USER MOD reduce.3.24.130724 H: found=0, std=0, add=608, rem=0, adj=14 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 Single : A 113 ASN : amide:sc= -0.715 X(o=-0.71,f=-0.96!) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 HIS : no HD1:sc= -2.97! C(o=-3!,f=-2.8!) USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 124 CYS SG : rot 180:sc= -1.24 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 132 TYR OH : rot 180:sc= 0.107 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 LYS NZ :NH3+ -166:sc= -0.35 (180deg=-0.741) USER MOD Single : A 140 THR OG1 : rot -116:sc= 0.248 USER MOD Single : A 144 MET CE :methyl -115:sc= -7.37! (180deg=-8.1!) USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 LYS NZ :NH3+ 156:sc= -0.756 (180deg=-1.52!) USER MOD Single : A 151 GLN : amide:sc= 0 X(o=0,f=-0.07) USER MOD Single : A 160 THR OG1 : rot 180:sc= -0.593 USER MOD Single : A 165 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 166 SER OG : rot -160:sc= 0.0903 USER MOD Single : A 169 GLN : amide:sc=-0.00666 X(o=-0.0067,f=-0.16) USER MOD Single : A 172 ASN : amide:sc= -0.279 K(o=-0.28,f=-2.2!) USER MOD Single : A 173 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 174 HIS : no HE2:sc= -4.72! C(o=-4.7!,f=-8.5!) USER MOD Single : A 176 HIS :FLIP no HD1:sc= -3.89! C(o=-5.5!,f=-3.9!) USER MOD Single : A 179 MET CE :methyl 157:sc= -1.65 (180deg=-3.2!) USER MOD Single : A 181 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 182 LYS NZ :NH3+ 134:sc= -0.224 (180deg=-0.966) USER MOD Single : A 186 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 110 N ASN A 113 -5.259 -7.224 10.248 1.00 0.00 N ATOM 111 CA ASN A 113 -4.706 -8.489 9.779 1.00 0.00 C ATOM 112 C ASN A 113 -5.788 -9.351 9.136 1.00 0.00 C ATOM 113 O ASN A 113 -5.808 -10.570 9.304 1.00 0.00 O ATOM 114 CB ASN A 113 -4.058 -9.247 10.940 1.00 0.00 C ATOM 115 CG ASN A 113 -3.495 -8.316 11.996 1.00 0.00 C ATOM 116 OD1 ASN A 113 -3.171 -7.162 11.713 1.00 0.00 O ATOM 117 ND2 ASN A 113 -3.377 -8.814 13.221 1.00 0.00 N ATOM 0 HA ASN A 113 -3.947 -8.269 9.028 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -4.796 -9.906 11.397 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -3.259 -9.881 10.555 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -3.005 -8.234 13.974 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -3.658 -9.776 13.410 1.00 0.00 H new ATOM 124 N LYS A 114 -6.686 -8.709 8.397 1.00 0.00 N ATOM 125 CA LYS A 114 -7.771 -9.415 7.726 1.00 0.00 C ATOM 126 C LYS A 114 -7.474 -9.582 6.239 1.00 0.00 C ATOM 127 O LYS A 114 -6.899 -8.695 5.608 1.00 0.00 O ATOM 128 CB LYS A 114 -9.090 -8.660 7.911 1.00 0.00 C ATOM 129 CG LYS A 114 -10.293 -9.387 7.335 1.00 0.00 C ATOM 130 CD LYS A 114 -11.596 -8.724 7.748 1.00 0.00 C ATOM 131 CE LYS A 114 -12.041 -9.182 9.128 1.00 0.00 C ATOM 132 NZ LYS A 114 -12.838 -8.138 9.829 1.00 0.00 N ATOM 0 H LYS A 114 -6.684 -7.700 8.247 1.00 0.00 H new ATOM 0 HA LYS A 114 -7.859 -10.404 8.175 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -9.255 -8.489 8.975 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -9.008 -7.681 7.439 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -10.222 -9.405 6.247 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -10.288 -10.424 7.672 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -11.471 -7.641 7.745 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -12.371 -8.957 7.018 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -12.635 -10.091 9.035 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -11.166 -9.434 9.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -13.122 -8.489 10.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -12.263 -7.279 9.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -13.687 -7.916 9.270 1.00 0.00 H new ATOM 146 N ILE A 115 -7.870 -10.723 5.686 1.00 0.00 N ATOM 147 CA ILE A 115 -7.648 -11.005 4.273 1.00 0.00 C ATOM 148 C ILE A 115 -8.949 -11.392 3.579 1.00 0.00 C ATOM 149 O ILE A 115 -9.864 -11.929 4.205 1.00 0.00 O ATOM 150 CB ILE A 115 -6.619 -12.134 4.079 1.00 0.00 C ATOM 151 CG1 ILE A 115 -7.184 -13.461 4.590 1.00 0.00 C ATOM 152 CG2 ILE A 115 -5.320 -11.795 4.794 1.00 0.00 C ATOM 153 CD1 ILE A 115 -6.369 -14.665 4.172 1.00 0.00 C ATOM 0 H ILE A 115 -8.346 -11.468 6.195 1.00 0.00 H new ATOM 0 HA ILE A 115 -7.259 -10.090 3.826 1.00 0.00 H new ATOM 0 HB ILE A 115 -6.409 -12.236 3.014 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -7.238 -13.429 5.678 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -8.204 -13.578 4.224 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -4.603 -12.603 4.648 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -4.912 -10.869 4.388 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -5.513 -11.670 5.859 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -6.828 -15.571 4.569 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -6.336 -14.722 3.084 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -5.355 -14.571 4.561 1.00 0.00 H new ATOM 165 N PHE A 116 -9.024 -11.119 2.280 1.00 0.00 N ATOM 166 CA PHE A 116 -10.213 -11.440 1.499 1.00 0.00 C ATOM 167 C PHE A 116 -10.040 -12.767 0.765 1.00 0.00 C ATOM 168 O PHE A 116 -9.267 -12.865 -0.189 1.00 0.00 O ATOM 169 CB PHE A 116 -10.507 -10.323 0.496 1.00 0.00 C ATOM 170 CG PHE A 116 -11.406 -10.750 -0.630 1.00 0.00 C ATOM 171 CD1 PHE A 116 -12.783 -10.650 -0.510 1.00 0.00 C ATOM 172 CD2 PHE A 116 -10.874 -11.249 -1.807 1.00 0.00 C ATOM 173 CE1 PHE A 116 -13.612 -11.042 -1.544 1.00 0.00 C ATOM 174 CE2 PHE A 116 -11.698 -11.643 -2.845 1.00 0.00 C ATOM 175 CZ PHE A 116 -13.069 -11.538 -2.713 1.00 0.00 C ATOM 0 H PHE A 116 -8.276 -10.676 1.747 1.00 0.00 H new ATOM 0 HA PHE A 116 -11.054 -11.532 2.186 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -10.968 -9.486 1.021 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -9.566 -9.960 0.082 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -13.213 -10.262 0.401 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -9.803 -11.331 -1.916 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -14.684 -10.961 -1.438 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -11.271 -12.032 -3.757 1.00 0.00 H new ATOM 0 HZ PHE A 116 -13.715 -11.843 -3.523 1.00 0.00 H new ATOM 185 N VAL A 117 -10.764 -13.786 1.217 1.00 0.00 N ATOM 186 CA VAL A 117 -10.691 -15.106 0.603 1.00 0.00 C ATOM 187 C VAL A 117 -11.921 -15.382 -0.255 1.00 0.00 C ATOM 188 O VAL A 117 -13.032 -15.507 0.257 1.00 0.00 O ATOM 189 CB VAL A 117 -10.563 -16.213 1.667 1.00 0.00 C ATOM 190 CG1 VAL A 117 -10.603 -17.587 1.016 1.00 0.00 C ATOM 191 CG2 VAL A 117 -9.284 -16.032 2.472 1.00 0.00 C ATOM 0 H VAL A 117 -11.407 -13.723 2.006 1.00 0.00 H new ATOM 0 HA VAL A 117 -9.802 -15.113 -0.028 1.00 0.00 H new ATOM 0 HB VAL A 117 -11.409 -16.137 2.350 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -10.511 -18.356 1.783 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -11.548 -17.712 0.488 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -9.778 -17.679 0.310 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -9.209 -16.822 3.219 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -8.424 -16.081 1.804 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -9.302 -15.063 2.970 1.00 0.00 H new ATOM 201 N GLY A 118 -11.712 -15.475 -1.565 1.00 0.00 N ATOM 202 CA GLY A 118 -12.813 -15.736 -2.474 1.00 0.00 C ATOM 203 C GLY A 118 -12.603 -16.994 -3.293 1.00 0.00 C ATOM 204 O GLY A 118 -11.560 -17.639 -3.197 1.00 0.00 O ATOM 0 H GLY A 118 -10.801 -15.374 -2.012 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -13.737 -15.828 -1.903 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -12.936 -14.886 -3.145 1.00 0.00 H new ATOM 208 N GLY A 119 -13.599 -17.346 -4.101 1.00 0.00 N ATOM 209 CA GLY A 119 -13.499 -18.535 -4.927 1.00 0.00 C ATOM 210 C GLY A 119 -13.528 -19.812 -4.110 1.00 0.00 C ATOM 211 O GLY A 119 -13.350 -20.905 -4.649 1.00 0.00 O ATOM 0 H GLY A 119 -14.473 -16.829 -4.198 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -14.321 -18.547 -5.643 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -12.575 -18.497 -5.503 1.00 0.00 H new ATOM 215 N ILE A 120 -13.749 -19.674 -2.807 1.00 0.00 N ATOM 216 CA ILE A 120 -13.799 -20.826 -1.916 1.00 0.00 C ATOM 217 C ILE A 120 -14.782 -21.874 -2.426 1.00 0.00 C ATOM 218 O ILE A 120 -15.879 -21.560 -2.887 1.00 0.00 O ATOM 219 CB ILE A 120 -14.201 -20.415 -0.487 1.00 0.00 C ATOM 220 CG1 ILE A 120 -13.223 -19.374 0.062 1.00 0.00 C ATOM 221 CG2 ILE A 120 -14.250 -21.635 0.422 1.00 0.00 C ATOM 222 CD1 ILE A 120 -13.767 -18.595 1.239 1.00 0.00 C ATOM 0 H ILE A 120 -13.896 -18.776 -2.345 1.00 0.00 H new ATOM 0 HA ILE A 120 -12.796 -21.252 -1.895 1.00 0.00 H new ATOM 0 HB ILE A 120 -15.196 -19.970 -0.519 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -12.303 -19.875 0.362 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -12.961 -18.677 -0.735 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -14.535 -21.328 1.428 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -14.982 -22.346 0.038 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -13.268 -22.106 0.452 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -13.020 -17.876 1.576 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -14.671 -18.066 0.938 