.146 -10.642 5.661 1.00 0.00 N ATOM 147 CA ILE A 115 -7.868 -10.896 4.253 1.00 0.00 C ATOM 148 C ILE A 115 -9.126 -11.344 3.516 1.00 0.00 C ATOM 149 O ILE A 115 -9.985 -12.019 4.085 1.00 0.00 O ATOM 150 CB ILE A 115 -6.777 -11.969 4.079 1.00 0.00 C ATOM 151 CG1 ILE A 115 -7.268 -13.318 4.606 1.00 0.00 C ATOM 152 CG2 ILE A 115 -5.501 -11.547 4.794 1.00 0.00 C ATOM 153 CD1 ILE A 115 -6.484 -14.497 4.073 1.00 0.00 C ATOM 0 H ILE A 115 -8.678 -11.378 6.126 1.00 0.00 H new ATOM 0 HA ILE A 115 -7.515 -9.957 3.827 1.00 0.00 H new ATOM 0 HB ILE A 115 -6.558 -12.074 3.016 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -7.211 -13.316 5.694 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -8.318 -13.441 4.342 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -4.739 -12.315 4.662 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -5.144 -10.606 4.376 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -5.705 -11.417 5.857 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -6.887 -15.420 4.489 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -6.562 -14.524 2.986 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -5.437 -14.397 4.359 1.00 0.00 H new ATOM 165 N PHE A 116 -9.228 -10.964 2.247 1.00 0.00 N ATOM 166 CA PHE A 116 -10.381 -11.327 1.431 1.00 0.00 C ATOM 167 C PHE A 116 -10.149 -12.657 0.721 1.00 0.00 C ATOM 168 O PHE A 116 -9.304 -12.760 -0.169 1.00 0.00 O ATOM 169 CB PHE A 116 -10.670 -10.231 0.403 1.00 0.00 C ATOM 170 CG PHE A 116 -11.503 -10.701 -0.756 1.00 0.00 C ATOM 171 CD1 PHE A 116 -12.883 -10.758 -0.656 1.00 0.00 C ATOM 172 CD2 PHE A 116 -10.904 -11.084 -1.946 1.00 0.00 C ATOM 173 CE1 PHE A 116 -13.651 -11.191 -1.721 1.00 0.00 C ATOM 174 CE2 PHE A 116 -11.667 -11.517 -3.014 1.00 0.00 C ATOM 175 CZ PHE A 116 -13.043 -11.569 -2.901 1.00 0.00 C ATOM 0 H PHE A 116 -8.527 -10.405 1.761 1.00 0.00 H new ATOM 0 HA PHE A 116 -11.242 -11.433 2.091 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -11.183 -9.406 0.898 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -9.725 -9.839 0.026 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -13.365 -10.461 0.264 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -9.829 -11.044 -2.040 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -14.726 -11.233 -1.630 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -11.188 -11.814 -3.935 1.00 0.00 H new ATOM 0 HZ PHE A 116 -13.642 -11.905 -3.735 1.00 0.00 H new ATOM 185 N VAL A 117 -10.904 -13.675 1.121 1.00 0.00 N ATOM 186 CA VAL A 117 -10.781 -15.000 0.524 1.00 0.00 C ATOM 187 C VAL A 117 -11.992 -15.326 -0.343 1.00 0.00 C ATOM 188 O VAL A 117 -13.110 -15.448 0.155 1.00 0.00 O ATOM 189 CB VAL A 117 -10.627 -16.089 1.602 1.00 0.00 C ATOM 190 CG1 VAL A 117 -10.629 -17.472 0.968 1.00 0.00 C ATOM 191 CG2 VAL A 117 -9.356 -15.865 2.407 1.00 0.00 C ATOM 0 H VAL A 117 -11.608 -13.608 1.856 1.00 0.00 H new ATOM 0 HA VAL A 117 -9.886 -14.986 -0.098 1.00 0.00 H new ATOM 0 HB VAL A 117 -11.477 -16.026 2.282 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -10.519 -18.229 1.745 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -11.569 -17.629 0.439 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -9.800 -17.551 0.265 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -9.263 -16.643 3.164 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -8.493 -15.901 1.742 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -9.400 -14.890 2.892 1.00 0.00 H new ATOM 201 N GLY A 118 -11.761 -15.466 -1.645 1.00 0.00 N ATOM 202 CA GLY A 118 -12.842 -15.778 -2.561 1.00 0.00 C ATOM 203 C GLY A 118 -12.628 -17.092 -3.285 1.00 0.00 C ATOM 204 O GLY A 118 -11.691 -17.830 -2.983 1.00 0.00 O ATOM 0 H GLY A 118 -10.844 -15.369 -2.081 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -13.781 -15.820 -2.009 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -12.937 -14.975 -3.292 1.00 0.00 H new ATOM 208 N GLY A 119 -13.501 -17.387 -4.243 1.00 0.00 N ATOM 209 CA GLY A 119 -13.387 -18.623 -4.996 1.00 0.00 C ATOM 210 C GLY A 119 -13.348 -19.846 -4.101 1.00 0.00 C ATOM 211 O GLY A 119 -12.826 -20.891 -4.490 1.00 0.00 O ATOM 0 H GLY A 119 -14.285 -16.792 -4.511 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -14.230 -18.706 -5.682 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -12.483 -18.592 -5.604 1.00 0.00 H new ATOM 215 N ILE A 120 -13.899 -19.715 -2.899 1.00 0.00 N ATOM 216 CA ILE A 120 -13.924 -20.818 -1.947 1.00 0.00 C ATOM 217 C ILE A 120 -14.867 -21.923 -2.410 1.00 0.00 C ATOM 218 O ILE A 120 -15.966 -21.670 -2.904 1.00 0.00 O ATOM 219 CB ILE A 120 -14.357 -20.344 -0.547 1.00 0.00 C ATOM 220 CG1 ILE A 120 -13.401 -19.266 -0.032 1.00 0.00 C ATOM 221 CG2 ILE A 120 -14.409 -21.519 0.418 1.00 0.00 C ATOM 222 CD1 ILE A 120 -13.956 -18.470 1.129 1.00 0.00 C ATOM 0 H ILE A 120 -14.334 -18.856 -2.562 1.00 0.00 H new ATOM 0 HA ILE A 120 -12.908 -21.209 -1.892 1.00 0.00 H new ATOM 0 HB ILE A 120 -15.356 -19.914 -0.618 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -12.467 -19.737 0.274 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -13.162 -18.584 -0.848 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -14.717 -21.168 1.403 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -15.126 -22.256 0.056 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -13.422 -21.976 0.488 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -13.225 -17.725 1.442 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -14.875 -17.970 0.822 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -14.169 -19.141 1.961 1.00 0.00 H new ATOM 234 N PRO A 121 -14.430 -23.181 -2.248 1.00 0.00 N ATOM 235 CA PRO A 121 -15.220 -24.351 -2.641 1.00 0.00 C ATOM 236 C PRO A 121 -16.438 -24.555 -1.747 1.00 0.00 C ATOM 237 O PRO A 121 -16.580 -23.898 -0.715 1.00 0.00 O ATOM 238 CB PRO A 121 -14.238 -25.514 -2.479 1.00 0.00 C ATOM 239 CG PRO A 121 -13.257 -25.042 -1.462 1.00 0.00 C ATOM 240 CD PRO A 121 -13.130 -23.557 -1.666 1.00 0.00 C ATOM 0 HA PRO A 121 -15.621 -24.251 -3.650 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -14.747 -26.419 -2.148 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -13.747 -25.752 -3.423 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -13.601 -25.269 -0.453 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -12.294 -25.537 -1.589 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -12.945 -23.037 -0.726 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -12.304 -23.312 -2.334 1.00 0.00 H new ATOM 248 N HIS A 122 -17.316 -25.469 -2.149 1.00 0.00 N ATOM 249 CA HIS A 122 -18.523 -25.760 -1.383 1.00 0.00 C ATOM 250 C HIS A 122 -18.247 -26.814 -0.315 1.00 0.00 C ATOM 251 O HIS A 122 -19.156 -27.513 0.129 1.00 0.00 O ATOM 252 CB HIS A 122 -19.639 -26.238 -2.312 1.00 0.00 C ATOM 253 CG HIS A 122 -19.336 -27.536 -2.994 1.00 0.00 C ATOM 254 ND1 HIS A 122 -19.056 -28.699 -2.308 1.00 0.00 N ATOM 255 CD2 HIS A 122 -19.272 -27.852 -4.308 1.00 0.00 C ATOM 256 CE1 HIS A 122 -18.830 -29.673 -3.171 1.00 0.00 C ATOM 257 NE2 HIS A 122 -18.956 -29.185 -4.392 1.00 0.00 N ATOM 0 H HIS A 122 -17.214 -26.021 -3.001 1.00 0.00 H new ATOM 0 HA HIS A 122 -18.841 -24.842 -0.889 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -20.558 -26.345 -1.736 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -19.823 -25.474 -3.068 1.00 0.00 H new ATOM 0 HD1 HIS A 122 -19.028 -28.792 -1.293 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -19.439 -27.180 -5.137 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -18.584 -30.694 -2.921 1.00 0.00 H new ATOM 265 N ASN A 123 -16.986 -26.921 0.092 1.00 0.00 N ATOM 266 CA ASN A 123 -16.591 -27.891 1.107 1.00 0.00 C ATOM 267 C ASN A 123 -15.691 -27.245 2.156 1.00 0.00 C ATOM 268 O ASN A 123 -15.736 -27.603 3.333 1.00 0.00 O ATOM 269 CB ASN A 123 -15.869 -29.074 0.458 1.00 0.00 C ATOM 270 CG ASN A 123 -15.934 -30.328 1.309 1.00 0.00 C ATOM 271 OD1 ASN A 123 -16.573 -30.345 2.361 1.00 0.00 O ATOM 272 ND2 ASN A 123 -15.270 -31.385 0.856 1.00 0.00 N ATOM 0 H ASN A 123 -16.221 -26.349 -0.265 1.00 0.00 H new ATOM 0 HA ASN A 123 -17.494 -28.251 1.601 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -16.312 -29.276 -0.517 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -14.826 -28.809 0.285 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -15.276 -32.257 1.386 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -14.754 -31.325 -0.022 1.00 0.00 H new ATOM 279 N CYS A 124 -14.875 -26.291 1.720 1.00 0.00 N ATOM 280 CA CYS A 124 -13.964 -25.594 2.621 1.00 0.00 C ATOM 281 C CYS A 124 -14.736 -24.742 3.623 1.00 0.00 C ATOM 282 O CYS A 124 -15.449 -23.814 3.244 1.00 0.00 O ATOM 283 CB CYS A 124 -12.998 -24.717 1.824 1.00 0.00 C ATOM 284 SG CYS A 124 -11.939 -23.666 2.846 1.00 0.00 S ATOM 0 H CYS A 124 -14.826 -25.983 0.749 1.00 0.00 H new ATOM 0 HA CYS A 124 -13.394 -26.342 3.172 