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -14.002 -19.282 2.052 1.00 0.00 H new ATOM 234 N PRO A 121 -14.382 -23.152 -2.341 1.00 0.00 N ATOM 235 CA PRO A 121 -15.213 -24.273 -2.787 1.00 0.00 C ATOM 236 C PRO A 121 -16.425 -24.491 -1.887 1.00 0.00 C ATOM 237 O PRO A 121 -16.508 -23.929 -0.795 1.00 0.00 O ATOM 238 CB PRO A 121 -14.265 -25.472 -2.706 1.00 0.00 C ATOM 239 CG PRO A 121 -13.256 -25.089 -1.680 1.00 0.00 C ATOM 240 CD PRO A 121 -13.086 -23.599 -1.802 1.00 0.00 C ATOM 0 HA PRO A 121 -15.625 -24.104 -3.782 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -14.797 -26.379 -2.418 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -13.795 -25.670 -3.669 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -13.593 -25.363 -0.680 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -12.311 -25.605 -1.850 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -12.871 -23.139 -0.838 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -12.263 -23.341 -2.469 1.00 0.00 H new ATOM 248 N HIS A 122 -17.363 -25.309 -2.353 1.00 0.00 N ATOM 249 CA HIS A 122 -18.570 -25.602 -1.589 1.00 0.00 C ATOM 250 C HIS A 122 -18.312 -26.703 -0.564 1.00 0.00 C ATOM 251 O HIS A 122 -19.242 -27.226 0.046 1.00 0.00 O ATOM 252 CB HIS A 122 -19.705 -26.018 -2.526 1.00 0.00 C ATOM 253 CG HIS A 122 -21.049 -26.041 -1.866 1.00 0.00 C ATOM 254 ND1 HIS A 122 -21.648 -27.201 -1.421 1.00 0.00 N ATOM 255 CD2 HIS A 122 -21.910 -25.039 -1.575 1.00 0.00 C ATOM 256 CE1 HIS A 122 -22.821 -26.910 -0.886 1.00 0.00 C ATOM 257 NE2 HIS A 122 -23.003 -25.604 -0.967 1.00 0.00 N ATOM 0 H HIS A 122 -17.310 -25.781 -3.256 1.00 0.00 H new ATOM 0 HA HIS A 122 -18.861 -24.696 -1.057 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -19.737 -25.331 -3.372 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -19.489 -27.008 -2.927 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -21.764 -23.989 -1.783 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -23.513 -27.619 -0.456 1.00 0.00 H new ATOM 0 HE2 HIS A 122 -23.823 -25.098 -0.632 1.00 0.00 H new ATOM 265 N ASN A 123 -17.041 -27.049 -0.383 1.00 0.00 N ATOM 266 CA ASN A 123 -16.661 -28.088 0.567 1.00 0.00 C ATOM 267 C ASN A 123 -15.761 -27.523 1.661 1.00 0.00 C ATOM 268 O ASN A 123 -15.632 -28.108 2.737 1.00 0.00 O ATOM 269 CB ASN A 123 -15.946 -29.231 -0.157 1.00 0.00 C ATOM 270 CG ASN A 123 -16.913 -30.256 -0.716 1.00 0.00 C ATOM 271 OD1 ASN A 123 -17.691 -29.961 -1.624 1.00 0.00 O ATOM 272 ND2 ASN A 123 -16.869 -31.469 -0.176 1.00 0.00 N ATOM 0 H ASN A 123 -16.258 -26.625 -0.881 1.00 0.00 H new ATOM 0 HA ASN A 123 -17.570 -28.471 1.031 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -15.344 -28.823 -0.969 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -15.260 -29.722 0.533 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -17.496 -32.200 -0.512 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -16.208 -31.669 0.575 1.00 0.00 H new ATOM 279 N CYS A 124 -15.143 -26.381 1.380 1.00 0.00 N ATOM 280 CA CYS A 124 -14.255 -25.736 2.340 1.00 0.00 C ATOM 281 C CYS A 124 -15.053 -24.951 3.376 1.00 0.00 C ATOM 282 O CYS A 124 -16.067 -24.332 3.055 1.00 0.00 O ATOM 283 CB CYS A 124 -13.279 -24.805 1.618 1.00 0.00 C ATOM 284 SG CYS A 124 -12.353 -23.710 2.719 1.00 0.00 S ATOM 0 H CYS A 124 -15.241 -25.883 0.495 1.00 0.00 H new ATOM 0 HA CYS A 124 -13.691 -26.513 2.855 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -12.574 -25.408 1.046 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -13.834 -24.198 0.902 1.00 0.00 H new ATOM 0 HG CYS A 124 -11.553 -22.964 2.017 1.00 0.00 H new ATOM 290 N GLY A 125 -14.588 -24.982 4.621 1.00 0.00 N ATOM 291 CA GLY A 125 -15.271 -24.271 5.686 1.00 0.00 C ATOM 292 C GLY A 125 -14.310 -23.661 6.686 1.00 0.00 C ATOM 293 O GLY A 125 -13.098 -23.663 6.472 1.00 0.00 O ATOM 0 H GLY A 125 -13.751 -25.487 4.911 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -15.889 -23.484 5.255 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -15.942 -24.956 6.204 1.00 0.00 H new ATOM 297 N GLU A 126 -14.851 -23.136 7.781 1.00 0.00 N ATOM 298 CA GLU A 126 -14.031 -22.518 8.817 1.00 0.00 C ATOM 299 C GLU A 126 -12.857 -23.418 9.191 1.00 0.00 C ATOM 300 O GLU A 126 -11.697 -23.018 9.091 1.00 0.00 O ATOM 301 CB GLU A 126 -14.876 -22.220 10.057 1.00 0.00 C ATOM 302 CG GLU A 126 -14.119 -21.480 11.147 1.00 0.00 C ATOM 303 CD GLU A 126 -14.992 -21.146 12.341 1.00 0.00 C ATOM 304 OE1 GLU A 126 -15.824 -20.222 12.227 1.00 0.00 O ATOM 305 OE2 GLU A 126 -14.843 -21.809 13.389 1.00 0.00 O ATOM 0 H GLU A 126 -15.853 -23.126 7.974 1.00 0.00 H new ATOM 0 HA GLU A 126 -13.636 -21.582 8.422 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -15.742 -21.628 9.762 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -15.254 -23.158 10.462 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -13.277 -22.089 11.476 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -13.705 -20.559 10.736 1.00 0.00 H new ATOM 312 N THR A 127 -13.167 -24.636 9.624 1.00 0.00 N ATOM 313 CA THR A 127 -12.140 -25.593 10.015 1.00 0.00 C ATOM 314 C THR A 127 -11.027 -25.660 8.976 1.00 0.00 C ATOM 315 O THR A 127 -9.866 -25.383 9.278 1.00 0.00 O ATOM 316 CB THR A 127 -12.730 -27.002 10.210 1.00 0.00 C ATOM 317 OG1 THR A 127 -13.686 -26.990 11.276 1.00 0.00 O ATOM 318 CG2 THR A 127 -11.633 -28.010 10.518 1.00 0.00 C ATOM 0 H THR A 127 -14.122 -24.983 9.713 1.00 0.00 H new ATOM 0 HA THR A 127 -11.728 -25.245 10.963 1.00 0.00 H new ATOM 0 HB THR A 127 -13.223 -27.296 9.284 1.00 0.00 H new ATOM 0 HG1 THR A 127 -14.058 -27.889 11.392 1.00 0.00 H new ATOM 0 HG21 THR A 127 -12.074 -28.998 10.652 1.00 0.00 H new ATOM 0 HG22 THR A 127 -10.923 -28.038 9.692 1.00 0.00 H new ATOM 0 HG23 THR A 127 -11.116 -27.717 11.431 1.00 0.00 H new ATOM 326 N GLU A 128 -11.388 -26.028 7.750 1.00 0.00 N ATOM 327 CA GLU A 128 -10.418 -26.131 6.667 1.00 0.00 C ATOM 328 C GLU A 128 -9.633 -24.831 6.514 1.00 0.00 C ATOM 329 O GLU A 128 -8.417 -24.801 6.702 1.00 0.00 O ATOM 330 CB GLU A 128 -11.123 -26.471 5.352 1.00 0.00 C ATOM 331 CG GLU A 128 -11.756 -27.852 5.341 1.00 0.00 C ATOM 332 CD GLU A 128 -13.150 -27.859 5.938 1.00 0.00 C ATOM 333 OE1 GLU A 128 -14.121 -27.651 5.180 1.00 0.00 O ATOM 334 OE2 GLU A 128 -13.271 -28.073 7.162 1.00 0.00 O ATOM 0 H GLU A 128 -12.345 -26.259 7.483 1.00 0.00 H new ATOM 0 HA GLU A 128 -9.719 -26.930 6.914 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -11.894 -25.725 5.160 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -10.404 -26.404 4.536 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -11.802 -28.218 4.315 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -11.123 -28.542 5.898 1.00 0.00 H new ATOM 341 N LEU A 129 -10.338 -23.758 6.170 1.00 0.00 N ATOM 342 CA LEU A 129 -9.709 -22.454 5.991 1.00 0.00 C ATOM 343 C LEU A 129 -8.553 -22.269 6.969 1.00 0.00 C ATOM 344 O LEU A 129 -7.400 -22.120 6.562 1.00 0.00 O ATOM 345 CB LEU A 129 -10.738 -21.339 6.182 1.00 0.00 C ATOM 346 CG LEU A 129 -11.805 -21.217 5.095 1.00 0.00 C ATOM 347 CD1 LEU A 129 -12.957 -20.346 5.572 1.00 0.00 C ATOM 348 CD2 LEU A 129 -11.202 -20.654 3.816 1.00 0.00 C ATOM 0 H LEU A 129 -11.345 -23.766 6.010 1.00 0.00 H new ATOM 0 HA LEU A 129 -9.314 -22.404 4.976 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -11.238 -21.493 7.138 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -10.207 -20.390 6.250 1.00 0.00 H new ATOM 0 HG LEU A 129 -12.194 -22.213 4.882 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -13.707 -20.271 4.784 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -13.406 -20.791 6.460 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -12.585 -19.351 5.814 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -11.976 -20.574 3.053 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -10.785 -19.667 4.014 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -10.412 -21.317 3.463 1.00 0.00 H new ATOM 360 N ARG A 130 -8.869 -22.281 8.260 1.00 0.00 N ATOM 361 CA ARG A 130 -7.857 -22.114 9.296 1.00 0.00 C ATOM 362 C ARG A 130 -6.792 -23.203 9.196 1.00 0.00 C ATOM 363 O ARG A 130 -5.597 -22.914 9.152 1.00 0.00 O ATOM 364 CB ARG A 130 -8.504 -22.146 10.681 1.00 0.00 C ATOM 365 CG ARG A 130 -9.679 -21.192 10.826 1.00 0.00 C ATOM 366 CD ARG A 130 -10.420 -21.415 12.135 1.00 0.00 C ATOM 367 NE ARG A 130 -9.807 -20.686 13.242 1.00 0.00 N ATOM 368 CZ ARG A 130 -10.018 -20.978 14.521 1.00 0.00 C ATOM 369 NH1 ARG A 130 -10.821 -21.980 14.852 1.00 0.00 N ATOM 370 NH2 ARG A 130 -9.424 -20.268 15.472 1.00 0.00 N ATOM 0 H ARG A 130 -9.818 -22.405 8.613 1.00 0.00 H new ATOM 0 HA ARG A 130 -7.378 -21.146 9.148 1.00 0.00 H new ATOM 0 HB2 ARG A 130 -8.842 -23.161 10.891 1.00 0.00 H new ATOM 0 HB3 ARG A 130 -7.752 -21.899 11.430 1.00 0.00 H new ATOM 0 HG2 ARG A 130 -9.322 -20.163 10.780 1.00 0.00 H new ATOM 0 HG3 ARG A 130 -10.365 -21.329 9.990 1.00 0.00 H new ATOM 0 HD2 ARG A 130 -11.457 -21.099 12.023 1.00 0.00 H new ATOM 0 HD3 ARG A 130 -10.435 -22.480 12.366 1.00 0.00 H new ATOM 0 HE ARG A 130 -9.183 -19.910 13.021 1.00 0.00 H new ATOM 0 HH11 ARG A 130 -11.278 -22.529 14.124 1.00 0.00 H new ATOM 0 HH12 ARG A 130 -10.981 -22.202 15.835 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -8.805 -19.497 15.221 1.00 0.00 H new ATOM 0 HH22 ARG A 130 -9.587 -20.493 16.453 1.00 0.00 H new ATOM 384 N GLU A 131 -7.236 -24.456 9.160 1.00 0.00 N ATOM 385 CA GLU A 131 -6.321 -25.587 9.066 1.00 0.00 C ATOM 386 C GLU A 131 -5.326 -25.389 7.926 1.00 0.00 C ATOM 387 O GLU A 131 -4.247 -25.982 7.920 1.00 0.00 O ATOM 388 CB GLU A 131 -7.101 -26.887 8.857 1.00 0.00 C ATOM 389 CG GLU A 131 -7.708 -27.444 10.133 1.00 0.00 C ATOM 390 CD GLU A 131 -6.757 -28.357 10.882 1.00 0.00 C ATOM 391 OE1 GLU A 131 -5.530 -28.147 10.782 1.00 0.00 O ATOM 392 OE2 GLU A 131 -7.239 -29.282 11.569 1.00 0.00 O ATOM 0 H GLU A 131 -8.223 -24.713 9.194 1.00 0.00 H new ATOM 0 HA GLU A 131 -5.766 -25.651 10.002 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -7.896 -26.711 8.133 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -6.436 -27.634 8.425 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -8.000 -26.619 10.782 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -8.617 -27.994 9.888 1.00 0.00 H new ATOM 399 N TYR A 132 -5.697 -24.553 6.964 1.00 0.00 N ATOM 400 CA TYR A 132 -4.840 -24.279 5.817 1.00 0.00 C ATOM 401 C TYR A 132 -4.187 -22.906 5.941 1.00 0.00 C ATOM 402 O TYR A 132 -3.167 -22.630 5.308 1.00 0.00 O ATOM 403 CB TYR A 132 -5.647 -24.356 4.520 1.00 0.00 C ATOM 404 CG TYR A 132 -4.792 -24.344 3.273 1.00 0.00 C ATOM 405 CD1 TYR A 132 -4.153 -23.183 2.855 1.00 0.00 C ATOM 406 CD2 TYR A 132 -4.622 -25.495 2.512 1.00 0.00 C ATOM 407 CE1 TYR A 132 -3.372 -23.168 1.716 1.00 0.00 C ATOM 408 CE2 TYR A 132 -3.841 -25.489 1.372 1.00 0.00 C ATOM 409 CZ TYR A 132 -3.219 -24.323 0.978 1.00 0.00 C ATOM 410 OH TYR A 132 -2.440 -24.312 -0.156 1.00 0.00 O ATOM 0 H TYR A 132 -6.586 -24.053 6.955 1.00 0.00 H new ATOM 0 HA TYR A 132 -4.055 -25.035 5.794 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -6.248 -25.265 4.529 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -6.340 -23.516 4.483 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -4.269 -22.277 3.431 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -5.109 -26.410 2.817 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -2.884 -22.256 1.405 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -3.718 -26.392 0.793 1.00 0.00 H new ATOM 0 HH TYR A 132 -2.436 -25.206 -0.558 1.00 0.00 H new ATOM 420 N PHE A 133 -4.782 -22.047 6.762 1.00 0.00 N ATOM 421 CA PHE A 133 -4.259 -20.702 6.971 1.00 0.00 C ATOM 422 C PHE A 133 -3.514 -20.607 8.299 1.00 0.00 C ATOM 423 O PHE A 133 -3.246 -19.514 8.798 1.00 0.00 O ATOM 424 CB PHE A 133 -5.397 -19.679 6.937 1.00 0.00 C ATOM 425 CG PHE A 133 -5.904 -19.392 5.553 1.00 0.00 C ATOM 426 CD1 PHE A 133 -5.027 -19.047 4.537 1.00 0.00 C ATOM 427 CD2 PHE A 133 -7.258 -19.466 5.268 1.00 0.00 C ATOM 428 CE1 PHE A 133 -5.490 -18.782 3.262 1.00 0.00 C ATOM 429 CE2 PHE A 133 -7.727 -19.202 3.995 1.00 0.00 C ATOM 430 CZ PHE A 133 -6.842 -18.859 2.991 1.00 0.00 C ATOM 0 H PHE A 133 -5.627 -22.258 7.293 1.00 0.00 H new ATOM 0 HA PHE A 133 -3.558 -20.483 6.166 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -6.222 -20.044 7.549 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -5.052 -18.749 7.389 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -3.969 -18.984 4.744 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -7.954 -19.733 6.049 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -4.796 -18.515 2.479 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -8.785 -19.264 3.785 1.00 0.00 H new ATOM 0 HZ PHE A 133 -7.207 -18.651 1.996 1.00 0.00 H new ATOM 440 N LYS A 134 -3.184 -21.761 8.869 1.00 0.00 N ATOM 441 CA LYS A 134 -2.470 -21.811 10.139 1.00 0.00 C ATOM 442 C LYS A 134 -0.965 -21.922 9.913 1.00 0.00 C ATOM 443 O LYS A 134 -0.171 -21.676 10.821 1.00 0.00 O ATOM 444 CB LYS A 134 -2.959 -22.996 10.976 1.00 0.00 C ATOM 445 CG LYS A 134 -2.576 -24.348 10.399 1.00 0.00 C ATOM 446 CD LYS A 134 -2.729 -25.456 11.427 1.00 0.00 C ATOM 447 CE LYS A 134 -2.687 -26.830 10.775 1.00 0.00 C ATOM 448 NZ LYS A 134 -2.307 -27.893 11.747 1.00 0.00 N ATOM 0 H LYS A 134 -3.400 -22.675 8.471 1.00 0.00 H new ATOM 0 HA LYS A 134 -2.672 -20.885 10.678 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -2.551 -22.912 11.983 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -4.044 -22.943 11.066 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -3.201 -24.565 9.533 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -1.545 -24.316 10.048 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -1.933 -25.379 12.168 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -3.673 -25.333 11.959 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -3.663 -27.060 10.349 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -1.974 -26.819 9.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -2.289 -28.814 11.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -1.364 -27.687 12.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -3.002 -27.920 12.521 1.00 0.00 H new ATOM 462 N LYS A 135 -0.580 -22.291 8.696 1.00 0.00 N ATOM 463 CA LYS A 135 0.829 -22.431 8.350 1.00 0.00 C ATOM 464 C LYS A 135 1.478 -21.065 8.147 1.00 0.00 C ATOM 465 O LYS A 135 2.638 -20.859 8.505 1.00 0.00 O ATOM 466 CB LYS A 135 0.982 -23.272 7.081 1.00 0.00 C ATOM 467 CG LYS A 135 -0.117 -23.038 6.059 1.00 0.00 C ATOM 468 CD LYS A 135 0.323 -23.446 4.663 1.00 0.00 C ATOM 469 CE LYS A 135 -0.866 -23.816 3.790 1.00 0.00 C ATOM 470 NZ LYS A 135 -1.693 -24.891 4.406 1.00 0.00 N ATOM 0 H LYS A 135 -1.224 -22.498 7.933 1.00 0.00 H new ATOM 0 HA LYS A 135 1.332 -22.934 9.176 1.00 0.00 H new ATOM 0 HB2 LYS A 135 1.946 -23.050 6.623 1.00 0.00 H new ATOM 0 HB3 LYS A 135 0.994 -24.327 7.354 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -1.004 -23.604 6.342 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -0.397 -21.985 6.060 1.00 0.00 H new ATOM 0 HD2 LYS A 135 0.875 -22.628 4.200 1.00 0.00 H new ATOM 0 HD3 LYS A 135 1.005 -24.293 4.729 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -1.483 -22.933 3.624 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -0.511 -24.145 2.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -2.344 -25.280 3.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -1.072 -25.648 4.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -2.241 -24.497 5.197 1.00 0.00 H new ATOM 484 N PHE A 136 0.723 -20.135 7.573 1.00 0.00 N ATOM 485 CA PHE A 136 1.224 -18.789 7.324 1.00 0.00 C ATOM 486 C PHE A 136 1.448 -18.041 8.635 1.00 0.00 C ATOM 487 O PHE A 136 2.279 -17.136 8.712 1.00 0.00 O ATOM 488 CB PHE A 136 0.245 -18.012 6.442 1.00 0.00 C ATOM 489 CG PHE A 136 0.143 -18.548 5.043 1.00 0.00 C ATOM 490 CD1 PHE A 136 1.224 -18.478 4.179 1.00 0.00 C ATOM 491 CD2 PHE A 136 -1.033 -19.124 4.591 1.00 0.00 C ATOM 492 CE1 PHE A 136 1.133 -18.970 2.891 1.00 0.00 C ATOM 493 CE2 PHE A 136 -1.131 -19.619 3.304 1.00 0.00 C ATOM 494 CZ PHE A 136 -0.045 -19.543 2.453 1.00 0.00 C ATOM 0 H PHE A 136 -0.239 -20.289 7.271 1.00 0.00 H new ATOM 0 HA PHE A 136 2.179 -18.874 6.806 1.00 0.00 H new ATOM 0 HB2 PHE A 136 -0.742 -18.033 6.903 1.00 0.00 H new ATOM 0 HB3 PHE A 136 0.556 -16.968 6.401 1.00 0.00 H new ATOM 0 HD1 PHE A 136 2.149 -18.034 4.516 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -1.884 -19.187 5.253 1.00 0.00 H new ATOM 0 HE1 PHE A 136 1.982 -18.907 2.227 1.00 0.00 H new ATOM 0 HE2 PHE A 136 -2.054 -20.064 2.964 1.00 0.00 H new ATOM 0 HZ PHE A 136 -0.117 -19.931 1.448 1.00 0.00 H new ATOM 504 N GLY A 137 0.700 -18.426 9.665 1.00 0.00 N ATOM 505 CA GLY A 137 0.831 -17.782 10.959 1.00 0.00 C ATOM 506 C GLY A 137 -0.152 -18.323 11.978 1.00 0.00 C ATOM 507 O GLY A 137 -0.078 -19.489 12.364 1.00 0.00 O ATOM 0 H GLY A 137 0.006 -19.172 9.626 1.00 0.00 H new ATOM 0 HA2 GLY A 137 1.847 -17.921 11.329 1.00 0.00 H new ATOM 0 HA3 GLY A 137 0.677 -16.709 10.845 1.00 0.00 H new ATOM 511 N VAL A 138 -1.075 -17.472 12.417 1.00 0.00 N ATOM 512 CA VAL A 138 -2.077 -17.871 13.398 1.00 0.00 C ATOM 513 C VAL A 138 -3.416 -17.196 13.122 1.00 0.00 C ATOM 514 O VAL A 138 -3.530 -15.972 13.182 1.00 0.00 O ATOM 515 CB VAL A 138 -1.627 -17.528 14.830 1.00 0.00 C ATOM 516 CG1 VAL A 138 -2.763 -17.756 15.816 1.00 0.00 C ATOM 517 CG2 VAL A 138 -0.404 -18.347 15.215 1.00 0.00 C ATOM 0 H VAL A 138 -1.149 -16.503 12.109 1.00 0.00 H new ATOM 0 HA VAL A 138 -2.194 -18.951 13.310 1.00 0.00 H new ATOM 0 HB VAL A 138 -1.355 -16.473 14.863 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -2.426 -17.508 16.823 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -3.609 -17.122 15.550 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -3.069 -18.802 15.783 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -0.100 -18.092 16.230 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -0.647 -19.409 15.165 1.00 0.00 H new ATOM 0 HG23 VAL A 138 0.412 -18.128 14.526 1.00 0.00 H new ATOM 527 N VAL A 139 -4.428 -18.003 12.818 1.00 0.00 N ATOM 528 CA VAL A 139 -5.760 -17.485 12.534 1.00 0.00 C ATOM 529 C VAL A 139 -6.508 -17.155 13.821 1.00 0.00 C ATOM 530 O VAL A 139 -6.840 -18.045 14.605 1.00 0.00 O ATOM 531 CB VAL A 139 -6.590 -18.490 11.714 1.00 0.00 C ATOM 532 CG1 VAL A 139 -7.939 -17.891 11.342 1.00 0.00 C ATOM 533 CG2 VAL A 139 -5.828 -18.920 10.470 1.00 0.00 C ATOM 0 H VAL A 139 -4.350 -19.018 12.762 1.00 0.00 H new ATOM 0 HA VAL A 139 -5.627 -16.574 11.951 1.00 0.00 H new ATOM 0 HB VAL A 139 -6.768 -19.373 12.327 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -8.512 -18.615 10.763 