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -12.368 -25.357 1.206 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -13.573 -24.086 1.146 1.00 0.00 H new ATOM 0 HG CYS A 124 -11.156 -22.964 2.081 1.00 0.00 H new ATOM 290 N GLY A 125 -14.589 -25.065 4.904 1.00 0.00 N ATOM 291 CA GLY A 125 -15.280 -24.321 5.941 1.00 0.00 C ATOM 292 C GLY A 125 -14.324 -23.646 6.904 1.00 0.00 C ATOM 293 O GLY A 125 -13.109 -23.692 6.717 1.00 0.00 O ATOM 0 H GLY A 125 -14.004 -25.829 5.242 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -15.918 -23.568 5.479 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -15.933 -24.996 6.495 1.00 0.00 H new ATOM 297 N GLU A 126 -14.874 -23.015 7.937 1.00 0.00 N ATOM 298 CA GLU A 126 -14.061 -22.325 8.932 1.00 0.00 C ATOM 299 C GLU A 126 -12.840 -23.159 9.309 1.00 0.00 C ATOM 300 O GLU A 126 -11.702 -22.701 9.200 1.00 0.00 O ATOM 301 CB GLU A 126 -14.892 -22.022 10.181 1.00 0.00 C ATOM 302 CG GLU A 126 -14.085 -21.412 11.315 1.00 0.00 C ATOM 303 CD GLU A 126 -14.871 -21.326 12.609 1.00 0.00 C ATOM 304 OE1 GLU A 126 -16.070 -20.981 12.552 1.00 0.00 O ATOM 305 OE2 GLU A 126 -14.287 -21.603 13.677 1.00 0.00 O ATOM 0 H GLU A 126 -15.879 -22.967 8.107 1.00 0.00 H new ATOM 0 HA GLU A 126 -13.718 -21.386 8.497 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -15.700 -21.341 9.913 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -15.356 -22.944 10.531 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -13.187 -22.008 11.478 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -13.757 -20.413 11.026 1.00 0.00 H new ATOM 312 N THR A 127 -13.085 -24.387 9.756 1.00 0.00 N ATOM 313 CA THR A 127 -12.007 -25.285 10.151 1.00 0.00 C ATOM 314 C THR A 127 -10.947 -25.386 9.060 1.00 0.00 C ATOM 315 O THR A 127 -9.774 -25.099 9.295 1.00 0.00 O ATOM 316 CB THR A 127 -12.539 -26.696 10.467 1.00 0.00 C ATOM 317 OG1 THR A 127 -13.507 -26.630 11.520 1.00 0.00 O ATOM 318 CG2 THR A 127 -11.404 -27.623 10.873 1.00 0.00 C ATOM 0 H THR A 127 -14.020 -24.782 9.853 1.00 0.00 H new ATOM 0 HA THR A 127 -11.559 -24.864 11.051 1.00 0.00 H new ATOM 0 HB THR A 127 -13.008 -27.094 9.567 1.00 0.00 H new ATOM 0 HG1 THR A 127 -13.842 -27.531 11.714 1.00 0.00 H new ATOM 0 HG21 THR A 127 -11.804 -28.613 11.091 1.00 0.00 H new ATOM 0 HG22 THR A 127 -10.683 -27.694 10.058 1.00 0.00 H new ATOM 0 HG23 THR A 127 -10.911 -27.227 11.761 1.00 0.00 H new ATOM 326 N GLU A 128 -11.369 -25.796 7.868 1.00 0.00 N ATOM 327 CA GLU A 128 -10.454 -25.935 6.741 1.00 0.00 C ATOM 328 C GLU A 128 -9.644 -24.657 6.537 1.00 0.00 C ATOM 329 O GLU A 128 -8.414 -24.691 6.478 1.00 0.00 O ATOM 330 CB GLU A 128 -11.229 -26.270 5.465 1.00 0.00 C ATOM 331 CG GLU A 128 -11.935 -27.614 5.517 1.00 0.00 C ATOM 332 CD GLU A 128 -10.967 -28.779 5.583 1.00 0.00 C ATOM 333 OE1 GLU A 128 -10.362 -29.109 4.542 1.00 0.00 O ATOM 334 OE2 GLU A 128 -10.814 -29.361 6.677 1.00 0.00 O ATOM 0 H GLU A 128 -12.337 -26.037 7.658 1.00 0.00 H new ATOM 0 HA GLU A 128 -9.765 -26.750 6.963 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -11.967 -25.489 5.282 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -10.541 -26.263 4.620 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -12.591 -27.642 6.387 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -12.568 -27.722 4.636 1.00 0.00 H new ATOM 341 N LEU A 129 -10.343 -23.532 6.430 1.00 0.00 N ATOM 342 CA LEU A 129 -9.690 -22.243 6.232 1.00 0.00 C ATOM 343 C LEU A 129 -8.488 -22.092 7.159 1.00 0.00 C ATOM 344 O LEU A 129 -7.401 -21.712 6.725 1.00 0.00 O ATOM 345 CB LEU A 129 -10.682 -21.104 6.476 1.00 0.00 C ATOM 346 CG LEU A 129 -11.802 -20.957 5.445 1.00 0.00 C ATOM 347 CD1 LEU A 129 -12.855 -19.977 5.937 1.00 0.00 C ATOM 348 CD2 LEU A 129 -11.238 -20.509 4.105 1.00 0.00 C ATOM 0 H LEU A 129 -11.361 -23.487 6.477 1.00 0.00 H new ATOM 0 HA LEU A 129 -9.338 -22.197 5.201 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -11.135 -21.247 7.457 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -10.126 -20.167 6.515 1.00 0.00 H new ATOM 0 HG LEU A 129 -12.275 -21.929 5.310 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -13.644 -19.885 5.190 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -13.281 -20.340 6.872 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -12.396 -19.002 6.102 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -12.049 -20.410 3.384 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -10.738 -19.548 4.224 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -10.522 -21.248 3.746 1.00 0.00 H new ATOM 360 N ARG A 130 -8.692 -22.396 8.437 1.00 0.00 N ATOM 361 CA ARG A 130 -7.625 -22.296 9.425 1.00 0.00 C ATOM 362 C ARG A 130 -6.568 -23.372 9.195 1.00 0.00 C ATOM 363 O ARG A 130 -5.383 -23.071 9.052 1.00 0.00 O ATOM 364 CB ARG A 130 -8.196 -22.420 10.839 1.00 0.00 C ATOM 365 CG ARG A 130 -9.337 -21.456 11.122 1.00 0.00 C ATOM 366 CD ARG A 130 -9.617 -21.348 12.613 1.00 0.00 C ATOM 367 NE ARG A 130 -10.696 -20.407 12.899 1.00 0.00 N ATOM 368 CZ ARG A 130 -10.853 -19.803 14.072 1.00 0.00 C ATOM 369 NH1 ARG A 130 -10.003 -20.040 15.062 1.00 0.00 N ATOM 370 NH2 ARG A 130 -11.860 -18.959 14.256 1.00 0.00 N ATOM 0 H ARG A 130 -9.586 -22.713 8.812 1.00 0.00 H new ATOM 0 HA ARG A 130 -7.154 -21.319 9.316 1.00 0.00 H new ATOM 0 HB2 ARG A 130 -8.547 -23.440 10.992 1.00 0.00 H new ATOM 0 HB3 ARG A 130 -7.398 -22.247 11.561 1.00 0.00 H new ATOM 0 HG2 ARG A 130 -9.090 -20.471 10.725 1.00 0.00 H new ATOM 0 HG3 ARG A 130 -10.236 -21.792 10.605 1.00 0.00 H new ATOM 0 HD2 ARG A 130 -9.879 -22.331 13.005 1.00 0.00 H new ATOM 0 HD3 ARG A 130 -8.712 -21.030 13.130 1.00 0.00 H new ATOM 0 HE ARG A 130 -11.366 -20.202 12.158 1.00 0.00 H new ATOM 0 HH11 ARG A 130 -9.227 -20.687 14.924 1.00 0.00 H new ATOM 0 HH12 ARG A 130 -10.125 -19.575 15.962 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -12.515 -18.773 13.496 1.00 0.00 H new ATOM 0 HH22 ARG A 130 -11.979 -18.496 15.157 1.00 0.00 H new ATOM 384 N GLU A 131 -7.006 -24.627 9.162 1.00 0.00 N ATOM 385 CA GLU A 131 -6.097 -25.747 8.951 1.00 0.00 C ATOM 386 C GLU A 131 -5.128 -25.454 7.809 1.00 0.00 C ATOM 387 O GLU A 131 -4.040 -26.027 7.741 1.00 0.00 O ATOM 388 CB GLU A 131 -6.885 -27.023 8.651 1.00 0.00 C ATOM 389 CG GLU A 131 -7.800 -27.454 9.786 1.00 0.00 C ATOM 390 CD GLU A 131 -7.109 -28.373 10.775 1.00 0.00 C ATOM 391 OE1 GLU A 131 -6.243 -27.888 11.531 1.00 0.00 O ATOM 392 OE2 GLU A 131 -7.436 -29.579 10.792 1.00 0.00 O ATOM 0 H GLU A 131 -7.984 -24.893 9.279 1.00 0.00 H new ATOM 0 HA GLU A 131 -5.521 -25.891 9.865 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -7.482 -26.868 7.753 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -6.185 -27.830 8.433 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -8.164 -26.570 10.310 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -8.672 -27.961 9.372 1.00 0.00 H new ATOM 399 N TYR A 132 -5.532 -24.560 6.913 1.00 0.00 N ATOM 400 CA TYR A 132 -4.703 -24.193 5.772 1.00 0.00 C ATOM 401 C TYR A 132 -4.051 -22.831 5.988 1.00 0.00 C ATOM 402 O TYR A 132 -2.917 -22.599 5.568 1.00 0.00 O ATOM 403 CB TYR A 132 -5.540 -24.173 4.492 1.00 0.00 C ATOM 404 CG TYR A 132 -4.714 -24.077 3.229 1.00 0.00 C ATOM 405 CD1 TYR A 132 -3.943 -22.952 2.963 1.00 0.00 C ATOM 406 CD2 TYR A 132 -4.703 -25.113 2.302 1.00 0.00 C ATOM 407 CE1 TYR A 132 -3.188 -22.860 1.810 1.00 0.00 C ATOM 408 CE2 TYR A 132 -3.949 -25.030 1.148 1.00 0.00 C ATOM 409 CZ TYR A 132 -3.194 -23.902 0.906 1.00 0.00 C ATOM 410 OH TYR A 132 -2.441 -23.815 -0.243 1.00 0.00 O ATOM 0 H TYR A 132 -6.429 -24.076 6.955 1.00 0.00 H new ATOM 0 HA TYR A 132 -3.916 -24.941 5.672 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -6.147 -25.077 4.451 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -6.228 -23.328 4.531 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -3.934 -22.136 3.670 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -5.294 -25.998 2.487 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -2.596 -21.977 1.617 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -3.951 -25.844 0.439 1.00 0.00 H new ATOM 0 HH TYR A 132 -2.158 -24.712 -0.517 1.00 0.00 H new ATOM 420 N PHE A 133 -4.776 -21.933 6.646 1.00 0.00 N ATOM 421 CA PHE A 133 -4.270 -20.593 6.919 1.00 0.00 C ATOM 422 C PHE A 133 -3.538 -20.550 8.257 1.00 0.00 C ATOM 423 O PHE A 133 -3.297 -19.478 8.812 1.00 0.00 O ATOM 424 CB PHE A 133 -5.418 -19.581 6.920 1.00 0.00 C ATOM 425 CG PHE A 133 -5.958 -19.286 5.550 1.00 0.00 C ATOM 426 CD1 PHE A 133 -5.106 -18.935 4.516 1.00 0.00 C ATOM 427 CD2 PHE A 133 -7.318 -19.360 5.297 1.00 0.00 C ATOM 428 CE1 PHE A 133 -5.600 -18.663 3.254 1.00 0.00 C ATOM 429 CE2 PHE A 133 -7.818 -19.089 4.037 1.00 0.00 C ATOM 430 CZ PHE A 133 -6.958 -18.739 3.014 1.00 0.00 C ATOM 0 H PHE A 133 -5.716 -22.109 7.000 1.00 0.00 H new ATOM 0 HA PHE A 133 -3.565 -20.331 6.130 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -6.226 -19.960 7.546 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -5.072 -18.652 7.373 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -4.043 -18.873 4.698 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -7.995 -19.632 6.093 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -4.925 -18.391 2.456 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -8.880 -19.151 3.852 1.00 0.00 H new ATOM 0 HZ PHE A 133 -7.347 -18.525 2.029 1.00 0.00 H new ATOM 440 N LYS A 134 -3.187 -21.724 8.771 1.00 0.00 N ATOM 441 CA LYS A 134 -2.482 -21.823 10.043 1.00 0.00 C ATOM 442 C LYS A 134 -0.975 -21.917 9.825 1.00 0.00 C ATOM 443 O LYS A 134 -0.187 -21.579 10.708 1.00 0.00 O ATOM 444 CB LYS A 134 -2.971 -23.043 10.827 1.00 0.00 C ATOM 445 CG LYS A 134 -2.467 -24.365 10.273 1.00 0.00 C ATOM 446 CD LYS A 134 -2.360 -25.421 11.360 1.00 0.00 C ATOM 447 CE LYS A 134 -3.654 -26.207 11.502 1.00 0.00 C ATOM 448 NZ LYS A 134 -3.628 -27.109 12.687 1.00 0.00 N ATOM 0 H LYS A 134 -3.380 -22.621 8.325 1.00 0.00 H new ATOM 0 HA LYS A 134 -2.693 -20.921 10.617 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -2.652 -22.949 11.865 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -4.061 -23.051 10.828 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -3.142 -24.714 9.491 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -1.491 -24.218 9.810 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -1.542 -26.103 11.127 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -2.117 -24.944 12.309 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -4.491 -25.515 11.591 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -3.822 -26.796 10.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -4.492 -27.688 12.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -2.795 -27.730 12.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -3.579 -26.539 13.556 1.00 0.00 H new ATOM 462 N LYS A 135 -0.581 -22.376 8.642 1.00 0.00 N ATOM 463 CA LYS A 135 0.831 -22.512 8.305 1.00 0.00 C ATOM 464 C LYS A 135 1.477 -21.144 8.108 1.00 0.00 C ATOM 465 O LYS A 135 2.643 -20.943 8.448 1.00 0.00 O ATOM 466 CB LYS A 135 0.996 -23.353 7.037 1.00 0.00 C ATOM 467 CG LYS A 135 0.106 -22.905 5.890 1.00 0.00 C ATOM 468 CD LYS A 135 0.644 -23.378 4.550 1.00 0.00 C ATOM 469 CE LYS A 135 -0.472 -23.549 3.531 1.00 0.00 C ATOM 470 NZ LYS A 135 0.036 -23.468 2.133 1.00 0.00 N ATOM 0 H LYS A 135 -1.220 -22.660 7.900 1.00 0.00 H new ATOM 0 HA LYS A 135 1.330 -23.014 9.134 1.00 0.00 H new ATOM 0 HB2 LYS A 135 2.037 -23.311 6.716 1.00 0.00 H new ATOM 0 HB3 LYS A 135 0.776 -24.395 7.271 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -0.902 -23.294 6.037 1.00 0.00 H new ATOM 0 HG3 LYS A 135 0.031 -21.818 5.890 1.00 0.00 H new ATOM 0 HD2 LYS A 135 1.373 -22.660 4.175 1.00 0.00 H new ATOM 0 HD3 LYS A 135 1.167 -24.325 4.681 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -0.960 -24.511 3.685 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -1.228 -22.780 3.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -0.766 -23.385 1.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 0.652 -22.635 2.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 0.578 -24.327 1.910 1.00 0.00 H new ATOM 484 N PHE A 136 0.712 -20.208 7.557 1.00 0.00 N ATOM 485 CA PHE A 136 1.211 -18.859 7.315 1.00 0.00 C ATOM 486 C PHE A 136 1.447 -18.122 8.631 1.00 0.00 C ATOM 487 O PHE A 136 2.351 -17.295 8.738 1.00 0.00 O ATOM 488 CB PHE A 136 0.222 -18.075 6.449 1.00 0.00 C ATOM 489 CG PHE A 136 0.097 -18.608 5.050 1.00 0.00 C ATOM 490 CD1 PHE A 136 1.220 -18.776 4.256 1.00 0.00 C ATOM 491 CD2 PHE A 136 -1.143 -18.941 4.530 1.00 0.00 C ATOM 492 CE1 PHE A 136 1.108 -19.266 2.969 1.00 0.00 C ATOM 493 CE2 PHE A 136 -1.261 -19.431 3.243 1.00 0.00 C ATOM 494 CZ PHE A 136 -0.134 -19.594 2.462 1.00 0.00 C ATOM 0 H PHE A 136 -0.255 -20.358 7.270 1.00 0.00 H new ATOM 0 HA PHE A 136 2.162 -18.939 6.788 1.00 0.00 H new ATOM 0 HB2 PHE A 136 -0.758 -18.092 6.925 1.00 0.00 H new ATOM 0 HB3 PHE A 136 0.537 -17.032 6.405 1.00 0.00 H new ATOM 0 HD1 PHE A 136 2.194 -18.521 4.647 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -2.028 -18.816 5.137 1.00 0.00 H new ATOM 0 HE1 PHE A 136 1.991 -19.392 2.360 1.00 0.00 H new ATOM 0 HE2 PHE A 136 -2.234 -19.686 2.849 1.00 0.00 H new ATOM 0 HZ PHE A 136 -0.224 -19.977 1.456 1.00 0.00 H new ATOM 504 N GLY A 137 0.625 -18.429 9.630 1.00 0.00 N ATOM 505 CA GLY A 137 0.760 -17.788 10.925 1.00 0.00 C ATOM 506 C GLY A 137 -0.220 -18.332 11.946 1.00 0.00 C ATOM 507 O GLY A 137 -0.110 -19.482 12.372 1.00 0.00 O ATOM 0 H GLY A 137 -0.132 -19.110 9.566 1.00 0.00 H new ATOM 0 HA2 GLY A 137 1.777 -17.927 11.292 1.00 0.00 H new ATOM 0 HA3 GLY A 137 0.606 -16.715 10.814 1.00 0.00 H new ATOM 511 N VAL A 138 -1.181 -17.503 12.342 1.00 0.00 N ATOM 512 CA VAL A 138 -2.184 -17.907 13.320 1.00 0.00 C ATOM 513 C VAL A 138 -3.529 -17.250 13.032 1.00 0.00 C ATOM 514 O VAL A 138 -3.689 -16.041 13.198 1.00 0.00 O ATOM 515 CB VAL A 138 -1.746 -17.549 14.753 1.00 0.00 C ATOM 516 CG1 VAL A 138 -2.863 -17.845 15.742 1.00 0.00 C ATOM 517 CG2 VAL A 138 -0.479 -18.303 15.127 1.00 0.00 C ATOM 0 H VAL A 138 -1.286 -16.548 12.000 1.00 0.00 H new ATOM 0 HA VAL A 138 -2.287 -18.989 13.239 1.00 0.00 H new ATOM 0 HB VAL A 138 -1.531 -16.481 14.792 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -2.536 -17.586 16.749 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -3.743 -17.256 15.484 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -3.112 -18.905 15.703 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -0.184 -18.038 16.142 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -0.664 -19.376 15.071 1.00 0.00 H new ATOM 0 HG23 VAL A 138 0.321 -18.036 14.436 1.00 0.00 H new ATOM 527 N VAL A 139 -4.494 -18.055 12.599 1.00 0.00 N ATOM 528 CA VAL A 139 -5.827 -17.552 12.289 1.00 0.00 C ATOM 529 C VAL A 139 -6.593 -17.205 13.560 1.00 0.00 C ATOM 530 O VAL A 139 -7.047 -18.090 14.286 1.00 0.00 O ATOM 531 CB VAL A 139 -6.639 -18.579 11.477 1.00 0.00 C ATOM 532 CG1 VAL A 139 -8.036 -18.049 11.191 1.00 0.00 C ATOM 533 CG2 VAL A 139 -5.917 -18.927 10.184 1.00 0.00 C ATOM 0 H VAL A 139 -4.378 -19.058 12.455 1.00 0.00 H new ATOM 0 HA VAL A 139 -5.694 -16.650 11.691 1.00 0.00 H new ATOM 0 HB VAL A 139 -6.736 -19.489 12.069 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -8.595 -18.788 10.617 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -8.551 -17.855 12.132 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -7.964 -17.124 10.619 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -6.505 -19.654 9.623 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -5.788 -18.025 9.585 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -4.940 -19.352 10.416 1.00 0.00 H new ATOM 543 N THR A 140 -6.734 -15.910 13.825 1.00 0.00 N ATOM 544 CA THR A 140 -7.444 -15.445 15.009 1.00 0.00 C ATOM 545 C THR A 140 -8.954 -15.498 14.801 1.00 0.00 C ATOM 546 O THR A 140 -9.701 -15.863 15.708 1.00 0.00 O ATOM 547 CB THR A 140 -7.039 -14.005 15.378 1.00 0.00 C ATOM 548 OG1 THR A 140 -7.181 -13.149 14.239 1.00 0.00 O ATOM 549 CG2 THR A 140 -5.603 -13.959 15.879 1.00 0.00 C ATOM 0 H THR A 140 -6.365 -15.164 13.235 1.00 0.00 H new ATOM 0 HA THR A 140 -7.168 -16.113 15.825 1.00 0.00 H new ATOM 0 HB THR A 140 -7.696 -13.659 16.175 1.00 0.00 H new ATOM 0 HG1 THR A 140 -7.934 -12.538 14.381 1.00 0.00 H new ATOM 0 HG21 THR A 140 -5.339 -12.932 16.133 1.00 0.00 H new ATOM 0 HG22 THR A 140 -5.506 -14.589 16.763 1.00 0.00 H new ATOM 0 HG23 THR A 140 -4.934 -14.323 15.099 1.00 0.00 H new ATOM 557 N GLU A 141 -9.394 -15.133 13.601 1.00 0.00 N ATOM 558 CA GLU A 141 -10.816 -15.140 13.276 1.00 0.00 C ATOM 559 C GLU A 141 -11.039 -15.543 11.821 1.00 0.00 C ATOM 560 O GLU A 141 -10.150 -15.397 10.981 1.00 0.00 O ATOM 561 CB GLU A 141 -11.427 -13.762 13.534 1.00 0.00 C ATOM 562 CG GLU A 141 -12.904 -13.808 13.888 1.00 0.00 C ATOM 563 CD GLU A 141 -13.148 -14.262 15.314 1.00 0.00 C ATOM 564 OE1 GLU A 141 -13.287 -15.484 15.533 1.00 0.00 O ATOM 565 OE2 GLU A 141 -13.201 -13.395 16.212 1.00 0.00 O ATOM 0 H GLU A 141 -8.788 -14.829 12.839 1.00 0.00 H new ATOM 0 HA GLU A 141 -11.306 -15.873 13.917 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -10.882 -13.278 14.345 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -11.294 -13.143 12.647 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -13.339 -12.819 13.746 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -13.417 -14.483 13.203 1.00 0.00 H new ATOM 572 N VAL A 142 -12.232 -16.051 11.530 1.00 0.00 N ATOM 573 CA VAL A 142 -12.573 -16.475 10.177 1.00 0.00 C ATOM 574 C VAL A 142 -13.958 -15.979 9.779 1.00 0.00 C ATOM 575 O VAL A 142 -14.974 -16.537 10.195 1.00 0.00 O ATOM 576 CB VAL A 142 -12.531 -18.009 10.042 