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -8.487 -17.637 12.249 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -7.786 -16.991 10.747 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -6.429 -19.630 9.902 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -5.618 -18.047 9.852 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -4.890 -19.391 10.763 1.00 0.00 H new ATOM 543 N THR A 140 -6.771 -15.870 14.034 1.00 0.00 N ATOM 544 CA THR A 140 -7.479 -15.422 15.227 1.00 0.00 C ATOM 545 C THR A 140 -8.985 -15.391 14.993 1.00 0.00 C ATOM 546 O THR A 140 -9.767 -15.693 15.894 1.00 0.00 O ATOM 547 CB THR A 140 -7.010 -14.021 15.665 1.00 0.00 C ATOM 548 OG1 THR A 140 -7.222 -13.080 14.607 1.00 0.00 O ATOM 549 CG2 THR A 140 -5.538 -14.038 16.049 1.00 0.00 C ATOM 0 H THR A 140 -6.504 -15.120 13.396 1.00 0.00 H new ATOM 0 HA THR A 140 -7.251 -16.137 16.017 1.00 0.00 H new ATOM 0 HB THR A 140 -7.593 -13.723 16.537 1.00 0.00 H new ATOM 0 HG1 THR A 140 -6.358 -12.733 14.300 1.00 0.00 H new ATOM 0 HG21 THR A 140 -5.230 -13.038 16.355 1.00 0.00 H new ATOM 0 HG22 THR A 140 -5.385 -14.733 16.875 1.00 0.00 H new ATOM 0 HG23 THR A 140 -4.942 -14.355 15.193 1.00 0.00 H new ATOM 557 N GLU A 141 -9.384 -15.026 13.779 1.00 0.00 N ATOM 558 CA GLU A 141 -10.797 -14.956 13.429 1.00 0.00 C ATOM 559 C GLU A 141 -11.023 -15.404 11.987 1.00 0.00 C ATOM 560 O GLU A 141 -10.138 -15.281 11.141 1.00 0.00 O ATOM 561 CB GLU A 141 -11.324 -13.533 13.620 1.00 0.00 C ATOM 562 CG GLU A 141 -12.801 -13.472 13.970 1.00 0.00 C ATOM 563 CD GLU A 141 -13.050 -13.533 15.465 1.00 0.00 C ATOM 564 OE1 GLU A 141 -12.438 -14.392 16.134 1.00 0.00 O ATOM 565 OE2 GLU A 141 -13.857 -12.722 15.965 1.00 0.00 O ATOM 0 H GLU A 141 -8.749 -14.774 13.022 1.00 0.00 H new ATOM 0 HA GLU A 141 -11.342 -15.629 14.091 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -10.752 -13.046 14.410 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -11.152 -12.965 12.705 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -13.227 -12.551 13.572 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -13.320 -14.299 13.485 1.00 0.00 H new ATOM 572 N VAL A 142 -12.215 -15.926 11.716 1.00 0.00 N ATOM 573 CA VAL A 142 -12.559 -16.392 10.378 1.00 0.00 C ATOM 574 C VAL A 142 -13.948 -15.915 9.970 1.00 0.00 C ATOM 575 O VAL A 142 -14.959 -16.472 10.398 1.00 0.00 O ATOM 576 CB VAL A 142 -12.509 -17.929 10.289 1.00 0.00 C ATOM 577 CG1 VAL A 142 -12.856 -18.394 8.882 1.00 0.00 C ATOM 578 CG2 VAL A 142 -11.140 -18.442 10.707 1.00 0.00 C ATOM 0 H VAL A 142 -12.959 -16.037 12.405 1.00 0.00 H new ATOM 0 HA VAL A 142 -11.819 -15.972 9.697 1.00 0.00 H new ATOM 0 HB VAL A 142 -13.250 -18.340 10.974 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -12.816 -19.482 8.838 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -13.860 -18.058 8.625 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -12.141 -17.976 8.174 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -11.122 -19.530 10.638 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -10.378 -18.024 10.049 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -10.936 -18.140 11.734 1.00 0.00 H new ATOM 588 N VAL A 143 -13.992 -14.879 9.138 1.00 0.00 N ATOM 589 CA VAL A 143 -15.257 -14.327 8.670 1.00 0.00 C ATOM 590 C VAL A 143 -15.738 -15.043 7.413 1.00 0.00 C ATOM 591 O VAL A 143 -14.937 -15.430 6.562 1.00 0.00 O ATOM 592 CB VAL A 143 -15.138 -12.820 8.375 1.00 0.00 C ATOM 593 CG1 VAL A 143 -16.460 -12.269 7.863 1.00 0.00 C ATOM 594 CG2 VAL A 143 -14.683 -12.069 9.617 1.00 0.00 C ATOM 0 H VAL A 143 -13.165 -14.405 8.774 1.00 0.00 H new ATOM 0 HA VAL A 143 -15.982 -14.477 9.470 1.00 0.00 H new ATOM 0 HB VAL A 143 -14.388 -12.678 7.597 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -16.356 -11.203 7.660 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -16.739 -12.787 6.946 1.00 0.00 H new ATOM 0 HG13 VAL A 143 -17.234 -12.421 8.616 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -14.604 -11.006 9.391 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -15.408 -12.217 10.418 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -13.710 -12.446 9.934 1.00 0.00 H new ATOM 604 N MET A 144 -17.051 -15.216 7.302 1.00 0.00 N ATOM 605 CA MET A 144 -17.639 -15.884 6.147 1.00 0.00 C ATOM 606 C MET A 144 -18.984 -15.263 5.786 1.00 0.00 C ATOM 607 O MET A 144 -19.839 -15.066 6.650 1.00 0.00 O ATOM 608 CB MET A 144 -17.813 -17.378 6.429 1.00 0.00 C ATOM 609 CG MET A 144 -16.542 -18.187 6.225 1.00 0.00 C ATOM 610 SD MET A 144 -16.843 -19.965 6.227 1.00 0.00 S ATOM 611 CE MET A 144 -16.174 -20.423 4.630 1.00 0.00 C ATOM 0 H MET A 144 -17.728 -14.903 7.998 1.00 0.00 H new ATOM 0 HA MET A 144 -16.962 -15.757 5.302 1.00 0.00 H new ATOM 0 HB2 MET A 144 -18.156 -17.508 7.455 1.00 0.00 H new ATOM 0 HB3 MET A 144 -18.594 -17.773 5.779 1.00 0.00 H new ATOM 0 HG2 MET A 144 -16.082 -17.901 5.279 1.00 0.00 H new ATOM 0 HG3 MET A 144 -15.830 -17.942 7.013 1.00 0.00 H new ATOM 0 HE1 MET A 144 -16.977 -20.790 3.991 1.00 0.00 H new ATOM 0 HE2 MET A 144 -15.710 -19.552 4.166 1.00 0.00 H new ATOM 0 HE3 MET A 144 -15.427 -21.206 4.759 1.00 0.00 H new ATOM 621 N ILE A 145 -19.165 -14.957 4.506 1.00 0.00 N ATOM 622 CA ILE A 145 -20.407 -14.359 4.032 1.00 0.00 C ATOM 623 C ILE A 145 -21.352 -15.421 3.479 1.00 0.00 C ATOM 624 O ILE A 145 -20.952 -16.268 2.681 1.00 0.00 O ATOM 625 CB ILE A 145 -20.144 -13.304 2.941 1.00 0.00 C ATOM 626 CG1 ILE A 145 -19.311 -12.152 3.506 1.00 0.00 C ATOM 627 CG2 ILE A 145 -21.458 -12.788 2.375 1.00 0.00 C ATOM 628 CD1 ILE A 145 -18.659 -11.299 2.441 1.00 0.00 C ATOM 0 H ILE A 145 -18.467 -15.113 3.778 1.00 0.00 H new ATOM 0 HA ILE A 145 -20.871 -13.874 4.891 1.00 0.00 H new ATOM 0 HB ILE A 145 -19.582 -13.771 2.132 1.00 0.00 H new ATOM 0 HG12 ILE A 145 -19.950 -11.521 4.124 1.00 0.00 H new ATOM 0 HG13 ILE A 145 -18.538 -12.559 4.158 1.00 0.00 H new ATOM 0 HG21 ILE A 145 -21.255 -12.043 1.605 1.00 0.00 H new ATOM 0 HG22 ILE A 145 -22.017 -13.616 1.940 1.00 0.00 H new ATOM 0 HG23 ILE A 145 -22.045 -12.334 3.173 1.00 0.00 H new ATOM 0 HD11 ILE A 145 -18.085 -10.502 2.914 1.00 0.00 H new ATOM 0 HD12 ILE A 145 -17.994 -11.916 1.837 1.00 0.00 H new ATOM 0 HD13 ILE A 145 -19.428 -10.863 1.803 1.00 0.00 H new ATOM 640 N TYR A 146 -22.609 -15.367 3.907 1.00 0.00 N ATOM 641 CA TYR A 146 -23.612 -16.324 3.456 1.00 0.00 C ATOM 642 C TYR A 146 -25.010 -15.893 3.888 1.00 0.00 C ATOM 643 O TYR A 146 -25.166 -15.033 4.755 1.00 0.00 O ATOM 644 CB TYR A 146 -23.302 -17.717 4.007 1.00 0.00 C ATOM 645 CG TYR A 146 -22.825 -17.708 5.441 1.00 0.00 C ATOM 646 CD1 TYR A 146 -23.558 -17.067 6.433 1.00 0.00 C ATOM 647 CD2 TYR A 146 -21.642 -18.340 5.805 1.00 0.00 C ATOM 648 CE1 TYR A 146 -23.126 -17.056 7.746 1.00 0.00 C ATOM 649 CE2 TYR A 146 -21.204 -18.335 7.115 1.00 0.00 C ATOM 650 CZ TYR A 146 -21.949 -17.692 8.081 1.00 0.00 C ATOM 651 OH TYR A 146 -21.514 -17.683 9.387 1.00 0.00 O ATOM 0 H TYR A 146 -22.957 -14.670 4.566 1.00 0.00 H new ATOM 0 HA TYR A 146 -23.582 -16.356 2.367 1.00 0.00 H new ATOM 0 HB2 TYR A 146 -24.197 -18.335 3.934 1.00 0.00 H new ATOM 0 HB3 TYR A 146 -22.541 -18.184 3.383 1.00 0.00 H new ATOM 0 HD1 TYR A 146 -24.481 -16.569 6.173 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -21.055 -18.844 5.051 1.00 0.00 H new ATOM 0 HE1 TYR A 146 -23.707 -16.552 8.505 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -20.283 -18.832 7.381 1.00 0.00 H new ATOM 0 HH TYR A 146 -20.670 -18.176 9.454 1.00 0.00 H new ATOM 661 N ASP A 147 -26.023 -16.497 3.277 1.00 0.00 N ATOM 662 CA ASP A 147 -27.409 -16.178 3.599 1.00 0.00 C ATOM 663 C ASP A 147 -27.895 -17.003 4.786 1.00 0.00 C ATOM 664 O ASP A 147 -28.042 -18.221 4.690 1.00 0.00 O ATOM 665 CB ASP A 147 -28.307 -16.428 2.386 1.00 0.00 C ATOM 666 CG ASP A 147 -29.744 -16.013 2.634 1.00 0.00 C ATOM 667 OD1 ASP A 147 -30.181 -16.056 3.804 1.00 0.00 O ATOM 668 OD2 ASP A 147 -30.431 -15.644 1.659 1.00 0.00 O ATOM 0 H ASP A 147 -25.911 -17.210 2.556 1.00 0.00 H new ATOM 0 HA ASP A 147 -27.460 -15.123 3.868 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -27.916 -15.879 1.529 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -28.277 -17.486 2.127 1.00 0.00 H new ATOM 673 N ALA A 148 -28.142 -16.331 5.906 1.00 0.00 N ATOM 674 CA ALA A 148 -28.612 -17.002 7.112 1.00 0.00 C ATOM 675 C ALA A 148 -29.515 -18.182 6.767 1.00 0.00 C ATOM 676 O ALA A 148 -29.212 -19.326 7.104 1.00 0.00 O ATOM 677 CB ALA A 148 -29.346 -16.019 8.011 1.00 0.00 C ATOM 0 H ALA A 148 -28.024 -15.322 6.003 1.00 0.00 H new ATOM 0 HA ALA A 148 -27.743 -17.387 7.646 1.00 0.00 H new ATOM 0 HB1 ALA A 148 -29.691 -16.534 8.908 1.00 0.00 H new ATOM 0 HB2 ALA A 148 -28.671 -15.211 8.294 1.00 0.00 H new ATOM 0 HB3 ALA A 148 -30.202 -15.607 7.477 1.00 0.00 H new ATOM 683 N GLU A 149 -30.626 -17.895 6.095 1.00 0.00 N ATOM 684 CA GLU A 149 -31.573 -18.933 5.707 1.00 0.00 C ATOM 685 C GLU A 149 -30.845 -20.221 5.331 1.00 0.00 C ATOM 686 O GLU A 149 -31.233 -21.312 5.748 1.00 0.00 O ATOM 687 CB GLU A 149 -32.431 -18.458 4.532 1.00 0.00 C ATOM 688 CG GLU A 149 -33.760 -19.186 4.417 1.00 0.00 C ATOM 689 CD GLU A 149 -33.595 -20.689 4.305 1.00 0.00 C ATOM 690 OE1 GLU A 149 -33.326 -21.174 3.186 1.00 0.00 O ATOM 691 OE2 GLU A 149 -33.734 -21.380 5.336 1.00 0.00 O ATOM 0 H GLU A 149 -30.892 -16.953 