1.00 0.00 C ATOM 577 CG1 VAL A 142 -12.922 -18.432 8.635 1.00 0.00 C ATOM 578 CG2 VAL A 142 -11.151 -18.538 10.403 1.00 0.00 C ATOM 0 H VAL A 142 -12.979 -16.179 12.213 1.00 0.00 H new ATOM 0 HA VAL A 142 -11.828 -16.039 9.511 1.00 0.00 H new ATOM 0 HB VAL A 142 -13.252 -18.437 10.738 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -12.887 -19.519 8.559 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -13.933 -18.086 8.419 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -12.227 -17.995 7.917 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -11.140 -19.623 10.302 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -10.408 -18.103 9.734 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -10.915 -18.267 11.432 1.00 0.00 H new ATOM 588 N VAL A 143 -13.993 -14.925 8.969 1.00 0.00 N ATOM 589 CA VAL A 143 -15.254 -14.353 8.512 1.00 0.00 C ATOM 590 C VAL A 143 -15.782 -15.094 7.288 1.00 0.00 C ATOM 591 O VAL A 143 -15.012 -15.523 6.430 1.00 0.00 O ATOM 592 CB VAL A 143 -15.101 -12.860 8.168 1.00 0.00 C ATOM 593 CG1 VAL A 143 -16.432 -12.275 7.720 1.00 0.00 C ATOM 594 CG2 VAL A 143 -14.546 -12.093 9.359 1.00 0.00 C ATOM 0 H VAL A 143 -13.162 -14.450 8.616 1.00 0.00 H new ATOM 0 HA VAL A 143 -15.965 -14.458 9.332 1.00 0.00 H new ATOM 0 HB VAL A 143 -14.395 -12.766 7.343 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -16.304 -11.219 7.481 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -16.784 -12.807 6.836 1.00 0.00 H new ATOM 0 HG13 VAL A 143 -17.163 -12.379 8.521 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -14.444 -11.040 9.098 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -15.226 -12.193 10.205 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -13.570 -12.496 9.628 1.00 0.00 H new ATOM 604 N MET A 144 -17.101 -15.240 7.216 1.00 0.00 N ATOM 605 CA MET A 144 -17.732 -15.928 6.096 1.00 0.00 C ATOM 606 C MET A 144 -19.078 -15.295 5.758 1.00 0.00 C ATOM 607 O MET A 144 -19.847 -14.935 6.650 1.00 0.00 O ATOM 608 CB MET A 144 -17.921 -17.411 6.421 1.00 0.00 C ATOM 609 CG MET A 144 -16.666 -18.243 6.213 1.00 0.00 C ATOM 610 SD MET A 144 -17.013 -20.009 6.108 1.00 0.00 S ATOM 611 CE MET A 144 -16.209 -20.421 4.561 1.00 0.00 C ATOM 0 H MET A 144 -17.753 -14.892 7.919 1.00 0.00 H new ATOM 0 HA MET A 144 -17.078 -15.834 5.229 1.00 0.00 H new ATOM 0 HB2 MET A 144 -18.245 -17.509 7.457 1.00 0.00 H new ATOM 0 HB3 MET A 144 -18.720 -17.812 5.798 1.00 0.00 H new ATOM 0 HG2 MET A 144 -16.168 -17.920 5.299 1.00 0.00 H new ATOM 0 HG3 MET A 144 -15.974 -18.061 7.035 1.00 0.00 H new ATOM 0 HE1 MET A 144 -16.894 -20.995 3.937 1.00 0.00 H new ATOM 0 HE2 MET A 144 -15.927 -19.505 4.042 1.00 0.00 H new ATOM 0 HE3 MET A 144 -15.317 -21.014 4.761 1.00 0.00 H new ATOM 621 N ILE A 145 -19.357 -15.161 4.466 1.00 0.00 N ATOM 622 CA ILE A 145 -20.610 -14.572 4.011 1.00 0.00 C ATOM 623 C ILE A 145 -21.534 -15.632 3.421 1.00 0.00 C ATOM 624 O ILE A 145 -21.099 -16.494 2.656 1.00 0.00 O ATOM 625 CB ILE A 145 -20.367 -13.475 2.958 1.00 0.00 C ATOM 626 CG1 ILE A 145 -19.525 -12.344 3.553 1.00 0.00 C ATOM 627 CG2 ILE A 145 -21.692 -12.938 2.438 1.00 0.00 C ATOM 628 CD1 ILE A 145 -18.934 -11.419 2.512 1.00 0.00 C ATOM 0 H ILE A 145 -18.731 -15.453 3.715 1.00 0.00 H new ATOM 0 HA ILE A 145 -21.084 -14.126 4.885 1.00 0.00 H new ATOM 0 HB ILE A 145 -19.819 -13.909 2.122 1.00 0.00 H new ATOM 0 HG12 ILE A 145 -20.144 -11.762 4.236 1.00 0.00 H new ATOM 0 HG13 ILE A 145 -18.717 -12.776 4.144 1.00 0.00 H new ATOM 0 HG21 ILE A 145 -21.504 -12.163 1.695 1.00 0.00 H new ATOM 0 HG22 ILE A 145 -22.259 -13.749 1.982 1.00 0.00 H new ATOM 0 HG23 ILE A 145 -22.263 -12.516 3.265 1.00 0.00 H new ATOM 0 HD11 ILE A 145 -18.350 -10.642 3.005 1.00 0.00 H new ATOM 0 HD12 ILE A 145 -18.289 -11.989 1.844 1.00 0.00 H new ATOM 0 HD13 ILE A 145 -19.737 -10.959 1.936 1.00 0.00 H new ATOM 640 N TYR A 146 -22.811 -15.562 3.780 1.00 0.00 N ATOM 641 CA TYR A 146 -23.797 -16.516 3.286 1.00 0.00 C ATOM 642 C TYR A 146 -25.201 -16.138 3.749 1.00 0.00 C ATOM 643 O TYR A 146 -25.368 -15.317 4.652 1.00 0.00 O ATOM 644 CB TYR A 146 -23.454 -17.928 3.762 1.00 0.00 C ATOM 645 CG TYR A 146 -23.017 -17.990 5.208 1.00 0.00 C ATOM 646 CD1 TYR A 146 -23.804 -17.448 6.217 1.00 0.00 C ATOM 647 CD2 TYR A 146 -21.816 -18.590 5.567 1.00 0.00 C ATOM 648 CE1 TYR A 146 -23.408 -17.501 7.539 1.00 0.00 C ATOM 649 CE2 TYR A 146 -21.413 -18.649 6.887 1.00 0.00 C ATOM 650 CZ TYR A 146 -22.212 -18.103 7.869 1.00 0.00 C ATOM 651 OH TYR A 146 -21.814 -18.159 9.185 1.00 0.00 O ATOM 0 H TYR A 146 -23.188 -14.855 4.411 1.00 0.00 H new ATOM 0 HA TYR A 146 -23.775 -16.491 2.197 1.00 0.00 H new ATOM 0 HB2 TYR A 146 -24.325 -18.570 3.627 1.00 0.00 H new ATOM 0 HB3 TYR A 146 -22.660 -18.331 3.134 1.00 0.00 H new ATOM 0 HD1 TYR A 146 -24.742 -16.977 5.963 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -21.187 -19.018 4.801 1.00 0.00 H new ATOM 0 HE1 TYR A 146 -24.032 -17.073 8.310 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -20.477 -19.120 7.148 1.00 0.00 H new ATOM 0 HH TYR A 146 -20.950 -18.617 9.246 1.00 0.00 H new ATOM 661 N ASP A 147 -26.205 -16.743 3.126 1.00 0.00 N ATOM 662 CA ASP A 147 -27.595 -16.472 3.474 1.00 0.00 C ATOM 663 C ASP A 147 -28.048 -17.358 4.630 1.00 0.00 C ATOM 664 O ASP A 147 -28.129 -18.579 4.495 1.00 0.00 O ATOM 665 CB ASP A 147 -28.500 -16.693 2.260 1.00 0.00 C ATOM 666 CG ASP A 147 -29.944 -16.330 2.541 1.00 0.00 C ATOM 667 OD1 ASP A 147 -30.182 -15.480 3.426 1.00 0.00 O ATOM 668 OD2 ASP A 147 -30.838 -16.893 1.875 1.00 0.00 O ATOM 0 H ASP A 147 -26.083 -17.425 2.377 1.00 0.00 H new ATOM 0 HA ASP A 147 -27.669 -15.431 3.787 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -28.134 -16.096 1.424 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -28.444 -17.738 1.954 1.00 0.00 H new ATOM 673 N ALA A 148 -28.342 -16.735 5.766 1.00 0.00 N ATOM 674 CA ALA A 148 -28.788 -17.467 6.945 1.00 0.00 C ATOM 675 C ALA A 148 -29.624 -18.681 6.555 1.00 0.00 C ATOM 676 O ALA A 148 -29.258 -19.818 6.849 1.00 0.00 O ATOM 677 CB ALA A 148 -29.581 -16.552 7.866 1.00 0.00 C ATOM 0 H ALA A 148 -28.279 -15.725 5.895 1.00 0.00 H new ATOM 0 HA ALA A 148 -27.905 -17.823 7.476 1.00 0.00 H new ATOM 0 HB1 ALA A 148 -29.908 -17.112 8.742 1.00 0.00 H new ATOM 0 HB2 ALA A 148 -28.952 -15.719 8.181 1.00 0.00 H new ATOM 0 HB3 ALA A 148 -30.452 -16.168 7.335 1.00 0.00 H new ATOM 683 N GLU A 149 -30.748 -18.431 5.891 1.00 0.00 N ATOM 684 CA GLU A 149 -31.636 -19.505 5.461 1.00 0.00 C ATOM 685 C GLU A 149 -30.838 -20.735 5.041 1.00 0.00 C ATOM 686 O GLU A 149 -31.161 -21.860 5.424 1.00 0.00 O ATOM 687 CB GLU A 149 -32.518 -19.035 4.303 1.00 0.00 C ATOM 688 CG GLU A 149 -33.656 -19.989 3.978 1.00 0.00 C ATOM 689 CD GLU A 149 -34.371 -19.626 2.691 1.00 0.00 C ATOM 690 OE1 GLU A 149 -33.708 -19.586 1.634 1.00 0.00 O ATOM 691 OE2 GLU A 149 -35.595 -19.383 2.742 1.00 0.00 O ATOM 0 H GLU A 149 -31.065 -17.495 5.639 1.00 0.00 H new ATOM 0 HA GLU A 149 -32.271 -19.776 6.304 1.00 0.00 H new ATOM 0 HB2 GLU A 149 -32.933 -18.057 4.547 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -31.899 -18.905 3.415 1.00 0.00 H new ATOM 0 HG2 GLU A 149 -33.264 -21.003 3.898 1.00 0.00 H new ATOM 0 HG3 GLU A 149 -34.372 -19.988 4.800 1.00 0.00 H new ATOM 698 N LYS A 150 -29.794 -20.514 4.249 1.00 0.00 N ATOM 699 CA LYS A 150 -28.948 -21.603 3.775 1.00 0.00 C ATOM 700 C LYS A 150 -27.948 -22.021 4.848 1.00 0.00 C ATOM 701 O LYS A 150 -27.689 -23.209 5.037 1.00 0.00 O ATOM 702 CB LYS A 150 -28.204 -21.182 2.506 1.00 0.00 C ATOM 703 CG LYS A 150 -29.045 -21.285 1.245 1.00 0.00 C ATOM 704 CD LYS A 150 -28.182 -21.524 0.017 1.00 0.00 C ATOM 705 CE LYS A 150 -28.953 -22.252 -1.073 1.00 0.00 C ATOM 706 NZ LYS A 150 -30.026 -21.399 -1.657 1.00 0.00 N ATOM 0 H LYS A 150 -29.513 -19.590 3.922 1.00 0.00 H new ATOM 0 HA LYS A 150 -29.588 -22.455 3.548 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -27.861 -20.154 2.621 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -27.316 -21.804 2.392 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -29.762 -22.099 1.351 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -29.620 -20.368 1.114 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -27.821 -20.570 -0.367 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -27.305 -22.108 0.296 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -28.265 -22.560 -1.860 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -29.394 -23.160 -0.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -30.529 -21.931 -2.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -30.697 -21.125 -0.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -29.603 -20.545 -2.072 1.00 0.00 H new ATOM 720 N GLN A 151 -27.393 -21.038 5.549 1.00 0.00 N ATOM 721 CA GLN A 151 -26.422 -21.306 6.604 1.00 0.00 C ATOM 722 C GLN A 151 -25.202 -22.034 6.049 1.00 0.00 C ATOM 723 O GLN A 151 -24.760 -23.038 6.607 1.00 0.00 O ATOM 724 CB GLN A 151 -27.064 -22.136 7.717 1.00 0.00 C ATOM 725 CG GLN A 151 -27.707 -21.296 8.809 1.00 0.00 C ATOM 726 CD GLN A 151 -27.667 -21.972 10.165 1.00 0.00 C ATOM 727 OE1 GLN A 151 -28.659 -22.548 10.613 1.00 0.00 O ATOM 728 NE2 GLN A 151 -26.518 -21.906 10.827 1.00 0.00 N ATOM 0 H GLN A 151 -27.599 -20.049 5.406 1.00 0.00 H new ATOM 0 HA GLN A 151 -26.096 -20.351 7.015 1.00 0.00 H new ATOM 0 HB2 GLN A 151 -27.819 -22.790 7.281 1.00 0.00 H new ATOM 0 HB3 GLN A 151 -26.305 -22.778 8.164 1.00 0.00 H new ATOM 0 HG2 GLN A 151 -27.196 -20.335 8.871 1.00 0.00 H new ATOM 0 HG3 GLN A 151 -28.743 -21.089 8.541 1.00 0.00 H new ATOM 0 HE21 GLN A 151 -25.721 -21.418 10.418 1.00 0.00 H new ATOM 0 HE22 GLN A 151 -26.432 -22.343 11.745 1.00 0.00 H new ATOM 737 N ARG A 152 -24.663 -21.521 4.948 1.00 0.00 N ATOM 738 CA ARG A 152 -23.495 -22.123 4.317 1.00 0.00 C ATOM 739 C ARG A 152 -22.776 -21.113 3.428 1.00 0.00 C ATOM 740 O ARG A 152 -23.396 -20.333 2.706 1.00 0.00 O ATOM 741 CB ARG A 152 -23.908 -23.343 3.491 1.00 0.00 C ATOM 742 CG ARG A 152 -23.014 -23.595 2.288 1.00 0.00 C ATOM 743 CD ARG A 152 -22.943 -25.075 1.946 1.00 0.00 C ATOM 744 NE ARG A 152 -24.221 -25.585 1.457 1.00 0.00 N ATOM 745 CZ ARG A 152 -24.495 -26.878 1.327 1.00 0.00 C ATOM 746 NH1 ARG A 152 -23.585 -27.787 1.649 1.00 0.00 N ATOM 747 NH2 ARG A 152 -25.681 -27.264 0.874 1.00 0.00 N ATOM 0 H ARG A 152 -25.017 -20.690 4.474 1.00 0.00 H new ATOM 0 HA ARG A 152 -22.811 -22.440 5.104 1.00 0.00 H new ATOM 0 HB2 ARG A 152 -23.898 -24.225 4.131 1.00 0.00 H new ATOM 0 HB3 ARG A 152 -24.934 -23.209 3.149 1.00 0.00 H new ATOM 0 HG2 ARG A 152 -23.393 -23.040 1.430 1.00 0.00 H new ATOM 0 HG3 ARG A 152 -22.012 -23.220 2.493 1.00 0.00 H new ATOM 0 HD2 ARG A 152 -22.175 -25.236 1.189 1.00 0.00 H new ATOM 0 HD3 ARG A 152 -22.642 -25.637 2.830 1.00 0.00 H new ATOM 0 HE ARG A 152 -24.943 -24.911 1.201 1.00 0.00 H new ATOM 0 HH11 ARG A 152 -22.672 -27.494 1.997 1.00 0.00 H new ATOM 0 HH12 ARG A 152 -23.798 -28.779 1.548 1.00 0.00 H new ATOM 0 HH21 ARG A 152 -26.383 -26.567 0.625 1.00 0.00 H new ATOM 0 HH22 ARG A 152 -25.890 -28.257 0.775 1.00 0.00 H new ATOM 761 N PRO A 153 -21.436 -21.127 3.480 1.00 0.00 N ATOM 762 CA PRO A 153 -20.603 -20.219 2.686 1.00 0.00 C ATOM 763 C PRO A 153 -20.646 -20.546 1.197 1.00 0.00 C ATOM 764 O PRO A 153 -20.114 -21.567 0.760 1.00 0.00 O ATOM 765 CB PRO A 153 -19.196 -20.449 3.243 1.00 0.00 C ATOM 766 CG PRO A 153 -19.232 -21.829 3.804 1.00 0.00 C ATOM 767 CD PRO A 153 -20.630 -22.031 4.318 1.00 0.00 C ATOM 0 HA PRO A 153 -20.942 -19.186 2.760 1.00 0.00 H new ATOM 0 HB2 PRO A 153 -18.441 -20.359 2.462 1.00 0.00 H new ATOM 0 HB3 PRO A 153 -18.949 -19.716 4.011 1.00 0.00 H new ATOM 0 HG2 PRO A 153 -18.987 -22.567 3.040 1.00 0.00 H new ATOM 0 HG3 PRO A 153 -18.501 -21.944 4.605 1.00 0.00 H new ATOM 0 HD2 PRO A 153 -20.950 -23.068 4.214 1.00 0.00 H new ATOM 0 HD3 PRO A 153 -20.710 -21.777 5.375 1.00 0.00 H new ATOM 775 N ARG A 154 -21.282 -19.673 0.422 1.00 0.00 N ATOM 776 CA ARG A 154 -21.395 -19.870 -1.018 1.00 0.00 C ATOM 777 C ARG A 154 -20.032 -20.174 -1.633 1.00 0.00 C ATOM 778 O ARG A 154 -19.877 -21.144 -2.375 1.00 0.00 O ATOM 779 CB ARG A 154 -21.999 -18.630 -1.678 1.00 0.00 C ATOM 780 CG ARG A 154 -23.347 -18.227 -1.101 1.00 0.00 C ATOM 781 CD ARG A 154 -23.744 -16.826 -1.537 1.00 0.00 C ATOM 782 NE ARG A 154 -25.194 -16.661 -1.595 1.00 0.00 N ATOM 783 CZ ARG A 154 -25.799 -15.740 -2.336 1.00 0.00 C ATOM 784 NH1 ARG A 154 -25.084 -14.906 -3.078 1.00 0.00 N ATOM 785 NH2 ARG A 154 -27.123 -15.652 -2.337 1.00 0.00 N ATOM 0 H ARG A 154 -21.727 -18.823 0.768 1.00 0.00 H new ATOM 0 HA ARG A 154 -22.052 -20.722 -1.193 1.00 0.00 H new ATOM 0 HB2 ARG A 154 -21.304 -17.797 -1.571 1.00 0.00 H new ATOM 0 HB3 ARG A 154 -22.112 -18.816 -2.746 1.00 0.00 H new ATOM 0 HG2 ARG A 154 -24.108 -18.938 -1.422 1.00 0.00 H new ATOM 0 HG3 ARG A 154 -23.306 -18.273 -0.013 1.00 0.00 H new ATOM 0 HD2 ARG A 154 -23.324 -16.098 -0.843 1.00 0.00 H new ATOM 0 HD3 ARG A 154 -23.316 -16.616 -2.517 1.00 0.00 H new ATOM 0 HE ARG A 154 -25.773 -17.287 -1.036 1.00 0.00 H new ATOM 0 HH11 ARG A 154 -24.066 -14.971 -3.081 1.00 0.00 H new ATOM 0 HH12 ARG A 154 -25.552 -14.200 -3.646 1.00 0.00 H new ATOM 0 HH21 ARG A 154 -27.677 -16.292 -1.768 1.00 0.00 H new ATOM 0 HH22 ARG A 154 -27.587 -14.944 -2.907 1.00 0.00 H new ATOM 799 N GLY A 155 -19.047 -19.338 -1.320 1.00 0.00 N ATOM 800 CA GLY A 155 -17.711 -19.534 -1.851 1.00 0.00 C ATOM 801 C GLY A 155 -16.875 -18.271 -1.797 1.00 0.00 C ATOM 802 O GLY A 155 -16.126 -17.973 -2.728 1.00 0.00 O ATOM 0 H GLY A 155 -19.150 -18.528 -0.708 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -17.211 -20.321 -1.287 1.00 0.00 H new ATOM 0 HA3 GLY A 155 -17.780 -19.876 -2.884 1.00 0.00 H new ATOM 806 N PHE A 156 -17.003 -17.524 -0.705 1.00 0.00 N ATOM 807 CA PHE A 156 -16.255 -16.284 -0.535 1.00 0.00 C ATOM 808 C PHE A 156 -16.374 -15.769 0.896 1.00 0.00 C ATOM 809 O PHE A 156 -17.269 -16.169 1.639 1.00 0.00 O ATOM 810 CB PHE A 156 -16.757 -15.222 -1.515 1.00 0.00 C ATOM 811 CG PHE A 156 -18.237 -14.981 -1.431 1.00 0.00 C ATOM 812 CD1 PHE A 156 -18.752 -14.051 -0.543 1.00 0.00 C ATOM 813 CD2 PHE A 156 -19.114 -15.686 -2.241 1.00 0.00 C ATOM 814 CE1 PHE A 156 -20.114 -13.827 -0.464 1.00 0.00 C ATOM 815 CE2 PHE A 156 -20.476 -15.466 -2.166 1.00 0.00 C ATOM 816 CZ PHE A 156 -20.977 -14.536 -1.276 1.00 0.00 C ATOM 0 H PHE A 156 -17.618 -17.756 0.075 1.00 0.00 H new ATOM 0 HA PHE A 156 -15.205 -16.491 -0.742 1.00 0.00 H new ATOM 0 HB2 PHE A 156 -16.233 -14.286 -1.323 1.00 0.00 H new ATOM 0 HB3 PHE A 156 -16.504 -15.527 -2.530 1.00 0.00 H new ATOM 0 HD1 PHE A 156 -18.082 -13.494 0.095 1.00 0.00 H new ATOM 0 HD2 PHE A 156 -18.728 -16.415 -2.938 1.00 0.00 H new ATOM 0 HE1 PHE A 156 -20.503 -13.098 0.232 1.00 0.00 H new ATOM 0 HE2 PHE A 156 -21.149 -16.021 -2.803 1.00 0.00 H new ATOM 0 HZ PHE A 156 -22.041 -14.364 -1.215 1.00 0.00 H new ATOM 826 N GLY A 157 -15.463 -14.878 1.276 1.00 0.00 N ATOM 827 CA GLY A 157 -15.483 -14.323 2.617 1.00 0.00 C ATOM 828 C GLY A 157 -14.171 -13.662 2.990 1.00 0.00 C ATOM 829 O GLY A 157 -13.462 -13.143 2.128 1.00 0.00 O ATOM 0 H GLY A 157 -14.712 -14.531 0.679 1.00 0.00 H new ATOM 0 HA2 GLY A 157 -16.289 -13.593 2.693 1.00 0.00 H new ATOM 0 HA3 GLY A 157 -15.703 -15.116 3.332 1.00 0.00 H new ATOM 833 N PHE A 158 -13.848 -13.678 4.279 1.00 0.00 N ATOM 834 CA PHE A 158 -12.613 -13.073 4.765 1.00 0.00 C ATOM 835 C PHE A 158 -12.073 -13.834 5.973 1.00 0.00 C ATOM 836 O PHE A 158 -12.751 -14.698 6.529 1.00 0.00 O ATOM 837 CB PHE A 158 -12.850 -11.607 5.136 1.00 0.00 C ATOM 838 CG PHE A 158 -13.577 -10.831 4.076 1.00 0.00 C ATOM 839 CD1 PHE A 158 -14.941 -10.994 3.891 1.00 0.00 C ATOM 840 CD2 PHE A 158 -12.898 -9.937 3.264 1.00 0.00 C ATOM 841 CE1 PHE A 158 -15.612 -10.282 2.916 1.00 0.00 C ATOM 842 CE2 PHE A 158 -13.564 -9.221 2.287 1.00 0.00 C ATOM 843 CZ PHE A 158 -14.923 -9.393 2.114 1.00 0.00 C ATOM 0 H PHE A 158 -14.424 -14.103 5.006 1.00 0.00 H new ATOM 0 HA PHE A 158 -11.874 -13.124 3.966 1.00 0.00 H new ATOM 0 HB2 PHE A 158 -13.421 -11.563 6.063 1.00 0.00 H new ATOM 0 HB3 PHE A 158 -11.889 -11.130 5.330 1.00 0.00 H new ATOM 0 HD1 PHE A 158 -15.485 -11.686 4.517 1.00 0.00 H new ATOM 0 HD2 PHE A 158 -11.835 -9.798 3.396 1.00 0.00 H new ATOM 0 HE1 PHE A 158 -16.675 -10.420 2.781 1.00 0.00 H new ATOM 0 HE2 PHE A 158 -13.022 -8.528 1.660 1.00 0.00 H new ATOM 0 HZ PHE A 158 -15.446 -8.833 1.353 1.00 0.00 H new ATOM 853 N ILE A 159 -10.849 -13.506 6.372 1.00 0.00 N ATOM 854 CA ILE A 159 -10.218 -14.158 7.513 1.00 0.00 C ATOM 855 C ILE A 159 -9.229 -13.224 8.201 1.00 0.00 C ATOM 856 O ILE A 159 -8.517 -12.462 7.546 1.00 0.00 O ATOM 857 CB ILE A 159 -9.484 -15.444 7.092 1.00 0.00 C ATOM 858 CG1 ILE A 159 -10.447 -16.396 6.378 1.00 0.00 C ATOM 859 CG2 ILE A 159 -8.863 -16.121 8.304 1.00 0.00 C ATOM 860 CD1 ILE A 159 -9.847 -17.754 6.084 1.00 0.00 C ATOM 0 H ILE A 159 -10.275 -12.793 5.922 1.00 0.00 H new ATOM 0 HA ILE A 159 -11.016 -14.417 8.209 1.00 0.00 H new ATOM 0 HB ILE A 159 -8.685 -15.179 6.400 1.00 0.00 H new ATOM 0 HG12 ILE A 159 -11.338 -16.527 6.992 1.00 0.00 H new ATOM 0 HG13 ILE A 159 -10.769 -15.940 5.442 1.00 0.00 H new ATOM 0 HG21 ILE A 159 -8.348 -17.029 7.990 1.00 0.00 H new ATOM 0 HG22 ILE A 159 -8.150 -15.443 8.774 1.00 0.00 H new ATOM 0 HG23 ILE A 159 -9.645 -16.377 9.018 1.00 0.00 H new ATOM 0 HD11 ILE A 159 -10.585 -18.376 5.578 1.00 0.00 H new ATOM 0 HD12 ILE A 159 -8.973 -17.635 5.444 1.00 0.00 H new ATOM 0 HD13 ILE A 159 -9.551 -18.231 7.018 1.00 0.00 H new ATOM 872 N THR A 160 -9.187 -13.289 9.528 1.00 0.00 N ATOM 873 CA THR A 160 -8.284 -12.450 10.307 1.00 0.00 C ATOM 874 C THR A 160 -7.127 -13.265 10.873 1.00 0.00 C ATOM 875 