5.808 1.00 0.00 H new ATOM 0 HA GLU A 149 -32.219 -19.137 6.561 1.00 0.00 H new ATOM 0 HB2 GLU A 149 -32.619 -17.390 4.639 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -31.871 -18.592 3.606 1.00 0.00 H new ATOM 0 HG2 GLU A 149 -34.373 -18.956 5.289 1.00 0.00 H new ATOM 0 HG3 GLU A 149 -34.297 -18.817 3.543 1.00 0.00 H new ATOM 698 N LYS A 150 -29.787 -20.085 4.539 1.00 0.00 N ATOM 699 CA LYS A 150 -29.003 -21.236 4.106 1.00 0.00 C ATOM 700 C LYS A 150 -28.010 -21.655 5.185 1.00 0.00 C ATOM 701 O LYS A 150 -27.795 -22.845 5.413 1.00 0.00 O ATOM 702 CB LYS A 150 -28.256 -20.911 2.810 1.00 0.00 C ATOM 703 CG LYS A 150 -29.144 -20.918 1.578 1.00 0.00 C ATOM 704 CD LYS A 150 -29.215 -22.299 0.949 1.00 0.00 C ATOM 705 CE LYS A 150 -28.094 -22.512 -0.056 1.00 0.00 C ATOM 706 NZ LYS A 150 -26.783 -22.737 0.614 1.00 0.00 N ATOM 0 H LYS A 150 -29.453 -19.189 4.184 1.00 0.00 H new ATOM 0 HA LYS A 150 -29.688 -22.064 3.926 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -27.789 -19.931 2.906 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -27.452 -21.634 2.672 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -30.147 -20.589 1.850 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -28.761 -20.204 0.849 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -29.155 -23.058 1.729 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -30.178 -22.425 0.454 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -28.331 -23.368 -0.688 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -28.023 -21.643 -0.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -26.153 -23.263 -0.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -26.352 -21.820 0.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -26.928 -23.285 1.486 1.00 0.00 H new ATOM 720 N GLN A 151 -27.411 -20.671 5.847 1.00 0.00 N ATOM 721 CA GLN A 151 -26.443 -20.939 6.903 1.00 0.00 C ATOM 722 C GLN A 151 -25.260 -21.739 6.367 1.00 0.00 C ATOM 723 O GLN A 151 -24.924 -22.799 6.896 1.00 0.00 O ATOM 724 CB GLN A 151 -27.108 -21.699 8.053 1.00 0.00 C ATOM 725 CG GLN A 151 -27.699 -20.792 9.120 1.00 0.00 C ATOM 726 CD GLN A 151 -27.685 -21.425 10.497 1.00 0.00 C ATOM 727 OE1 GLN A 151 -27.910 -22.627 10.643 1.00 0.00 O ATOM 728 NE2 GLN A 151 -27.421 -20.617 11.517 1.00 0.00 N ATOM 0 H GLN A 151 -27.579 -19.681 5.671 1.00 0.00 H new ATOM 0 HA GLN A 151 -26.074 -19.983 7.274 1.00 0.00 H new ATOM 0 HB2 GLN A 151 -27.897 -22.334 7.650 1.00 0.00 H new ATOM 0 HB3 GLN A 151 -26.373 -22.358 8.515 1.00 0.00 H new ATOM 0 HG2 GLN A 151 -27.139 -19.858 9.148 1.00 0.00 H new ATOM 0 HG3 GLN A 151 -28.725 -20.541 8.850 1.00 0.00 H new ATOM 0 HE21 GLN A 151 -27.240 -19.627 11.350 1.00 0.00 H new ATOM 0 HE22 GLN A 151 -27.399 -20.986 12.468 1.00 0.00 H new ATOM 737 N ARG A 152 -24.633 -21.225 5.314 1.00 0.00 N ATOM 738 CA ARG A 152 -23.489 -21.892 4.705 1.00 0.00 C ATOM 739 C ARG A 152 -22.743 -20.946 3.769 1.00 0.00 C ATOM 740 O ARG A 152 -23.342 -20.178 3.016 1.00 0.00 O ATOM 741 CB ARG A 152 -23.945 -23.133 3.935 1.00 0.00 C ATOM 742 CG ARG A 152 -23.073 -23.460 2.735 1.00 0.00 C ATOM 743 CD ARG A 152 -23.113 -24.944 2.404 1.00 0.00 C ATOM 744 NE ARG A 152 -22.266 -25.727 3.300 1.00 0.00 N ATOM 745 CZ ARG A 152 -21.968 -27.006 3.098 1.00 0.00 C ATOM 746 NH1 ARG A 152 -22.444 -27.641 2.037 1.00 0.00 N ATOM 747 NH2 ARG A 152 -21.191 -27.651 3.959 1.00 0.00 N ATOM 0 H ARG A 152 -24.898 -20.348 4.865 1.00 0.00 H new ATOM 0 HA ARG A 152 -22.811 -22.196 5.503 1.00 0.00 H new ATOM 0 HB2 ARG A 152 -23.952 -23.988 4.612 1.00 0.00 H new ATOM 0 HB3 ARG A 152 -24.971 -22.984 3.598 1.00 0.00 H new ATOM 0 HG2 ARG A 152 -23.409 -22.885 1.872 1.00 0.00 H new ATOM 0 HG3 ARG A 152 -22.045 -23.159 2.938 1.00 0.00 H new ATOM 0 HD2 ARG A 152 -24.140 -25.303 2.470 1.00 0.00 H new ATOM 0 HD3 ARG A 152 -22.789 -25.095 1.374 1.00 0.00 H new ATOM 0 HE ARG A 152 -21.882 -25.267 4.126 1.00 0.00 H new ATOM 0 HH11 ARG A 152 -23.041 -27.148 1.373 1.00 0.00 H new ATOM 0 HH12 ARG A 152 -22.214 -28.623 1.884 1.00 0.00 H new ATOM 0 HH21 ARG A 152 -20.822 -27.165 4.776 1.00 0.00 H new ATOM 0 HH22 ARG A 152 -20.963 -28.633 3.803 1.00 0.00 H new ATOM 761 N PRO A 153 -21.403 -21.000 3.816 1.00 0.00 N ATOM 762 CA PRO A 153 -20.546 -20.155 2.980 1.00 0.00 C ATOM 763 C PRO A 153 -20.608 -20.546 1.507 1.00 0.00 C ATOM 764 O PRO A 153 -20.181 -21.636 1.126 1.00 0.00 O ATOM 765 CB PRO A 153 -19.145 -20.405 3.541 1.00 0.00 C ATOM 766 CG PRO A 153 -19.221 -21.757 4.162 1.00 0.00 C ATOM 767 CD PRO A 153 -20.622 -21.892 4.690 1.00 0.00 C ATOM 0 HA PRO A 153 -20.851 -19.109 3.010 1.00 0.00 H new ATOM 0 HB2 PRO A 153 -18.392 -20.373 2.754 1.00 0.00 H new ATOM 0 HB3 PRO A 153 -18.871 -19.647 4.275 1.00 0.00 H new ATOM 0 HG2 PRO A 153 -19.003 -22.535 3.431 1.00 0.00 H new ATOM 0 HG3 PRO A 153 -18.490 -21.860 4.964 1.00 0.00 H new ATOM 0 HD2 PRO A 153 -20.976 -22.921 4.633 1.00 0.00 H new ATOM 0 HD3 PRO A 153 -20.688 -21.590 5.735 1.00 0.00 H new ATOM 775 N ARG A 154 -21.141 -19.649 0.683 1.00 0.00 N ATOM 776 CA ARG A 154 -21.258 -19.901 -0.748 1.00 0.00 C ATOM 777 C ARG A 154 -19.898 -20.232 -1.355 1.00 0.00 C ATOM 778 O ARG A 154 -19.731 -21.266 -2.000 1.00 0.00 O ATOM 779 CB ARG A 154 -21.861 -18.684 -1.453 1.00 0.00 C ATOM 780 CG ARG A 154 -23.197 -18.245 -0.877 1.00 0.00 C ATOM 781 CD ARG A 154 -23.578 -16.852 -1.353 1.00 0.00 C ATOM 782 NE ARG A 154 -25.019 -16.624 -1.278 1.00 0.00 N ATOM 783 CZ ARG A 154 -25.616 -15.538 -1.756 1.00 0.00 C ATOM 784 NH1 ARG A 154 -24.901 -14.586 -2.339 1.00 0.00 N ATOM 785 NH2 ARG A 154 -26.932 -15.403 -1.650 1.00 0.00 N ATOM 0 H ARG A 154 -21.498 -18.742 0.982 1.00 0.00 H new ATOM 0 HA ARG A 154 -21.917 -20.758 -0.888 1.00 0.00 H new ATOM 0 HB2 ARG A 154 -21.158 -17.854 -1.391 1.00 0.00 H new ATOM 0 HB3 ARG A 154 -21.989 -18.914 -2.511 1.00 0.00 H new ATOM 0 HG2 ARG A 154 -23.971 -18.955 -1.169 1.00 0.00 H new ATOM 0 HG3 ARG A 154 -23.147 -18.258 0.212 1.00 0.00 H new ATOM 0 HD2 ARG A 154 -23.061 -16.108 -0.747 1.00 0.00 H new ATOM 0 HD3 ARG A 154 -23.242 -16.715 -2.381 1.00 0.00 H new ATOM 0 HE ARG A 154 -25.598 -17.337 -0.835 1.00 0.00 H new ATOM 0 HH11 ARG A 154 -23.889 -14.686 -2.422 1.00 0.00 H new ATOM 0 HH12 ARG A 154 -25.363 -13.753 -2.705 1.00 0.00 H new ATOM 0 HH21 ARG A 154 -27.485 -16.133 -1.201 1.00 0.00 H new ATOM 0 HH22 ARG A 154 -27.390 -14.569 -2.017 1.00 0.00 H new ATOM 799 N GLY A 155 -18.929 -19.347 -1.143 1.00 0.00 N ATOM 800 CA GLY A 155 -17.597 -19.563 -1.676 1.00 0.00 C ATOM 801 C GLY A 155 -16.741 -18.314 -1.623 1.00 0.00 C ATOM 802 O GLY A 155 -15.989 -18.027 -2.554 1.00 0.00 O ATOM 0 H GLY A 155 -19.043 -18.484 -0.611 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -17.109 -20.358 -1.113 1.00 0.00 H new ATOM 0 HA3 GLY A 155 -17.673 -19.904 -2.709 1.00 0.00 H new ATOM 806 N PHE A 156 -16.856 -17.566 -0.530 1.00 0.00 N ATOM 807 CA PHE A 156 -16.088 -16.338 -0.359 1.00 0.00 C ATOM 808 C PHE A 156 -16.205 -15.817 1.070 1.00 0.00 C ATOM 809 O PHE A 156 -17.058 -16.263 1.837 1.00 0.00 O ATOM 810 CB PHE A 156 -16.568 -15.270 -1.344 1.00 0.00 C ATOM 811 CG PHE A 156 -18.050 -15.029 -1.292 1.00 0.00 C ATOM 812 CD1 PHE A 156 -18.915 -15.781 -2.070 1.00 0.00 C ATOM 813 CD2 PHE A 156 -18.577 -14.052 -0.464 1.00 0.00 C ATOM 814 CE1 PHE A 156 -20.279 -15.561 -2.024 1.00 0.00 C ATOM 815 CE2 PHE A 156 -19.940 -13.827 -0.413 1.00 0.00 C ATOM 816 CZ PHE A 156 -20.792 -14.584 -1.194 1.00 0.00 C ATOM 0 H PHE A 156 -17.474 -17.789 0.250 1.00 0.00 H new ATOM 0 HA PHE A 156 -15.041 -16.564 -0.560 1.00 0.00 H new ATOM 0 HB2 PHE A 156 -16.048 -14.335 -1.135 1.00 0.00 H new ATOM 0 HB3 PHE A 156 -16.292 -15.569 -2.355 1.00 0.00 H new ATOM 0 HD1 PHE A 156 -18.519 -16.548 -2.720 1.00 0.00 H new ATOM 0 HD2 PHE A 156 -17.915 -13.459 0.149 1.00 0.00 H new ATOM 0 HE1 PHE A 156 -20.943 -16.153 -2.637 1.00 0.00 H new ATOM 0 HE2 PHE A 156 -20.338 -13.061 0.236 1.00 0.00 H new ATOM 0 HZ PHE A 156 -21.857 -14.412 -1.155 1.00 0.00 H new ATOM 826 N GLY A 157 -15.340 -14.871 1.422 1.00 0.00 N ATOM 827 CA GLY A 157 -15.362 -14.305 2.758 1.00 0.00 C ATOM 828 C GLY A 157 -14.041 -13.668 3.140 1.00 0.00 C ATOM 829 O GLY A 157 -13.253 -13.288 2.274 1.00 0.00 O ATOM 0 H GLY A 157 -14.624 -14.486 0.806 1.00 0.00 H new ATOM 0 HA2 GLY A 157 -16.153 -13.558 2.820 1.00 0.00 H new ATOM 0 HA3 GLY A 157 -15.606 -15.087 3.477 1.00 0.00 H new ATOM 833 N PHE A 158 -13.797 -13.549 4.441 1.00 0.00 N ATOM 834 CA PHE A 158 -12.563 -12.951 4.936 1.00 0.00 C ATOM 835 C PHE A 158 -12.002 -13.752 6.108 1.00 0.00 C ATOM 836 O PHE A 158 -12.690 -14.596 6.683 1.00 0.00 O ATOM 837 CB PHE A 158 -12.809 -11.503 5.365 1.00 0.00 C ATOM 838 CG PHE A 158 -13.477 -10.670 4.309 1.00 0.00 C ATOM 839 CD1 PHE A 158 -14.846 -10.749 4.109 1.00 0.00 C ATOM 840 CD2 PHE A 158 -12.736 -9.808 3.516 1.00 0.00 C ATOM 841 CE1 PHE A 158 -15.463 -9.985 3.137 1.00 0.00 C ATOM 842 CE2 PHE A 158 -13.348 -9.041 2.543 1.00 0.00 C ATOM 843 CZ PHE A 158 -14.713 -9.128 2.354 1.00 0.00 C ATOM 0 H PHE A 158 -14.438 -13.859 5.171 1.00 0.00 H new ATOM 0 HA PHE A 158 -11.833 -12.964 4.127 1.00 0.00 H new ATOM 0 HB2 PHE A 158 -13.426 -11.499 6.264 1.00 0.00 H new ATOM 0 HB3 PHE A 158 -11.856 -11.044 5.630 1.00 0.00 H new ATOM 0 HD1 PHE A 158 -15.437 -11.415 4.720 1.00 0.00 H new ATOM 0 HD2 PHE A 158 -11.668 -9.735 3.660 1.00 0.00 H new