O THR A 160 -7.305 -14.413 11.282 1.00 0.00 O ATOM 876 CB THR A 160 -9.023 -11.754 11.466 1.00 0.00 C ATOM 877 OG1 THR A 160 -10.116 -10.983 10.956 1.00 0.00 O ATOM 878 CG2 THR A 160 -8.078 -10.852 12.245 1.00 0.00 C ATOM 0 H THR A 160 -9.768 -13.914 10.086 1.00 0.00 H new ATOM 0 HA THR A 160 -7.893 -11.692 9.628 1.00 0.00 H new ATOM 0 HB THR A 160 -9.404 -12.522 12.139 1.00 0.00 H new ATOM 0 HG1 THR A 160 -10.582 -10.545 11.699 1.00 0.00 H new ATOM 0 HG21 THR A 160 -8.622 -10.371 13.058 1.00 0.00 H new ATOM 0 HG22 THR A 160 -7.263 -11.447 12.656 1.00 0.00 H new ATOM 0 HG23 THR A 160 -7.671 -10.090 11.580 1.00 0.00 H new ATOM 886 N PHE A 161 -5.942 -12.665 10.895 1.00 0.00 N ATOM 887 CA PHE A 161 -4.754 -13.336 11.412 1.00 0.00 C ATOM 888 C PHE A 161 -4.254 -12.654 12.681 1.00 0.00 C ATOM 889 O PHE A 161 -4.709 -11.567 13.035 1.00 0.00 O ATOM 890 CB PHE A 161 -3.648 -13.347 10.355 1.00 0.00 C ATOM 891 CG PHE A 161 -3.905 -14.306 9.228 1.00 0.00 C ATOM 892 CD1 PHE A 161 -4.816 -13.997 8.231 1.00 0.00 C ATOM 893 CD2 PHE A 161 -3.235 -15.517 9.165 1.00 0.00 C ATOM 894 CE1 PHE A 161 -5.055 -14.878 7.193 1.00 0.00 C ATOM 895 CE2 PHE A 161 -3.469 -16.403 8.130 1.00 0.00 C ATOM 896 CZ PHE A 161 -4.380 -16.082 7.142 1.00 0.00 C ATOM 0 H PHE A 161 -5.778 -11.715 10.561 1.00 0.00 H new ATOM 0 HA PHE A 161 -5.024 -14.364 11.655 1.00 0.00 H new ATOM 0 HB2 PHE A 161 -3.536 -12.342 9.948 1.00 0.00 H new ATOM 0 HB3 PHE A 161 -2.703 -13.605 10.832 1.00 0.00 H new ATOM 0 HD1 PHE A 161 -5.346 -13.056 8.265 1.00 0.00 H new ATOM 0 HD2 PHE A 161 -2.521 -15.772 9.934 1.00 0.00 H new ATOM 0 HE1 PHE A 161 -5.769 -14.625 6.423 1.00 0.00 H new ATOM 0 HE2 PHE A 161 -2.941 -17.344 8.094 1.00 0.00 H new ATOM 0 HZ PHE A 161 -4.564 -16.771 6.331 1.00 0.00 H new ATOM 906 N GLU A 162 -3.314 -13.302 13.363 1.00 0.00 N ATOM 907 CA GLU A 162 -2.752 -12.759 14.594 1.00 0.00 C ATOM 908 C GLU A 162 -1.744 -11.654 14.291 1.00 0.00 C ATOM 909 O GLU A 162 -1.676 -10.650 15.001 1.00 0.00 O ATOM 910 CB GLU A 162 -2.080 -13.868 15.407 1.00 0.00 C ATOM 911 CG GLU A 162 -1.607 -13.416 16.778 1.00 0.00 C ATOM 912 CD GLU A 162 -2.743 -12.927 17.655 1.00 0.00 C ATOM 913 OE1 GLU A 162 -3.421 -13.774 18.273 1.00 0.00 O ATOM 914 OE2 GLU A 162 -2.953 -11.698 17.724 1.00 0.00 O ATOM 0 H GLU A 162 -2.926 -14.203 13.084 1.00 0.00 H new ATOM 0 HA GLU A 162 -3.568 -12.333 15.178 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -2.781 -14.694 15.528 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -1.228 -14.252 14.846 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -1.100 -14.244 17.274 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -0.874 -12.618 16.660 1.00 0.00 H new ATOM 921 N ASP A 163 -0.964 -11.846 13.233 1.00 0.00 N ATOM 922 CA ASP A 163 0.040 -10.867 12.835 1.00 0.00 C ATOM 923 C ASP A 163 -0.079 -10.540 11.349 1.00 0.00 C ATOM 924 O ASP A 163 -0.254 -11.432 10.520 1.00 0.00 O ATOM 925 CB ASP A 163 1.444 -11.389 13.144 1.00 0.00 C ATOM 926 CG ASP A 163 1.854 -11.130 14.581 1.00 0.00 C ATOM 927 OD1 ASP A 163 1.247 -11.735 15.489 1.00 0.00 O ATOM 928 OD2 ASP A 163 2.781 -10.322 14.797 1.00 0.00 O ATOM 0 H ASP A 163 -1.008 -12.671 12.635 1.00 0.00 H new ATOM 0 HA ASP A 163 -0.133 -9.954 13.405 1.00 0.00 H new ATOM 0 HB2 ASP A 163 1.482 -12.460 12.946 1.00 0.00 H new ATOM 0 HB3 ASP A 163 2.161 -10.915 12.473 1.00 0.00 H new ATOM 933 N GLU A 164 0.017 -9.255 11.022 1.00 0.00 N ATOM 934 CA GLU A 164 -0.082 -8.812 9.636 1.00 0.00 C ATOM 935 C GLU A 164 0.764 -9.692 8.721 1.00 0.00 C ATOM 936 O GLU A 164 0.314 -10.108 7.654 1.00 0.00 O ATOM 937 CB GLU A 164 0.362 -7.353 9.511 1.00 0.00 C ATOM 938 CG GLU A 164 0.479 -6.873 8.075 1.00 0.00 C ATOM 939 CD GLU A 164 1.742 -7.366 7.395 1.00 0.00 C ATOM 940 OE1 GLU A 164 2.712 -7.693 8.111 1.00 0.00 O ATOM 941 OE2 GLU A 164 1.759 -7.425 6.148 1.00 0.00 O ATOM 0 H GLU A 164 0.163 -8.504 11.696 1.00 0.00 H new ATOM 0 HA GLU A 164 -1.125 -8.895 9.329 1.00 0.00 H new ATOM 0 HB2 GLU A 164 -0.349 -6.719 10.040 1.00 0.00 H new ATOM 0 HB3 GLU A 164 1.326 -7.232 10.005 1.00 0.00 H new ATOM 0 HG2 GLU A 164 -0.389 -7.213 7.511 1.00 0.00 H new ATOM 0 HG3 GLU A 164 0.464 -5.783 8.058 1.00 0.00 H new ATOM 948 N GLN A 165 1.991 -9.971 9.148 1.00 0.00 N ATOM 949 CA GLN A 165 2.901 -10.801 8.367 1.00 0.00 C ATOM 950 C GLN A 165 2.140 -11.903 7.635 1.00 0.00 C ATOM 951 O GLN A 165 2.344 -12.123 6.442 1.00 0.00 O ATOM 952 CB GLN A 165 3.968 -11.417 9.273 1.00 0.00 C ATOM 953 CG GLN A 165 5.236 -11.817 8.535 1.00 0.00 C ATOM 954 CD GLN A 165 6.144 -12.698 9.369 1.00 0.00 C ATOM 955 OE1 GLN A 165 5.787 -13.823 9.719 1.00 0.00 O ATOM 956 NE2 GLN A 165 7.327 -12.190 9.694 1.00 0.00 N ATOM 0 H GLN A 165 2.378 -9.635 10.030 1.00 0.00 H new ATOM 0 HA GLN A 165 3.387 -10.166 7.626 1.00 0.00 H new ATOM 0 HB2 GLN A 165 4.223 -10.704 10.057 1.00 0.00 H new ATOM 0 HB3 GLN A 165 3.552 -12.296 9.765 1.00 0.00 H new ATOM 0 HG2 GLN A 165 4.968 -12.343 7.619 1.00 0.00 H new ATOM 0 HG3 GLN A 165 5.779 -10.919 8.240 1.00 0.00 H new ATOM 0 HE21 GLN A 165 7.583 -11.253 9.383 1.00 0.00 H new ATOM 0 HE22 GLN A 165 7.980 -12.737 10.255 1.00 0.00 H new ATOM 965 N SER A 166 1.264 -12.591 8.360 1.00 0.00 N ATOM 966 CA SER A 166 0.476 -13.673 7.781 1.00 0.00 C ATOM 967 C SER A 166 -0.257 -13.201 6.529 1.00 0.00 C ATOM 968 O SER A 166 -0.137 -13.802 5.461 1.00 0.00 O ATOM 969 CB SER A 166 -0.529 -14.205 8.805 1.00 0.00 C ATOM 970 OG SER A 166 0.127 -14.647 9.981 1.00 0.00 O ATOM 0 H SER A 166 1.082 -12.419 9.349 1.00 0.00 H new ATOM 0 HA SER A 166 1.157 -14.476 7.501 1.00 0.00 H new ATOM 0 HB2 SER A 166 -1.245 -13.423 9.056 1.00 0.00 H new ATOM 0 HB3 SER A 166 -1.096 -15.028 8.370 1.00 0.00 H new ATOM 0 HG SER A 166 -0.538 -14.830 10.677 1.00 0.00 H new ATOM 976 N VAL A 167 -1.018 -12.120 6.669 1.00 0.00 N ATOM 977 CA VAL A 167 -1.771 -11.565 5.551 1.00 0.00 C ATOM 978 C VAL A 167 -0.923 -11.523 4.284 1.00 0.00 C ATOM 979 O VAL A 167 -1.381 -11.904 3.206 1.00 0.00 O ATOM 980 CB VAL A 167 -2.276 -10.144 5.864 1.00 0.00 C ATOM 981 CG1 VAL A 167 -2.849 -9.493 4.614 1.00 0.00 C ATOM 982 CG2 VAL A 167 -3.312 -10.181 6.978 1.00 0.00 C ATOM 0 H VAL A 167 -1.129 -11.611 7.546 1.00 0.00 H new ATOM 0 HA VAL A 167 -2.627 -12.220 5.391 1.00 0.00 H new ATOM 0 HB VAL A 167 -1.432 -9.543 6.203 1.00 0.00 H new ATOM 0 HG11 VAL A 167 -3.201 -8.490 4.855 1.00 0.00 H new ATOM 0 HG12 VAL A 167 -2.076 -9.432 3.848 1.00 0.00 H new ATOM 0 HG13 VAL A 167 -3.682 -10.090 4.242 1.00 0.00 H new ATOM 0 HG21 VAL A 167 -3.658 -9.169 7.187 1.00 0.00 H new ATOM 0 HG22 VAL A 167 -4.157 -10.797 6.669 1.00 0.00 H new ATOM 0 HG23 VAL A 167 -2.864 -10.604 7.877 1.00 0.00 H new ATOM 992 N ASP A 168 0.314 -11.060 4.422 1.00 0.00 N ATOM 993 CA ASP A 168 1.227 -10.970 3.289 1.00 0.00 C ATOM 994 C ASP A 168 1.574 -12.357 2.759 1.00 0.00 C ATOM 995 O ASP A 168 1.564 -12.590 1.551 1.00 0.00 O ATOM 996 CB ASP A 168 2.504 -10.230 3.693 1.00 0.00 C ATOM 997 CG ASP A 168 3.599 -10.355 2.653 1.00 0.00 C ATOM 998 OD1 ASP A 168 4.009 -11.497 2.356 1.00 0.00 O ATOM 999 OD2 ASP A 168 4.047 -9.311 2.135 1.00 0.00 O ATOM 0 H ASP A 168 0.708 -10.741 5.307 1.00 0.00 H new ATOM 0 HA ASP A 168 0.729 -10.412 2.496 1.00 0.00 H new ATOM 0 HB2 ASP A 168 2.275 -9.176 3.851 1.00 0.00 H new ATOM 0 HB3 ASP A 168 2.863 -10.624 4.644 1.00 0.00 H new ATOM 1004 N GLN A 169 1.883 -13.274 3.671 1.00 0.00 N ATOM 1005 CA GLN A 169 2.235 -14.637 3.295 1.00 0.00 C ATOM 1006 C GLN A 169 1.222 -15.208 2.307 1.00 0.00 C ATOM 1007 O GLN A 169 1.594 -15.817 1.304 1.00 0.00 O ATOM 1008 CB GLN A 169 2.312 -15.528 4.536 1.00 0.00 C ATOM 1009 CG GLN A 169 3.567 -15.309 5.365 1.00 0.00 C ATOM 1010 CD GLN A 169 4.777 -16.018 4.789 1.00 0.00 C ATOM 1011 OE1 GLN A 169 4.646 -16.952 3.998 1.00 0.00 O ATOM 1012 NE2 GLN A 169 5.966 -15.576 5.183 1.00 0.00 N ATOM 0 H GLN A 169 1.896 -13.097 4.675 1.00 0.00 H new ATOM 0 HA GLN A 169 3.212 -14.613 2.813 1.00 0.00 H new ATOM 0 HB2 GLN A 169 1.438 -15.344 5.160 1.00 0.00 H new ATOM 0 HB3 GLN A 169 2.269 -16.572 4.227 1.00 0.00 H new ATOM 0 HG2 GLN A 169 3.773 -14.241 5.430 1.00 0.00 H new ATOM 0 HG3 GLN A 169 3.393 -15.662 6.381 1.00 0.00 H new ATOM 0 HE21 GLN A 169 6.029 -14.799 5.840 1.00 0.00 H new ATOM 0 HE22 GLN A 169 6.816 -16.014 4.828 1.00 0.00 H new ATOM 1021 N ALA A 170 -0.059 -15.007 2.598 1.00 0.00 N ATOM 1022 CA ALA A 170 -1.125 -15.500 1.734 1.00 0.00 C ATOM 1023 C ALA A 170 -1.273 -14.627 0.493 1.00 0.00 C ATOM 1024 O ALA A 170 -1.131 -15.104 -0.634 1.00 0.00 O ATOM 1025 CB ALA A 170 -2.439 -15.560 2.500 1.00 0.00 C ATOM 0 H ALA A 170 -0.384 -14.506 3.425 1.00 0.00 H new ATOM 0 HA ALA A 170 -0.860 -16.506 1.409 1.00 0.00 H new ATOM 0 HB1 ALA A 170 -3.226 -15.930 1.843 1.00 0.00 H new ATOM 0 HB2 ALA A 170 -2.333 -16.231 3.353 1.00 0.00 H new ATOM 0 HB3 ALA A 170 -2.700 -14.562 2.853 1.00 0.00 H new ATOM 