ATOM 0 HE1 PHE A 158 -16.530 -10.057 2.989 1.00 0.00 H new ATOM 0 HE2 PHE A 158 -12.759 -8.374 1.931 1.00 0.00 H new ATOM 0 HZ PHE A 158 -15.194 -8.528 1.596 1.00 0.00 H new ATOM 853 N ILE A 159 -10.748 -13.483 6.454 1.00 0.00 N ATOM 854 CA ILE A 159 -10.094 -14.177 7.557 1.00 0.00 C ATOM 855 C ILE A 159 -9.068 -13.281 8.240 1.00 0.00 C ATOM 856 O ILE A 159 -8.267 -12.618 7.579 1.00 0.00 O ATOM 857 CB ILE A 159 -9.397 -15.464 7.077 1.00 0.00 C ATOM 858 CG1 ILE A 159 -10.395 -16.373 6.357 1.00 0.00 C ATOM 859 CG2 ILE A 159 -8.762 -16.192 8.252 1.00 0.00 C ATOM 860 CD1 ILE A 159 -9.869 -17.769 6.105 1.00 0.00 C ATOM 0 H ILE A 159 -10.164 -12.789 5.987 1.00 0.00 H new ATOM 0 HA ILE A 159 -10.874 -14.440 8.271 1.00 0.00 H new ATOM 0 HB ILE A 159 -8.609 -15.192 6.374 1.00 0.00 H new ATOM 0 HG12 ILE A 159 -11.307 -16.439 6.950 1.00 0.00 H new ATOM 0 HG13 ILE A 159 -10.666 -15.918 5.404 1.00 0.00 H new ATOM 0 HG21 ILE A 159 -8.273 -17.099 7.897 1.00 0.00 H new ATOM 0 HG22 ILE A 159 -8.024 -15.544 8.726 1.00 0.00 H new ATOM 0 HG23 ILE A 159 -9.533 -16.455 8.977 1.00 0.00 H new ATOM 0 HD11 ILE A 159 -10.630 -18.357 5.592 1.00 0.00 H new ATOM 0 HD12 ILE A 159 -8.973 -17.714 5.486 1.00 0.00 H new ATOM 0 HD13 ILE A 159 -9.624 -18.243 7.056 1.00 0.00 H new ATOM 872 N THR A 160 -9.095 -13.265 9.569 1.00 0.00 N ATOM 873 CA THR A 160 -8.167 -12.450 10.343 1.00 0.00 C ATOM 874 C THR A 160 -7.028 -13.296 10.903 1.00 0.00 C ATOM 875 O THR A 160 -7.223 -14.456 11.264 1.00 0.00 O ATOM 876 CB THR A 160 -8.881 -11.737 11.507 1.00 0.00 C ATOM 877 OG1 THR A 160 -9.947 -10.925 11.003 1.00 0.00 O ATOM 878 CG2 THR A 160 -7.906 -10.873 12.292 1.00 0.00 C ATOM 0 H THR A 160 -9.750 -13.808 10.132 1.00 0.00 H new ATOM 0 HA THR A 160 -7.761 -11.702 9.663 1.00 0.00 H new ATOM 0 HB THR A 160 -9.288 -12.496 12.175 1.00 0.00 H new ATOM 0 HG1 THR A 160 -10.397 -10.476 11.749 1.00 0.00 H new ATOM 0 HG21 THR A 160 -8.433 -10.380 13.109 1.00 0.00 H new ATOM 0 HG22 THR A 160 -7.111 -11.499 12.699 1.00 0.00 H new ATOM 0 HG23 THR A 160 -7.474 -10.121 11.632 1.00 0.00 H new ATOM 886 N PHE A 161 -5.839 -12.707 10.972 1.00 0.00 N ATOM 887 CA PHE A 161 -4.668 -13.407 11.487 1.00 0.00 C ATOM 888 C PHE A 161 -4.179 -12.767 12.783 1.00 0.00 C ATOM 889 O PHE A 161 -4.781 -11.818 13.284 1.00 0.00 O ATOM 890 CB PHE A 161 -3.546 -13.401 10.447 1.00 0.00 C ATOM 891 CG PHE A 161 -3.784 -14.345 9.303 1.00 0.00 C ATOM 892 CD1 PHE A 161 -4.652 -14.007 8.278 1.00 0.00 C ATOM 893 CD2 PHE A 161 -3.139 -15.570 9.253 1.00 0.00 C ATOM 894 CE1 PHE A 161 -4.874 -14.873 7.225 1.00 0.00 C ATOM 895 CE2 PHE A 161 -3.356 -16.441 8.202 1.00 0.00 C ATOM 896 CZ PHE A 161 -4.224 -16.092 7.186 1.00 0.00 C ATOM 0 H PHE A 161 -5.661 -11.747 10.678 1.00 0.00 H new ATOM 0 HA PHE A 161 -4.954 -14.438 11.696 1.00 0.00 H new ATOM 0 HB2 PHE A 161 -3.430 -12.390 10.056 1.00 0.00 H new ATOM 0 HB3 PHE A 161 -2.608 -13.664 10.935 1.00 0.00 H new ATOM 0 HD1 PHE A 161 -5.161 -13.055 8.302 1.00 0.00 H new ATOM 0 HD2 PHE A 161 -2.459 -15.848 10.044 1.00 0.00 H new ATOM 0 HE1 PHE A 161 -5.555 -14.598 6.433 1.00 0.00 H new ATOM 0 HE2 PHE A 161 -2.847 -17.393 8.175 1.00 0.00 H new ATOM 0 HZ PHE A 161 -4.394 -16.770 6.363 1.00 0.00 H new ATOM 906 N GLU A 162 -3.084 -13.295 13.320 1.00 0.00 N ATOM 907 CA GLU A 162 -2.515 -12.777 14.559 1.00 0.00 C ATOM 908 C GLU A 162 -1.556 -11.624 14.276 1.00 0.00 C ATOM 909 O GLU A 162 -1.553 -10.617 14.984 1.00 0.00 O ATOM 910 CB GLU A 162 -1.784 -13.889 15.315 1.00 0.00 C ATOM 911 CG GLU A 162 -1.354 -13.490 16.717 1.00 0.00 C ATOM 912 CD GLU A 162 -0.572 -14.582 17.420 1.00 0.00 C ATOM 913 OE1 GLU A 162 -1.160 -15.648 17.700 1.00 0.00 O ATOM 914 OE2 GLU A 162 0.629 -14.371 17.689 1.00 0.00 O ATOM 0 H GLU A 162 -2.573 -14.081 12.917 1.00 0.00 H new ATOM 0 HA GLU A 162 -3.332 -12.405 15.177 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -2.434 -14.762 15.378 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -0.904 -14.187 14.745 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -0.744 -12.588 16.663 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -2.236 -13.243 17.307 1.00 0.00 H new ATOM 921 N ASP A 163 -0.742 -11.780 13.238 1.00 0.00 N ATOM 922 CA ASP A 163 0.222 -10.753 12.860 1.00 0.00 C ATOM 923 C ASP A 163 0.044 -10.352 11.399 1.00 0.00 C ATOM 924 O ASP A 163 0.010 -11.204 10.512 1.00 0.00 O ATOM 925 CB ASP A 163 1.648 -11.252 13.095 1.00 0.00 C ATOM 926 CG ASP A 163 2.074 -11.127 14.544 1.00 0.00 C ATOM 927 OD1 ASP A 163 1.415 -11.739 15.411 1.00 0.00 O ATOM 928 OD2 ASP A 163 3.066 -10.416 14.813 1.00 0.00 O ATOM 0 H ASP A 163 -0.730 -12.608 12.643 1.00 0.00 H new ATOM 0 HA ASP A 163 0.045 -9.876 13.482 1.00 0.00 H new ATOM 0 HB2 ASP A 163 1.720 -12.295 12.787 1.00 0.00 H new ATOM 0 HB3 ASP A 163 2.336 -10.686 12.467 1.00 0.00 H new ATOM 933 N GLU A 164 -0.071 -9.050 11.158 1.00 0.00 N ATOM 934 CA GLU A 164 -0.247 -8.537 9.804 1.00 0.00 C ATOM 935 C GLU A 164 0.556 -9.360 8.801 1.00 0.00 C ATOM 936 O GLU A 164 0.105 -9.605 7.683 1.00 0.00 O ATOM 937 CB GLU A 164 0.178 -7.068 9.732 1.00 0.00 C ATOM 938 CG GLU A 164 -0.348 -6.342 8.505 1.00 0.00 C ATOM 939 CD GLU A 164 0.333 -6.790 7.226 1.00 0.00 C ATOM 940 OE1 GLU A 164 1.568 -6.976 7.244 1.00 0.00 O ATOM 941 OE2 GLU A 164 -0.369 -6.954 6.207 1.00 0.00 O ATOM 0 H GLU A 164 -0.046 -8.332 11.882 1.00 0.00 H new ATOM 0 HA GLU A 164 -1.304 -8.615 9.548 1.00 0.00 H new ATOM 0 HB2 GLU A 164 -0.172 -6.553 10.627 1.00 0.00 H new ATOM 0 HB3 GLU A 164 1.267 -7.013 9.738 1.00 0.00 H new ATOM 0 HG2 GLU A 164 -1.421 -6.511 8.419 1.00 0.00 H new ATOM 0 HG3 GLU A 164 -0.204 -5.269 8.633 1.00 0.00 H new ATOM 948 N GLN A 165 1.747 -9.782 9.211 1.00 0.00 N ATOM 949 CA GLN A 165 2.614 -10.577 8.348 1.00 0.00 C ATOM 950 C GLN A 165 1.811 -11.633 7.595 1.00 0.00 C ATOM 951 O GLN A 165 1.779 -11.642 6.365 1.00 0.00 O ATOM 952 CB GLN A 165 3.714 -11.247 9.172 1.00 0.00 C ATOM 953 CG GLN A 165 4.943 -10.374 9.369 1.00 0.00 C ATOM 954 CD GLN A 165 6.173 -11.174 9.752 1.00 0.00 C ATOM 955 OE1 GLN A 165 6.548 -11.236 10.923 1.00 0.00 O ATOM 956 NE2 GLN A 165 6.807 -11.793 8.763 1.00 0.00 N ATOM 0 H GLN A 165 2.134 -9.587 10.134 1.00 0.00 H new ATOM 0 HA GLN A 165 3.073 -9.908 7.620 1.00 0.00 H new ATOM 0 HB2 GLN A 165 3.311 -11.519 10.148 1.00 0.00 H new ATOM 0 HB3 GLN A 165 4.011 -12.173 8.681 1.00 0.00 H new ATOM 0 HG2 GLN A 165 5.144 -9.824 8.450 1.00 0.00 H new ATOM 0 HG3 GLN A 165 4.739 -9.636 10.144 1.00 0.00 H new ATOM 0 HE21 GLN A 165 6.461 -11.714 7.807 1.00 0.00 H new ATOM 0 HE22 GLN A 165 7.640 -12.347 8.959 1.00 0.00 H new ATOM 965 N SER A 166 1.166 -12.523 8.343 1.00 0.00 N ATOM 966 CA SER A 166 0.367 -13.587 7.746 1.00 0.00 C ATOM 967 C SER A 166 -0.349 -13.091 6.493 1.00 0.00 C ATOM 968 O SER A 166 -0.237 -13.689 5.423 1.00 0.00 O ATOM 969 CB SER A 166 -0.655 -14.114 8.756 1.00 0.00 C ATOM 970 OG SER A 166 -0.118 -14.122 10.068 1.00 0.00 O ATOM 0 H SER A 166 1.181 -12.528 9.363 1.00 0.00 H new ATOM 0 HA SER A 166 1.039 -14.397 7.463 1.00 0.00 H new ATOM 0 HB2 SER A 166 -1.550 -13.493 8.730 1.00 0.00 H new ATOM 0 HB3 SER A 166 -0.959 -15.123 8.478 1.00 0.00 H new ATOM 0 HG SER A 166 -0.637 -14.735 10.630 1.00 0.00 H new ATOM 976 N VAL A 167 -1.085 -11.993 6.635 1.00 0.00 N ATOM 977 CA VAL A 167 -1.818 -11.415 5.515 1.00 0.00 C ATOM 978 C VAL A 167 -0.951 -11.356 4.262 1.00 0.00 C ATOM 979 O VAL A 167 -1.296 -11.928 3.228 1.00 0.00 O ATOM 980 CB VAL A 167 -2.321 -9.998 5.846 1.00 0.00 C ATOM 981 CG1 VAL A 167 -2.945 -9.352 4.618 1.00 0.00 C ATOM 982 CG2 VAL A 167 -3.314 -10.041 6.998 1.00 0.00 C ATOM 0 H VAL A 167 -1.189 -11.486 7.514 1.00 0.00 H new ATOM 0 HA VAL A 167 -2.675 -12.062 5.329 1.00 0.00 H new ATOM 0 HB VAL A 167 -1.469 -9.391 6.153 1.00 0.00 H new ATOM 0 HG11 VAL A 167 -3.295 -8.351 4.871 1.00 0.00 H new ATOM 0 HG12 VAL A 167 -2.201 -9.286 3.824 1.00 0.00 H new ATOM 0 HG13 VAL A 167 -3.787 -9.955 4.278 1.00 0.00 H new ATOM 0 HG21 VAL A 167 -3.659 -9.031 7.219 1.00 0.00 H new ATOM 0 HG22 VAL A 167 -4.165 -10.663 6.722 1.00 0.00 H new ATOM 0 HG23 VAL A 167 -2.830 -10.460 7.880 1.00 0.00 H new ATOM 992 N ASP A 168 0.176 -10.659 4.362 1.00 0.00 N ATOM 993 CA ASP A 168 1.094 -10.525 3.237 1.00 0.00 C ATOM 994 C ASP A 168 1.410 -11.888 2.629 1.00 0.00 C ATOM 995 O ASP A 168 1.230 -12.100 1.430 1.00 0.00 O ATOM 996 CB ASP A 168 2.386 -9.840 3.685 1.00 0.00 C ATOM 997 CG ASP A 168 3.517 -10.035 2.695 1.00 0.00 C ATOM 998 OD1 ASP A 168 3.397 -9.544 1.553 1.00 0.00 O ATOM 999 OD2 ASP A 168 4.523 -10.678 3.061 1.00 0.00 O ATOM 0 H ASP A 168 0.475 -10.178 5.210 1.00 0.00 H new ATOM 0 HA ASP A 168 0.612 -9.911 2.476 1.00 0.00 H new ATOM 0 HB2 ASP A 168 2.202 -8.774 3.817 1.00 0.00 H new ATOM 0 HB3 ASP A 168 2.685 -10.234 4.656 1.00 0.00 H new ATOM 1004 N GLN A 169 1.884 -12.808 3.464 1.00 0.00 N ATOM 1005 CA GLN A 169 2.227 -14.149 3.007 1.00 0.00 C ATOM 1006 C GLN A 169 1.135 -14.712 2.104 1.00 0.00 C ATOM 1007 O GLN A 169 1.410 -15.186 1.002 1.00 0.00 O ATOM 1008 CB GLN A 169 2.446 -15.077 4.203 1.00 0.00 C ATOM 1009 CG GLN A 169 3.667 -14.721 5.035 1.00 0.00 C ATOM 1010 CD GLN A 169 4.180 -15.892 5.849 1.00 0.00 C ATOM 1011 OE1 GLN A 169 4.433 -16.972 5.314 1.00 0.00 O ATOM 1012 NE2 GLN A 169 4.339 -15.684 7.151 1.00 0.00 N ATOM 0 H GLN A 169 2.039 -12.649 4.460 1.00 0.00 H new ATOM 0 HA GLN