1031 N VAL A 171 -1.561 -13.347 0.705 1.00 0.00 N ATOM 1032 CA VAL A 171 -1.728 -12.408 -0.397 1.00 0.00 C ATOM 1033 C VAL A 171 -0.651 -12.608 -1.458 1.00 0.00 C ATOM 1034 O VAL A 171 -0.951 -12.745 -2.643 1.00 0.00 O ATOM 1035 CB VAL A 171 -1.683 -10.949 0.096 1.00 0.00 C ATOM 1036 CG1 VAL A 171 -1.736 -9.986 -1.079 1.00 0.00 C ATOM 1037 CG2 VAL A 171 -2.822 -10.681 1.068 1.00 0.00 C ATOM 0 H VAL A 171 -1.684 -12.937 1.631 1.00 0.00 H new ATOM 0 HA VAL A 171 -2.706 -12.605 -0.835 1.00 0.00 H new ATOM 0 HB VAL A 171 -0.742 -10.790 0.622 1.00 0.00 H new ATOM 0 HG11 VAL A 171 -1.703 -8.961 -0.711 1.00 0.00 H new ATOM 0 HG12 VAL A 171 -0.883 -10.164 -1.734 1.00 0.00 H new ATOM 0 HG13 VAL A 171 -2.660 -10.142 -1.636 1.00 0.00 H new ATOM 0 HG21 VAL A 171 -2.775 -9.646 1.407 1.00 0.00 H new ATOM 0 HG22 VAL A 171 -3.775 -10.857 0.569 1.00 0.00 H new ATOM 0 HG23 VAL A 171 -2.733 -11.348 1.926 1.00 0.00 H new ATOM 1047 N ASN A 172 0.604 -12.623 -1.022 1.00 0.00 N ATOM 1048 CA ASN A 172 1.727 -12.806 -1.935 1.00 0.00 C ATOM 1049 C ASN A 172 1.397 -13.846 -3.002 1.00 0.00 C ATOM 1050 O ASN A 172 1.351 -13.535 -4.192 1.00 0.00 O ATOM 1051 CB ASN A 172 2.976 -13.233 -1.160 1.00 0.00 C ATOM 1052 CG ASN A 172 4.238 -13.130 -1.996 1.00 0.00 C ATOM 1053 OD1 ASN A 172 4.566 -12.064 -2.517 1.00 0.00 O ATOM 1054 ND2 ASN A 172 4.952 -14.242 -2.128 1.00 0.00 N ATOM 0 H ASN A 172 0.869 -12.511 -0.043 1.00 0.00 H new ATOM 0 HA ASN A 172 1.921 -11.854 -2.429 1.00 0.00 H new ATOM 0 HB2 ASN A 172 3.080 -12.610 -0.272 1.00 0.00 H new ATOM 0 HB3 ASN A 172 2.854 -14.260 -0.816 1.00 0.00 H new ATOM 0 HD21 ASN A 172 5.810 -14.235 -2.679 1.00 0.00 H new ATOM 0 HD22 ASN A 172 4.642 -15.103 -1.678 1.00 0.00 H new ATOM 1061 N MET A 173 1.169 -15.080 -2.567 1.00 0.00 N ATOM 1062 CA MET A 173 0.841 -16.165 -3.485 1.00 0.00 C ATOM 1063 C MET A 173 -0.426 -15.848 -4.271 1.00 0.00 C ATOM 1064 O MET A 173 -0.525 -16.156 -5.459 1.00 0.00 O ATOM 1065 CB MET A 173 0.663 -17.476 -2.716 1.00 0.00 C ATOM 1066 CG MET A 173 1.866 -17.850 -1.866 1.00 0.00 C ATOM 1067 SD MET A 173 2.053 -19.633 -1.673 1.00 0.00 S ATOM 1068 CE MET A 173 0.405 -20.091 -1.141 1.00 0.00 C ATOM 0 H MET A 173 1.205 -15.354 -1.585 1.00 0.00 H new ATOM 0 HA MET A 173 1.666 -16.274 -4.189 1.00 0.00 H new ATOM 0 HB2 MET A 173 -0.214 -17.395 -2.074 1.00 0.00 H new ATOM 0 HB3 MET A 173 0.466 -18.280 -3.425 1.00 0.00 H new ATOM 0 HG2 MET A 173 2.768 -17.441 -2.321 1.00 0.00 H new ATOM 0 HG3 MET A 173 1.768 -17.390 -0.883 1.00 0.00 H new ATOM 0 HE1 MET A 173 0.451 -21.019 -0.571 1.00 0.00 H new ATOM 0 HE2 MET A 173 -0.008 -19.300 -0.515 1.00 0.00 H new ATOM 0 HE3 MET A 173 -0.233 -20.233 -2.014 1.00 0.00 H new ATOM 1078 N HIS A 174 -1.394 -15.229 -3.602 1.00 0.00 N ATOM 1079 CA HIS A 174 -2.656 -14.869 -4.239 1.00 0.00 C ATOM 1080 C HIS A 174 -3.363 -16.108 -4.782 1.00 0.00 C ATOM 1081 O HIS A 174 -4.155 -16.022 -5.720 1.00 0.00 O ATOM 1082 CB HIS A 174 -2.413 -13.870 -5.371 1.00 0.00 C ATOM 1083 CG HIS A 174 -3.656 -13.500 -6.120 1.00 0.00 C ATOM 1084 ND1 HIS A 174 -3.655 -13.155 -7.455 1.00 0.00 N ATOM 1085 CD2 HIS A 174 -4.945 -13.424 -5.714 1.00 0.00 C ATOM 1086 CE1 HIS A 174 -4.890 -12.881 -7.837 1.00 0.00 C ATOM 1087 NE2 HIS A 174 -5.692 -13.037 -6.799 1.00 0.00 N ATOM 0 H HIS A 174 -1.328 -14.966 -2.619 1.00 0.00 H new ATOM 0 HA HIS A 174 -3.296 -14.407 -3.487 1.00 0.00 H new ATOM 0 HB2 HIS A 174 -1.965 -12.966 -4.957 1.00 0.00 H new ATOM 0 HB3 HIS A 174 -1.690 -14.293 -6.069 1.00 0.00 H new ATOM 0 HD1 HIS A 174 -2.830 -13.117 -8.054 1.00 0.00 H new ATOM 0 HD2 HIS A 174 -5.317 -13.630 -4.721 1.00 0.00 H new ATOM 0 HE1 HIS A 174 -5.192 -12.581 -8.829 1.00 0.00 H new ATOM 1095 N PHE A 175 -3.070 -17.259 -4.185 1.00 0.00 N ATOM 1096 CA PHE A 175 -3.677 -18.515 -4.610 1.00 0.00 C ATOM 1097 C PHE A 175 -3.370 -19.631 -3.614 1.00 0.00 C ATOM 1098 O PHE A 175 -2.356 -19.594 -2.917 1.00 0.00 O ATOM 1099 CB PHE A 175 -3.173 -18.905 -6.001 1.00 0.00 C ATOM 1100 CG PHE A 175 -3.965 -18.291 -7.119 1.00 0.00 C ATOM 1101 CD1 PHE A 175 -5.347 -18.384 -7.140 1.00 0.00 C ATOM 1102 CD2 PHE A 175 -3.328 -17.619 -8.149 1.00 0.00 C ATOM 1103 CE1 PHE A 175 -6.078 -17.820 -8.168 1.00 0.00 C ATOM 1104 CE2 PHE A 175 -4.053 -17.052 -9.180 1.00 0.00 C ATOM 1105 CZ PHE A 175 -5.431 -17.152 -9.189 1.00 0.00 C ATOM 0 H PHE A 175 -2.417 -17.348 -3.407 1.00 0.00 H new ATOM 0 HA PHE A 175 -4.757 -18.373 -4.649 1.00 0.00 H new ATOM 0 HB2 PHE A 175 -2.130 -18.605 -6.098 1.00 0.00 H new ATOM 0 HB3 PHE A 175 -3.203 -19.990 -6.099 1.00 0.00 H new ATOM 0 HD1 PHE A 175 -5.859 -18.903 -6.344 1.00 0.00 H new ATOM 0 HD2 PHE A 175 -2.251 -17.537 -8.146 1.00 0.00 H new ATOM 0 HE1 PHE A 175 -7.155 -17.902 -8.173 1.00 0.00 H new ATOM 0 HE2 PHE A 175 -3.543 -16.532 -9.977 1.00 0.00 H new ATOM 0 HZ PHE A 175 -6.001 -16.709 -9.992 1.00 0.00 H new ATOM 1115 N HIS A 176 -4.255 -20.621 -3.553 1.00 0.00 N ATOM 1116 CA HIS A 176 -4.079 -21.748 -2.644 1.00 0.00 C ATOM 1117 C HIS A 176 -4.899 -22.950 -3.103 1.00 0.00 C ATOM 1118 O HIS A 176 -5.855 -22.806 -3.865 1.00 0.00 O ATOM 1119 CB HIS A 176 -4.485 -21.352 -1.224 1.00 0.00 C ATOM 1120 CG HIS A 176 -3.860 -20.073 -0.756 1.00 0.00 C ATOM 1121 ND1 HIS A 176 -4.320 -18.801 -0.785 1.00 0.00 N flip ATOM 1122 CD2 HIS A 176 -2.609 -20.014 -0.180 1.00 0.00 C flip ATOM 1123 CE1 HIS A 176 -3.349 -18.004 -0.229 1.00 0.00 C flip ATOM 1124 NE2 HIS A 176 -2.328 -18.761 0.128 1.00 0.00 N flip ATOM 0 H HIS A 176 -5.101 -20.666 -4.122 1.00 0.00 H new ATOM 0 HA HIS A 176 -3.025 -22.026 -2.649 1.00 0.00 H new ATOM 0 HB2 HIS A 176 -5.570 -21.254 -1.179 1.00 0.00 H new ATOM 0 HB3 HIS A 176 -4.209 -22.154 -0.539 1.00 0.00 H new ATOM 0 HD1 HIS A 176 -5.220 -18.491 -1.151 1.00 0.00 H new ATOM 0 HD2 HIS A 176 -1.960 -20.860 -0.008 1.00 0.00 H new ATOM 0 HE1 HIS A 176 -3.411 -16.933 -0.104 1.00 0.00 H new ATOM 1132 N ASP A 177 -4.517 -24.133 -2.636 1.00 0.00 N ATOM 1133 CA ASP A 177 -5.217 -25.360 -2.999 1.00 0.00 C ATOM 1134 C ASP A 177 -5.851 -26.008 -1.771 1.00 0.00 C ATOM 1135 O ASP A 177 -5.224 -26.824 -1.095 1.00 0.00 O ATOM 1136 CB ASP A 177 -4.255 -26.342 -3.669 1.00 0.00 C ATOM 1137 CG ASP A 177 -3.629 -25.772 -4.927 1.00 0.00 C ATOM 1138 OD1 ASP A 177 -4.381 -25.272 -5.790 1.00 0.00 O ATOM 1139 OD2 ASP A 177 -2.388 -25.825 -5.048 1.00 0.00 O ATOM 0 H ASP A 177 -3.727 -24.269 -2.005 1.00 0.00 H new ATOM 0 HA ASP A 177 -6.009 -25.103 -3.702 1.00 0.00 H new ATOM 0 HB2 ASP A 177 -3.468 -26.612 -2.965 1.00 0.00 H new ATOM 0 HB3 ASP A 177 -4.790 -27.259 -3.916 1.00 0.00 H new ATOM 1144 N ILE A 178 -7.095 -25.637 -1.489 1.00 0.00 N ATOM 1145 CA ILE A 178 -7.813 -26.182 -0.344 1.00 0.00 C ATOM 1146 C ILE A 178 -8.871 -27.188 -0.785 1.00 0.00 C ATOM 1147 O ILE A 178 -9.866 -26.823 -1.410 1.00 0.00 O ATOM 1148 CB ILE A 178 -8.490 -25.069 0.478 1.00 0.00 C ATOM 1149 CG1 ILE A 178 -7.452 -24.047 0.947 1.00 0.00 C ATOM 1150 CG2 ILE A 178 -9.231 -25.663 1.666 1.00 0.00 C ATOM 1151 CD1 ILE A 178 -8.052 -22.724 1.365 1.00 0.00 C ATOM 0 H ILE A 178 -7.627 -24.961 -2.038 1.00 0.00 H new ATOM 0 HA ILE A 178 -7.075 -26.686 0.280 1.00 0.00 H new ATOM 0 HB ILE A 178 -9.213 -24.558 -0.157 1.00 0.00 H new ATOM 0 HG12 ILE A 178 -6.896 -24.465 1.786 1.00 0.00 H new ATOM 0 HG13 ILE A 178 -6.736 -23.874 0.144 1.00 0.00 H new ATOM 0 HG21 ILE A 178 -9.704 -24.864 2.237 1.00 0.00 H new ATOM 0 HG22 ILE A 178 -9.994 -26.355 1.310 1.00 0.00 H new ATOM 0 HG23 ILE A 178 -8.527 -26.197 2.304 1.00 0.00 H new ATOM 0 HD11 ILE A 178 -7.258 -22.049 1.685 1.00 0.00 H new ATOM 0 HD12 ILE A 178 -8.585 -22.283 0.522 1.00 0.00 H new ATOM 0 HD13 ILE A 178 -8.747 -22.884 2.190 1.00 0.00 H new ATOM 1163 N MET A 179 -8.648 -28.455 -0.454 1.00 0.00 N ATOM 1164 CA MET A 179 -9.584 -29.514 -0.814 1.00 0.00 C ATOM 1165 C MET A 179 -9.717 -29.631 -2.329 1.00 0.00 C ATOM 1166 O MET A 179 -10.817 -29.793 -2.854 1.00 0.00 O ATOM 1167 CB MET A 179 -10.955 -29.246 -0.189 1.00 0.00 C ATOM 1168 CG MET A 179 -10.959 -29.336 1.328 1.00 0.00 C ATOM 1169 SD MET A 179 -12.471 -28.677 2.059 1.00 0.00 S ATOM 1170 CE MET A 179 -12.915 -30.006 3.174 1.00 0.00 C ATOM 0 H MET A 179 -7.828 -28.774 0.062 1.00 0.00 H new ATOM 0 HA MET A 179 -9.194 -30.456 -0.428 1.00 0.00 H new ATOM 0 HB2 MET A 179 -11.293 -28.254 -0.487 1.00 0.00 H new ATOM 0 HB3 MET A 179 -11.674 -29.961 -0.589 1.00 0.00 H new ATOM 0 HG2 MET A 179 -10.840 -30.377 1.627 1.00 0.00 H new ATOM 0 HG3 MET A 179 -10.102 -28.791 1.723 1.00 0.00 H new ATOM 0 HE1 MET A 179 -13.537 -29.613 3.979 1.00 0.00 H new ATOM 0 HE2 MET A 179 -13.468 -30.770 2.628 1.00 0.00 H new ATOM 0 HE3 MET A 179 -12.011 -30.445 3.595 1.00 0.00 H new ATOM 1180 N GLY A 180 -8.588 -29.546 -3.026 1.00 0.00 N ATOM 1181 CA GLY A 180 -8.601 -29.644 -4.474 1.00 0.00 C ATOM 1182 C GLY A 180 -9.353 -28.500 -5.125 1.00 0.00 C ATOM 1183 O GLY A 180 -10.181 -28.716 -6.010 1.00 0.00 O ATOM 0 H GLY A 180 -7.665 -29.411 -2.614 1.00 0.00 H new ATOM 0 HA2 GLY A 180 -7.576 -29.658 -4.844 1.00 0.00 H new ATOM 0 HA3 GLY A 180 -9.058 -30.589 -4.767 1.00 0.00 H new ATOM 1187 N LYS A 181 -9.066 -27.279 -4.686 1.00 0.00 N ATOM 1188 CA LYS A 181 -9.721 -26.096 -5.231 1.00 0.00 C ATOM 1189 C LYS A 181 -8.812 -24.876 -5.130 1.00 0.00 C ATOM 1190 O LYS A 181 -8.115 -24.688 -4.133 1.00 0.00 O ATOM 1191 CB LYS A 181 -11.035 -25.829 -4.493 1.00 0.00 C ATOM 1192 CG LYS A 181 -11.887 -24.750 -5.138 1.00 0.00 C ATOM 1193 CD LYS A 181 -12.679 -25.295 -6.315 1.00 0.00 C ATOM 1194 CE LYS A 181 -13.858 -26.137 -5.851 1.00 0.00 C ATOM 1195 NZ LYS A 181 -14.599 -26.732 -6.997 1.00 0.00 N ATOM 0 H LYS A 181 -8.384 -27.083 -3.954 1.00 0.00 H new ATOM 0 HA LYS A 181 -9.934 -26.282 -6.284 1.00 0.00 H new ATOM 0 HB2 LYS A 181 -11.610 -26.754 -4.446 1.00 0.00 H new ATOM 0 HB3 LYS A 181 -10.813 -25.539 -3.466 1.00 0.00 H new ATOM 0 HG2 LYS A 181 -12.572 -24.335 -4.398 1.00 0.00 H new ATOM 0 HG3 LYS A 181 -11.248 -23.933 -5.475 1.00 0.00 H new ATOM 0 HD2 LYS A 181 -13.039 -24.468 -6.927 1.00 0.00 H new ATOM 0 HD3 LYS A 181 -12.026 -25.898 -6.947 1.00 0.00 H new ATOM 0 HE2 LYS A 181 -13.501 -26.933 -5.197 1.00 0.00 H new ATOM 0 HE3 LYS A 181 -14.536 -25.520 -5.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 181 -15.395 -27.298 -6.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 181 -14.961 -25.972 -7.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 181 -13.959 -27.342 -7.545 1.00 0.00 H new ATOM 1209 N LYS A 182 -8.824 -24.047 -6.169 1.00 0.00 N ATOM 1210 CA LYS A 182 -8.003 -22.843 -6.197 1.00 0.00 C ATOM 1211 C LYS A 182 -8.707 -21.688 -5.493 1.00 0.00 C ATOM 1212 O LYS A 182 -9.619 -21.073 -6.047 1.00 0.00 O ATOM 1213 CB LYS A 182 -7.681 -22.454 -7.642 1.00 0.00 C ATOM 1214 CG LYS A 182 -6.469 -21.547 -7.772 1.00 0.00 C ATOM 1215 CD LYS A 182 -5.182 -22.284 -7.440 1.00 0.00 C ATOM 1216 CE LYS A 182 -3.997 -21.704 -8.195 1.00 0.00 C ATOM 1217 NZ LYS A 182 -2.699 -22.178 -7.639 1.00 0.00 N ATOM 0 H LYS A 182 -9.394 -24.188 -7.003 1.00 0.00 H new ATOM 0 HA LYS A 182 -7.073 -23.055 -5.669 1.00 0.00 H new ATOM 0 HB2 LYS A 182 -7.511 -23.360 -8.224 1.00 0.00 H new ATOM 0 HB3 LYS A 182 -8.547 -21.954 -8.076 1.00 0.00 H new ATOM 0 HG2 LYS A 182 -6.414 -21.156 -8.788 1.00 0.00 H new ATOM 0 HG3 LYS A 182 -6.581 -20.691 -7.107 1.00 0.00 H new ATOM 0 HD2 LYS A 182 -4.995 -22.227 -6.368 1.00 0.00 H new ATOM 0 HD3 LYS A 182 -5.292 -23.340 -7.688 1.00 0.00 H new ATOM 0 HE2 LYS A 182 -4.065 -21.982 -9.247 1.00 0.00 H new ATOM 0 HE3 LYS A 182 -4.035 -20.616 -8.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 182 -1.920 -21.635 -8.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 182 -2.693 -22.042 -6.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 182 -2.576 -23.188 -7.856 1.00 0.00 H new ATOM 1231 N VAL A 183 -8.278 -21.396 -4.269 1.00 0.00 N ATOM 1232 CA VAL A 183 -8.866 -20.312 -3.491 1.00 0.00 C ATOM 1233 C VAL A 183 -8.096 -19.012 -3.689 1.00 0.00 C ATOM 1234 O VAL A 183 -6.867 -18.991 -3.621 1.00 0.00 O ATOM 1235 CB VAL A 183 -8.898 -20.653 -1.989 1.00 0.00 C ATOM 1236 CG1 VAL A 183 -9.919 -19.787 -1.267 1.00 0.00 C ATOM 1237 CG2 VAL A 183 -9.200 -22.130 -1.785 1.00 0.00 C ATOM 0 H VAL A 183 -7.525 -21.895 -3.795 1.00 0.00 H new ATOM 0 HA VAL A 183 -9.887 -20.184 -3.849 1.00 0.00 H new ATOM 0 HB VAL A 183 -7.916 -20.444 -1.565 1.00 0.00 H new ATOM 0 HG11 VAL A 183 -9.928 -20.042 -0.207 1.00 0.00 H new ATOM 0 HG12 VAL A 183 -9.654 -18.736 -1.385 1.00 0.00 H new ATOM 0 HG13 VAL A 183 -10.908 -19.961 -1.690 1.00 0.00 H new ATOM 0 HG21 VAL A 183 -9.219 -22.354 -0.718 1.00 0.00 H new ATOM 0 HG22 VAL A 183 -10.170 -22.367 -2.223 1.00 0.00 H new ATOM 0 HG23 VAL A 183 -8.428 -22.729 -2.268 1.00 0.00 H new ATOM 1247 N GLU A 184 -8.826 -17.929 -3.935 1.00 0.00 N ATOM 1248 CA GLU A 184 -8.210 -16.624 -4.144 1.00 0.00 C ATOM 1249 C GLU A 184 -8.119 -15.849 -2.832 1.00 0.00 C ATOM 1250 O GLU A 184 -8.999 -15.949 -1.977 1.00 0.00 O ATOM 1251 CB GLU A 184 -9.008 -15.817 -5.171 1.00 0.00 C ATOM 1252 CG GLU A 184 -8.162 -14.833 -5.961 1.00 0.00 C ATOM 1253 CD GLU A 184 -8.990 -13.972 -6.896 1.00 0.00 C ATOM 1254 OE1 GLU A 184 -10.025 -13.435 -6.449 1.00 0.00 O ATOM 1255 OE2 GLU A 184 -8.601 -13.835 -8.075 1.00 0.00 O ATOM 0 H GLU A 184 -9.844 -17.929 -3.994 1.00 0.00 H new ATOM 0 HA GLU A 184 -7.201 -16.784 -4.523 1.00 0.00 H new ATOM 0 HB2 GLU A 184 -9.493 -16.505 -5.864 1.00 0.00 H new ATOM 0 HB3 GLU A 184 -9.800 -15.272 -4.657 1.00 0.00 H new ATOM 0 HG2 GLU A 184 -7.617 -14.191 -5.269 1.00 0.00 H new ATOM 0 HG3 GLU A 184 -7.419 -15.381 -6.540 1.00 0.00 H new ATOM 1262 N VAL A 185 -7.047 -15.078 -2.681 1.00 0.00 N ATOM 1263 CA VAL A 185 -6.839 -14.286 -1.474 1.00 0.00 C ATOM 1264 C VAL A 185 -6.247 -12.921 -1.808 1.00 0.00 C ATOM 1265 O VAL A 185 -5.273 -12.820 -2.554 1.00 0.00 O ATOM 1266 CB VAL A 185 -5.909 -15.008 -0.482 1.00 0.00 C ATOM 1267 CG1 VAL A 185 -5.411 -14.043 0.583 1.00 0.00 C ATOM 1268 CG2 VAL A 185 -6.623 -16.192 0.152 1.00 0.00 C ATOM 0 H VAL A 185 -6.309 -14.985 -3.379 1.00 0.00 H new ATOM 0 HA VAL A 185 -7.817 -14.152 -1.011 1.00 0.00 H new ATOM 0 HB VAL A 185 -5.045 -15.384 -1.029 1.00 0.00 H new ATOM 0 HG11 VAL A 185 -4.755 -14.572 1.275 1.00 0.00 H new ATOM 0 HG12 VAL A 185 -4.860 -13.231 0.109 1.00 0.00 H new ATOM 0 HG13 VAL A 185 -6.261 -13.634 1.129 1.00 0.00 H new ATOM 0 HG21 VAL A 185 -5.951 -16.691 0.850 1.00 0.00 H new ATOM 0 HG22 VAL A 185 -7.506 -15.841 0.686 1.00 0.00 H new ATOM 0 HG23 VAL A 185 -6.924 -16.894 -0.625 1.00 0.00 H new ATOM 1278 N LYS A 186 -6.842 -11.872 -1.251 1.00 0.00 N ATOM 1279 CA LYS A 186 -6.374 -10.512 -1.487 1.00 0.00 C ATOM 1280 C LYS A 186 -6.511 -9.663 -0.227 1.00 0.00 C ATOM 1281 O LYS A 186 -7.488 -9.786 0.512 1.00 0.00 O ATOM 1282 CB LYS A 186 -7.160 -9.872 -2.634 1.00 0.00 C ATOM 1283 CG LYS A 186 -7.217 -10.731 -3.885 1.00 0.00 C ATOM 1284 CD LYS A 186 -7.321 -9.881 -5.140 1.00 0.00 C ATOM 1285 CE LYS A 186 -8.771 -9.606 -5.509 1.00 0.00 C ATOM 1286 NZ LYS A 186 -8.935 -9.359 -6.969 1.00 0.00 N ATOM 0 H LYS A 186 -7.650 -11.938 -0.632 1.00 0.00 H new ATOM 0 HA LYS A 186 -5.320 -10.559 -1.759 1.00 0.00 H new ATOM 0 HB2 LYS A 186 -8.176 -9.667 -2.297 1.00 0.00 H new ATOM 0 HB3 LYS A 186 -6.707 -8.912 -2.883 1.00 0.00 H new ATOM 0 HG2 LYS A 186 -6.325 -11.355 -3.940 1.00 0.00 H new ATOM 0 HG3 LYS A 186 -8.073 -11.403 -3.827 1.00 0.00 H new ATOM 0 HD2 LYS A 186 -6.799 -8.937 -4.986 1.00 0.00 H new ATOM 0 HD3 LYS A 186 -6.824 -10.389 -5.967 1.00 0.00 H new ATOM 0 HE2 LYS A 186 -9.388 -10.454 -5.213 1.00 0.00 H new ATOM 0 HE3 LYS A 186 -9.130 -8.741 -4.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 186 -9.937 -9.176 -7.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 186 -8.366 -8.534 -7.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 186 -8.617 -10.194 -7.500 1.00 0.00 H new ATOM 1300 N ARG A 187 -5.528 -8.801 0.011 1.00 0.00 N ATOM 1301 CA ARG A 187 -5.539 -7.932 1.181 1.00 0.00 C ATOM 1302 C ARG A 187 -6.909 -7.286 1.364 1.00 0.00 C ATOM 1303 O ARG A 187 -7.357 -6.507 0.523 1.00 0.00 O ATOM 1304 CB ARG A 187 -4.466 -6.850 1.050 1.00 0.00 C ATOM 1305 CG ARG A 187 -3.111 -7.266 1.598 1.00 0.00 C ATOM 1306 CD ARG A 187 -2.163 -6.081 1.697 1.00 0.00 C ATOM 1307 NE ARG A 187 -1.544 -5.766 0.412 1.00 0.00 N ATOM 1308 CZ ARG A 187 -2.116 -5.001 -0.511 1.00 0.00 C ATOM 1309 NH1 ARG A 187 -3.313 -4.475 -0.292 1.00 0.00 N ATOM 1310 NH2 ARG A 187 -1.489 -4.760 -1.656 1.00 0.00 N ATOM 0 H ARG A 187 -4.713 -8.686 -0.592 1.00 0.00 H new ATOM 0 HA ARG A 187 -5.323 -8.542 2.058 1.00 0.00 H new ATOM 0 HB2 ARG A 187 -4.357 -6.584 -0.001 1.00 0.00 H new ATOM 0 HB3 ARG A 187 -4.800 -5.954 1.573 1.00 0.00 H new ATOM 0 HG2 ARG A 187 -3.238 -7.715 2.583 1.00 0.00 H new ATOM 0 HG3 ARG A 187 -2.675 -8.029 0.953 1.00 0.00 H new ATOM 0 HD2 ARG A 187 -2.708 -5.210 2.060 1.00 0.00 H new ATOM 0 HD3 ARG A 187 -1.386 -6.299 2.430 1.00 0.00 H new ATOM 0 HE ARG A 187 -0.622 -6.155 0.213 1.00 0.00 H new ATOM 0 HH11 ARG A 187 -3.797 -4.657 0.587 1.00 0.00 H new ATOM 0 HH12 ARG A 187 -3.750 -3.888 -1.003 1.00 0.00 H new ATOM 0 HH21 ARG A 187 -0.568 -5.162 -1.827 1.00 0.00 H new ATOM 0 HH22 ARG A 187 -1.929 -4.172 -2.364 1.00 0.00 H new ATOM 1324 N ALA A 188 -7.570 -7.615 2.469 1.00 0.00 N ATOM 1325 CA ALA A 188 -8.888 -7.066 2.764 1.00 0.00 C ATOM 1326 C ALA A 188 -8.785 -5.625 3.253 1.00 0.00 C ATOM 1327 O ALA A 188 -8.024 -5.325 4.171 1.00 0.00 O ATOM 1328 CB ALA A 188 -9.599 -7.926 3.797 1.00 0.00 C ATOM 0 H ALA A 188 -7.214 -8.259 3.175 1.00 0.00 H new ATOM 0 HA ALA A 188 -9.470 -7.069 1.843 1.00 0.00 H new ATOM 0 HB1 ALA A 188 -10.582 -7.504 4.007 1.00 0.00 H new ATOM 0 HB2 ALA A 188 -9.714 -8.939 3.410 1.00 0.00 H new ATOM 0 HB3 ALA A 188 -9.012 -7.953 4.715 1.00 0.00 H new