A 169 3.151 -14.085 2.432 1.00 0.00 H new ATOM 0 HB2 GLN A 169 1.562 -15.049 4.840 1.00 0.00 H new ATOM 0 HB3 GLN A 169 2.548 -16.101 3.844 1.00 0.00 H new ATOM 0 HG2 GLN A 169 4.460 -14.366 4.376 1.00 0.00 H new ATOM 0 HG3 GLN A 169 3.418 -13.899 5.706 1.00 0.00 H new ATOM 0 HE21 GLN A 169 4.117 -14.773 7.553 1.00 0.00 H new ATOM 0 HE22 GLN A 169 4.683 -16.435 7.749 1.00 0.00 H new ATOM 1021 N ALA A 170 -0.105 -14.658 2.579 1.00 0.00 N ATOM 1022 CA ALA A 170 -1.239 -15.162 1.813 1.00 0.00 C ATOM 1023 C ALA A 170 -1.443 -14.352 0.537 1.00 0.00 C ATOM 1024 O ALA A 170 -1.542 -14.910 -0.555 1.00 0.00 O ATOM 1025 CB ALA A 170 -2.501 -15.139 2.663 1.00 0.00 C ATOM 0 H ALA A 170 -0.350 -14.271 3.490 1.00 0.00 H new ATOM 0 HA ALA A 170 -1.025 -16.192 1.528 1.00 0.00 H new ATOM 0 HB1 ALA A 170 -3.340 -15.518 2.079 1.00 0.00 H new ATOM 0 HB2 ALA A 170 -2.359 -15.766 3.543 1.00 0.00 H new ATOM 0 HB3 ALA A 170 -2.710 -14.116 2.977 1.00 0.00 H new ATOM 1031 N VAL A 171 -1.507 -13.032 0.684 1.00 0.00 N ATOM 1032 CA VAL A 171 -1.699 -12.145 -0.457 1.00 0.00 C ATOM 1033 C VAL A 171 -0.754 -12.504 -1.598 1.00 0.00 C ATOM 1034 O VAL A 171 -1.191 -12.842 -2.697 1.00 0.00 O ATOM 1035 CB VAL A 171 -1.477 -10.672 -0.066 1.00 0.00 C ATOM 1036 CG1 VAL A 171 -1.348 -9.803 -1.308 1.00 0.00 C ATOM 1037 CG2 VAL A 171 -2.609 -10.180 0.823 1.00 0.00 C ATOM 0 H VAL A 171 -1.429 -12.554 1.582 1.00 0.00 H new ATOM 0 HA VAL A 171 -2.729 -12.274 -0.788 1.00 0.00 H new ATOM 0 HB VAL A 171 -0.546 -10.600 0.497 1.00 0.00 H new ATOM 0 HG11 VAL A 171 -1.192 -8.766 -1.012 1.00 0.00 H new ATOM 0 HG12 VAL A 171 -0.500 -10.142 -1.903 1.00 0.00 H new ATOM 0 HG13 VAL A 171 -2.260 -9.878 -1.901 1.00 0.00 H new ATOM 0 HG21 VAL A 171 -2.435 -9.137 1.089 1.00 0.00 H new ATOM 0 HG22 VAL A 171 -3.555 -10.265 0.288 1.00 0.00 H new ATOM 0 HG23 VAL A 171 -2.649 -10.784 1.729 1.00 0.00 H new ATOM 1047 N ASN A 172 0.546 -12.429 -1.329 1.00 0.00 N ATOM 1048 CA ASN A 172 1.554 -12.746 -2.334 1.00 0.00 C ATOM 1049 C ASN A 172 1.157 -13.985 -3.131 1.00 0.00 C ATOM 1050 O ASN A 172 1.140 -13.964 -4.361 1.00 0.00 O ATOM 1051 CB ASN A 172 2.914 -12.969 -1.669 1.00 0.00 C ATOM 1052 CG ASN A 172 4.058 -12.927 -2.664 1.00 0.00 C ATOM 1053 OD1 ASN A 172 3.951 -13.455 -3.771 1.00 0.00 O ATOM 1054 ND2 ASN A 172 5.160 -12.298 -2.273 1.00 0.00 N ATOM 0 H ASN A 172 0.926 -12.152 -0.424 1.00 0.00 H new ATOM 0 HA ASN A 172 1.625 -11.902 -3.020 1.00 0.00 H new ATOM 0 HB2 ASN A 172 3.072 -12.207 -0.906 1.00 0.00 H new ATOM 0 HB3 ASN A 172 2.913 -13.933 -1.161 1.00 0.00 H new ATOM 0 HD21 ASN A 172 5.963 -12.238 -2.900 1.00 0.00 H new ATOM 0 HD22 ASN A 172 5.204 -11.875 -1.346 1.00 0.00 H new ATOM 1061 N MET A 173 0.836 -15.061 -2.421 1.00 0.00 N ATOM 1062 CA MET A 173 0.437 -16.308 -3.062 1.00 0.00 C ATOM 1063 C MET A 173 -0.798 -16.100 -3.934 1.00 0.00 C ATOM 1064 O MET A 173 -0.881 -16.624 -5.045 1.00 0.00 O ATOM 1065 CB MET A 173 0.156 -17.382 -2.009 1.00 0.00 C ATOM 1066 CG MET A 173 0.045 -18.784 -2.584 1.00 0.00 C ATOM 1067 SD MET A 173 1.653 -19.558 -2.844 1.00 0.00 S ATOM 1068 CE MET A 173 1.416 -21.121 -2.002 1.00 0.00 C ATOM 0 H MET A 173 0.844 -15.095 -1.402 1.00 0.00 H new ATOM 0 HA MET A 173 1.258 -16.639 -3.698 1.00 0.00 H new ATOM 0 HB2 MET A 173 0.952 -17.366 -1.264 1.00 0.00 H new ATOM 0 HB3 MET A 173 -0.771 -17.137 -1.490 1.00 0.00 H new ATOM 0 HG2 MET A 173 -0.547 -19.403 -1.910 1.00 0.00 H new ATOM 0 HG3 MET A 173 -0.491 -18.742 -3.532 1.00 0.00 H new ATOM 0 HE1 MET A 173 2.327 -21.715 -2.075 1.00 0.00 H new ATOM 0 HE2 MET A 173 1.185 -20.938 -0.953 1.00 0.00 H new ATOM 0 HE3 MET A 173 0.592 -21.663 -2.466 1.00 0.00 H new ATOM 1078 N HIS A 174 -1.755 -15.333 -3.423 1.00 0.00 N ATOM 1079 CA HIS A 174 -2.986 -15.056 -4.156 1.00 0.00 C ATOM 1080 C HIS A 174 -3.586 -16.342 -4.715 1.00 0.00 C ATOM 1081 O HIS A 174 -4.273 -16.326 -5.737 1.00 0.00 O ATOM 1082 CB HIS A 174 -2.716 -14.069 -5.292 1.00 0.00 C ATOM 1083 CG HIS A 174 -3.937 -13.722 -6.086 1.00 0.00 C ATOM 1084 ND1 HIS A 174 -3.903 -13.444 -7.437 1.00 0.00 N ATOM 1085 CD2 HIS A 174 -5.234 -13.610 -5.713 1.00 0.00 C ATOM 1086 CE1 HIS A 174 -5.126 -13.175 -7.859 1.00 0.00 C ATOM 1087 NE2 HIS A 174 -5.952 -13.269 -6.833 1.00 0.00 N ATOM 0 H HIS A 174 -1.703 -14.892 -2.505 1.00 0.00 H new ATOM 0 HA HIS A 174 -3.702 -14.614 -3.463 1.00 0.00 H new ATOM 0 HB2 HIS A 174 -2.292 -13.155 -4.875 1.00 0.00 H new ATOM 0 HB3 HIS A 174 -1.966 -14.493 -5.960 1.00 0.00 H new ATOM 0 HD1 HIS A 174 -3.065 -13.446 -8.019 1.00 0.00 H new ATOM 0 HD2 HIS A 174 -5.630 -13.761 -4.720 1.00 0.00 H new ATOM 0 HE1 HIS A 174 -5.403 -12.921 -8.872 1.00 0.00 H new ATOM 1095 N PHE A 175 -3.323 -17.455 -4.039 1.00 0.00 N ATOM 1096 CA PHE A 175 -3.836 -18.751 -4.469 1.00 0.00 C ATOM 1097 C PHE A 175 -3.534 -19.827 -3.430 1.00 0.00 C ATOM 1098 O PHE A 175 -2.550 -19.739 -2.696 1.00 0.00 O ATOM 1099 CB PHE A 175 -3.228 -19.142 -5.817 1.00 0.00 C ATOM 1100 CG PHE A 175 -3.972 -18.583 -6.995 1.00 0.00 C ATOM 1101 CD1 PHE A 175 -5.354 -18.663 -7.060 1.00 0.00 C ATOM 1102 CD2 PHE A 175 -3.291 -17.978 -8.039 1.00 0.00 C ATOM 1103 CE1 PHE A 175 -6.042 -18.150 -8.143 1.00 0.00 C ATOM 1104 CE2 PHE A 175 -3.973 -17.463 -9.125 1.00 0.00 C ATOM 1105 CZ PHE A 175 -5.351 -17.548 -9.177 1.00 0.00 C ATOM 0 H PHE A 175 -2.757 -17.486 -3.191 1.00 0.00 H new ATOM 0 HA PHE A 175 -4.918 -18.668 -4.577 1.00 0.00 H new ATOM 0 HB2 PHE A 175 -2.194 -18.798 -5.854 1.00 0.00 H new ATOM 0 HB3 PHE A 175 -3.205 -20.229 -5.895 1.00 0.00 H new ATOM 0 HD1 PHE A 175 -5.900 -19.132 -6.255 1.00 0.00 H new ATOM 0 HD2 PHE A 175 -2.214 -17.908 -8.004 1.00 0.00 H new ATOM 0 HE1 PHE A 175 -7.119 -18.220 -8.181 1.00 0.00 H new ATOM 0 HE2 PHE A 175 -3.429 -16.995 -9.932 1.00 0.00 H new ATOM 0 HZ PHE A 175 -5.887 -17.145 -10.024 1.00 0.00 H new ATOM 1115 N HIS A 176 -4.390 -20.843 -3.375 1.00 0.00 N ATOM 1116 CA HIS A 176 -4.215 -21.938 -2.426 1.00 0.00 C ATOM 1117 C HIS A 176 -5.000 -23.170 -2.868 1.00 0.00 C ATOM 1118 O HIS A 176 -6.062 -23.055 -3.480 1.00 0.00 O ATOM 1119 CB HIS A 176 -4.664 -21.507 -1.030 1.00 0.00 C ATOM 1120 CG HIS A 176 -4.022 -20.239 -0.559 1.00 0.00 C ATOM 1121 ND1 HIS A 176 -4.433 -18.952 -0.650 1.00 0.00 N flip ATOM 1122 CD2 HIS A 176 -2.808 -20.207 0.093 1.00 0.00 C flip ATOM 1123 CE1 HIS A 176 -3.469 -18.174 -0.057 1.00 0.00 C flip ATOM 1124 NE2 HIS A 176 -2.499 -18.955 0.383 1.00 0.00 N flip ATOM 0 H HIS A 176 -5.210 -20.931 -3.975 1.00 0.00 H new ATOM 0 HA HIS A 176 -3.156 -22.195 -2.396 1.00 0.00 H new ATOM 0 HB2 HIS A 176 -5.746 -21.379 -1.029 1.00 0.00 H new ATOM 0 HB3 HIS A 176 -4.437 -22.304 -0.322 1.00 0.00 H new ATOM 0 HD2 HIS A 176 -2.204 -21.070 0.330 1.00 0.00 H new ATOM 0 HE1 HIS A 176 -3.499 -17.098 0.035 1.00 0.00 H new ATOM 0 HE2 HIS A 176 -1.655 -18.645 0.865 1.00 0.00 H new ATOM 1132 N ASP A 177 -4.469 -24.347 -2.556 1.00 0.00 N ATOM 1133 CA ASP A 177 -5.120 -25.600 -2.920 1.00 0.00 C ATOM 1134 C ASP A 177 -5.828 -26.215 -1.717 1.00 0.00 C ATOM 1135 O ASP A 177 -5.238 -26.998 -0.971 1.00 0.00 O ATOM 1136 CB ASP A 177 -4.095 -26.586 -3.484 1.00 0.00 C ATOM 1137 CG ASP A 177 -3.496 -26.113 -4.793 1.00 0.00 C ATOM 1138 OD1 ASP A 177 -2.620 -25.224 -4.758 1.00 0.00 O ATOM 1139 OD2 ASP A 177 -3.904 -26.632 -5.854 1.00 0.00 O ATOM 0 H ASP A 177 -3.589 -24.460 -2.052 1.00 0.00 H new ATOM 0 HA ASP A 177 -5.866 -25.385 -3.685 1.00 0.00 H new ATOM 0 HB2 ASP A 177 -3.298 -26.733 -2.755 1.00 0.00 H new ATOM 0 HB3 ASP A 177 -4.572 -27.554 -3.635 1.00 0.00 H new ATOM 1144 N ILE A 178 -7.094 -25.854 -1.534 1.00 0.00 N ATOM 1145 CA ILE A 178 -7.881 -26.371 -0.421 1.00 0.00 C ATOM 1146 C ILE A 178 -8.965 -27.324 -0.911 1.00 0.00 C ATOM 1147 O ILE A 178 -9.931 -26.907 -1.549 1.00 0.00 O ATOM 1148 CB ILE A 178 -8.539 -25.232 0.380 1.00 0.00 C ATOM 1149 CG1 ILE A 178 -7.474 -24.261 0.895 1.00 0.00 C ATOM 1150 CG2 ILE A 178 -9.352 -25.797 1.534 1.00 0.00 C ATOM 1151 CD1 ILE A 178 -8.048 -22.983 1.467 1.00 0.00 C ATOM 0 H ILE A 178 -7.596 -25.206 -2.141 1.00 0.00 H new ATOM 0 HA ILE A 178 -7.192 -26.911 0.229 1.00 0.00 H new ATOM 0 HB ILE A 178 -9.213 -24.686 -0.279 1.00 0.00 H new ATOM 0 HG12 ILE A 178 -6.881 -24.759 1.662 1.00 0.00 H new ATOM 0 HG13 ILE A 178 -6.796 -24.012 0.079 1.00 0.00 H new ATOM 0 HG21 ILE A 178 -9.811 -24.980 2.090 1.00 0.00 H new ATOM 0 HG22 ILE A 178 -10.131 -26.452 1.144 1.00 0.00 H new ATOM 0 HG23 ILE A 178 -8.698 -26.365 2.196 1.00 0.00 H new ATOM 0 HD11 ILE A 178 -7.237 -22.342 1.813 1.00 0.00 H new ATOM 0 HD12 ILE A 178 -8.618 -22.463 0.697 1.00 0.00 H new ATOM 0 HD13 ILE A 178 -8.704 -23.221 2.304 1.00 0.00 H new ATOM 1163 N MET A 179 -8.799 -28.607 -0.607 1.00 0.00 N ATOM 1164 CA MET A 179 -9.766 -29.620 -1.014 1.00 0.00 C ATOM 1165 C MET A 179 -9.838 -29.723 -2.534 1.00 0.00 C ATOM 1166 O MET A 179 -10.923 -29.787 -3.111 1.00 0.00 O ATOM 1167 CB MET A 179 -11.149 -29.294 -0.447 1.00 0.00 C ATOM 1168 CG MET A 179 -11.180 -29.213 1.071 1.00 0.00 C ATOM 1169 SD MET A 179 -12.826 -28.856 1.714 1.00 0.00 S ATOM 1170 CE MET A 179 -12.925 -30.032 3.061 1.00 0.00 C ATOM 0 H MET A 179 -8.004 -28.970 -0.080 1.00 0.00 H new ATOM 0 HA MET A 179 -9.437 -30.580 -0.617 1.00 0.00 H new ATOM 0 HB2 MET A 179 -11.487 -28.344 -0.860 1.00 0.00 H new ATOM 0 HB3 MET A 179 -11.856 -30.055 -0.777 1.00 0.00 H new ATOM 0 HG2 MET A 179 -10.828 -30.156 1.489 1.00 0.00 H new ATOM 0 HG3 MET A 179 -10.488 -28.439 1.404 1.00 0.00 H new ATOM 0 HE1 MET A 179 -13.658 -29.688 3.791 1.00 0.00 H new ATOM 0 HE2 MET A 179 -13.228 -31.005 2.673 1.00 0.00 H new ATOM 0 HE3 MET A 179 -11.950 -30.120 3.540 1.00 0.00 H new ATOM 1180 N GLY A 180 -8.675 -29.738 -3.178 1.00 0.00 N ATOM 1181 CA GLY A 180 -8.630 -29.833 -4.626 1.00 0.00 C ATOM 1182 C GLY A 180 -9.300 -28.655 -5.305 1.00 0.00 C ATOM 1183 O GLY A 180 -10.042 -28.827 -6.273 1.00 0.00 O ATOM 0 H GLY A 180 -7.763 -29.686 -2.723 1.00 0.00 H new ATOM 0 HA2 GLY A 180 -7.591 -29.893 -4.951 1.00 0.00 H new ATOM 0 HA3 GLY A 180 -9.117 -30.756 -4.942 1.00 0.00 H new ATOM 1187 N LYS A 181 -9.041 -27.455 -4.797 1.00 0.00 N ATOM 1188 CA LYS A 181 -9.624 -26.243 -5.360 1.00 0.00 C ATOM 1189 C LYS A 181 -8.692 -25.051 -5.168 1.00 0.00 C ATOM 1190 O LYS A 181 -7.992 -24.953 -4.160 1.00 0.00 O ATOM 1191 CB LYS A 181 -10.979 -25.955 -4.709 1.00 0.00 C ATOM 1192 CG LYS A 181 -11.867 -25.038 -5.533 1.00 0.00 C ATOM 1193 CD LYS A 181 -12.592 -25.802 -6.628 1.00 0.00 C ATOM 1194 CE LYS A 181 -13.752 -26.611 -6.069 1.00 0.00 C ATOM 1195 NZ LYS A 181 -14.178 -27.689 -7.004 1.00 0.00 N ATOM 0 H LYS A 181 -8.430 -27.296 -3.996 1.00 0.00 H new ATOM 0 HA LYS A 181 -9.767 -26.401 -6.429 1.00 0.00 H new ATOM 0 HB2 LYS A 181 -11.500 -26.898 -4.542 1.00 0.00 H new ATOM 0 HB3 LYS A 181 -10.814 -25.504 -3.730 1.00 0.00 H new ATOM 0 HG2 LYS A 181 -12.595 -24.554 -4.882 1.00 0.00 H new ATOM 0 HG3 LYS A 181 -11.262 -24.248 -5.978 1.00 0.00 H new ATOM 0 HD2 LYS A 181 -12.963 -25.102 -7.377 1.00 0.00 H new ATOM 0 HD3 LYS A 181 -11.892 -26.468 -7.133 1.00 0.00 H new ATOM 0 HE2 LYS A 181 -13.461 -27.051 -5.115 1.00 0.00 H new ATOM 0 HE3 LYS A 181 -14.594 -25.948 -5.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 181 -14.971 -28.217 -6.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 181 -14.480 -27.267 -7.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 181 -13.382 -28.336 -7.174 1.00 0.00 H new ATOM 1209 N LYS A 182 -8.689 -24.146 -6.141 1.00 0.00 N ATOM 1210 CA LYS A 182 -7.846 -22.958 -6.079 1.00 0.00 C ATOM 1211 C LYS A 182 -8.589 -21.797 -5.426 1.00 0.00 C ATOM 1212 O LYS A 182 -9.496 -21.215 -6.020 1.00 0.00 O ATOM 1213 CB LYS A 182 -7.387 -22.559 -7.483 1.00 0.00 C ATOM 1214 CG LYS A 182 -6.063 -21.816 -7.502 1.00 0.00 C ATOM 1215 CD LYS A 182 -4.887 -22.768 -7.365 1.00 0.00 C ATOM 1216 CE LYS A 182 -4.450 -23.312 -8.716 1.00 0.00 C ATOM 1217 NZ LYS A 182 -4.077 -22.222 -9.659 1.00 0.00 N ATOM 0 H LYS A 182 -9.261 -24.213 -6.983 1.00 0.00 H new ATOM 0 HA LYS A 182 -6.972 -23.194 -5.472 1.00 0.00 H new ATOM 0 HB2 LYS A 182 -7.299 -23.456 -8.096 1.00 0.00 H new ATOM 0 HB3 LYS A 182 -8.152 -21.933 -7.942 1.00 0.00 H new ATOM 0 HG2 LYS A 182 -5.972 -21.256 -8.433 1.00 0.00 H new ATOM 0 HG3 LYS A 182 -6.041 -21.090 -6.690 1.00 0.00 H new ATOM 0 HD2 LYS A 182 -4.052 -22.251 -6.893 1.00 0.00 H new ATOM 0 HD3 LYS A 182 -5.161 -23.595 -6.710 1.00 0.00 H new ATOM 0 HE2 LYS A 182 -3.600 -23.981 -8.580 1.00 0.00 H new ATOM 0 HE3 LYS A 182 -5.257 -23.905 -9.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 182 -3.181 -22.462 -10.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 182 -4.824 -22.110 -10.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 182 -3.965 -21.332 -9.133 1.00 0.00 H new ATOM 1231 N VAL A 183 -8.197 -21.463 -4.200 1.00 0.00 N ATOM 1232 CA VAL A 183 -8.824 -20.370 -3.468 1.00 0.00 C ATOM 1233 C VAL A 183 -8.064 -19.064 -3.673 1.00 0.00 C ATOM 1234 O VAL A 183 -6.847 -19.009 -3.500 1.00 0.00 O ATOM 1235 CB VAL A 183 -8.900 -20.675 -1.960 1.00 0.00 C ATOM 1236 CG1 VAL A 183 -9.916 -19.768 -1.282 1.00 0.00 C ATOM 1237 CG2 VAL A 183 -9.243 -22.139 -1.730 1.00 0.00 C ATOM 0 H VAL A 183 -7.448 -21.934 -3.693 1.00 0.00 H new ATOM 0 HA VAL A 183 -9.835 -20.265 -3.861 1.00 0.00 H new ATOM 0 HB VAL A 183 -7.923 -20.480 -1.518 1.00 0.00 H new ATOM 0 HG11 VAL A 183 -9.956 -19.998 -0.217 1.00 0.00 H new ATOM 0 HG12 VAL A 183 -9.622 -18.727 -1.418 1.00 0.00 H new ATOM 0 HG13 VAL A 183 -10.899 -19.928 -1.725 1.00 0.00 H new ATOM 0 HG21 VAL A 183 -9.293 -22.337 -0.659 1.00 0.00 H new ATOM 0 HG22 VAL A 183 -10.208 -22.363 -2.186 1.00 0.00 H new ATOM 0 HG23 VAL A 183 -8.475 -22.768 -2.180 1.00 0.00 H new ATOM 1247 N GLU A 184 -8.792 -18.015 -4.044 1.00 0.00 N ATOM 1248 CA GLU A 184 -8.185 -16.709 -4.273 1.00 0.00 C ATOM 1249 C GLU A 184 -8.109 -15.909 -2.976 1.00 0.00 C ATOM 1250 O GLU A 184 -9.066 -15.866 -2.202 1.00 0.00 O ATOM 1251 CB GLU A 184 -8.982 -15.928 -5.320 1.00 0.00 C ATOM 1252 CG GLU A 184 -8.160 -14.885 -6.059 1.00 0.00 C ATOM 1253 CD GLU A 184 -9.002 -14.025 -6.981 1.00 0.00 C ATOM 1254 OE1 GLU A 184 -10.148 -13.700 -6.608 1.00 0.00 O ATOM 1255 OE2 GLU A 184 -8.512 -13.675 -8.075 1.00 0.00 O ATOM 0 H GLU A 184 -9.801 -18.044 -4.192 1.00 0.00 H new ATOM 0 HA GLU A 184 -7.172 -16.868 -4.642 1.00 0.00 H new ATOM 0 HB2 GLU A 184 -9.399 -16.629 -6.043 1.00 0.00 H new ATOM 0 HB3 GLU A 184 -9.823 -15.436 -4.831 1.00 0.00 H new ATOM 0 HG2 GLU A 184 -7.654 -14.247 -5.335 1.00 0.00 H new ATOM 0 HG3 GLU A 184 -7.385 -15.384 -6.641 1.00 0.00 H new ATOM 1262 N VAL A 185 -6.964 -15.275 -2.744 1.00 0.00 N ATOM 1263 CA VAL A 185 -6.762 -14.476 -1.541 1.00 0.00 C ATOM 1264 C VAL A 185 -6.160 -13.117 -1.879 1.00 0.00 C ATOM 1265 O VAL A 185 -5.191 -13.025 -2.634 1.00 0.00 O ATOM 1266 CB VAL A 185 -5.843 -15.197 -0.536 1.00 0.00 C ATOM 1267 CG1 VAL A 185 -5.436 -14.254 0.586 1.00 0.00 C ATOM 1268 CG2 VAL A 185 -6.529 -16.435 0.019 1.00 0.00 C ATOM 0 H VAL A 185 -6.162 -15.299 -3.374 1.00 0.00 H new ATOM 0 HA VAL A 185 -7.743 -14.333 -1.087 1.00 0.00 H new ATOM 0 HB VAL A 185 -4.940 -15.514 -1.058 1.00 0.00 H new ATOM 0 HG11 VAL A 185 -4.787 -14.780 1.286 1.00 0.00 H new ATOM 0 HG12 VAL A 185 -4.902 -13.400 0.168 1.00 0.00 H new ATOM 0 HG13 VAL A 185 -6.326 -13.905 1.109 1.00 0.00 H new ATOM 0 HG21 VAL A 185 -5.866 -16.932 0.727 1.00 0.00 H new ATOM 0 HG22 VAL A 185 -7.449 -16.145 0.526 1.00 0.00 H new ATOM 0 HG23 VAL A 185 -6.765 -17.117 -0.798 1.00 0.00 H new ATOM 1278 N LYS A 186 -6.739 -12.063 -1.316 1.00 0.00 N ATOM 1279 CA LYS A 186 -6.260 -10.707 -1.555 1.00 0.00 C ATOM 1280 C LYS A 186 -6.209 -9.910 -0.255 1.00 0.00 C ATOM 1281 O LYS A 186 -6.869 -10.259 0.724 1.00 0.00 O ATOM 1282 CB LYS A 186 -7.163 -9.995 -2.565 1.00 0.00 C ATOM 1283 CG LYS A 186 -7.068 -10.564 -3.971 1.00 0.00 C ATOM 1284 CD LYS A 186 -5.767 -10.165 -4.647 1.00 0.00 C ATOM 1285 CE LYS A 186 -5.847 -8.759 -5.223 1.00 0.00 C ATOM 1286 NZ LYS A 186 -6.556 -8.735 -6.532 1.00 0.00 N ATOM 0 H LYS A 186 -7.542 -12.122 -0.690 1.00 0.00 H new ATOM 0 HA LYS A 186 -5.251 -10.773 -1.961 1.00 0.00 H new ATOM 0 HB2 LYS A 186 -8.197 -10.059 -2.225 1.00 0.00 H new ATOM 0 HB3 LYS A 186 -6.902 -8.937 -2.591 1.00 0.00 H new ATOM 0 HG2 LYS A 186 -7.140 -11.651 -3.930 1.00 0.00 H new ATOM 0 HG3 LYS A 186 -7.911 -10.211 -4.565 1.00 0.00 H new ATOM 0 HD2 LYS A 186 -4.950 -10.219 -3.927 1.00 0.00 H new ATOM 0 HD3 LYS A 186 -5.537 -10.873 -5.443 1.00 0.00 H new ATOM 0 HE2 LYS A 186 -6.363 -8.107 -4.518 1.00 0.00 H new ATOM 0 HE3 LYS A 186 -4.840 -8.360 -5.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 186 -6.589 -7.759 -6.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 186 -6.050 -9.337 -7.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 186 -7.525 -9.092 -6.409 1.00 0.00 H new ATOM 1300 N ARG A 187 -5.422 -8.839 -0.253 1.00 0.00 N ATOM 1301 CA ARG A 187 -5.286 -7.994 0.927 1.00 0.00 C ATOM 1302 C ARG A 187 -6.587 -7.252 1.218 1.00 0.00 C ATOM 1303 O ARG A 187 -7.019 -6.405 0.437 1.00 0.00 O ATOM 1304 CB ARG A 187 -4.148 -6.990 0.733 1.00 0.00 C ATOM 1305 CG ARG A 187 -3.495 -6.549 2.033 1.00 0.00 C ATOM 1306 CD ARG A 187 -4.256 -5.400 2.676 1.00 0.00 C ATOM 1307 NE ARG A 187 -4.006 -4.131 1.998 1.00 0.00 N ATOM 1308 CZ ARG A 187 -4.430 -2.958 2.454 1.00 0.00 C ATOM 1309 NH1 ARG A 187 -5.122 -2.893 3.583 1.00 0.00 N ATOM 1310 NH2 ARG A 187 -4.163 -1.847 1.781 1.00 0.00 N ATOM 0 H ARG A 187 -4.869 -8.536 -1.055 1.00 0.00 H new ATOM 0 HA ARG A 187 -5.055 -8.636 1.777 1.00 0.00 H new ATOM 0 HB2 ARG A 187 -3.390 -7.434 0.088 1.00 0.00 H new ATOM 0 HB3 ARG A 187 -4.534 -6.112 0.214 1.00 0.00 H new ATOM 0 HG2 ARG A 187 -3.453 -7.391 2.724 1.00 0.00 H new ATOM 0 HG3 ARG A 187 -2.467 -6.243 1.840 1.00 0.00 H new ATOM 0 HD2 ARG A 187 -5.324 -5.617 2.657 1.00 0.00 H new ATOM 0 HD3 ARG A 187 -3.967 -5.315 3.723 1.00 0.00 H new ATOM 0 HE ARG A 187 -3.477 -4.146 1.126 1.00 0.00 H new ATOM 0 HH11 ARG A 187 -5.330 -3.745 4.104 1.00 0.00 H new ATOM 0 HH12 ARG A 187 -5.446 -1.991 3.931 1.00 0.00 H new ATOM 0 HH21 ARG A 187 -3.631 -1.893 0.912 1.00 0.00 H new ATOM 0 HH22 ARG A 187 -4.489 -0.947 2.133 1.00 0.00 H new ATOM 1324 N ALA A 188 -7.208 -7.579 2.347 1.00 0.00 N ATOM 1325 CA ALA A 188 -8.459 -6.943 2.742 1.00 0.00 C ATOM 1326 C ALA A 188 -8.200 -5.661 3.525 1.00 0.00 C ATOM 1327 O ALA A 188 -7.111 -5.460 4.061 1.00 0.00 O ATOM 1328 CB ALA A 188 -9.303 -7.906 3.566 1.00 0.00 C ATOM 0 H ALA A 188 -6.865 -8.280 3.004 1.00 0.00 H new ATOM 0 HA ALA A 188 -9.006 -6.680 1.837 1.00 0.00 H new ATOM 0 HB1 ALA A 188 -10.234 -7.418 3.854 1.00 0.00 H new ATOM 0 HB2 ALA A 188 -9.526 -8.793 2.973 1.00 0.00 H new ATOM 0 HB3 ALA A 188 -8.753 -8.197 4.461 1.00 0.00 H new